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Bioactive Compound Library (96-well)

Product Details:FormulationContainer 96 Well Format Sample Storage Tube With Screw Cap and Optional 2D Barcode

Stability2 weeks | 4°C | in DMSO

Shipping Blue ice or Dry ice

Packaged under inert Yes

Plate layout: L1700-01

1 2 3 4 5

aS1001 S1010 S1021 S1032 S1041

Dasatinib STF-62247

bS1002 S1011 S1022 S1033 S1042

ABT-737 Afatinib (BIBW2992) Nilotinib (AMN-107) Sunitinib Malate

cS1003 S1012 S1023 S1034 S1043

Linifanib (ABT-869) BMS-536924 NVP-AEW541

dS1004 S1013 S1025 S1035 S1044

Veliparib (ABT-888) Gefitinib (ZD1839)

eS1005 S1014 S1026 S1036 S1045

Axitinib Bosutinib (SKI-606) PD0325901 Trichostatin A (TSA)

fS1006 S1017 S1028 S1038 S1046

PI-103

gS1007 S1018 S1029 S1039 S1047

FG-4592

For more information on Selleck library service, please contact us via +1-832-582-8158 or [email protected]

A unique collection of 1902 bioactive compounds

3 months | ﹣20°C | in DMSO

6 months | ﹣80°C | in DMSO

ABT-263 (Navitoclax)

Nintedanib (BIBF 1120)

Motesanib Diphosphate (AMG-706)

Ridaforolimus (Deforolimus, MK-8669)

Erlotinib HCl (OSI-744)

Tandutinib (MLN518)

Bortezomib (PS-341)

Pazopanib HCl (GW786034 HCl)

Temsirolimus (CCI-779, NSC 683864)

Imatinib Mesylate (STI571)

Saracatinib (AZD0530)

Cediranib (AZD2171)

Lapatinib (GW-572016) Ditosylate

Vandetanib (ZD6474)

Dovitinib (TKI-258, CHIR-258)

Lenalidomide (CC-5013)

Rapamycin (Sirolimus)

Vorinostat (SAHA, MK0683)

hS1008 S1020 S1030 S1040 S1048

Sorafenib Tosylate


1 2 3 4 5

aS1112 S1120 S1134 S1144 S1155

SGX-523 AT9283 Ivacaftor (VX-770) S3I-201

bS1113 S1121 S1137 S1145 S1156

GSK690693 TW-37 Malotilate Capecitabine

cS1114 S1122 S1138 S1147 S1157

JNJ-38877605

dS1115 S1124 S1139 S1148 S1158

BMS-754807 ADL5859 HCl Docetaxel MK-8245

eS1116 S1129 S1140 S1150 S1159

SRT1720 Andarine Paclitaxel

fS1117 S1130 S1141 S1152 S1162

Triciribine PLX-4720 PA-824

gS1118 S1132 S1142 S1153 S1163

XL147 INO-1001 AT13387

hS1119 S1133 S1143 S1154 S1164

Alisertib (MLN8237) SNS-314 Mesylate Lenvatinib (E7080)


1 2 3 4 5

Selumetinib (AZD6244)

PD184352 (CI-1040)

Panobinostat (LBH589)

VX-680 (Tozasertib, MK-0457)

Everolimus (RAD001)

SNS-032 (BMS-387032)

Mocetinostat (MGCD0103)

Brivanib Alaninate (BMS-582664)

Barasertib (AZD1152-HQPA)

CEP-18770 (Delanzomib)

Odanacatib (MK-0822)

Palbociclib (PD-0332991) HCl

Ganetespib (STA-9090)

YM155 (Sepantronium Bromide)

17-AAG (Tanespimycin)

17-DMAG (Alvespimycin) HCl

Roscovitine (Seliciclib,CYC202)

Cabozantinib (XL184, BMS-907351)

AG-490 (Tyrphostin B42)

aS1221 S1229 S1244 S1256 S1266

Dacarbazine Rufinamide WYE-354

bS1222 S1231 S1247 S1257 S1267

Topotecan HCl Leflunomide Posaconazole

cS1223 S1233 S1248 S1258 S1271

Epirubicin HCl Vinblastine Prasugrel Acarbose

dS1224 S1234 S1249 S1259 S1274

Oxaliplatin AG-1024 JNJ-7706621 Ramelteon BX-795

eS1225 S1235 S1250 S1260 S1275

Etoposide Letrozole Cinacalcet HCl BX-912

fS1226 S1237 S1251 S1261 S1276

KU-0063794 Temozolomide Dienogest Celecoxib Adapalene

gS1227 S1241 S1252 S1262 S1278

Raloxifene HCl Vincristine Entecavir Hydrate Altretamine

hS1228 S1243 S1255 S1264 S1280

Idarubicin HCl Agomelatine Nepafenac PD173074 Amisulpride


1 2 3 4 5

aS1366 S1380 S1391 S1403 S1425

BMS-707035 Lopinavir Oxcarbazepine Tigecycline Ranolazine 2HCl

bS1367 S1381 S1392 S1404 S1426

Amonafide Meropenem Pelitinib (EKB-569) Trilostane Repaglinide

cS1368 S1382 S1393 S1405 S1430

Fludarabine Phosphate

Amuvatinib (MP-470)

Dexrazoxane HCl (ICRF-187, ADR-529)

Vemurafenib (PLX4032, RG7204)

2-Methoxyestradiol (2-MeOE2)

Enzalutamide (MDV3100)

Avagacestat (BMS-708163)

cAcitretin Mianserin HCl Pirarubicin Rolipram

dS1374 S1385 S1394 S1407 S1431

Doripenem Hydrate Mosapride Citrate Pizotifen Malate Bimatoprost Sildenafil Citrate

eS1376 S1386 S1396 S1408 S1432

Gestodene Resveratrol Linezolid

fS1377 S1387 S1397 S1409 S1436

Drospirenone Naftopidil DiHCl Alfuzosin HCl Tianeptine sodium

gS1378 S1389 S1398 S1415 S1437

Omeprazole Stavudine (d4T) Clopidogrel Tizanidine HCl

hS1379 S1390 S1400 S1422 S1438

Isotretinoin Ondansetron HCl Droxinostat Topiramate


1 2 3 4 5

aS1512 S1526 S1536 S1548 S1565

Tadalafil Quizartinib (AC220) CP-673451 Dapagliflozin

bS1514 S1528 S1537 S1549 S1567

Cyclosporine LY2811376 Nebivolol Pomalidomide

cS1515 S1529 S1538 S1550 S1568

Pracinostat (SB939) Hesperadin Telaprevir (VX-950) Pimobendan PD318088

dS1517 S1530 S1540 S1555 S1569

Natamycin BIX 02188 Saxagliptin AZD8055 Tazarotene

eS1519 S1531 S1541 S1556 S1570

Vecuronium Bromide

Nafamostat Mesylate

Sumatriptan Succinate

Rocuronium Bromide

Ruxolitinib (INCB018424)

Tenofovir Disoproxil Fumarate

VX-809 (Lumacaftor)

DMXAA (Vadimezan)

eCCT129202 BIX 02189 EX 527 (Selisistat) PHT-427 KU-60019

fS1523 S1532 S1544 S1557 S1572

AZD7762 AM1241 KRN 633 BS-181 HCl

gS1524 S1533 S1545 S1558 S1573

AT7519 R406 (free base) SB408124 AT7867

hS1525 S1534 S1547 S1561 S1574

MK-1775 Org 27569 Febuxostat BMS-777607


1 2 3 4 5

aS1653 S1667 S1679 S1693 S1708

Tretinoin Trichlormethiazide Flurbiprofen Carbamazepine Hydrochlorothiazide

bS1654 S1669 S1680 S1696 S1709

Phenylbutazone Disulfiram Hydrocortisone Estradiol

cS1655 S1671 S1681 S1701 S1712

Ezetimibe Mesalamine Desonide Deferasirox

dS1657 S1672 S1683 S1702 S1713

Aminoglutethimide Ipratropium Bromide Didanosine Piroxicam

eS1658 S1673 S1685 S1703 S1714

Dofetilide Aminophylline Sulfanilamide Divalproex Sodium Gemcitabine

fS1662 S1675 S1689 S1704 S1715

Isradipine Lubiprostone Meprednisone Emtricitabine Glipizide

gS1665 S1676 S1691 S1705 S1716

Estrone Amorolfine HCl Praziquantel Progesterone Glyburide

SAR245409 (XL765)

Fasudil (HA-1077) HCl

BIRB 796 (Doramapimod)

Loteprednol etabonate

（6-）ε- Aminocaproic acid

Enalaprilat Dihydrate

hS1666 S1677 S1692 S1706 S1718

Flucytosine Chloramphenicol Busulfan Lamivudine Adefovir Dipivoxil


1 2 3 4 5

aS1807 S1830 S1843 S1859 S1883

Aciclovir Oxfendazole Diethylstilbestrol Idoxuridine

bS1808 S1831 S1845 S1865 S1884

Nifedipine Carvedilol Cimetidine Diltiazem HCl Sparfloxacin

cS1811 S1832 S1847 S1866 S1885

Amiloride HCl Atracurium Besylate Felodipine

dS1816 S1833 S1848 S1869 S1888

Curcumin Dapoxetine HCl Deflazacort

eS1823 S1835 S1849 S1876 S1889

Fenoprofen Calcium Azithromycin Daidzein Valaciclovir HCl Mitoxantrone

fS1825 S1836 S1854 S1878 S1890

Erdosteine Albendazole Oxide Bifonazole Ganciclovir Nizatidine

gS1828 S1839 S1855 S1880 S1891

Proparacaine HCl Chloroxine Pefloxacin Mesylate Carbidopa

hS1829 S1840 S1856 S1881 S1894

Pranlukast Lomustine Metoprolol Tartrate Protionamide Valsartan

Chenodeoxycholic Acid

Clemastine Fumarate

Diphenhydramine HCl

Chlorpheniramine Maleate

Butoconazole nitrate

Roxatidine Acetate HCl


1 2 3 4 5

aS1992 S2013 S2025 S2036 S2045

PF-573228 Urapidil HCl Aspartame Doxifluridine

bS1994 S2014 S2026 S2037 S2046

Lacidipine BMS-265246 Ginkgolide A Pioglitazone HCl

cS2001 S2015 S2028 S2038 S2047

Suplatast Tosylate Diclazuril Lornoxicam

dS2003 S2016 S2029 S2040 S2051

Maraviroc Mirtazapine Uridine Nimesulide Captopril

eS2005 S2017 S2030 S2041 S2053

Benidipine HCl Flunarizine 2HCl Dyclonine HCl Cytidine

fS2006 S2020 S2031 S2042 S2054

Pyrimethamine

gS2007 S2021 S2032 S2043 S2055

Sulindac Chlormezanone Rebamipide Memantine HCl Gimeracil

hS2012 S2024 S2035 S2044 S2058

PCI-34051 Ketotifen Fumarate Epalrestat Tolnaftate


1 2 3 4 5

aS2149 S2160 S2177 S2187 S2202

GSK1292263 Almorexant HCl Dichlorphenamide Avasimibe NVP-BHG712

Fluticasone propionate

Candesartan Cilexetil

Elvitegravir (GS-9137, JTK-303)

Phentolamine Mesylate

Raltegravir (MK-0518)

Formoterol Hemifumarate

Fenticonazole Nitrate

Cyproterone Acetate

Orphenadrine Citrate

Cyproheptadine HCl

bS2151 S2161 S2178 S2192 S2205

RAF265 (CHIR-265) AG-14361 AZD8931 (Sapitinib) OSI-420

cS2153 S2162 S2179 S2193 S2207

CGS 21680 HCl AZD1480 LY2784544 GSK461364 PIK-293

dS2154 S2163 S2180 S2194 S2208

Dabigatran Etexilate PF-4708671 MLN2238 R406 Formestane

eS2155 S2168 S2181 S2195 S2214

LY2608204 PD128907 HCl MLN9708 CYT997 (Lexibulin) AZ 960

fS2156 S2169 S2182 S2198 S2215

LY2886721 SB743921 SGI-1776 free base DAPT (GSI-IX)

gS2158 S2170 S2185 S2199 S2216

KW-2449 AST-1306

hS2159 S2173 S2186 S2201 S2217

Tebipenem Pivoxil SB505124 BMS-794833


1 2 3 4 5

aS2290 S2302 S2312 S2322 S2333

Glycyrrhizic Acid Icariin (+)-Matrine Nobiletin

bS2292 S2303 S2313 S2323 S2334

Diosmin Gossypol Indole-3-carbinol Methyl-Hesperidin Oleanolic Acid

cS2293 S2304 S2314 S2325 S2335

DL-Carnitine HCl Gramine Kaempferol Morin Hydrate Oridonin

LDE225 (NVP-LDE225,Erismodegib)

Rosuvastatin Calcium

Givinostat (ITF2357)

Aliskiren Hemifumarate

Mubritinib (TAK 165)

Telotristat Etiprate (LX 1606 Hippurate)

Irinotecan HCl Trihydrate

Dihydroartemisinin (DHA)

dS2295 S2306 S2316 S2326 S2336

Emodin Kinetin Myricetin

eS2296 S2308 S2317 S2327 S2337

Enoxolone Hesperetin Myricitrin Osthole

fS2298 S2309 S2319 S2328 S2338

Fisetin Hesperidin Limonin Nalidixic acid Oxymatrine

gS2299 S2310 S2320 S2329 S2339

Formononetin Honokiol Luteolin Naringin Paeonol

hS2300 S2311 S2321 S2332 S2341

Ferulic Acid Magnolol Neohesperidin (-)-Parthenolide


1 2 3 4 5

aS2401 S2410 S2425 S2450 S2458

Sodium Danshensu Paeoniflorin Apocynin Equol Clonidine HCl

bS2403 S2411 S2437 S2451 S2459

Tetrandrine Geniposide Rotundine Amantadine HCl Clozapine

cS2404 S2412 S2438 S2452 S2460

Isoliquiritigenin Genipin Synephrine HCl Amfebutamone HCl Pramipexole

dS2405 S2413 S2439 S2453 S2461

Sophocarpine Geniposidic acid Guanosine Benserazide HCl Domperidone

eS2406 S2415 S2442 S2454 S2466

Chrysophanic Acid Astragaloside A Inosine Bupivacaine HCl Estriol

Gynostemma Extract

Orotic acid (6-Carboxyuracil)

L-(+)-Rhamnose Monohydrate

Hyodeoxycholic acid (HDCA)

fS2407 S2417 S2443 S2455 S2467

Curcumol Tolbutamide Famciclovir

gS2408 S2420 S2446 S2456 S2468

Cephalomannine Aloperine Levosimendan Chlorpromazine HCl Fenbendazole

hS2409 S2422 S2449 S2457 S2470

Forskolin Clindamycin HCl


1 2 3 4 5

aS2536 S2548 S2556 S2569 S2584

Miconazole Scopine HCl Rosiglitazone Phenylephrine HCl

bS2537 S2549 S2557 S2573 S2585

Secnidazole Trospium chloride Terbinafine HCl Tetracaine HCl

cS2538 S2550 S2559 S2574 S2586

Acetanilide Tolterodine tartrate Cortisone acetate Tetracycline HCl Dimethyl Fumarate

dS2541 S2551 S2561 S2576 S2589

Clomipramine HCl Sulbactam sodium Clomifene citrate Xylometazoline HCl Miglitol

eS2542 S2552 S2564 S2577 S2590

Phenformin HCl Azelastine HCl Cloxacillin Sodium Phenacetin Pioglitazone

fS2543 S2553 S2565 S2579 S2593

Ceftiofur HCl Amoxicillin Sodium Zidovudine Tolvaptan

gS2545 S2554 S2566 S2581 S2594

Scopine Daphnetin Isoprenaline HCl Quinapril HCl Pramiracetam

20-Hydroxyecdysone

Bethanechol chloride

10-Deacetylbaccatin-III

Ipriflavone (Osteofix)

Fluocinolone Acetonide

Clobetasol propionate

Brompheniramine hydrogen maleate

5-Aminolevulinic acid HCl

hS2547 S2555 S2567 S2583 S2596

Clarithromycin Thiamphenicol


1 2 3 4 5

aS2672 S2683 S2693 S2711 S2722

PF-00562271 CHIR-124 Resminostat YO-01027 JTC-801

bS2673 S2685 S2694 S2713 S2726

KW-2478 XL335 Geldanamycin PH-797804

cS2674 S2686 S2696 S2714 S2727

A922500 NVP-BSK805 2HCl LY411575

dS2677 S2688 S2697 S2717 S2728

BRL-15572 R547 A-769662 CP-91149

eS2679 S2689 S2698 S2718 S2729

Flavopiridol HCl WAY-600 RS-127445 TAK-901 SB415286

fS2680 S2690 S2699 S2719 S2730

ADX-47273 CH5132799 AMG-900

gS2681 S2691 S2700 S2720 S2731

AS-604850 BMY 7378 KX2-391 ZM 336372 AZ 3146

hS2682 S2692 S2703 S2721 S2735

CAY10505 TG101209 GSK1838705A Nilvadipine


1 2 3 4 5

Tiotropium Bromide hydrate

Medroxyprogesterone acetate

Clindamycin palmitate HCl

Trametinib (GSK1120212)

GDC-0980 (RG7422)

Dacomitinib (PF299804, PF299)

AG-1478 (Tyrphostin AG-1478)

Ibrutinib (PCI-32765)

Crenolanib (CP-868596)

MK-8776 (SCH 900776)

aS2806 S2816 S2825 S2847 S2857

CEP-33779 Tyrphostin AG 879 ML133 HCl

bS2807 S2817 S2828 S2849 S2858

Torin 2 JNJ-1661010 SB269970 HCl

cS2808 S2818 S2830 S2851 S2859

GDC-0068 Clindamycin Golvatinib (E7050)

dS2809 S2819 S2832 S2852 S2860

MPEP AM251 Epiandrosterone BRL-54443

eS2811 S2820 S2840 S2853 S2861

INK 128 (MLN0128) ARN-509 CTEP (RO4956371)

fS2812 S2821 S2842 S2854 S2862

AT101 RG108 SAR131675 BML-190 VU 0364770

gS2813 S2822 S2843 S2855 S2863

Ciproxifan OC000459 BI-D1870 MRS 2578 ML130 (Nodinitib-1)

hS2814 S2824 S2845 S2856 S2864

BYL719 TPCA-1 SB271046 IMD 0354


1 2 3 4 5

aS3000 S3017 S3025 S3037 S3051

Aspirin PMSF Bosentan Hydrate

bS3001 S3018 S3026 S3038 S3052

Clevudine Niflumic acid Piceatannol

Cathepsin Inhibitor 1

MK-801 (Dizocilpine)

Dabrafenib (GSK2118436)

StemRegenin 1 (SR1)

CI994 (Tacedinaline)

Baricitinib (LY3009104, INCB028050)

IEM 1754 dihydrobroMide

TAE226 (NVP-TAE226)

Carfilzomib (PR-171)

Semaxanib (SU5416)

Carbazochrome sodium sulfonate (AC-17)

Bepotastine Besilate

Fosaprepitant dimeglumine salt

Rupatadine Fumarate

cS3002 S3019 S3031 S3042 S3053

Rivaroxaban Linagliptin Purmorphamine Azelnidipine

dS3005 S3020 S3032 S3043 S3054

Paroxetine HCl Bindarit Rofecoxib Alverine Citrate

eS3007 S3021 S3033 S3045 S3057

Zanamivir Rimonabant Cinepazide maleate

fS3008 S3022 S3034 S3046 S3060

Zaltoprofen Cabazitaxel Sitaxentan sodium Azilsartan Medetomidine HCl

gS3012 S3023 S3035 S3047 S3061

Pazopanib Bufexamac Daunorubicin HCl Otilonium Bromide Epinephrine HCl

hS3015 S3024 S3036 S3048 S3062

Amoxicillin Lamotrigine Pravastatin sodium


1 2 3 4 5

aS3176 S3188 S3201 S3604 S4009

Betahistine 2HCl Triptolide (PG490) Mirabegron

bS3178 S3189 S3202 S4000 S4010

Brinzolamide Ropinirole HCl Catharanthine Pergolide mesylate Acebutolol HCl

cS3179 S3190 S3204 S4001 S4011

Meptazinol HCl Ampiroxicam

dS3180 S3193 S3208 S4002 S4012

Eletriptan HBr Ticarcillin sodium Fexofenadine HCl Desloratadine

eS3181 S3195 S3209 S4003 S4014

Ciclopirox ethanolamine

Romidepsin (FK228, Depsipeptide)

Vildagliptin (LAF-237)

Azilsartan Medoxomil

Solifenacin succinate

Diclofenac Potassium

(+,-)-Octopamine HCl

Trifluoperazine 2HCl

Carbenicillin disodium

N6-methyladenosine (m6A)

Cabozantinib malate (XL184)

Sitagliptin phosphate monohydrate

eFlumequine Amidopyrine Lithocholic acid Hyoscyamine

fS3183 S3196 S3212 S4004 S4015

Amitriptyline HCl Azacyclonol Ethambutol HCl Cyclamic acid

gS3185 S3199 S3600 S4005 S4016

Adrenalone HCl Doxycycline HCl Ouabain

hS3186 S3200 S3603 S4007 S4017

Azatadine dimaleate Triflusal Betulinic acid Pentamidine Allylthiourea


1 2 3 4 5

aS4080 S4090 S4100 S4110 S4120

Triamterene Fenspiride HCl Esmolol HCl Estradiol Benzoate Sulconazole Nitrate

bS4081 S4091 S4101 S4111 S4122

Ifenprodil Tartrate Voglibose Dicloxacillin Sodium Tilmicosin

cS4082 S4092 S4102 S4112 S4123

Spiramycin Pramoxine HCl Timolol Maleate

dS4084 S4095 S4104 S4113 S4124

Lomerizine HCl Difluprednate Desvenlafaxine Tolazoline HCl

eS4085 S4096 S4105 S4114 S4125

Levobetaxolol HCl Droperidol Closantel Sodium Triclabendazole

fS4086 S4097 S4106 S4116 S4128

Loxapine Succinate Dydrogesterone Closantel Isovaleramide Troxipide

gS4088 S4098 S4107 S4118 S4131

Flumethasone Halcinonide Clofazimine Histamine 2HCl Levodropropizine

Azlocillin sodium salt

Moclobemide (Ro 111163)

Reboxetine mesylate

Schisandrin B (Sch B)

Sulfacetamide Sodium

Eprosartan Mesylate

Desvenlafaxine Succinate

Diminazene Aceturate

Sodium Phenylbutyrate

hS4089 S4099 S4109 S4119 S4132

Dexlansoprazole Lorcaserin HCl Deoxyarbutin


1 2 3 4 5

aS4199 S4207 S4217 S4227 S4237

Antazoline HCl Clofibric Acid Fidaxomicin

bS4200 S4208 S4219 S4228 S4238

Tolperisone HCl Chromocarb Azaperone Cepharanthine

cS4201 S4209 S4220 S4229 S4239

Florfenicol Chlorocresol Bosentan Oxybuprocaine HCl Bergapten

dS4202 S4210 S4221 S4230 S4240

Verapamil HCl Benzocaine Benzbromarone Oxaprozin

eS4203 S4211 S4222 S4231 S4242

Furaltadone HCl Montelukast Sodium Piperacillin Sodium Pilocarpine HCl

fS4204 S4213 S4223 S4232 S4244

Isosorbide Dirithromycin Mevastatin Nithiamide Serotonin HCl

gS4205 S4214 S4224 S4233 S4245

Dibenzothiophene Sucralose Erythritol Zoxazolamine Sodium ascorbate

hS4206 S4216 S4225 S4235 S4246

Cysteamine HCl Valnemulin HCl Mexiletine HCl


Halobetasol Propionate

Pefloxacin Mesylate Dihydrate

Liothyronine Sodium

Primaquine Diphosphate

Fluorometholone Acetate

Doxylamine Succinate

Cetrimonium Bromide (CTAB)

Phenazopyridine HCl

Tranylcypromine (2-PCPA) HCl

1 2 3 4 5

aS4902 S5003 S7015 S7033 S7049

QNZ (EVP4593) Tacrolimus (FK506) Birinapant GSK2656157

bS4904 S6002 S7016 S7036 S7050

JZL184 NXY-059 VS-5584 (SB2343) XL019 AZ20

cS4907 S6003 S7018 S7037 S7051

SC-514 Ataluren (PTC124) CZC24832 Wnt-C59 (C59) CGI1746

dS4908 S6005 S7023 S7039 S7059

SN-38 VX-702 Z-VAD-FMK PD168393 VX-661

eS4921 S7000 S7024 S7040 S7060

AP26113 Stattic AZD3514 PP1

fS4926 S7007 S7025 S7041 S7062

(R)-Nepicastat HCl Embelin CX-6258 HCl EPZ5676

gS5001 S7008 S7028 S7046 S7065

PP2 IPI-145 (INK1197) Brefeldin A MK-8745

hS5002 S7010 S7029 S7048 S7070

GDC-0152 AZD2461 BMN 673 GSK J4 HCl


1 2 3 4 5

aS7147 S7162 S7189 S7207 S7223

LDN-212854 Mdivi-1 I-BET-762 RepSox

bS7148 S7165 S7192 S7208 S7224

ML347 UNC1999 PF-04620110 GF109203X Deltarasin

Oprozomib (ONX 0912)

MNS (3,4-Methylenedioxy-β-nitrostyrene, MDBN)

MEK162 (ARRY-162, ARRY-438162)

Tofacitinib (CP-690550) Citrate

Fingolimod (FTY720) HCl

Ro 31-8220 Mesylate

cS7149 S7167 S7193 S7209 S7229

NSC 319726 SSR128129E 1-Azakenpaullone GSK650394 RGFP966

dS7152 S7172 S7194 S7213 S7233

C646 ONX-0914 (PR-957) GZD824 Thiamet G Bromosporine

eS7153 S7173 S7195 S7214 S7234

10058-F4 AVL-292 RKI-1447 Skepinone-L IOX1

fS7155 S7176 S7198 S7215 S7237

Batimastat (BB-94) SKI II BIO OG-L002

gS7157 S7177 S7199 S7217 S7241

PF-543 DBeQ OAC1 AGI-6780

hS7158 S7185 S7206 S7218 S7242

LY2835219 AGI-5198 CNX-2006 Erastin


1 2 3 4 5

aS7337 S7359 S7372 S7392 S7423

SH-4-54 K02288 PTC-209 KN-93 Phosphate

bS7338 S7360 S7373 S7393 S7424

AZ191 OTX015 UNC669 Aloxistatin PD 151746

cS7340 S7364 S7378 S7397 S7429

CH5138303 Atglistatin AEBSF HCl Sorafenib

dS7351 S7365 S7379 S7399 S7430

JSH-23 AdipoRon E-64 FLI-06 SB-3CT

Losmapimod (GW856553X)

Ilomastat (GM6001, Galardin)

Alvelestat (AZD9668)

Loxistatin Acid (E-64C)

MI-2 (MALT1 inhibitor)

eS7353 S7367 S7380 S7414 S7434

EPZ004777 GNE-0877 TAPI-1

fS7355 S7368 S7382 S7417 S7435

ARQ 621 GNE-9605 Puromycin 2HCl AR-A014418

gS7356 S7369 S7383 S7421 S7436

HS-173 4EGI-1 CGP 57380 NH125

hS7357 S7370 S7391 S7422 S7437

PF-562271 HCl 4E1RCat Z-FA-FMK KN-62 Sal003


1 2 3 4 5

aS7595 S8004 S8016 S8028 S8038

ZM 39923 HCl TAK-438 Tariquidar UPF 1069

bS7597 S8005 S8019 S8029 S8039

BV-6 SMI-4a AZD5363 PU-H71

cS7605 S8006 S8020 S8031 S8040

BIX 01294 GW0742 NSC 23766 GDC-0349

dS7635 S8007 S8021 S8032 S8042

Lomitapide VE-821 GW2580

eS8000 S8009 S8022 S8034 S8043

Tenovin-1 AG-18 Scriptaid

fS8001 S8010 S8023 S8035 S8044

TCS 359 VU 0364439 BMS-345541

Leupeptin Hemisulfate

Caffeic Acid Phenethyl Ester

Phosphoramidon Disodium Salt

(-)-p-Bromotetramisole Oxalate

Santacruzamate A (CAY10683)

WY-14643 (Pirinixic Acid)

Filgotinib (GLPG0634)

Vortioxetine (Lu AA21004) HBr

PRT062607 (P505-15, BIIB057) HCl

Empagliflozin (BI 10773)

Apremilast (CC-10004)

Rocilinostat (ACY-1215)

PRX-08066 Maleic acid

gS8002 S8014 S8024 S8036 S8047

GSK2636771 GW9508 Tyrphostin AG 1296 Butein Dynasore

hS8003 S8015 S8025 S8037 S8048

PQ 401 CEP-32496 GSK3787 Necrostatin-1 ABT-199 (GDC-0199)


Product Details:

96 Well Format Sample Storage Tube With Screw Cap and Optional 2D Barcode

2 weeks | 4°C | in DMSO

Blue ice or Dry ice

Yes


6 7 8 9 10 11

S1049 S1064 S1072 S1085 S1094 S1103

Y-27632 2HCl Masitinib (AB1010) ZSTK474 Belinostat (PXD101) PF-04217903 ZM 447439

S1052 S1065 S1075 S1087 S1095 S1104

GDC-0941 SB216763 Iniparib (BSI-201) GDC-0879

S1053 S1066 S1076 S1088 S1096 S1105

Entinostat (MS-275) SL-327 SB203580 NVP-ADW742 LY294002

S1055 S1067 S1077 S1089 S1097 S1106

SB431542 SB202190 (FHPI) BTZ043 Racemate OSU-03012 (AR-12)

S1056 S1068 S1078 S1090 S1098 S1107

MK-2206 2HCl

S1057 S1069 S1080 S1091 S1100 S1109

SU11274 OSI-906 (Linsitinib) MLN8054 BI 2536

S1060 S1070 S1082 S1092 S1101 S1110

PHA-665752

+1-832-582-8158 or [email protected]

Elesclomol (STA-4783)

LAQ824 (Dacinostat)

Quisinostat (JNJ-26481585)

Enzastaurin (LY317615)

Refametinib (RDEA119, Bay 86-9766)

AC480 (BMS-599626)

Crizotinib (PF-02341066)

PCI-24781 (Abexinostat)

Rucaparib (AG-014699,PF-01367338)

Danusertib (PHA-739358)

Obatoclax Mesylate (GX15-070)

AUY922 (NVP-AUY922)

Olaparib (AZD2281, Ku-0059436)

Vismodegib (GDC-0449)

KU-55933 (ATM Kinase Inhibitor)

Vatalanib (PTK787) 2HCl

Varespladib (LY315920)

S1061 S1071 S1084 S1093 S1102 S1111

Nutlin-3 HA14-1 GSK1904529A U0126-EtOH


6 7 8 9 10 11

S1165 S1173 S1183 S1193 S1201 S1210

ABT-751 (E7010) WZ4002 Thalidomide Dimesna Methotrexate

S1166 S1174 S1185 S1194 S1202 S1212

Cisplatin MK-2866 (GTx-024) Ritonavir CUDC-101 Dutasteride Bendamustine HCl

S1167 S1175 S1186 S1195 S1204 S1213

CP-724714 BIIB021 BIBR 1532 TAK-700 (Orteronel) Melatonin Nelarabine

S1168 S1177 S1188 S1196 S1205 S1214

PD98059 Anastrozole Exemestane PIK-75 Bleomycin Sulfate

S1169 S1178 S1189 S1197 S1206 S1216

TGX-221 Aprepitant Finasteride Bisoprolol fumarate PFI-1 (PF-6405761)

S1170 S1179 S1190 S1198 S1207 S1218

WZ3146 WZ8040 Bicalutamide Irinotecan Tivozanib (AV-951) Clofarabine

S1171 S1180 S1191 S1199 S1208 S1219

CYC116 XAV-939 Fulvestrant Cladribine YM201636

S1172 S1181 S1192 S1200 S1209 S1220

ENMD-2076 Raltitrexed Decitabine OSI-930


6 7 8 9 10 11

Brivanib (BMS-540215)

Foretinib (GSK1363089)

Danoprevir (ITMN-191)

Valproic acid sodium salt (Sodium valproate)

Regorafenib (BAY 73-4506)

Doxorubicin (Adriamycin)

JNJ-26854165 (Serdemetan)

Fluorouracil (5-Fluoracil, 5-FU)

S1281 S1289 S1304 S1328 S1342 S1357

Aniracetam Carmofur Megestrol Acetate Etodolac Genistein Lidocaine

S1282 S1291 S1305 S1329 S1343 S1358

Artemisinin Cetirizine DiHCl Etomidate Ginkgolide B Loratadine

S1283 S1293 S1312 S1330 S1344 S1359

Asenapine Cilnidipine Felbamate Glimepiride

S1284 S1294 S1315 S1331 S1351 S1360

Benazepril HCl Cilostazol Ki16425 Fluconazole Ivermectin GSK1059615

S1285 S1297 S1319 S1332 S1352 S1361

Biperiden HCl Epothilone A Costunolide Flumazenil TG100-115 MGCD-265

S1286 S1299 S1322 S1333 S1353 S1362

Budesonide Floxuridine Fluoxetine HCl Ketoconazole

S1287 S1300 S1324 S1334 S1354 S1363

Bumetanide Doxazosin Mesylate Flupirtine maleate Lansoprazole Ki8751

S1288 S1302 S1326 S1336 S1356 S1364

Camptothecin Ifosfamide Edaravone Levetiracetam


6 7 8 9 10 11

S1439 S1452 S1460 S1472 S1483 S1494

Tranilast SP600125 Iloperidone LY2228820

S1441 S1453 S1462 S1474 S1484 S1497

Venlafaxine Tipifarnib AZD6482 GSK429286A MC1568 Pralatrexate

S1442 S1454 S1465 S1475 S1485 S1500

Mercaptopurine (6-MP)

Streptozotocin (STZ)

Losartan Potassium (DuP 753)

Dexamethasone (DHAP)

Rigosertib (ON-01910)

FT-207 (NSC 148958)

Fluvoxamine maleate

Epothilone B (EPO906, Patupilone)

Ispinesib (SB-715992)

Safinamide Mesylate

Voriconazole PHA-680632 Moxifloxacin HCl HMN-214 Betamethasone

S1443 S1455 S1466 S1476 S1486 S1501

Zileuton Cilomilast Calcitriol SB525334

S1444 S1456 S1467 S1478 S1487 S1502

Ziprasidone HCl Doxercalciferol Oligomycin A PHA-793887 Cephalexin

S1445 S1457 S1468 S1480 S1488 S1504

Zonisamide Atazanavir Sulfate Alfacalcidol Naratriptan Dyphylline

S1450 S1458 S1469 S1481 S1489 S1505

Nanchangmycin VX-745 Calcifediol PIK-93 Aztreonam

S1451 S1459 S1470 S1482 S1490 S1508

Aurora A Inhibitor I Thiazovivin Alprostadil


6 7 8 9 10 11

S1575 S1601 S1610 S1622 S1631 S1643

RO4929097 Reserpine Metolazone Prednisone Allopurinol Sodium Ursodiol

S1576 S1603 S1611 S1623 S1633 S1644

Sulfasalazine Furosemide Cefoperazone Acetylcysteine Zafirlukast Nitrofural

S1577 S1604 S1613 S1625 S1635 S1645

Tie2 kinase inhibitor Silodosin Ethinyl Estradiol Erythromycin Ketoprofen

S1578 S1605 S1614 S1626 S1636 S1646

Candesartan Cefdinir Riluzole Naproxen Amphotericin B Ketorolac

S1582 S1606 S1615 S1627 S1638 S1647

Pimasertib (AS-703026)

AEE788 (NVP-AEE788)

Mycophenolate Mofetil

Zibotentan (ZD4054)

VX-222 (VCH-222, Lomibuvir)

Zosuquidar (LY335979) 3HCl

TSU-68 (SU6668, Orantinib)

Daclatasvir (BMS-790052)

Ponatinib (AP24534)

Olmesartan Medoxomil

H 89 2HCl Clotrimazole Risperidone Nitazoxanide Ibuprofen Adenosine

S1590 S1607 S1618 S1628 S1639 S1649

TWS119 Sulfameter Amprenavir Zolmitriptan

S1593 S1608 S1619 S1629 S1640 S1651

Apixaban Prilocaine Orlistat Albendazole Telbivudine

S1594 S1609 S1620 S1630 S1641 S1652

Methimazole Allopurinol Chlorothiazide Monobenzone


6 7 8 9 10 11

S1719 S1733 S1741 S1761 S1773 S1792

Zalcitabine Methylprednisolone Rifabutin Suprofen Simvastatin

S1721 S1734 S1742 S1762 S1776 S1793

Azathioprine Meloxicam Nevirapine Pyrazinamide Toremifene Citrate Ramipril

S1723 S1735 S1744 S1763 S1777 S1794

Indomethacin Mesna Nicotinic Acid Ethionamide Fenofibrate

S1725 S1736 S1747 S1764 S1778 S1799

Terbinafine Methocarbamol Nimodipine Rifampin Trifluridine Ranolazine

S1727 S1737 S1748 S1767 S1782 S1801

Levonorgestrel Prednisolone Nisoldipine Beta Carotene Azacitidine Ranitidine

S1729 S1738 S1756 S1768 S1784 S1802

Gemfibrozil Telmisartan Enoxacin Cefditoren Pivoxil Vidarabine Acadesine

S1730 S1739 S1759 S1770 S1787 S1805

Indapamide Thiabendazole Sulfadiazine Teniposide

Rizatriptan Benzoate

Triamcinolone Acetonide

Pyridostigmine Bromide

Semagacestat (LY450139)

Darunavir Ethanolate

Oxytetracycline (Terramycin)

Quetiapine Fumarate

Pitavastatin Calcium Acetylcholine Chloride

S1732 S1740 S1760 S1771 S1790 S1806

Mitotane Guaifenesin Rifapentine Chlorprothixene Rifaximin Acipimox


6 7 8 9 10 11

S1895 S1905 S1916 S1937 S1959 S1973

Dipyridamole Amlodipine Sulfisoxazole Isoniazid Tolfenamic Acid Cyclocytidine HCl

S1896 S1907 S1917 S1940 S1960 S1974

Hydroxyurea Metronidazole Crystal Violet Levofloxacin Pranoprofen Meglumine

S1897 S1908 S1920 S1941 S1962 S1975

Potassium Iodide Flutamide Haloperidol Enalapril Maleate Sulphadimethoxine Aripiprazole

S1898 S1909 S1921 S1949 S1964 S1978

Tropisetron Fluvastatin Sodium Phenindione Menadione Rimantadine Methscopolamine

S1899 S1910 S1928 S1952 S1965 S1979

Tioconazole Alibendol Methoxsalen Primidone Amiodarone HCl

S1902 S1913 S1929 S1956 S1969 S1983

Vitamin B12 Tropicamide Irsogladine Miconazole Nitrate Nefiracetam Adenine HCl

S1903 S1914 S1933 S1957 S1971 S1987

Diclofenac Sodium Pregnenolone Triamcinolone Sulfamethizole Nicorandil

S1904 S1915 S1934 S1958 S1972 S1988

Avobenzone Sulfamethoxazole Sulbactam Tamoxifen Citrate Propylthiouracil

Nicotinamide (Vitamin B3)

Mometasone furoate

Nystatin (Fungicidin)


6 7 8 9 10 11

S2059 S2069 S2084 S2098 S2113 S2124

Terazosin HCl Argatroban Duloxetine HCl Bexarotene Xylose

S2060 S2074 S2085 S2099 S2114 S2125

Bromhexine HCl Mecarbinate Trimebutine Temocapril HCl Dronedarone HCl Mestranol

S2061 S2077 S2086 S2101 S2116 S2126

Lovastatin Ivabradine HCl Gabexate Mesylate Conivaptan HCl Naftopidil

S2062 S2078 S2087 S2102 S2118 S2127

Tiopronin Famotidine Rasagiline Mesylate Ibutilide Fumarate S- (+)-Rolipram

S2064 S2079 S2091 S2103 S2119 S2128

Balofloxacin Moexipril HCl Betaxolol Naltrexone HCl Probucol Bazedoxifene HCl

S2065 S2080 S2092 S2104 S2120 S2130

Lafutidine Clevidipine Butyrate Detomidine HCl Levosulpiride Arbidol HCl Atropine

S2066 S2081 S2096 S2108 S2121 S2131

Moxonidine Almotriptan Malate Flunixin Meglumin Licofelone Roflumilast

S2067 S2082 S2097 S2109 S2123 S2134

Ozagrel HCl Adiphenine HCl Ambrisentan Imidapril HCl Dextrose AZD8330


6 7 8 9 10 11

S2218 S2228 S2239 S2253 S2264 S2276

PP242 VX-765 Tubacin Artemether Bilobalide

Cisatracurium Besylate

Atorvastatin Calcium

Rivastigmine Tartrate

Cilazapril Monohydrate

3-Indolebutyric acid (IBA)

S2219 S2229 S2240 S2256 S2265 S2277

CYT387 Eltrombopag Artesunate Caffeic Acid

S2220 S2230 S2243 S2258 S2266 S2280

SB590885 LY2157299 Degrasyn (WP1130) Esculin Asiatic Acid Chlorogenic Acid

S2221 S2231 S2244 S2259 S2267 S2281

Apatinib Telatinib AR-42 Aloe-emodin Azomycin Chrysin

S2224 S2232 S2247 S2260 S2268 S2282

UK 383367 Ketanserin Laetrile Baicalein Cinchonidine

S2225 S2233 S2248 S2261 S2269 S2285

TAME Andrographolide Baicalin Cryptotanshinone

S2226 S2235 S2250 S2262 S2270 S2286

Volasertib (BI 6727) Apigenin Bergenin Cyclosporin A

S2227 S2238 S2252 S2263 S2271 S2287

PIK-294 Palomid 529 (P529) (+)-Usniacin Arbutin Berberine HCl Cytisine


6 7 8 9 10 11

S2342 S2354 S2364 S2373 S2381 S2391

Phloretin Sclareol Tanshinone I Yohimbine HCl D-Mannitol Quercetin

S2343 S2355 S2365 S2374 S2383 S2392

Phlorizin Sclareolide Tanshinone IIA Gastrodin Sesamin

S2344 S2356 S2366 S2375 S2384 S2393

Piperine Shikimic Acid Aloin Hematoxylin Sorbitol

Fesoterodine Fumarate

4-Methylumbelliferone (4-MU)

BKM120 (NVP-BKM120, Buparlisib)

Esomeprazole Sodium

CX-4945 (Silmitasertib)

CAL-101 (Idelalisib, GS-1101)

(-)-Epigallocatechin Gallate

5-hydroxytryptophan (5-HTP)

Taxifolin (Dihydroquercetin)

S2346 S2357 S2367 S2376 S2385 S2394

Puerarin Silibinin Hordenine Naringenin

S2347 S2358 S2369 S2377 S2386 S2395

Quercetin Dihydrate Silymarin Troxerutin Biochanin A Indirubin Rheochrysidin

S2349 S2359 S2370 S2378 S2387 S2396

Rutaecarpine Sinomenine Ursolic Acid Lappaconite HBr Salidroside

S2350 S2362 S2371 S2379 S2389 S2397

Rutin Synephrine Vanillylacetone Dioscin Palmatine chloride

S2351 S2363 S2372 S2380 S2390 S2399

Salicin Tangeretin Xanthone Diosmetin Polydatin Dihydromyricetin


6 7 8 9 10 11

S2471 S2484 S2494 S2503 S2516 S2527

Milrinone Olopatadine HCl Racecadotril Xylazine HCl Methacycline HCl

S2473 S2485 S2495 S2504 S2517 S2528

Hexestrol Mitoxantrone HCl Oxymetazoline HCl Ribavirin Maprotiline HCl Ciclopirox

S2475 S2486 S2496 S2506 S2519 S2529

Imatinib (STI571) Moroxydine HCl Ozagrel Roxithromycin Naphazoline HCl Dopamine HCl

S2476 S2487 S2497 S2508 S2521 S2531

Itraconazole Mycophenolic acid Scopolamine HBr Asaraldehyde

S2479 S2489 S2498 S2509 S2522 S2532

Lincomycin HCl Nateglinide D-Pantothenic acid Sotalol L-Adrenaline

Tetrahydropapaverine HCl

Ammonium Glycyrrhizinate

Butylscopolamine Bromide

Naringin Dihydrochalcone

Gallamine Triethiodide

Pancuronium dibromide

Epinephrine Bitartrate

L-Ascorbyl 6-palmitate

S2480 S2491 S2499 S2510 S2524 S2533

Loperamide HCl Nitrendipine Spectinomycin HCl Phenytoin sodium Ritodrine HCl

S2481 S2492 S2500 S2512 S2525 S2534

Manidipine Novobiocin Sodium Propafenone HCl Tenoxicam Phenytoin Isoconazole nitrate

S2482 S2493 S2502 S2515 S2526 S2535

Manidipine 2HCl Olanzapine Alizarin Econazole nitrate


6 7 8 9 10 11

S2599 S2608 S2620 S2629 S2637 S2662

L-Thyroxine Fluocinonide GSK256066 PNU-120596 TAK-875 ICG-001

S2601 S2610 S2621 S2630 S2638 S2663

Gliclazide Lonidamine AZD5438 GW3965 HCl

S2602 S2612 S2622 S2631 S2639 S2664

Acemetacin Ribitol PP121 URB597 Clinofibrate

S2603 S2613 S2623 S2632 S2656 S2665

Tioxolone Clorsulon BMS-378806 Ciprofibrate

S2604 S2614 S2624 S2633 S2658 S2666

Arecoline OSI-027 NPS-2143 PF-3845

S2605 S2615 S2625 S2634 S2659 S2667

Idebenone Fostamatinib (R788)

S2606 S2617 S2626 S2635 S2660 S2670

Mifepristone TAK-733 LY2603618 CCT128930 MK-0752 A-674563

Phenoxybenzamine HCl

Quinine HCl Dihydrate

Vardenafil HCl Trihydrate

NU7441 (KU-57788)

WAY-100635 Maleate

SNX-2112 (PF-04928473)

Omecamtiv mecarbil (CK-1827452)

PF-04929113 (SNX-5422)

Dehydroepiandrosterone (DHEA)

GSK2126458 (GSK458)

Noradrenaline bitartrate monohydrate

DCC-2036 (Rebastinib)

5-hydroxymethyl Tolterodine (PNU 200577, 5-HMT, 5-HM)

Dolutegravir (GSK1349572)

S2607 S2619 S2627 S2636 S2661 S2671

Buflomedil HCl MG-132 Tubastatin A HCl A66 AS-252424


6 7 8 9 10 11

S2736 S2749 S2761 S2774 S2782 S2792

NVP-BVU972 MK-2461 GW4064 Torcetrapib

S2738 S2750 S2765 S2775 S2783 S2794

PAC-1 GW788388 MK-2048 Nocodazole AZD2014

S2742 S2751 S2767 S2776 S2784 S2795

PHA-767491 3-Methyladenine CPI-613 TAK-285 VU 0357121

S2743 S2752 S2768 S2777 S2785 S2796

PF-04691502 HER2-Inhibitor-1 PF-5274857 A-803467 WP1066

S2744 S2755 S2769 S2778 S2787 S2797

CCT137690 Varlitinib GW842166X Laquinimod Lonafarnib

S2746 S2758 S2770 S2779 S2789 S2801

AZ 628 Wortmannin MK-5108 (VX-689) M344 AZD4547

S2747 S2759 S2772 S2780 S2790 S2803

AMG-458 CUDC-907 Istradefylline Galeterone

S2748 S2760 S2773 S2781 S2791 S2804

Canagliflozin SB705498 RITA (NSC 652287) Sotrastaurin Sirtinol


6 7 8 9 10 11

WYE-125132 (WYE-132)

TG101348 (SAR302503)

BGT226 (NVP-BGT226)

Sofosbuvir (PSI-7977, GS-7977)

Milciclib (PHA-848125)

Dinaciclib (SCH727965)

Dovitinib (TKI-258) Dilactic Acid

Tofacitinib (CP-690550,Tasocitinib)

Dalcetrapib (JTT-705, RO4607381)

I-BET151 (GSK1210151A)

Anacetrapib (MK-0859)

S2865 S2875 S2892 S2902 S2912 S2922

VUF 10166 Prucalopride VU 0361737 WZ811 Icotinib

S2866 S2876 S2894 S2903 S2913 S2923

U-104 (-)-MK 801 Maleate SB742457 Lumiracoxib BAY 11-7082 Salubrinal

S2867 S2882 S2895 S2904 S2914 S2924

WHI-P154 Tyrphostin 9 PF-477736

S2868 S2883 S2896 S2905 S2915 S2925

Alogliptin ZM 323881 HCl JNJ-7777120 GW9662

S2870 S2884 S2897 S2906 S2916 S2927

TG100713 ZM 306416 Ki16198 ML161

S2871 S2885 S2899 S2907 S2918 S2928

T0070907 A-205804 GNF-2 Pirfenidone HC-030031 TAK-715

S2872 S2886 S2900 S2910 S2919 S2929

GW5074 PJ34 Tempol IOX2 Pifithrin-α (PFTα)

S2874 S2890 S2901 S2911 S2921 S2930

Camostat Mesilate PF-562271 CCG 50014 Go 6983 PF-4981517 Pifithrin-μ


6 7 8 9 10 11

S3063 S3076 S3105 S3130 S3146 S3161

Foscarnet Sodium Nadifloxacin Biotin (Vitamin B7) Tripelennamine HCl

S3064 S3078 S3106 S3132 S3147 S3162

Ambroxol HCl Pidotimod Sulfamerazine Entacapone Tylosin tartrate

S-Ruxolitinib (INCB018424)

IKK-16 (IKK Inhibitor VII)

Dapivirine (TMC120)

CHIR-99021 (CT99021) HCl

4-Aminohippuric Acid

Evacetrapib (LY2484595)

Acesulfame Potassium

Apoptosis Activator 2

Cobicistat (GS-9350)

Diclofenac Diethylamine

Sertaconazole nitrate

Beclomethasone dipropionate

S3066 S3079 S3113 S3133 S3149 S3163

Naloxone HCl Atovaquone Pyridoxine HCl Sulfamethazine Estradiol valerate

S3067 S3080 S3114 S3137 S3150 S3167

Chlorhexidine HCl Etravirine (TMC125) Vitamin C Sodium salicylate Articaine HCl Altrenogest

S3070 S3081 S3116 S3138 S3151 S3170

Piracetam Ulipristal Sulfathiazole Methylthiouracil Gliquidone Ampicillin sodium

S3071 S3083 S3117 S3139 S3154 S3172

Vanillin Indacaterol Maleate Oxybutynin chloride Methenamine Butenafine HCl Anagrelide HCl

S3073 S3100 S3121 S3140 S3155 S3173

2-Thiouracil Ornidazole Milnacipran HCl Mepivacaine HCl Antipyrine

S3075 S3104 S3129 S3144 S3160 S3175

Dexmedetomidine Moguisteine Trimethoprim Darifenacin HBr Ethynodiol diacetate Atomoxetine HCl


6 7 8 9 10 11

S4019 S4027 S4041 S4049 S4059 S4072

Avanafil Flavoxate HCl Olsalazine Sodium Valdecoxib

S4020 S4031 S4042 S4050 S4062 S4073

Sodium Picosulfate Aclidinium Bromide Nafcillin Sodium Valganciclovir HCl Ronidazole

S4021 S4034 S4043 S4051 S4063 S4074

Tolcapone Nabumetone Vitamin D3 Sodium Nitrite

S4022 S4035 S4044 S4053 S4064 S4075

Probenecid Vitamin D2 Toltrazuril Sertraline HCl Zinc Pyrithione

S4023 S4037 S4045 S4054 S4065 S4076

Benztropine mesylate

Caspofungin Acetate

Sodium Nitroprusside

Decamethonium Bromide

Sodium 4-Aminosalicylate

Diphemanil Methylsulfate

Tetrahydrozoline HCl

Escitalopram Oxalate

Procaine HCl Doxapram HCl Spironolactone Guanabenz Acetate Propranolol HCl

S4024 S4038 S4046 S4056 S4068 S4077

Dibucaine HCl Estradiol Cypionate Retapamulin Tinidazole Mequinol

S4025 S4039 S4047 S4057 S4070 S4078

Methazolamide Bisacodyl Methyclothiazide Guanidine HCl Mefenamic Acid

S4026 S4040 S4048 S4058 S4071 S4079

Hydroxyzine 2HCl Norethindrone Carbimazole Ropivacaine HCl Griseofulvin Ticagrelor


6 7 8 9 10 11

S4135 S4148 S4162 S4171 S4181 S4190

Clorprenaline HCl Ampicillin Trihydrate Choline Chloride Nicardipine HCl Cinchophen

S4136 S4149 S4163 S4172 S4182 S4191

Carprofen Doxycycline Hyclate Nifuroxazide Betamipron

S4138 S4151 S4164 S4173 S4184 S4192

Dropropizine Penfluridol Doxofylline 1-Hexadecanol Penciclovir Chlorquinaldol

S4139 S4152 S4165 S4175 s4185 S4194

Cyclizine 2HCl Ethamsylate Benzydamine HCl Sulfaguanidine Tiratricol Azaguanine-8

S4141 S4155 S4166 S4176 S4186 S4195

Dinitolmide Chlorzoxazone Chlorpropamide Trometamol Domiphen Bromide Broxyquinoline

S4143 S4159 S4167 S4177 S4187 S4196

Bezafibrate Cyromazine Uracil Salicylanilide

S4144 S4160 S4169 S4178 S4188 S4197

Amprolium HCl Penicillin G Sodium Teriflunomide Climbazole Sasapyrine Bemegride

Pheniramine Maleate

Homatropine Methylbromide

Homatropine Bromide

Benzethonium Chloride

Amfenac Sodium Monohydrate

Cetylpyridinium Chloride

Pentoxyverine Citrate

Ethacridine lactate monohydrate

S4146 S4161 S4170 S4179 S4189 S4198

Bacitracin Benzoic Acid Coumarin Mezlocillin Sodium Cyclandelate Aminothiazole


6 7 8 9 10 11

S4247 S4256 S4265 S4276 S4285 S4294

Buspirone HCl Nicaraven Etizolam Ospemifene Procainamide HCl

S4248 S4257 S4266 S4277 S4286 S4295

Bromfenac Sodium Alizapride HCl Brimonidine Tartrate Bambuterol HCl

S4249 S4258 S4267 S4278 S4288 S4297

Flopropione Luliconazole Diacerein Carteolol HCl Chloroambucil Mupirocin

S4250 S4259 S4268 S4279 S4289 S4299

Vilazodone HCl Flufenamic acid Demeclocycline HCl MetoclopraMide HCl Dicoumarol

S4251 S4260 S4269 S4280 S4290 S4420

Phenothiazine Tamibarotene Vinorelbine Tartrate Digoxin Mefloquine HCl

S4252 S4261 S4270 S4282 S4291 S4627

EUK 134 Oxiracetam Nelfinavir Mesylate Labetalol HCl

S4253 S4263 S4273 S4283 S4292 S4900

Epinastine HCl Efaproxiral Sodium 3-Aminobenzamide Diphenidol HCl Tenovin-6

S4255 S4264 S4274 S4284 S4293 S4901

Quinacrine 2HCl Etofibrate Rotigotine Chloroprocaine HCl Promethazine HCl JNK-IN-8


Prucalopride Succinat

Anidulafungin (LY303366)

Meclofenamate Sodium

Sulfamethoxypyridazine

Meclofenoxate (Centrophenoxine) HCl

Mechlorethamine HCl

TTNPB (Arotinoid Acid)

Cyclobenzaprine HCl

6 7 8 9 10 11

S7071 S7087 S7097 S7111 S7127 S7136

(+)-Bicuculline GSK2334470 NLG919 TIC10 CGK 733

S7072 S7088 S7098 S7113 S7128 S7138

UNC1215 PD123319 Zebularine EPZ-6438 BMS-833923

S7076 S7090 S7099 S7114 S7129 S7139

T0901317 GSK923295 (-)-Blebbistatin NU6027 PYR-41 CFTRinh-172

S7077 S7091 S7102 S7115 S7130 S7140

Cilengitide VE-822 AMG-517 PR-619 TCID

S7079 S7092 S7104 S7120 S7132 S7142

SGC 0946 SANT-1 AZD1208 P5091 (P005091) NSC697923

S7083 S7093 S7106 S7122 S7133 S7143

LDK378 IPA-3 AZD3463 XL888 P22077 LGK-974

S7085 S7094 S7108 S7124 S7134 S7145

IWP-2 PF-3758309 LGX818 SC144 IU1 AZD1080

S7086 S7096 S7110 S7125 S7135 S7146

IWR-1-endo KY02111 (+)-JQ1 KPT-185 LDN-57444 DMH1


6 7 8 9 10 11

S7243 S7258 S7273 S7291 S7304 S7325

Ferrostatin-1 (Fer-1) SKLB1002 SC75741 TAK-632 CPI-203 UNC2881

S7248 S7261 S7276 S7292 S7307 S7326

Ro3280 Beta-Lapachone SGI-1027 GSK2606414 Tasisulam

HSP990 (NVP-HSP990)

NMDA (N-Methyl-D-aspartic acid)

Zotarolimus(ABT-578)

3-Deazaneplanocin A (DZNeP)

RG2833 (RGFP109)

S7251 S7263 S7279 S7293 S7310 S7327

KPT-276 AZD1981 ZCL278 SF1670 ID-8

S7252 S7265 S7280 S7295 S7316 S7329

KPT-330 MM-102 Edoxaban RVX-208 STF-118804 IOWH032

S7253 S7266 S7282 S7297 S7317 S7330

AZD2858 Golgicide A NMS-E973 AZD9291 WZ4003 6H05

S7255 S7269 S7284 S7300 S7319 S7332

PD173955 CO-1686 (AVL-301) PJ34 HCl EHop-016

S7256 S7270 S7285 S7301 S7320 S7333

SGC-CBP30 SRPIN340 NMS-873 IWP-L6 TG003

S7257 S7272 S7289 S7303 S7324 S7336

CNX-774 4μ8C PFK15 Rilpivirine TMP269 CW069


6 7 8 9 10 11

S7438 S7458 S7482 S7499 S7516 S7529

ME0328 VER-49009 EHT 1864 ESI-09 Y-320 ML323

S7440 S7459 S7484 S7500 S7517 S7534

LEE011 VER-50589 FH535 HJC0350 AZD7545 BAPTA-AM

S7447 S7460 S7488 S7501 S7518 S7539

ZLN005 BTB06584 MPI-0479605 HO-3867 PTC-209 HBr

S7448 S7461 S7489 S7505 S7520 S7546

CORM-3 LDC000067 YH239-EE (S)-crizotinib

Suvorexant (MK-4305)

NMS-P937 (NMS1286937)

K-Ras(G12C) inhibitor 9

K-Ras(G12C) inhibitor 6

Voreloxin (SNS-595)

Darapladib (SB-480848)

Pritelivir (BAY 57-1293)

S7449 S7462 S7490 S7508 S7523 S7565

CRT0044876 PI-1840 WIKI4 JNK Inhibitor IX GS-9973 WH-4-023

S7450 S7467 S7493 S7509 S7525 S7566

FH1(BRD-K4477) LB42708 INH1 ML167 XMD8-92 IM-12

S7451 S7470 S7494 S7513 S7526 S7587

FPH1 (BRD-6125) Triapine INH6 Trelagliptin GNF-5 INCB024360

S7452 S7473 S7497 S7515 S7528 S7589

FPH2 (BRD-9424) Nexturastat A CK-636 VGX-1027 GNE-7915 N6022


6 7 8 9 10 11

S8049 S8065

Empty Empty Empty Empty

Tubastatin A Nutlin-3b

S8050 S8072


ETP-46464 NSC 405020

S8051 S8073


Macitentan Optovin

S8056 S8076


Lomeguatrib

S8057 S8077


Pacritinib (SB1518) RI-1

S8058 S8078


P276-00 Bardoxolone Methyl

PluriSIn #1 (NSC 14613)

S8059

Empty Empty Empty Empty Empty

Nutlin-3a

S8061

Empty Empty Empty Empty Empty

Sabutoclax


Product Details:

96 Well Format Sample Storage Tube With Screw Cap and Optional 2D Barcode

2 weeks | 4°C | in DMSO

Blue ice or Dry ice

Yes


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Catalog No.Product NamPlate LocatioRack NumberM.w. CAS NumberFormS1001 ABT-263 (Navita1 L1700-01 974.61 923564-51-6 free base

S1002 ABT-737 b1 L1700-01 813.43 852808-04-9 free base

S1003 Linifanib (ABT-c1 L1700-01 375.41 796967-16-3 free base

S1004 Veliparib (ABTd1 L1700-01 244.29 912444-00-9 free base

S1005 Axitinib e1 L1700-01 386.47 319460-85-0 free base

S1006 Saracatinib (A f1 L1700-01 542.03 379231-04-6 free base

S1007 FG-4592 g1 L1700-01 352.34 808118-40-3 free base

S1008 Selumetinib (Ah1 L1700-01 457.68 606143-52-6 free base

S1010 Nintedanib (BI a2 L1700-01 539.62 656247-17-5 free base

S1011 Afatinib (BIBWb2 L1700-01 485.94 439081-18-2 free base

S1012 BMS-536924 c2 L1700-01 479.96 468740-43-4 Free BaseS1013 Bortezomib (PSd2 L1700-01 384.24 179324-69-7 free base

S1014 Bosutinib (SKIe2 L1700-01 530.45 380843-75-4 free base

S1017 Cediranib (AZDf2 L1700-01 450.51 288383-20-0 free base

S1018 Dovitinib (TKI-g2 L1700-01 392.43 405169-16-6 citrate

S1020 PD184352 (CI-1h2 L1700-01 478.67 212631-79-3 free base

S1021 Dasatinib a3 L1700-01 488.01 302962-49-8 free base

S1022 Ridaforolimus b3 L1700-01 990.21 572924-54-0 free base

S1023 Erlotinib HCl ( c3 L1700-01 429.9 183319-69-9 hydrochloride

S1025 Gefitinib (ZD18d3 L1700-01 446.9 184475-35-2 free base

S1026 Imatinib Mesylae3 L1700-01 589.71 220127-57-1 mesylate

S1028 Lapatinib (GW-f3 L1700-01 925.46 388082-77-7 ditosylat

S1029 Lenalidomide (g3 L1700-01 259.26 191732-72-6 free base

S1030 Panobinostat h3 L1700-01 349.43 404950-80-7 free base

S1032 Motesanib Dipa4 L1700-01 569.44 857876-30-3 diphosphate

S1033 Nilotinib (AMNb4 L1700-01 529.52 641571-10-0 free base

S1034 NVP-AEW541 c4 L1700-01 439.55 475489-16-8 free base

S1035 Pazopanib HCld4 L1700-01 473.98 635702-64-6 hydrochloride

S1036 PD0325901 e4 L1700-01 482.19 391210-10-9 free base

S1038 PI-103 f4 L1700-01 348.36 371935-74-9 free base

S1039 Rapamycin (Sirg4 L1700-01 914.18 53123-88-9 free base

S1040 Sorafenib Tosyh4 L1700-01 637.03 475207-59-1 tosylate

S1041 STF-62247 a5 L1700-01 267.35 315702-99-9 free base

S1042 Sunitinib Malatb5 L1700-01 532.56 341031-54-7 malate

S1043 Tandutinib (MLc5 L1700-01 562.7 387867-13-2 free base

S1044 Temsirolimus (d5 L1700-01 1030.29 162635-04-3 free base

S1045 Trichostatin A e5 L1700-01 302.4 58880-19-6 free base

S1046 Vandetanib (ZDf5 L1700-01 475.35 443913-73-3 free base

S1047 Vorinostat (S g5 L1700-01 264.3 149647-78-9 free base

S1048 VX-680 (Tozaseh5 L1700-01 464.59 639089-54-6 free base

S1049 Y-27632 2HCl a6 L1700-01 320.26 129830-38-2 dihydrochloric

S1052 Elesclomol (STb6 L1700-01 400.5 488832-69-5 free base

S1053 Entinostat (MSc6 L1700-01 376.41 209783-80-2 free base

S1055 Enzastaurin (Ld6 L1700-01 515.61 170364-57-5 free base

S1056 AC480 (BMS-59e6 L1700-01 567.01 714971-09-2 free base

S1057 Obatoclax Mesyf6 L1700-01 413.49 803712-79-0 mesylate

S1060 Olaparib (AZD2g6 L1700-01 434.46 763113-22-0 free base

S1061 Nutlin-3 h6 L1700-01 581.5 890090-75-2 free base

S1064 Masitinib (AB1a7 L1700-01 498.64 790299-79-5 free base

S1065 GDC-0941 b7 L1700-01 513.64 957054-30-7 free base

S1066 SL-327 c7 L1700-01 335.35 305350-87-2 free base

S1067 SB431542 d7 L1700-01 384.39 301836-41-9 free base

S1068 Crizotinib (PF-e7 L1700-01 450.34 877399-52-5 free base

S1069 AUY922 (NVP- f7 L1700-01 465.54 747412-49-3 free base

S1070 PHA-665752 g7 L1700-01 641.61 477575-56-7 free base

S1071 HA14-1 h7 L1700-01 409.23 65673-63-4 free base

S1072 ZSTK474 a8 L1700-01 417.41 475110-96-4 free base

S1075 SB216763 b8 L1700-01 371.22 280744-09-4 free base

S1076 SB203580 c8 L1700-01 377.43 152121-47-6 free base

S1077 SB202190 (FHPd8 L1700-01 331.34 152121-30-7 free base

S1078 MK-2206 2HCl e8 L1700-01 480.39 1032350-13-2 dihydrochloride

S1080 SU11274 f8 L1700-01 568.09 658084-23-2 free base

S1082 Vismodegib (Gg8 L1700-01 421.3 879085-55-9 free base

S1084 Brivanib (BMS-h8 L1700-01 370.38 649735-46-6 free base

S1085 Belinostat (PX a9 L1700-01 318.35 414864-00-9 free base

S1087 Iniparib (BSI-2 b9 L1700-01 292.03 160003-66-7 free base

S1088 NVP-ADW742 c9 L1700-01 453.58 475488-23-4 free base

S1089 Refametinib (Rd9 L1700-01 572.34 923032-37-5 Free BaseS1090 PCI-24781 (Abee9 L1700-01 397.42 783355-60-2 free base

S1091 OSI-906 (Linsitf9 L1700-01 421.49 867160-71-2 free base

S1092 KU-55933 (ATM g9 L1700-01 395.49 587871-26-9 free base

S1093 GSK1904529A h9 L1700-01 851.96 1089283-49-7 free base

S1094 PF-04217903 a10 L1700-01 372.38 956905-27-4 free base

S1095 LAQ824 (Dacinob10 L1700-01 379.459 404951-53-7 free base

S1096 Quisinostat (J c10 L1700-01 394.476 875320-29-9 free base

S1097 BTZ043 Racemd10 L1700-01 431.39 957217-65-1 Racemate

S1098 Rucaparib (AGe10 L1700-01 421.36 459868-92-9 phosphate

S1100 MLN8054 f10 L1700-01 476.86 869363-13-3 free base

S1101 Vatalanib (PTKg10 L1700-01 419.73 212141-51-0 dihydrochloride

S1102 U0126-EtOH h10 L1700-01 426.56 1173097-76-1 ethanolat

S1103 ZM 447439 a11 L1700-01 513.59 331771-20-1 free base

S1104 GDC-0879 b11 L1700-01 334.37 905281-76-7 free base

S1105 LY294002 c11 L1700-01 307.34 154447-36-6 free base

S1106 OSU-03012 (ARd11 L1700-01 460.45 742112-33-0 free base

S1107 Danusertib (PHe11 L1700-01 474.55 827318-97-8 free base

S1109 BI 2536 f11 L1700-01 521.66 755038-02-9 free base

S1110 Varespladib (Lg11 L1700-01 380.39 172732-68-2 free base

S1111 Foretinib (GSKh11 L1700-01 632.65 849217-64-7 free base

S1112 SGX-523 a1 L1700-02 359.41 1022150-57-7 free base

S1113 GSK690693 b1 L1700-02 425.48 937174-76-0 free base

S1114 JNJ-38877605 c1 L1700-02 377.35 943540-75-8 free base

S1115 Odanacatib (Md1 L1700-02 525.56 603139-19-1 free base

S1116 Palbociclib (P e1 L1700-02 483.99 827022-32-2 hydrochloride

S1117 Triciribine f1 L1700-02 320.3 35943-35-2 free base

S1118 XL147 g1 L1700-02 448.52 956958-53-5 free base

S1119 Cabozantinib (h1 L1700-02 501.51 849217-68-1 free base

S1120 Everolimus (R a2 L1700-02 958.22 159351-69-6 free base

S1121 TW-37 b2 L1700-02 573.7 877877-35-5 free base

S1122 Mocetinostat c2 L1700-02 396.44 726169-73-9 free base

S1124 BMS-754807 d2 L1700-02 461.49 1001350-96-4 free base

S1129 SRT1720 e2 L1700-02 506.02 1001645-58-4 hydrochloride

S1130 YM155 (Sepantf2 L1700-02 443.29 781661-94-7 bromide

S1132 INO-1001 g2 L1700-02 136.15 3544-24-9 free base

S1133 Alisertib (MLN h2 L1700-02 518.92 1028486-01-2 free base

S1134 AT9283 a3 L1700-02 381.43 896466-04-9 free base

S1137 Malotilate b3 L1700-02 288.38 59937-28-9 free base

S1138 Brivanib Alani c3 L1700-02 441.46 649735-63-7 alaninate

S1139 ADL5859 HCl d3 L1700-02 428.95 850173-95-4 hydrochloride

S1140 Andarine e3 L1700-02 441.36 401900-40-1 free base

S1141 17-AAG (Tanesf3 L1700-02 585.69 75747-14-7 free base

S1142 17-DMAG (Alveg3 L1700-02 653.21 467214-21-7 hydrochloride

S1143 AG-490 (Tyrphoh3 L1700-02 294.3 133550-30-8 free base

S1144 Ivacaftor (VX-7a4 L1700-02 392.49 873054-44-5 free base

S1145 SNS-032 (BMS-b4 L1700-02 380.53 345627-80-7 free base

S1147 Barasertib (A c4 L1700-02 507.56 722544-51-6 free base

S1148 Docetaxel d4 L1700-02 807.88 114977-28-5 free base

S1150 Paclitaxel e4 L1700-02 853.91 33069-62-4 free base

S1152 PLX-4720 f4 L1700-02 413.83 918505-84-7 free base

S1153 Roscovitine (Sg4 L1700-02 354.45 186692-46-6 free base

S1154 SNS-314 Mesylh4 L1700-02 527.04 1146618-41-8 mesylate

S1155 S3I-201 a5 L1700-02 365.36 501919-59-1 free base

S1156 Capecitabine b5 L1700-02 359.35 154361-50-9 free base

S1157 CEP-18770 (Dec5 L1700-02 413.28 847499-27-8 free base

S1158 MK-8245 d5 L1700-02 467.25 1030612-90-8 free base

S1159 Ganetespib (S e5 L1700-02 364.4 888216-25-9 free base

S1162 PA-824 f5 L1700-02 359.26 187235-37-6 free base

S1163 AT13387 g5 L1700-02 409.52 912999-49-6 free base

S1164 Lenvatinib (E7h5 L1700-02 426.85 417716-92-8 free base

S1165 ABT-751 (E701a6 L1700-02 371.41 141430-65-1 free base

S1166 Cisplatin b6 L1700-02 300.05 15663-27-1 free base

S1167 CP-724714 c6 L1700-02 469.53 537705-08-1 free base

S1168 Valproic acid d6 L1700-02 166.19 1069-66-5 free base

S1169 TGX-221 e6 L1700-02 364.44 663619-89-4 free base

S1170 WZ3146 f6 L1700-02 464.95 1214265-56-1 free base

S1171 CYC116 g6 L1700-02 368.46 693228-63-6 free base

S1172 JNJ-26854165 h6 L1700-02 328.41 881202-45-5 free base

S1173 WZ4002 a7 L1700-02 494.18 1213269-23-8 free base

S1174 MK-2866 (GTx-b7 L1700-02 389.33 841205-47-8 free base

S1175 BIIB021 c7 L1700-02 318.76 848695-25-0 free base

S1177 PD98059 d7 L1700-02 267.28 167869-21-8 free base

S1178 Regorafenib (Be7 L1700-02 482.82 755037-03-7 free base

S1179 WZ8040 f7 L1700-02 481.01 1214265-57-2 free base

S1180 XAV-939 g7 L1700-02 312.31 284028-89-3 free base

S1181 ENMD-2076 h7 L1700-02 375.47 934353-76-1 tartaric acid

S1183 Danoprevir (IT a8 L1700-02 731.83 850876-88-9 free base

S1185 Ritonavir b8 L1700-02 720.94 155213-67-5 free base

S1186 BIBR 1532 c8 L1700-02 331.36 321674-73-1 free base

S1188 Anastrozole d8 L1700-02 293.37 120511-73-1 free base

S1189 Aprepitant e8 L1700-02 534.43 170729-80-3 free base

S1190 Bicalutamide f8 L1700-02 430.37 90357-06-5 free base

S1191 Fulvestrant g8 L1700-02 606.77 129453-61-8 free base

S1192 Raltitrexed h8 L1700-02 458.49 112887-68-0 free base

S1193 Thalidomide a9 L1700-02 258.23 50-35-1 free base

S1194 CUDC-101 b9 L1700-02 434.49 1012054-59-9 free base

S1195 TAK-700 (Orterc9 L1700-02 307.35 426219-18-3 free base

S1196 Exemestane d9 L1700-02 296.4 107868-30-4 free base

S1197 Finasteride e9 L1700-02 372.54 98319-26-7 free base

S1198 Irinotecan f9 L1700-02 586.68 97682-44-5 free base

S1199 Cladribine g9 L1700-02 285.69 4291-63-8 free base

S1200 Decitabine h9 L1700-02 228.21 2353-33-5 free base

S1201 Dimesna a10 L1700-02 326.34 16208-51-8 free base

S1202 Dutasteride b10 L1700-02 528.53 164656-23-9 free base

S1204 Melatonin c10 L1700-02 232.28 73-31-4 free base

S1205 PIK-75 d10 L1700-02 488.74 372196-77-5 hydrochloride

S1206 Bisoprolol fume10 L1700-02 441.52 104344-23-2 free base

S1207 Tivozanib (AV-f10 L1700-02 454.86 475108-18-0 free base

S1208 Doxorubicin (Ag10 L1700-02 579.98 25316-40-9 hydrochloride

S1209 Fluorouracil (5h10 L1700-02 130.08 51-21-8 free base

S1210 Methotrexate a11 L1700-02 454.44 59-05-2 free base

S1212 Bendamustine b11 L1700-02 394.72 3543-75-7 hydrochloride

S1213 Nelarabine c11 L1700-02 297.27 121032-29-9 free base

S1214 Bleomycin Sulfd11 L1700-02 1512.62 9041-93-4 sulfate

S1216 PFI-1 (PF-6405e11 L1700-02 347.39 1403764-72-6 free base

S1218 Clofarabine f11 L1700-02 303.68 123318-82-1 free base

S1219 YM201636 g11 L1700-02 467.48 371942-69-7 free base

S1220 OSI-930 h11 L1700-02 443.44 728033-96-3 free base

S1221 Dacarbazine a1 L1700-03 182.18 4342-03-4 free base

S1222 Dexrazoxane HCb1 L1700-03 304.73 149003-01-0 hydrochloride

S1223 Epirubicin HClc1 L1700-03 579.98 56390-09-1 hydrochloride

S1224 Oxaliplatin d1 L1700-03 397.29 61825-94-3 free base

S1225 Etoposide e1 L1700-03 588.56 33419-42-0 free base

S1226 KU-0063794 f1 L1700-03 465.54 938440-64-3 free base

S1227 Raloxifene HClg1 L1700-03 510.04 82640-04-8 hydrochloride

S1228 Idarubicin HCl h1 L1700-03 533.95 57852-57-0 hydrochloride

S1229 Fludarabine P a2 L1700-03 365.21 75607-67-9 phosphate

S1231 Topotecan HClb2 L1700-03 457.91 119413-54-6 hydrochloride

S1233 2-Methoxyestrac2 L1700-03 302.41 362-07-2 free base

S1234 AG-1024 d2 L1700-03 305.17 65678-07-1 free base

S1235 Letrozole e2 L1700-03 285.3 112809-51-5 free base

S1237 Temozolomidef2 L1700-03 194.15 85622-93-1 free base

S1241 Vincristine g2 L1700-03 923.04 2068-78-2 sulfate

S1243 Agomelatine h2 L1700-03 243.3 138112-76-2 free base

S1244 Amuvatinib (MPa3 L1700-03 447.51 850879-09-3 free base

S1247 Leflunomide b3 L1700-03 270.21 75706-12-6 free base

S1248 Vinblastine c3 L1700-03 810.97 865-21-4 free base

S1249 JNJ-7706621 d3 L1700-03 394.36 443797-96-4 free base

S1250 Enzalutamide e3 L1700-03 464.44 915087-33-1 free base

S1251 Dienogest f3 L1700-03 311.42 65928-58-7 free base

S1252 Entecavir Hydrg3 L1700-03 295.29 209216-23-9 hydrate

S1255 Nepafenac h3 L1700-03 254.28 78281-72-8 free base

S1256 Rufinamide a4 L1700-03 238.19 106308-44-5 free base

S1257 Posaconazole b4 L1700-03 700.78 171228-49-2 free base

S1258 Prasugrel c4 L1700-03 373.44 150322-43-3 free base

S1259 Ramelteon d4 L1700-03 259.34 196597-26-9 free base

S1260 Cinacalcet HCle4 L1700-03 393.87 364782-34-3 hydrochloride

S1261 Celecoxib f4 L1700-03 381.37 169590-42-5 free base

S1262 Avagacestat ( g4 L1700-03 520.88 1146699-66-2 free base

S1264 PD173074 h4 L1700-03 523.67 219580-11-7 free base

S1266 WYE-354 a5 L1700-03 495.53 1062169-56-5 free base

S1267 Vemurafenib ( b5 L1700-03 489.92 918504-65-1 free base

S1271 Acarbose c5 L1700-03 645.6 56180-94-0 free base

S1274 BX-795 d5 L1700-03 591.47 702675-74-9 free base

S1275 BX-912 e5 L1700-03 471.35 702674-56-4 free base

S1276 Adapalene f5 L1700-03 412.52 106685-40-9 free base

S1278 Altretamine g5 L1700-03 210.28 645-05-6 free base

S1280 Amisulpride h5 L1700-03 369.48 71675-85-9 free base

S1281 Aniracetam a6 L1700-03 219.24 72432-10-1 free base

S1282 Artemisinin b6 L1700-03 282.33 63968-64-9 free base

S1283 Asenapine c6 L1700-03 401.84 85650-56-2 maleate

S1284 Benazepril HCld6 L1700-03 460.95 86541-74-4 hydrochloride

S1285 Biperiden HCl e6 L1700-03 347.92 1235-82-1 hydrochloride

S1286 Budesonide f6 L1700-03 430.53 51333-22-3 free base

S1287 Bumetanide g6 L1700-03 364.42 28395-03-1 free base

S1288 Camptothecin h6 L1700-03 348.35 7689-03-4 free base

S1289 Carmofur a7 L1700-03 257.26 61422-45-5 free base

S1291 Cetirizine DiHCb7 L1700-03 461.81 83881-52-1 hydrochloride

S1293 Cilnidipine c7 L1700-03 492.52 132203-70-4 free base

S1294 Cilostazol d7 L1700-03 369.46 73963-72-1 free base

S1297 Epothilone A e7 L1700-03 493.66 152044-53-6 free base

S1299 Floxuridine f7 L1700-03 246.19 50-91-9 free base

S1300 FT-207 (NSC 14g7 L1700-03 200.17 17902-23-7 free base

S1302 Ifosfamide h7 L1700-03 261.09 3778-73-2 free base

S1304 Megestrol Aceta8 L1700-03 384.51 595-33-5 acetate

S1305 Mercaptopurineb8 L1700-03 152.18 50-44-2 free base

S1312 Streptozotocinc8 L1700-03 265.22 18883-66-4 free base

S1315 Ki16425 d8 L1700-03 474.96 355025-24-0 free base

S1319 Costunolide e8 L1700-03 232.32 553-21-9 free base

S1322 Dexamethasonf8 L1700-03 392.46 50-02-2 free base

S1324 Doxazosin Mesg8 L1700-03 547.58 77883-43-3 mesylate

S1326 Edaravone h8 L1700-03 174.2 89-25-8 free base

S1328 Etodolac a9 L1700-03 287.35 41340-25-4 free base

S1329 Etomidate b9 L1700-03 244.29 33125-97-2 free base

S1330 Felbamate c9 L1700-03 238.24 25451-15-4 free base

S1331 Fluconazole d9 L1700-03 306.27 86386-73-4 free base

S1332 Flumazenil e9 L1700-03 303.29 78755-81-4 free base

S1333 Fluoxetine HClf9 L1700-03 345.79 56296-78-7 hydrochloride

S1334 Flupirtine maleg9 L1700-03 420.39 75507-68-5 maleate

S1336 Fluvoxamine mh9 L1700-03 434.41 61718-82-9 maleate

S1342 Genistein a10 L1700-03 270.24 446-72-0 free base

S1343 Ginkgolide B b10 L1700-03 424.4 15291-77-7 free base

S1344 Glimepiride c10 L1700-03 490.62 93479-97-1 free base

S1351 Ivermectin d10 L1700-03 875.09 70288-86-7 free base

S1352 TG100-115 e10 L1700-03 346.34 677297-51-7 free base

S1353 Ketoconazole f10 L1700-03 531.43 65277-42-1 free base

S1354 Lansoprazole g10 L1700-03 369.36 103577-45-3 free base

S1356 Levetiracetam h10 L1700-03 170.21 102767-28-2 free base

S1357 Lidocaine a11 L1700-03 234.34 137-58-6 free base

S1358 Loratadine b11 L1700-03 382.88 79794-75-5 free base

S1359 Losartan Potasc11 L1700-03 462.01 124750-99-8 potassium

S1360 GSK1059615 d11 L1700-03 333.36 958852-01-2 free base

S1361 MGCD-265 e11 L1700-03 517.6 875337-44-3 free base

S1362 Rigosertib (ONf11 L1700-03 473.47 1225497-78-8 sodium

S1363 Ki8751 g11 L1700-03 469.41 228559-41-9 free base

S1364 Epothilone B ( h11 L1700-03 507.68 152044-54-7 free base

S1366 BMS-707035 a1 L1700-04 410.42 729607-74-3 free base

S1367 Amonafide b1 L1700-04 283.33 69408-81-7 free base

S1368 Acitretin c1 L1700-04 326.43 55079-83-9 free base

S1374 Doripenem Hydd1 L1700-04 438.52 364622-82-2 hydrate

S1376 Gestodene e1 L1700-04 310.43 60282-87-3 free base

S1377 Drospirenone f1 L1700-04 366.49 67392-87-4 free base

S1378 Ruxolitinib (I g1 L1700-04 306.37 941678-49-5 free base

S1379 Isotretinoin h1 L1700-04 300.44 4759-48-2 free base

S1380 Lopinavir a2 L1700-04 628.8 192725-17-0 free base

S1381 Meropenem b2 L1700-04 383.46 96036-03-2 free base

S1382 Mianserin HCl c2 L1700-04 300.83 21535-47-7 hydrochloride

S1385 Mosapride Citrd2 L1700-04 614.02 112885-42-4 citrate

S1386 Nafamostat Mee2 L1700-04 539.58 82956-11-4 mesylate

S1387 Naftopidil DiHCf2 L1700-04 465.41 57149-08-3 dihydrochloride

S1389 Omeprazole g2 L1700-04 345.42 73590-58-6 free base

S1390 Ondansetron Hh2 L1700-04 329.82 99614-01-4 hydrochloride

S1391 Oxcarbazepinea3 L1700-04 252.27 28721-07-5 free base

S1392 Pelitinib (EKB-b3 L1700-04 467.92 257933-82-7 free base

S1393 Pirarubicin c3 L1700-04 627.64 72496-41-4 free base

S1394 Pizotifen Malatd3 L1700-04 429.53 5189-11-7 malate

S1396 Resveratrol e3 L1700-04 228.24 501-36-0 free base

S1397 Rocuronium B f3 L1700-04 609.68 119302-91-9 bromide

S1398 Stavudine (d4Tg3 L1700-04 224.21 3056-17-5 free base

S1400 Tenofovir Disoh3 L1700-04 635.51 202138-50-9 fumarate

S1403 Tigecycline a4 L1700-04 585.65 220620-09-7 free base

S1404 Trilostane b4 L1700-04 329.43 13647-35-3 free base

S1405 Vecuronium Brc4 L1700-04 637.73 50700-72-6 bromide

S1407 Bimatoprost d4 L1700-04 415.57 155206-00-1 free base

S1408 Linezolid e4 L1700-04 337.35 165800-03-3 free base

S1409 Alfuzosin HCl f4 L1700-04 425.91 81403-68-1 hydrochloride

S1415 Clopidogrel g4 L1700-04 419.9 120202-66-6 sulfate

S1422 Droxinostat h4 L1700-04 243.69 99873-43-5 free base

S1425 Ranolazine 2Ha5 L1700-04 500.46 95635-56-6 dihydrochloride

S1426 Repaglinide b5 L1700-04 452.59 135062-02-1 free base

S1430 Rolipram c5 L1700-04 275.34 61413-54-5 free base

S1431 Sildenafil Citrad5 L1700-04 666.7 171599-83-0 citrate

S1432 Sumatriptan Sue5 L1700-04 413.49 103628-48-4 succinate

S1436 Tianeptine sodf5 L1700-04 458.93 30123-17-2 sodium

S1437 Tizanidine HClg5 L1700-04 290.17 64461-82-1 hydrochloride

S1438 Topiramate h5 L1700-04 339.36 97240-79-4 free base

S1439 Tranilast a6 L1700-04 327.33 53902-12-8 free base

S1441 Venlafaxine b6 L1700-04 313.86 99300-78-4 hydrochloride

S1442 Voriconazole c6 L1700-04 349.31 137234-62-9 free base

S1443 Zileuton d6 L1700-04 236.29 111406-87-2 free base

S1444 Ziprasidone HCe6 L1700-04 449.4 122883-93-6 hydrochloride

S1445 Zonisamide f6 L1700-04 212.23 68291-97-4 free base

S1450 Nanchangmycig6 L1700-04 889.1 65101-87-3 free base

S1451 Aurora A Inhibih6 L1700-04 588.07 1158838-45-9 free base

S1452 Ispinesib (SB- a7 L1700-04 517.06 336113-53-2 free base

S1453 Tipifarnib b7 L1700-04 489.4 192185-72-1 free base

S1454 PHA-680632 c7 L1700-04 501.62 398493-79-3 free base

S1455 Cilomilast d7 L1700-04 343.42 153259-65-5 free base

S1456 Zibotentan (ZDe7 L1700-04 424.43 186497-07-4 free base

S1457 Atazanavir Sulff7 L1700-04 802.93 229975-97-7 sulfate

S1458 VX-745 g7 L1700-04 436.26 209410-46-8 free base

S1459 Thiazovivin h7 L1700-04 311.36 1226056-71-8 free base

S1460 SP600125 a8 L1700-04 220.23 129-56-6 free base

S1462 AZD6482 b8 L1700-04 408.45 1173900-33-8 free base

S1465 Moxifloxacin Hc8 L1700-04 437.89 186826-86-8 hydrochloride

S1466 Calcitriol d8 L1700-04 416.64 32222-06-3 free base

S1467 Doxercalciferole8 L1700-04 412.65 54573-75-0 free base

S1468 Alfacalcidol f8 L1700-04 400.64 41294-56-8 free base

S1469 Calcifediol g8 L1700-04 400.64 19356-17-3 free base

S1470 TSU-68 (SU6668h8 L1700-04 310.35 252916-29-3 free base

S1472 Safinamide Mesa9 L1700-04 398.45 202825-46-5 mesylate

S1474 GSK429286A b9 L1700-04 432.37 864082-47-3 free base

S1475 Pimasertib (ASc9 L1700-04 431.2 1236699-92-5 free base

S1476 SB525334 d9 L1700-04 343.42 356559-20-1 free base

S1478 Oligomycin A e9 L1700-04 791.06 579-13-5 free base

S1480 VX-222 (VCH-22f9 L1700-04 445.61 1026785-59-0 free base

S1481 Zosuquidar (L g9 L1700-04 636.99 167465-36-3 hydrochloride

S1482 Daclatasvir (B h9 L1700-04 738.88 1009119-64-5 free base

S1483 Iloperidone a10 L1700-04 426.48 133454-47-4 free base

S1484 MC1568 b10 L1700-04 314.31 852475-26-4 free base

S1485 HMN-214 c10 L1700-04 424.47 173529-46-9 free base

S1486 AEE788 (NVP- d10 L1700-04 440.58 497839-62-0 free base

S1487 PHA-793887 e10 L1700-04 361.48 718630-59-2 free base

S1488 Naratriptan f10 L1700-04 371.93 143388-64-1 free base

S1489 PIK-93 g10 L1700-04 389.88 593960-11-3 free base

S1490 Ponatinib (AP2h10 L1700-04 532.56 943319-70-8 free base

S1494 LY2228820 a11 L1700-04 612.74 862507-23-1 mesylate

S1497 Pralatrexate b11 L1700-04 477.47 146464-95-1 free base

S1500 Betamethasonec11 L1700-04 392.46 378-44-9 free base

S1501 Mycophenolate d11 L1700-04 433.49 128794-94-5 free base

S1502 Cephalexin e11 L1700-04 347.39 15686-71-2 free base

S1504 Dyphylline f11 L1700-04 254.24 479-18-5 free base

S1505 Aztreonam g11 L1700-04 435.43 78110-38-0 free base

S1508 Alprostadil h11 L1700-04 354.48 745-65-3 free base

S1512 Tadalafil a1 L1700-05 389.4 171596-29-5 free base

S1514 Cyclosporine b1 L1700-05 1202.61 79217-60-0 free base

S1515 Pracinostat (S c1 L1700-05 358.48 929016-96-6 free base

S1517 Natamycin d1 L1700-05 665.73 7681-93-8 free base

S1519 CCT129202 e1 L1700-05 497.02 942947-93-5 free base

S1523 SAR245409 (XLf1 L1700-05 599.66 1349796-36-6 free base

S1524 AT7519 g1 L1700-05 382.24 844442-38-2 free base

S1525 MK-1775 h1 L1700-05 500.6 955365-80-7 free base

S1526 Quizartinib (A a2 L1700-05 560.67 950769-58-1 free base

S1528 LY2811376 b2 L1700-05 320.36 1194044-20-6 free base

S1529 Hesperadin c2 L1700-05 516.65 422513-13-1 free base

S1530 BIX 02188 d2 L1700-05 412.48 1094614-84-2 free base

S1531 BIX 02189 e2 L1700-05 440.54 1094614-85-3 free base

S1532 AZD7762 f2 L1700-05 362.42 860352-01-8 free base

S1533 R406 (free baseg2 L1700-05 470.45 841290-80-0 free base

S1534 Org 27569 h2 L1700-05 409.95 868273-06-7 free base

S1536 CP-673451 a3 L1700-05 417.5 343787-29-1 free base

S1537 DMXAA (Vadimb3 L1700-05 282.29 117570-53-3 free base

S1538 Telaprevir (VX-c3 L1700-05 679.85 402957-28-2 free base

S1540 Saxagliptin d3 L1700-05 315.41 361442-04-8 free base

S1541 EX 527 (Selisise3 L1700-05 248.71 49843-98-3 free base

S1544 AM1241 f3 L1700-05 503.33 444912-48-5 free base

S1545 SB408124 g3 L1700-05 356.37 288150-92-5 free base

S1547 Febuxostat h3 L1700-05 316.37 144060-53-7 free base

S1548 Dapagliflozin a4 L1700-05 408.87 461432-26-8 free base

S1549 Nebivolol b4 L1700-05 441.9 152520-56-4 hydrochloride

S1550 Pimobendan c4 L1700-05 334.37 74150-27-9 free base

S1555 AZD8055 d4 L1700-05 465.54 1009298-09-2 free base

S1556 PHT-427 e4 L1700-05 409.61 1191951-57-1 free base

S1557 KRN 633 f4 L1700-05 416.86 286370-15-8 free base

S1558 AT7867 g4 L1700-05 337.85 857531-00-1 free base

S1561 BMS-777607 h4 L1700-05 512.89 1025720-94-8 free base

S1565 VX-809 (Lumacaa5 L1700-05 452.41 936727-05-8 free base

S1567 Pomalidomideb5 L1700-05 273.24 19171-19-8 free base

S1568 PD318088 c5 L1700-05 561.09 391210-00-7 free base

S1569 Tazarotene d5 L1700-05 351.46 118292-40-3 free base

S1570 KU-60019 e5 L1700-05 547.67 925701-49-1 free base

S1572 BS-181 HCl f5 L1700-05 416.99 hydrochloride

S1573 Fasudil (HA-10g5 L1700-05 327.83 105628-07-7 hydrochloride

S1574 BIRB 796 (Dor h5 L1700-05 527.66 285983-48-4 free base

S1575 RO4929097 a6 L1700-05 469.4 847925-91-1 Free BaseS1576 Sulfasalazine b6 L1700-05 398.39 599-79-1 free base

S1577 Tie2 kinase inhc6 L1700-05 439.53 948557-43-5 free base

S1578 Candesartan d6 L1700-05 440.45 139481-59-7 free base

S1582 H 89 2HCl e6 L1700-05 519.28 130964-39-5 2HCl

S1590 TWS119 f6 L1700-05 318.33 601514-19-6 free base

S1593 Apixaban g6 L1700-05 459.5 503612-47-3 free base

S1594 Semagacestat h6 L1700-05 361.44 425386-60-3 free base

S1601 Reserpine a7 L1700-05 608.68 50-55-5 free base

S1603 Furosemide b7 L1700-05 330.74 54-31-9 free base

S1604 Olmesartan Mec7 L1700-05 558.59 144689-63-4 free base

S1605 Cefdinir d7 L1700-05 395.41 91832-40-5 free base

S1606 Clotrimazole e7 L1700-05 344.84 23593-75-1 free base

S1607 Rizatriptan Be f7 L1700-05 391.47 145202-66-0 benzoate

S1608 Pyridostigmineg7 L1700-05 261.12 101-26-8 bromide

S1609 Methimazole h7 L1700-05 114.17 60-56-0 free base

S1610 Metolazone a8 L1700-05 365.83 17560-51-9 free base

S1611 Cefoperazone b8 L1700-05 645.67 62893-19-0 free base

S1613 Silodosin c8 L1700-05 495.53 160970-54-7 free base

S1614 Riluzole d8 L1700-05 234.2 1744-22-5 free base

S1615 Risperidone e8 L1700-05 410.48 106266-06-2 free base

S1618 Sulfameter f8 L1700-05 280.3 651-06-9 free base

S1619 Prilocaine g8 L1700-05 220.31 721-50-6 free base

S1620 Darunavir Ethah8 L1700-05 593.73 635728-49-3 ethanolate

S1622 Prednisone a9 L1700-05 358.43 53-03-2 free base

S1623 Acetylcysteineb9 L1700-05 163.19 616-91-1 free base

S1625 Ethinyl Estradic9 L1700-05 296.4 57-63-6 free base

S1626 Naproxen d9 L1700-05 252.24 26159-34-2 sodium

S1627 Nitazoxanide e9 L1700-05 307.28 55981-09-4 free base

S1628 Triamcinolone f9 L1700-05 434.5 76-25-5 free base

S1629 Orlistat g9 L1700-05 495.73 96829-58-2 free base

S1630 Allopurinol h9 L1700-05 136.11 315-30-0 free base

S1631 Allopurinol Soa10 L1700-05 159.1 17795-21-0 Sodium SaltS1633 Zafirlukast b10 L1700-05 575.68 107753-78-6 free base

S1635 Erythromycin c10 L1700-05 733.93 114-07-8 free base

S1636 Amphotericin Bd10 L1700-05 924.08 1397-89-3 free base

S1638 Ibuprofen e10 L1700-05 206.28 15687-27-1 free base

S1639 Amprenavir f10 L1700-05 505.63 161814-49-9 free base

S1640 Albendazole g10 L1700-05 265.33 54965-21-8 free base

1397219-81-6

S1641 Chlorothiazideh10 L1700-05 295.72 58-94-6 free base

S1643 Ursodiol a11 L1700-05 392.57 128-13-2 free base

S1644 Nitrofural b11 L1700-05 198.14 59-87-0 free base

S1645 Ketoprofen c11 L1700-05 254.28 22071-15-4 free base

S1646 Ketorolac d11 L1700-05 376.4 74103-07-4 tromethamine

S1647 Adenosine e11 L1700-05 267.24 58-61-7 free base

S1649 Zolmitriptan f11 L1700-05 287.36 139264-17-8 free base

S1651 Telbivudine g11 L1700-05 242.23 3424-98-4 free base

S1652 Monobenzone h11 L1700-05 200.23 103-16-2 free base

S1653 Tretinoin a1 L1700-06 300.4 302-79-4 free base

S1654 Phenylbutazonb1 L1700-06 308.37 50-33-9 free base

S1655 Ezetimibe c1 L1700-06 409.4 163222-33-1 free base

S1657 Enalaprilat Dihd1 L1700-06 348.4 84680-54-6 dihydrate

S1658 Dofetilide e1 L1700-06 441.56 115256-11-6 free base

S1662 Isradipine f1 L1700-06 371.39 75695-93-1 free base

S1665 Estrone g1 L1700-06 270.37 53-16-7 free base

S1666 Flucytosine h1 L1700-06 129.09 2022-85-7 free base

S1667 Trichlormethiaza2 L1700-06 380.66 133-67-5 free base

S1669 Loteprednol etb2 L1700-06 466.95 82034-46-6 free base

S1671 c2 L1700-06 131.17 60-32-2 free base

S1672 Aminoglutethimd2 L1700-06 232.28 125-84-8 free base

S1673 Aminophyllinee2 L1700-06 420.43 317-34-0 ethylenediamin

S1675 Lubiprostone f2 L1700-06 390.46 136790-76-6 free base

S1676 Amorolfine HClg2 L1700-06 353.97 78613-38-4 hydrochloride

S1677 Chloramphenich2 L1700-06 323.13 56-75-7 free base

S1679 Flurbiprofen a3 L1700-06 244.26 5104-49-4 free base

S1680 Disulfiram b3 L1700-06 296.54 97-77-8 free base

S1681 Mesalamine c3 L1700-06 153.14 89-57-6 free base

S1683 Ipratropium Brd3 L1700-06 412.37 22254-24-6 bromide

S1685 Sulfanilamide e3 L1700-06 172.2 63-74-1 free base

S1689 Meprednisone f3 L1700-06 372.455 1247-42-3 free base

S1691 Praziquantel g3 L1700-06 312.41 55268-74-1 free base

S1692 Busulfan h3 L1700-06 246.3 55-98-1 free base

S1693 Carbamazepinea4 L1700-06 236.27 298-46-4 free base

S1696 Hydrocortisoneb4 L1700-06 362.46 50-23-7 free base

S1701 Desonide c4 L1700-06 416.51 638-94-8 free base

S1702 Didanosine d4 L1700-06 236.23 69655-05-6 free base

S1703 Divalproex So e4 L1700-06 310.41 76584-70-8 sodium

S1704 Emtricitabine f4 L1700-06 247.25 143491-57-0 free base

S1705 Progesterone g4 L1700-06 314.46 57-83-0 free base

S1706 Lamivudine h4 L1700-06 229.26 134678-17-4 free base

S1708 Hydrochlorothia5 L1700-06 297.74 58-93-5 free base

S1709 Estradiol b5 L1700-06 272.38 50-28-2 free base

S1712 Deferasirox c5 L1700-06 373.36 201530-41-8 free base

S1713 Piroxicam d5 L1700-06 331.35 36322-90-4 free base

S1714 Gemcitabine e5 L1700-06 263.2 95058-81-4 free base

S1715 Glipizide f5 L1700-06 445.54 29094-61-9 free base

S1716 Glyburide g5 L1700-06 494 10238-21-8 free base

（6-）ε- Aminocaproic acid

S1718 Adefovir Dipivoh5 L1700-06 501.47 142340-99-6 free base

S1719 Zalcitabine a6 L1700-06 211.22 7481-89-2 free base

S1721 Azathioprine b6 L1700-06 277.26 446-86-6 free base

S1723 Indomethacin c6 L1700-06 357.79 53-86-1 free base

S1725 Terbinafine d6 L1700-06 291.43 91161-71-6 free base

S1727 Levonorgestrele6 L1700-06 312.45 797-63-7 free base

S1729 Gemfibrozil f6 L1700-06 250.33 25812-30-0 free base

S1730 Indapamide g6 L1700-06 365.83 26807-65-8 free base

S1732 Mitotane h6 L1700-06 320.04 53-19-0 free base

S1733 Methylprednis a7 L1700-06 374.47 83-43-2 free base

S1734 Meloxicam b7 L1700-06 351.4 71125-38-7 free base

S1735 Mesna c7 L1700-06 164.18 19767-45-4 free base

S1736 Methocarbamold7 L1700-06 241.24 532-03-6 free base

S1737 Prednisolone e7 L1700-06 360.44 50-24-8 free base

S1738 Telmisartan f7 L1700-06 514.62 144701-48-4 free base

S1739 Thiabendazoleg7 L1700-06 201.25 148-79-8 free base

S1740 Guaifenesin h7 L1700-06 198.22 93-14-1 free base

S1741 Rifabutin a8 L1700-06 847 72559-06-9 free base

S1742 Nevirapine b8 L1700-06 266.3 129618-40-2 free base

S1744 Nicotinic Acid c8 L1700-06 123.11 59-67-6 free base

S1747 Nimodipine d8 L1700-06 418.44 66085-59-4 free base

S1748 Nisoldipine e8 L1700-06 388.41 63675-72-9 free base

S1756 Enoxacin f8 L1700-06 320.32 74011-58-8 free base

S1759 Pitavastatin Cag8 L1700-06 880.98 147526-32-7 calcium

S1760 Rifapentine h8 L1700-06 877.03 61379-65-5 free base

S1761 Suprofen a9 L1700-06 260.31 40828-46-4 free base

S1762 Pyrazinamide b9 L1700-06 123.11 98-96-4 free base

S1763 Quetiapine Fu c9 L1700-06 883.09 111974-72-2 fumarate

S1764 Rifampin d9 L1700-06 822.94 13292-46-1 free base

S1767 Beta Carotene e9 L1700-06 536.87 7235-40-7 free base

S1768 Cefditoren Pivof9 L1700-06 620.72 117467-28-4 free base

S1770 Sulfadiazine g9 L1700-06 250.28 68-35-9 free base

S1771 Chlorprothixenh9 L1700-06 315.86 113-59-7 free base

S1773 Oxytetracyclina10 L1700-06 460.43 79-57-2 free base

S1776 Toremifene Citb10 L1700-06 598.08 89778-27-8 citrate

S1777 Ethionamide c10 L1700-06 166.24 536-33-4 free base

S1778 Trifluridine d10 L1700-06 296.2 70-00-8 free base

S1782 Azacitidine e10 L1700-06 244.2 320-67-2 free base

S1784 Vidarabine f10 L1700-06 267.24 5536-17-4 free base

S1787 Teniposide g10 L1700-06 656.65 29767-20-2 free base

S1790 Rifaximin h10 L1700-06 785.88 80621-81-4 free base

S1792 Simvastatin a11 L1700-06 418.57 79902-63-9 free base

S1793 Ramipril b11 L1700-06 416.51 87333-19-5 free base

S1794 Fenofibrate c11 L1700-06 360.83 49562-28-9 free base

S1799 Ranolazine d11 L1700-06 427.54 95635-55-5 free base

S1801 Ranitidine e11 L1700-06 350.86 66357-59-3 hydrochloride

S1802 Acadesine f11 L1700-06 258.23 2627-69-2 free base

S1805 Acetylcholine g11 L1700-06 181.66 60-31-1 chloride

S1806 Acipimox h11 L1700-06 154.12 51037-30-0 free base

S1807 Aciclovir a1 L1700-07 225.2 59277-89-3 free base

S1808 Nifedipine b1 L1700-07 346.33 21829-25-4 free base

S1811 Amiloride HCl c1 L1700-07 266.09 2016-88-8 hydrochloride

S1816 Chlorpheniramid1 L1700-07 390.86 113-92-8 maleate

S1823 Fenoprofen Cae1 L1700-07 522.6 34597-40-5 free base

S1825 Erdosteine f1 L1700-07 249.31 84611-23-4 free base

S1828 Proparacaine Hg1 L1700-07 330.85 5875-06-9 hydrochloride

S1829 Pranlukast h1 L1700-07 481.5 103177-37-3 free base

S1830 Oxfendazole a2 L1700-07 315.35 53716-50-0 free base

S1831 Carvedilol b2 L1700-07 406.47 72956-09-3 free base

S1832 Atracurium Besc2 L1700-07 1243.48 64228-81-5 besylate

S1833 Butoconazole nd2 L1700-07 474.79 64872-77-1 nitrate

S1835 Azithromycin e2 L1700-07 748.98 83905-01-5 free base

S1836 Albendazole Of2 L1700-07 281.33 54029-12-8 free base

S1839 Chloroxine g2 L1700-07 214.05 773-76-2 free base

S1840 Lomustine h2 L1700-07 233.7 13010-47-4 free base

S1843 Chenodeoxychoa3 L1700-07 392.57 474-25-9 free base

S1845 Cimetidine b3 L1700-07 252.34 51481-61-9 free base

S1847 Clemastine Fu c3 L1700-07 459.96 14976-57-9 free base

S1848 Curcumin d3 L1700-07 368.38 458-37-7 free base

S1849 Daidzein e3 L1700-07 254.24 486-66-8 free base

S1854 Bifonazole f3 L1700-07 310.39 60628-96-8 free base

S1855 Pefloxacin Mesg3 L1700-07 429.46 70458-95-6 mesylate

S1856 Metoprolol Tarth3 L1700-07 684.81 392-17-7 tartrate

S1859 Diethylstilbestra4 L1700-07 268.35 56-53-1 free base

S1865 Diltiazem HCl b4 L1700-07 450.98 33286-22-5 hydrochloride

S1866 Diphenhydramic4 L1700-07 291.82 147-24-0 hydrochloride

S1869 Dapoxetine HCld4 L1700-07 341.87 129938-20-1 hydrochloride

S1876 Valaciclovir HCe4 L1700-07 360.8 124832-27-5 hydrochloride

S1878 Ganciclovir f4 L1700-07 255.23 82410-32-0 free base

S1880 Roxatidine Aceg4 L1700-07 384.9 93793-83-0 hydrochloride

S1881 Protionamide h4 L1700-07 180.27 14222-60-7 free base

S1883 Idoxuridine a5 L1700-07 354.1 54-42-2 free base

S1884 Sparfloxacin b5 L1700-07 392.4 110871-86-8 free base

S1885 Felodipine c5 L1700-07 384.25 72509-76-3 free base

S1888 Deflazacort d5 L1700-07 441.52 14484-47-0 free base

S1889 Mitoxantrone e5 L1700-07 444.48 65271-80-9 Free BaseS1890 Nizatidine f5 L1700-07 331.46 76963-41-2 free base

S1891 Carbidopa g5 L1700-07 226.23 28860-95-9 free base

S1894 Valsartan h5 L1700-07 435.52 137862-53-4 free base

S1895 Dipyridamole a6 L1700-07 504.63 58-32-2 free base

S1896 Hydroxyurea b6 L1700-07 76.05 127-07-1 free base

S1897 Potassium Iodic6 L1700-07 166 7681-11-0 Inorganic salt

S1898 Tropisetron d6 L1700-07 320.81 105826-92-4 hydrochloride

S1899 Nicotinamide (e6 L1700-07 122.12 98-92-0 free base

S1902 Vitamin B12 f6 L1700-07 1355.37 68-19-9 free base

S1903 Diclofenac So g6 L1700-07 318.13 15307-79-6 sodium

S1904 Avobenzone h6 L1700-07 310.39 70356-09-1 free base

S1905 Amlodipine a7 L1700-07 408.88 88150-42-9 free base

S1907 Metronidazole b7 L1700-07 171.15 443-48-1 free base

S1908 Flutamide c7 L1700-07 276.21 13311-84-7 free base

S1909 Fluvastatin Sod7 L1700-07 433.45 93957-55-2 sodium

S1910 Tioconazole e7 L1700-07 387.71 65899-73-2 free base

S1913 Tropicamide f7 L1700-07 284.35 1508-75-4 free base

S1914 Pregnenolone g7 L1700-07 316.48 145-13-1 free base

S1915 Sulfamethoxazh7 L1700-07 253.28 723-46-6 free base

S1916 Sulfisoxazole a8 L1700-07 267.3 127-69-5 free base

S1917 Crystal Violet b8 L1700-07 407.98 548-62-9 chlorate

S1920 Haloperidol c8 L1700-07 375.86 52-86-8 free base

S1921 Phenindione d8 L1700-07 222.24 83-12-5 free base

S1928 Alibendol e8 L1700-07 251.28 26750-81-2 free base

S1929 Irsogladine f8 L1700-07 256.09 57381-26-7 free base

S1933 Triamcinoloneg8 L1700-07 394.43 124-94-7 free base

S1934 Nystatin (Fungih8 L1700-07 926.09 1400-61-9 free base

S1937 Isoniazid a9 L1700-07 137.14 54-85-3 free base

S1940 Levofloxacin b9 L1700-07 361.37 100986-85-4 free base

S1941 Enalapril Maleac9 L1700-07 492.52 76095-16-4 maleate

S1949 Menadione d9 L1700-07 172.18 58-27-5 free base

S1952 Methoxsalen e9 L1700-07 216.19 298-81-7 free base

S1956 Miconazole Nitf9 L1700-07 479.14 22832-87-7 nitrate

S1957 Sulfamethizoleg9 L1700-07 270.33 144-82-1 free base

S1958 Sulbactam h9 L1700-07 233.24 68373-14-8 free base

S1959 Tolfenamic Acia10 L1700-07 261.7 13710-19-5 free base

S1960 Pranoprofen b10 L1700-07 255.27 52549-17-4 free base

S1962 Sulphadimethoc10 L1700-07 310.33 122-11-2 free base

S1964 Rimantadine d10 L1700-07 179.3 13392-28-4 free base

S1965 Primidone e10 L1700-07 218.25 125-33-7 free base

S1969 Nefiracetam f10 L1700-07 246.3 77191-36-7 free base

S1971 Nicorandil g10 L1700-07 211.17 65141-46-0 free base

S1972 Tamoxifen Citrh10 L1700-07 563.64 54965-24-1 citrate

S1973 Cyclocytidine a11 L1700-07 261.66 10212-25-6 hydrochloride

S1974 Meglumine b11 L1700-07 195.21 6284-40-8 free base

S1975 Aripiprazole c11 L1700-07 448.39 129722-12-9 free base

S1978 Methscopolamid11 L1700-07 398.29 155-41-9 bromide

S1979 Amiodarone HCe11 L1700-07 681.77 19774-82-4 hydrochloride

S1983 Adenine HCl f11 L1700-07 171.59 2922-28-3 hydrochloride

S1987 Mometasone fug11 L1700-07 521.43 83919-23-7 furoate

S1988 Propylthiouracih11 L1700-07 170.23 51-52-5 free base

S1992 Fluticasone pra1 L1700-08 500.57 80474-14-2 propionate

S1994 Lacidipine b1 L1700-08 455.54 103890-78-4 free base

S2001 Elvitegravir (G c1 L1700-08 447.88 697761-98-1 free base

S2003 Maraviroc d1 L1700-08 513.67 376348-65-1 free base

S2005 Raltegravir (M e1 L1700-08 444.42 518048-05-0 free base

S2006 Pyrimethaminef1 L1700-08 248.71 58-14-0 free base

S2007 Sulindac g1 L1700-08 356.41 38194-50-2 free base

S2012 PCI-34051 h1 L1700-08 296.32 950762-95-5 free base

S2013 PF-573228 a2 L1700-08 491.49 869288-64-2 free base

S2014 BMS-265246 b2 L1700-08 345.34 582315-72-8 free base

S2015 Suplatast Tosyc2 L1700-08 499.64 94055-76-2 tosylate

S2016 Mirtazapine d2 L1700-08 265.35 85650-52-8 free base

S2017 Benidipine HCle2 L1700-08 542.02 91599-74-5 hydrochloride

S2020 Formoterol He f2 L1700-08 402.4 43229-80-7 fumarate

S2021 Chlormezanoneg2 L1700-08 273.74 80-77-3 free base

S2024 Ketotifen Fumah2 L1700-08 425.5 34580-14-8 fumarate

S2025 Urapidil HCl a3 L1700-08 423.94 64887-14-5 hydrochloride

S2026 Ginkgolide A b3 L1700-08 408.4 15291-75-5 free base

S2028 Diclazuril c3 L1700-08 407.64 101831-37-2 free base

S2029 Uridine d3 L1700-08 244.2 58-96-8 free base

S2030 Flunarizine 2He3 L1700-08 477.42 30484-77-6 2HCl

S2031 Fenticonazole Nf3 L1700-08 518.41 73151-29-8 nitrate

S2032 Rebamipide g3 L1700-08 370.79 90098-04-7 free base

S2035 Epalrestat h3 L1700-08 319.4 82159-09-9 free base

S2036 Aspartame a4 L1700-08 294.3 22839-47-0 free base

S2037 Candesartan Cib4 L1700-08 610.66 145040-37-5 free base

S2038 Phentolamine c4 L1700-08 377.46 65-28-1 mesylate

S2040 Nimesulide d4 L1700-08 308.31 51803-78-2 free base

S2041 Dyclonine HCl e4 L1700-08 325.87 536-43-6 hydrochloride

S2042 Cyproterone Acf4 L1700-08 416.94 427-51-0 acetate

S2043 Memantine HClg4 L1700-08 215.76 41100-52-1 hydrochloride

S2044 Cyproheptadineh4 L1700-08 323.86 969-33-5 hydrochloride

S2045 Doxifluridine a5 L1700-08 246.19 3094-09-5 free base

S2046 Pioglitazone Hb5 L1700-08 392.9 112529-15-4 hydrochloride

S2047 Lornoxicam c5 L1700-08 371.82 70374-39-9 free base

S2051 Captopril d5 L1700-08 217.29 62571-86-2 free base

S2053 Cytidine e5 L1700-08 243.22 65-46-3 free base

S2054 Orphenadrine Cf5 L1700-08 461.5 4682-36-4 citrate

S2055 Gimeracil g5 L1700-08 145.54 103766-25-2 free base

S2058 Tolnaftate h5 L1700-08 307.41 2398-96-1 free base

S2059 Terazosin HCl a6 L1700-08 459.92 70024-40-7 hydrochloride

S2060 Bromhexine HCb6 L1700-08 412.59 611-75-6 hydrochloride

S2061 Lovastatin c6 L1700-08 404.54 75330-75-5 free base

S2062 Tiopronin d6 L1700-08 163.19 1953-02-2 free base

S2064 Balofloxacin e6 L1700-08 389.42 127294-70-6 free base

S2065 Lafutidine f6 L1700-08 431.55 118288-08-7 free base

S2066 Moxonidine g6 L1700-08 241.68 75438-57-2 free base

S2067 Ozagrel HCl h6 L1700-08 264.71 78712-43-3 hydrochloride

S2069 Argatroban a7 L1700-08 508.63 74863-84-6 free base

S2074 Mecarbinate b7 L1700-08 233.26 15574-49-9 free base

S2077 Atorvastatin C c7 L1700-08 1155.34 134523-03-8 calcium

S2078 Famotidine d7 L1700-08 337.45 76824-35-6 free base

S2079 Moexipril HCl e7 L1700-08 535.03 82586-52-5 hydrochloride

S2080 Clevidipine Butf7 L1700-08 456.32 167221-71-8 free base

S2081 Cilazapril Mon g7 L1700-08 435.51 92077-78-6 monohydrate

S2082 Adiphenine HCh7 L1700-08 347.88 50-42-0 hydrochloride

S2084 Duloxetine HCla8 L1700-08 333.88 136434-34-9 hydrochloride

S2085 Trimebutine b8 L1700-08 387.47 39133-31-8 free base

S2086 Ivabradine HClc8 L1700-08 505.05 148849-67-6 hydrochloride

S2087 Rivastigmine Td8 L1700-08 400.42 129101-54-8 tartrate

S2091 Betaxolol e8 L1700-08 307.43 659-18-7 free base

S2092 Detomidine HCf8 L1700-08 222.71 90038-01-0 hydrochloride

S2096 Almotriptan Mag8 L1700-08 469.55 181183-52-8 malate

S2097 Ambrisentan h8 L1700-08 378.42 177036-94-1 free base

S2098 Bexarotene a9 L1700-08 348 153559-49-0 free base

S2099 Temocapril HClb9 L1700-08 513.07 110221-44-8 hydrochloride

S2101 Gabexate Mesyc9 L1700-08 417.48 56974-61-9 mesylate

S2102 Rasagiline Mesd9 L1700-08 267.34 161735-79-1 mesylate

S2103 Naltrexone HCle9 L1700-08 377.86 16676-29-2 hydrochloride

S2104 Levosulpiride f9 L1700-08 341.43 23672-07-3 free base

S2108 Flunixin Meglug9 L1700-08 491.46 42461-84-7 meglumine

S2109 Imidapril HCl h9 L1700-08 441.91 89396-94-1 free base

S2113 Cisatracurium a10 L1700-08 1243.48 96946-42-8 besylate

S2114 Dronedarone Hb10 L1700-08 593.22 141625-93-6 hydrochloride

S2116 Conivaptan HClc10 L1700-08 535.04 168626-94-6 hydrochloride

S2118 Ibutilide Fumard10 L1700-08 885.23 122647-32-9 fumarate

S2119 Probucol e10 L1700-08 516.84 23288-49-5 free base

S2120 Arbidol HCl f10 L1700-08 513.88 131707-23-8 hydrochloride

S2121 Licofelone g10 L1700-08 379.88 156897-06-2 free base

S2123 Dextrose h10 L1700-08 180.16 50-99-7 free base

S2124 Xylose a11 L1700-08 150.13 25990-60-7 free base

S2125 Mestranol b11 L1700-08 310.43 72-33-3 free base

S2126 Naftopidil c11 L1700-08 392.49 57149-07-2 free base

S2127 S- (+)-Rolipramd11 L1700-08 275.34 85416-73-5 free base

S2128 Bazedoxifene e11 L1700-08 507.06 198480-56-7 free base

S2130 Atropine f11 L1700-08 694.83 5908-99-6 coordination co

S2131 Roflumilast g11 L1700-08 403.21 162401-32-3 free base

S2134 AZD8330 h11 L1700-08 461.23 869357-68-6 free base

S2149 GSK1292263 a1 L1700-09 456.56 1032823-75-8 free base

S2151 LDE225 (NVP-Lb1 L1700-09 485.5 956697-53-3 free base

S2153 CGS 21680 HClc1 L1700-09 535.98 124431-80-7 hydrochloride

S2154 Dabigatran Etexd1 L1700-09 627.73 211915-06-9 free base

S2155 LY2608204 e1 L1700-09 559.81 1234703-40-2 free base

S2156 LY2886721 f1 L1700-09 390.41 1262036-50-9 free base

S2158 KW-2449 g1 L1700-09 332.4 1000669-72-6 free base

S2159 Tebipenem Pivoh1 L1700-09 497.63 161715-24-8 free base

S2160 Almorexant HCa2 L1700-09 549.02 913358-93-7 HClS2161 RAF265 (CHIR-b2 L1700-09 518.41 927880-90-8 free base

S2162 AZD1480 c2 L1700-09 348.77 935666-88-9 Free BaseS2163 PF-4708671 d2 L1700-09 390.41 1255517-76-0 free base

S2168 PD128907 HCl e2 L1700-09 285.77 112960-16-4 hydrochloride

S2169 Rosuvastatin f2 L1700-09 500.57 147098-20-2 free base

S2170 Givinostat (ITFg2 L1700-09 475.97 732302-99-7 chloride

S2173 Telotristat Eti h2 L1700-09 754.15 11137608-69-5 SaltS2177 Dichlorphenama3 L1700-09 305.16 120-97-8 free base

S2178 AG-14361 b3 L1700-09 320.39 328543-09-5 free base

S2179 LY2784544 c3 L1700-09 469.94 1229236-86-5 free base

S2180 MLN2238 d3 L1700-09 361.03 1072833-77-2 free base

S2181 MLN9708 e3 L1700-09 517.12 1201902-80-8 free base

S2182 SB743921 f3 L1700-09 553.52 940929-33-9 hydrochloride

S2185 AST-1306 g3 L1700-09 621.08 1050500-29-2 mesylate

S2186 SB505124 h3 L1700-09 335.4 694433-59-5 free base

S2187 Avasimibe a4 L1700-09 501.72 166518-60-1 free base

S2192 AZD8931 (Sapitb4 L1700-09 473.93 848942-61-0 free base

S2193 GSK461364 c4 L1700-09 543.6 929095-18-1 free base

S2194 R406 d4 L1700-09 628.63 841290-81-1 besylate

S2195 CYT997 (Lexibue4 L1700-09 434.53 917111-44-5 Free BaseS2198 SGI-1776 free f4 L1700-09 405.42 1025065-69-3 free base

S2199 Aliskiren Hemig4 L1700-09 609.83 173334-58-2 fumarate

S2201 BMS-794833 h4 L1700-09 468.84 1174046-72-0 free base

S2202 NVP-BHG712 a5 L1700-09 503.48 940310-85-0 free base

S2205 OSI-420 b5 L1700-09 415.87 183320-51-6 hydrochloride

S2207 PIK-293 c5 L1700-09 397.43 900185-01-5 free base

S2208 Formestane d5 L1700-09 302.41 566-48-3 free base

S2214 AZ 960 e5 L1700-09 354.36 905586-69-8 free base

S2215 DAPT (GSI-IX) f5 L1700-09 432.46 208255-80-5 free base

S2216 Mubritinib (TA g5 L1700-09 468.47 366017-09-6 free base

S2217 Irinotecan HCl h5 L1700-09 677.18 136572-09-3 hydrate

S2218 PP242 a6 L1700-09 308.34 1092351-67-1 free base

S2219 CYT387 b6 L1700-09 414.46 1056634-68-4 free base

S2220 SB590885 c6 L1700-09 453.54 405554-55-4 free base

S2221 Apatinib d6 L1700-09 493.58 811803-05-1 sulfate

S2224 UK 383367 e6 L1700-09 324.38 348622-88-8 free base

S2225 TAME f6 L1700-09 342.41 901-47-3 free base

S2226 CAL-101 (Idelalg6 L1700-09 415.42 870281-82-6 free base

S2227 PIK-294 h6 L1700-09 489.53 900185-02-6 free base

S2228 VX-765 a7 L1700-09 509 273404-37-8,85free base

S2229 Eltrombopag b7 L1700-09 442.47 496775-61-2 free base

S2230 LY2157299 c7 L1700-09 369.42 700874-72-2 free base

S2231 Telatinib d7 L1700-09 409.83 332012-40-5 free base

S2232 Ketanserin e7 L1700-09 395.43 74050-98-9 free base

S2233 Esomeprazole f7 L1700-09 367.4 161796-78-7 free base

S2235 Volasertib (BI g7 L1700-09 618.81 755038-65-4 free base

S2238 Palomid 529 (Ph7 L1700-09 406.43 914913-88-5 free base

S2239 Tubacin a8 L1700-09 721.86 537049-40-4 Free BaseS2240 Fesoterodine Fb8 L1700-09 527.65 286930-03-8 fumarate

S2243 Degrasyn (WP1c8 L1700-09 384.27 856243-80-6 free base

S2244 AR-42 d8 L1700-09 312.36 935881-37-1 free base

S2247 BKM120 (NVP-Be8 L1700-09 410.39 944396-07-0 free base

S2248 CX-4945 (Silmitf8 L1700-09 349.77 1009820-21-6 free base

S2250 (-)-Epigallocat g8 L1700-09 458.37 989-51-5 free base

S2252 (+)-Usniacin h8 L1700-09 344.32 7562-61-0 free base

S2253 3-Indolebutyrica9 L1700-09 203.24 133-32-4 free base

S2256 4-Methylumbellb9 L1700-09 176.17 90-33-5 free base

S2258 Esculin c9 L1700-09 340.28 531-75-9 free base

S2259 Aloe-emodin d9 L1700-09 270.24 481-72-1 free base

S2260 Laetrile e9 L1700-09 457.43 29883-15-6 free base

S2261 Andrographoli f9 L1700-09 350.45 5508-58-7 free base

S2262 Apigenin g9 L1700-09 270.24 520-36-5 free base

S2263 Arbutin h9 L1700-09 272.25 497-76-7 free base

S2264 Artemether a10 L1700-09 298.37 71963-77-4 free base

S2265 Artesunate b10 L1700-09 384.42 88495-63-0 free base

S2266 Asiatic Acid c10 L1700-09 488.7 464-92-6 free base

S2267 Azomycin d10 L1700-09 113.07 527-73-1 free base

S2268 Baicalein e10 L1700-09 270.24 491-67-8 free base

S2269 Baicalin f10 L1700-09 446.36 21967-41-9 free base

S2270 Bergenin g10 L1700-09 328.27 477-90-7 free base

S2271 Berberine HCl h10 L1700-09 371.82 633-65-8 hydrochloride

S2276 Bilobalide a11 L1700-09 326.3 33570-04-6 free base

S2277 Caffeic Acid b11 L1700-09 180.16 331-39-5 free base

S2280 Chlorogenic Acc11 L1700-09 354.31 327-97-9 free base

S2281 Chrysin d11 L1700-09 254.24 480-40-0 free base

S2282 Cinchonidine e11 L1700-09 294.39 485-71-2 free base

S2285 Cryptotanshin f11 L1700-09 296.36 35825-57-1 free base

S2286 Cyclosporin A g11 L1700-09 1202.61 59865-13-3 free base

S2287 Cytisine h11 L1700-09 190.24 485-35-8 free base

S2290 Dihydroartemisa1 L1700-10 284.35 71939-50-9 free base

S2292 Diosmin b1 L1700-10 608.55 520-27-4 free base

S2293 DL-Carnitine Hc1 L1700-10 197.66 461-05-2 hydrochloride

S2295 Emodin d1 L1700-10 270.24 518-82-1 free base

S2296 Enoxolone e1 L1700-10 470.68 471-53-4 free base

S2298 Fisetin f1 L1700-10 286.24 528-48-3 free base

S2299 Formononetin g1 L1700-10 268.26 485-72-3 free base

S2300 Ferulic Acid h1 L1700-10 194.19 1135-24-6 free base

S2302 Glycyrrhizic Aca2 L1700-10 822.93 1405-86-3 free base

S2303 Gossypol b2 L1700-10 518.56 303-45-7 free base

S2304 Gramine c2 L1700-10 174.24 87-52-5 free base

S2306 Gynostemma Exd2 L1700-10 917.13 80321-63-7 free base

S2308 Hesperetin e2 L1700-10 302.27 520-33-2 free base

S2309 Hesperidin f2 L1700-10 610.56 520-26-3 free base

S2310 Honokiol g2 L1700-10 266.334 35354-74-6 free base

S2311 Hyodeoxycholih2 L1700-10 392.57 83-49-8 free base

S2312 Icariin a3 L1700-10 676.66 489-32-7 free base

S2313 Indole-3-carbinb3 L1700-10 147.18 700-06-1 free base

S2314 Kaempferol c3 L1700-10 286.23 520-18-3 free base

S2316 Kinetin d3 L1700-10 215.21 525-79-1 free base

S2317 L-(+)-Rhamnose3 L1700-10 182.17 10030-85-0 monohydrate

S2319 Limonin f3 L1700-10 470.51 1180-71-8 free base

S2320 Luteolin g3 L1700-10 286.24 491-70-3 free base

S2321 Magnolol h3 L1700-10 266.33 528-43-8 free base

S2322 (+)-Matrine a4 L1700-10 248.36 519-02-8 free base

S2323 Methyl-Hesperib4 L1700-10 642.6 11013-97-1 free base

S2325 Morin Hydrate c4 L1700-10 320.25 6202-27-3 hydrate

S2326 Myricetin d4 L1700-10 318.24 529-44-2 free base

S2327 Myricitrin e4 L1700-10 464.38 17912-87-7 free base

S2328 Nalidixic acid f4 L1700-10 232.24 389-08-2 free base

S2329 Naringin g4 L1700-10 580.53 10236-47-2 free base

S2332 Neohesperidinh4 L1700-10 610.56 13241-33-3 free base

S2333 Nobiletin a5 L1700-10 402.39 478-01-3 free base

S2334 Oleanolic Acidb5 L1700-10 456.7 508-02-1 free base

S2335 Oridonin c5 L1700-10 364.43 28957-04-2 free base

S2336 Orotic acid (6- d5 L1700-10 156.1 65-86-1 free base

S2337 Osthole e5 L1700-10 244.29 484-12-8 free base

S2338 Oxymatrine f5 L1700-10 264.36 16837-52-8 free base

S2339 Paeonol g5 L1700-10 166.17 552-41-0 free base

S2341 (-)-Parthenolidh5 L1700-10 248.32 20554-84-1 free base

S2342 Phloretin a6 L1700-10 274.27 60-82-2 free base

S2343 Phlorizin b6 L1700-10 436.41 60-81-1 free base

S2344 Piperine c6 L1700-10 285.34 94-62-2 free base

S2346 Puerarin d6 L1700-10 416.38 3681-99-0 free base

S2347 Quercetin Dihye6 L1700-10 338.27 6151-25-3 dihydrate

S2349 Rutaecarpine f6 L1700-10 287.32 84-26-4 free base

S2350 Rutin g6 L1700-10 610.52 153-18-4 free base

S2351 Salicin h6 L1700-10 286.28 138-52-3 free base

S2354 Sclareol a7 L1700-10 308.5 515-03-7 free base

S2355 Sclareolide b7 L1700-10 250.38 564-20-5 free base

S2356 Shikimic Acid c7 L1700-10 174.15 138-59-0 free base

S2357 Silibinin d7 L1700-10 482.44 22888-70-6 free base

S2358 Silymarin e7 L1700-10 482.44 65666-07-1 free base

S2359 Sinomenine f7 L1700-10 329.39 115-53-7 free base

S2362 Synephrine g7 L1700-10 167.21 94-07-5 free base

S2363 Tangeretin h7 L1700-10 372.37 481-53-8 free base

S2364 Tanshinone I a8 L1700-10 276.29 568-73-0 free base

S2365 Tanshinone IIAb8 L1700-10 294.34 568-72-9 free base

S2366 Taxifolin (Dihyc8 L1700-10 304.25 480-18-2 free base

S2367 Tetrahydropapad8 L1700-10 379.88 1654280 hydrochloride

S2369 Troxerutin e8 L1700-10 742.68 7085-55-4 free base

S2370 Ursolic Acid f8 L1700-10 456.7 77-52-1 free base

S2371 Vanillylaceton g8 L1700-10 194.23 122-48-5 free base

S2372 Xanthone h8 L1700-10 196.2 90-47-1 free base

S2373 Yohimbine HCla9 L1700-10 390.9 65-19-0 hydrochloride

S2374 5-hydroxytryptb9 L1700-10 220.22 56-69-9 free base

S2375 Aloin c9 L1700-10 418.39 1415-73-2 free base

S2376 Ammonium Glycd9 L1700-10 839.96 1407-03-0 glycyrrhizinate

S2377 Biochanin A e9 L1700-10 284.26 491-80-5 free base

S2378 Butylscopolamf9 L1700-10 440.37 149-64-4 bromide

S2379 Dioscin g9 L1700-10 869.04 19057-60-4 free base

S2380 Diosmetin h9 L1700-10 300.26 520-34-3 free base

S2381 D-Mannitol a10 L1700-10 182.17 69-65-8 free base

S2383 Gastrodin b10 L1700-10 286.28 62499-27-8 free base

S2384 Hematoxylin c10 L1700-10 302.28 517-28-2 free base

S2385 Hordenine d10 L1700-10 165.23 539-15-1 free base

S2386 Indirubin e10 L1700-10 262.26 479-41-4 free base

S2387 Lappaconite H f10 L1700-10 665.61 97792-45-5 hydrobromide

S2389 Naringin Dihydg10 L1700-10 582.55 18916-17-1 free base

S2390 Polydatin h10 L1700-10 390.38 65914-17-2 free base

S2391 Quercetin a11 L1700-10 302.24 117-39-5 free base

S2392 Sesamin b11 L1700-10 354.35 607-80-7 free base

S2393 Sorbitol c11 L1700-10 182.17 50-70-4 free base

S2394 Naringenin d11 L1700-10 272.25 480-41-1 free base

S2395 Rheochrysidine11 L1700-10 284.26 521-61-9 free base

S2396 Salidroside f11 L1700-10 300.3 10338-51-9 free base

S2397 Palmatine chlog11 L1700-10 387.86 10605-02-4 chloride

S2399 Dihydromyriceth11 L1700-10 320.25 27200-12-0 free base

S2401 Sodium Dansha1 L1700-11 220.15 67920-52-9 sodium

S2403 Tetrandrine b1 L1700-11 622.75 518-34-3 free base

S2404 Isoliquiritigeni c1 L1700-11 256.25 961-29-5 free base

S2405 Sophocarpine d1 L1700-11 246.35 6483-15-4 free base

S2406 Chrysophanic e1 L1700-11 254.24 481-74-3 free base

S2407 Curcumol f1 L1700-11 236.35 4871-97-0 free base

S2408 Cephalomanning1 L1700-11 831.9 71610-00-9 free base

S2409 10-Deacetylbacch1 L1700-11 544.59 32981-86-5 free base

S2410 Paeoniflorin a2 L1700-11 480.46 23180-57-6 free base

S2411 Geniposide b2 L1700-11 388.37 24512-63-8 free base

S2412 Genipin c2 L1700-11 226.23 6902-77-8 free base

S2413 Geniposidic acd2 L1700-11 374.34 27741-01-1 free base

S2415 Astragaloside e2 L1700-11 784.97 83207-58-3 free base

S2417 20-Hydroxyecdf2 L1700-11 480.63 5289-74-7 free base

S2420 Aloperine g2 L1700-11 232.36 56293-29-9 free base

S2422 Ipriflavone (Osh2 L1700-11 280.32 35212-22-7 free base

S2425 Apocynin a3 L1700-11 166.17 498-02-2 free base

S2437 Rotundine b3 L1700-11 355.43 483-14-7 free base

S2438 Synephrine HCc3 L1700-11 203.67 5985-28-4 hydrochloride

S2439 Guanosine d3 L1700-11 283.24 118-00-3 free base

S2442 Inosine e3 L1700-11 268.23 58-63-9 free base

S2443 Tolbutamide f3 L1700-11 270.35 64-77-7 free base

S2446 Levosimendang3 L1700-11 280.28 141505-33-1 free base

S2449 Forskolin h3 L1700-11 410.5 66575-29-9 free base

S2450 Equol a4 L1700-11 242.27 531-95-3 free base

S2451 Amantadine HCb4 L1700-11 187.7 665-66-7 hydrochloride

S2452 Amfebutamonec4 L1700-11 276.2 31677-93-7 hydrochloride

S2453 Benserazide Hd4 L1700-11 293.7 14919-77-8 hydrochloride

S2454 Bupivacaine HCe4 L1700-11 324.89 18010-40-7 hydrochloride

S2455 Bethanechol chf4 L1700-11 196.68 590-63-6 chloride

S2456 Chlorpromazing4 L1700-11 355.33 69-09-0 hydrochloride

S2457 Clindamycin HCh4 L1700-11 461.44 21462-39-5 hydrochloride

S2458 Clonidine HCl a5 L1700-11 266.5 4205-91-8 hydrochloride

S2459 Clozapine b5 L1700-11 326.82 5786-21-0 free base

S2460 Pramipexole c5 L1700-11 211.33 104632-26-0 free base

S2461 Domperidone d5 L1700-11 425.91 57808-66-9 free base

S2466 Estriol e5 L1700-11 288.39 50-27-1 free base

S2467 Famciclovir f5 L1700-11 321.33863 104227-87-4 free base

S2468 Fenbendazole g5 L1700-11 299.35 43210-67-9 free base

S2470 Fluocinolone Ah5 L1700-11 452.4999 67-73-2 free base

S2471 Gallamine Trieta6 L1700-11 891.53 65-29-2 lodine salt

S2473 Hexestrol b6 L1700-11 270.37 84-16-2 free base

S2475 Imatinib (STI57c6 L1700-11 493.6 152459-95-5 free base

S2476 Itraconazole d6 L1700-11 705.65031 84625-61-6 free base

S2479 Lincomycin HCe6 L1700-11 443 859-18-7 hydrochloride

S2480 Loperamide HCf6 L1700-11 513.5 34552-83-5 hydrochloride

S2481 Manidipine g6 L1700-11 610.7 89226-50-6 free base

S2482 Manidipine 2HCh6 L1700-11 683.62 89226-75-5 dihydrochloride

S2484 Milrinone a7 L1700-11 211.22 78415-72-2 free base

S2485 Mitoxantrone Hb7 L1700-11 517.4 70476-82-3 hydrochloride

S2486 Moroxydine HCc7 L1700-11 207.66 3160-91-6 hydrochloride

S2487 Mycophenolic d7 L1700-11 320.34 24280-93-1 free base

S2489 Nateglinide e7 L1700-11 317.42 105816-04-4 free base

S2491 Nitrendipine f7 L1700-11 360.3699 39562-70-4 free base

S2492 Novobiocin Sog7 L1700-11 634.61 1476-53-5 sodium

S2493 Olanzapine h7 L1700-11 312.43975 132539-06-1 free base

S2494 Olopatadine HCa8 L1700-11 373.87 140462-76-6 hydrochloride

S2495 Oxymetazolineb8 L1700-11 296.84 2315-02-8 hydrochloride

S2496 Ozagrel c8 L1700-11 228.25 82571-53-7 free base

S2497 Pancuronium dd8 L1700-11 732.67 15500-66-0 bromide

S2498 D-Pantothenic e8 L1700-11 219.23954 79-83-4 free base

S2499 Phenoxybenzaf8 L1700-11 340.3 63-92-3 hydrochloride

S2500 Propafenone Hg8 L1700-11 377.9 34183-22-7 free base

S2502 Quinine HCl Dih8 L1700-11 396.91 6119-47-7 dydrate

S2503 Racecadotril a9 L1700-11 385.48 81110-73-8 free base

S2504 Ribavirin b9 L1700-11 244.20864 36791-04-5 free base

S2506 Roxithromycin c9 L1700-11 837.06727 80214-83-1 free base

S2508 Scopolamine Hd9 L1700-11 384.26 114-49-8 hydrobromide

S2509 Sotalol e9 L1700-11 308.82 959-24-0 hydrochloride

S2510 Spectinomycinf9 L1700-11 405.27 21736-83-4 hydrochloride

S2512 Tenoxicam g9 L1700-11 337.37832 59804-37-4 free base

S2515 Vardenafil HCl h9 L1700-11 579.11 224785-90-4 dydrate

S2516 Xylazine HCl a10 L1700-11 256.79 23076-35-9 hydrochloride

S2517 Maprotiline HCb10 L1700-11 313.86 10347-81-6 hydrochloride

S2519 Naphazoline HCc10 L1700-11 246.74 550-99-2 hydrochloride

S2521 Epinephrine Bitd10 L1700-11 333.29 51-42-3 bitartrate

S2522 L-Adrenaline e10 L1700-11 183.2 51-43-4 free base

S2524 Phenytoin sod f10 L1700-11 274.25 630-93-3 sodium

S2525 Phenytoin g10 L1700-11 252.27 57-41-0 free base

S2526 Alizarin h10 L1700-11 240.21 72-48-0 free base

S2527 Methacycline Ha11 L1700-11 478.88 3963-95-9 hydrochloride

S2528 Ciclopirox b11 L1700-11 207.27 29342-05-0 free base

S2529 Dopamine HCl c11 L1700-11 189.64 62-31-7 hydrochloride

S2531 Asaraldehyde d11 L1700-11 196.2 4460-86-0 free base

S2532 L-Ascorbyl 6-pe11 L1700-11 414.53 137-66-6 free base

S2533 Ritodrine HCl f11 L1700-11 323.81 23239-51-2 hydrochloride

S2534 Isoconazole nitg11 L1700-11 479.14 24168-96-5 nitrate

S2535 Econazole nitrah11 L1700-11 444.7 24169-02-6 nitrate

S2536 Miconazole a1 L1700-12 416.13 22916-47-8 free base

S2537 Secnidazole b1 L1700-12 185.18 3366-95-8 free base

S2538 Acetanilide c1 L1700-12 135.16 103-84-4 free base

S2541 Clomipramine d1 L1700-12 351.31 17321-77-6 hydrochloride

S2542 Phenformin HCe1 L1700-12 241.72 834-28-6 hydrochloride

S2543 Ceftiofur HCl f1 L1700-12 560.02 103980-44-5 hydrochloride

S2545 Scopine g1 L1700-12 155.19 498-45-3 free base

S2547 Tiotropium Broh1 L1700-12 490.43 139404-48-1 hydrate

S2548 Scopine HCl a2 L1700-12 191.66 85700-55-6 hydrochloride

S2549 Trospium chlorb2 L1700-12 427.96 10405-02-4 chloride

S2550 Tolterodine tarc2 L1700-12 475.57 124937-52-6 tartrate

S2551 Sulbactam sodd2 L1700-12 255.22 69388-84-7 sodium

S2552 Azelastine HCle2 L1700-12 418.36 79307-93-0 hydrochloride

S2553 5-Aminolevulinf2 L1700-12 167.59 5451-09-2 hydrochloride

S2554 Daphnetin g2 L1700-12 178.14 486-35-1 free base

S2555 Clarithromycinh2 L1700-12 747.95 81103-11-9 free base

S2556 Rosiglitazone a3 L1700-12 357.43 122320-73-4 free base

S2557 Terbinafine HClb3 L1700-12 327.89 78628-80-5 hydrochloride

S2559 Cortisone acetac3 L1700-12 402.48 50-04-4 free base

S2561 Clomifene citrad3 L1700-12 598.08 50-41-9 citrate

S2564 Cloxacillin So e3 L1700-12 475.88 7081-44-9 sodium

S2565 Amoxicillin So f3 L1700-12 387.39 34642-77-8 sodium

S2566 Isoprenaline Hg3 L1700-12 247.72 51-30-9 hydrochloride

S2567 Medroxyprogesh3 L1700-12 386.52 71-58-9 free base

S2569 Phenylephrinea4 L1700-12 203.67 61-76-7 hydrochloride

S2573 Tetracaine HClb4 L1700-12 300.82 136-47-0 hydrochloride

S2574 Tetracycline H c4 L1700-12 480.9 64-75-5 hydrochloride

S2576 Xylometazolined4 L1700-12 280.84 1218-35-5 hydrochloride

S2577 Phenacetin e4 L1700-12 179.22 62-44-2 free base

S2579 Zidovudine f4 L1700-12 267.24 30516-87-1 free base

S2581 Quinapril HCl g4 L1700-12 474.98 82586-55-8 hydrochloride

S2583 Thiamphenicolh4 L1700-12 356.22 15318-45-3 free base

S2584 Clobetasol proa5 L1700-12 466.97 25122-46-7 propionate

S2585 Brompheniramib5 L1700-12 435.31 980-71-2 maleate

S2586 Dimethyl Fumac5 L1700-12 144.13 624-49-7 fumarate

S2589 Miglitol d5 L1700-12 207.22 72432-03-2 free base

S2590 Pioglitazone e5 L1700-12 356.44 111025-46-8 free base

S2593 Tolvaptan f5 L1700-12 448.94 150683-30-0 free base

S2594 Pramiracetam g5 L1700-12 269.38 68497-62-1 free base

S2596 Clindamycin pah5 L1700-12 699.85 25507-04-4 hydrochloride

S2599 L-Thyroxine a6 L1700-12 776.87 51-48-9 free base

S2601 Gliclazide b6 L1700-12 323.41 21187-98-4 free base

S2602 Acemetacin c6 L1700-12 415.82 53164-05-9 free base

S2603 Tioxolone d6 L1700-12 168.17 4991-65-5 free base

S2604 Dehydroepiande6 L1700-12 288.43 53-43-0 free base

S2605 Idebenone f6 L1700-12 338.44 58186-27-9 free base

S2606 Mifepristone g6 L1700-12 429.59 84371-65-3 free base

S2607 Buflomedil HClh6 L1700-12 343.85 35543-24-9 hydrochloride

S2608 Fluocinonide a7 L1700-12 494.52 356-12-7 free base

S2610 Lonidamine b7 L1700-12 321.16 50264-69-2 free base

S2612 Ribitol c7 L1700-12 152.15 488-81-3 free base

S2613 Clorsulon d7 L1700-12 380.66 60200-06-8 free base

S2614 Arecoline e7 L1700-12 236.11 300-08-3 HBr

S2615 Noradrenaline f7 L1700-12 337.28 108341-18-0 monohydrate

S2617 TAK-733 g7 L1700-12 504.23 1035555-63-5 free base

S2619 MG-132 h7 L1700-12 475.62 133407-82-6 free base

S2620 GSK256066 a8 L1700-12 518.58 801312-28-7 free base

S2621 AZD5438 b8 L1700-12 371.46 602306-29-6 free base

S2622 PP121 c8 L1700-12 319.36 1092788-83-4 free base

S2623 Omecamtiv mecd8 L1700-12 401.43 873697-71-3 free base

S2624 OSI-027 e8 L1700-12 406.44 936890-98-1 free base

S2625 Fostamatinib ( f8 L1700-12 580.46 901119-35-5 free base

S2626 LY2603618 g8 L1700-12 436.3 911222-45-2 free base

S2627 Tubastatin A Hh8 L1700-12 371.86 1310693-92-5 hydrochloride

S2629 PNU-120596 a9 L1700-12 311.72 501925-31-1 free base

S2630 GW3965 HCl b9 L1700-12 618.51 405911-17-3 hydrochloride

S2631 URB597 c9 L1700-12 338.4 546141-08-6 free base

S2632 BMS-378806 d9 L1700-12 406.43 357263-13-9 free base

S2633 NPS-2143 e9 L1700-12 408.92 284035-33-2 free base

S2634 DCC-2036 (Rebaf9 L1700-12 553.59 1020172-07-9 free base

S2635 CCT128930 g9 L1700-12 341.84 885499-61-6 free base

S2636 A66 h9 L1700-12 393.53 1166227-08-2 free base

S2637 TAK-875 a10 L1700-12 533.63 1374598-80-7 hydrate

S2638 NU7441 (KU-57b10 L1700-12 413.49 503468-95-9 free base

S2639 SNX-2112 (PF- c10 L1700-12 464.48 908112-43-6 free base

S2656 PF-04929113 ( d10 L1700-12 521.53 908115-27-5 free base

S2658 GSK2126458 ( e10 L1700-12 505.5 1086062-66-9 free base

S2659 5-hydroxymethyf10 L1700-12 341.49 207679-81-0 free base

S2660 MK-0752 g10 L1700-12 442.9 471905-41-6 free base

S2661 WYE-125132 (Wh10 L1700-12 519.6 1144068-46-1 free base

S2662 ICG-001 a11 L1700-12 548.63 780757-88-2 free base

S2663 WAY-100635 Mab11 L1700-12 538.64 1092679-51-0 hydrochloride

S2664 Clinofibrate c11 L1700-12 468.58 30299-08-2 free base

S2665 Ciprofibrate d11 L1700-12 289.15 52214-84-3 free base

S2666 PF-3845 e11 L1700-12 456.46 1196109-52-0 free base

S2667 Dolutegravir ( f11 L1700-12 419.38 1051375-16-6 free base

S2670 A-674563 g11 L1700-12 358.44 552325-73-2 free base

S2671 AS-252424 h11 L1700-12 305.28 900515-16-4 free base

S2672 PF-00562271 a1 L1700-13 665.66 939791-38-5 benzenesulfonic

S2673 Trametinib (G b1 L1700-13 615.39 871700-17-3 free base

S2674 A922500 c1 L1700-13 428.48 959122-11-3 free base

S2677 BRL-15572 d1 L1700-13 479.87 193611-72-2 dihydrochloride

S2679 Flavopiridol HCe1 L1700-13 438.3 131740-09-5 hydrochloride

S2680 Ibrutinib (PCI- f1 L1700-13 440.5 936563-96-1 free base

S2681 AS-604850 g1 L1700-13 285.22 648449-76-7 free base

S2682 CAY10505 h1 L1700-13 289.28 1218777-13-9 free base

S2683 CHIR-124 a2 L1700-13 419.91 405168-58-3 free base

S2685 KW-2478 b2 L1700-13 574.66 819812-04-9 free base

S2686 NVP-BSK805 2c2 L1700-13 563.47 1092499-93-8(f hydrochloride

S2688 R547 d2 L1700-13 441.45 741713-40-6 free base

S2689 WAY-600 e2 L1700-13 494.59 1062159-35-6 free base

S2690 ADX-47273 f2 L1700-13 369.36 851881-60-2 free base

S2691 BMY 7378 g2 L1700-13 458.42 21102-95-4 dihydrochloride

S2692 TG101209 h2 L1700-13 509.67 936091-14-4 free base

S2693 Resminostat a3 L1700-13 349.4 864814-88-0 free base

S2694 XL335 b3 L1700-13 438.47 629664-81-9 free base

S2696 GDC-0980 (RG7c3 L1700-13 498.6 1032754-93-0 free base

S2697 A-769662 d3 L1700-13 360.39 844499-71-4 free base

S2698 RS-127445 e3 L1700-13 281.33 199864-87-3 free base

S2699 CH5132799 f3 L1700-13 377.42 1007207-67-1 free base

S2700 KX2-391 g3 L1700-13 431.53 897016-82-9 free base

S2703 GSK1838705A h3 L1700-13 532.57 1116235-97-2 free base

S2711 YO-01027 a4 L1700-13 463.48 209984-56-5 free base

S2713 Geldanamycinb4 L1700-13 560.64 30562-34-6 free base

S2714 LY411575 c4 L1700-13 479.48 209984-57-6 free base

S2717 CP-91149 d4 L1700-13 399.87 186392-40-5 free base

S2718 TAK-901 e4 L1700-13 504.64 934541-31-8 free base

S2719 AMG-900 f4 L1700-13 503.58 945595-80-2 free base

S2720 ZM 336372 g4 L1700-13 389.45 208260-29-1 free base

S2721 Nilvadipine h4 L1700-13 385.37 75530-68-6 free base

S2722 JTC-801 a5 L1700-13 447.96 244218-51-7 hydrochloride

S2726 PH-797804 b5 L1700-13 477.3 586379-66-0 free base

S2727 Dacomitinib (Pc5 L1700-13 469.94 1110813-31-4 free base

S2728 AG-1478 (Tyrphd5 L1700-13 315.75 153436-53-4 free base

S2729 SB415286 e5 L1700-13 359.72 264218-23-7 free base

S2730 Crenolanib (CPf5 L1700-13 443.54 670220-88-9 free base

S2731 AZ 3146 g5 L1700-13 452.55 1124329-14-1 free base

S2735 MK-8776 (SCH h5 L1700-13 376.25 891494-63-6 free base

S2736 TG101348 (SARa6 L1700-13 524.68 936091-26-8 free base

S2738 PAC-1 b6 L1700-13 392.49 315183-21-2 free base

S2742 PHA-767491 c6 L1700-13 213.24 845714-00-3 free base

S2743 PF-04691502 d6 L1700-13 425.48 1013101-36-4 free base

S2744 CCT137690 e6 L1700-13 551.48 1095382-05-0 free base

S2746 AZ 628 f6 L1700-13 451.52 878739-06-1 free base

S2747 AMG-458 g6 L1700-13 539.58 913376-83-7 free base

S2748 Anacetrapib (Mh6 L1700-13 637.51 875446-37-0 free base

S2749 BGT226 (NVP- a7 L1700-13 650.6 1245537-68-1 free base

S2750 GW788388 b7 L1700-13 425.48 452342-67-5 free base

S2751 Milciclib (PHA c7 L1700-13 460.57 802539-81-7 free base

S2752 HER2-Inhibitord7 L1700-13 569.63 937265-83-3 free base

S2755 Varlitinib e7 L1700-13 466.94 845272-21-1 free base

S2758 Wortmannin f7 L1700-13 428.43 19545-26-7 free base

S2759 CUDC-907 g7 L1700-13 508.55 1339928-25-4 free base

S2760 Canagliflozin h7 L1700-13 444.52 842133-18-0 free base

S2761 NVP-BVU972 a8 L1700-13 340.38 1185763-69-2 free base

S2765 MK-2048 b8 L1700-13 461.87 869901-69-9 free base

S2767 3-Methyladeni c8 L1700-13 149.15 5142-23-4 free base

S2768 Dinaciclib (SC d8 L1700-13 396.49 779353-01-4 free base

S2769 Dovitinib (TKI-2e8 L1700-13 572.59 852433-84-2 dilactic Acid

S2770 MK-5108 (VX-6f8 L1700-13 461.94 1010085-13-8 free base

S2772 Dalcetrapib (J g8 L1700-13 389.59 211513-37-0 free base

S2773 SB705498 h8 L1700-13 429.23 501951-42-4 free base

S2774 MK-2461 a9 L1700-13 495.55 917879-39-1 free base

S2775 Nocodazole b9 L1700-13 301.32 31430-18-9 free base

S2776 CPI-613 c9 L1700-13 388.59 95809-78-2 free base

S2777 PF-5274857 d9 L1700-13 436.96 1373615-35-0 free base

S2778 GW842166X e9 L1700-13 449.25 666260-75-9 free base

S2779 M344 f9 L1700-13 307.39 251456-60-7 free base

S2780 I-BET151 (GSKg9 L1700-13 415.44 1300031-49-5 free base

S2781 RITA (NSC 652h9 L1700-13 292.37 213261-59-7 free base

S2782 GW4064 a10 L1700-13 542.84 278779-30-9 free base

S2783 AZD2014 b10 L1700-13 462.54 1009298-59-2 free base

S2784 TAK-285 c10 L1700-13 547.96 871026-44-7 free base

S2785 A-803467 d10 L1700-13 357.79 944261-79-4 free base

S2787 Laquinimod e10 L1700-13 356.8 248281-84-7 free base

S2789 Tofacitinib (CPf10 L1700-13 312.37 477600-75-2 free base

S2790 Istradefylline g10 L1700-13 384.43 155270-99-8 free base

S2791 Sotrastaurin h10 L1700-13 438.48 425637-18-9 free base

S2792 Torcetrapib a11 L1700-13 600.47 262352-17-0 free base

S2794 Sofosbuvir (PSb11 L1700-13 529.45 1190307-88-0 Free BaseS2795 VU 0357121 c11 L1700-13 305.32 433967-28-3 free base

S2796 WP1066 d11 L1700-13 356.22 857064-38-1 free base

S2797 Lonafarnib e11 L1700-13 638.82 193275-84-2 free base

S2801 AZD4547 f11 L1700-13 463.57 1035270-39-3 free base

S2803 Galeterone g11 L1700-13 388.55 851983-85-2 free base

S2804 Sirtinol h11 L1700-13 394.47 410536-97-9 free base

S2806 CEP-33779 a1 L1700-14 462.57 1257704-57-6 free base

S2807 Dabrafenib (G b1 L1700-14 519.56 1195765-45-7 free base

S2808 GDC-0068 c1 L1700-14 458 1001264-89-6 free base

S2809 MPEP d1 L1700-14 193.24 96206-92-7 free base

S2811 INK 128 (MLN0e1 L1700-14 309.33 1224844-38-5 free base

S2812 AT101 f1 L1700-14 578.61 866541-93-7 free base

S2813 Ciproxifan g1 L1700-14 386.4 184025-18-1 maleate

S2814 BYL719 h1 L1700-14 441.47 1217486-61-7 free base

S2816 Tyrphostin AGa2 L1700-14 316.46 148741-30-4 free base

S2817 Torin 2 b2 L1700-14 432.4 1223001-51-1 free base

S2818 CI994 (Tacedinac2 L1700-14 269.3 112522-64-2 free base

S2819 AM251 d2 L1700-14 555.24 183232-66-8 free base

S2820 TAE226 (NVP-Te2 L1700-14 468.94 761437-28-9 free base

S2821 RG108 f2 L1700-14 334.33 48208-26-0 free base

S2822 OC000459 g2 L1700-14 348.37 851723-84-7,95free base

S2824 TPCA-1 h2 L1700-14 279.29 507475-17-4 free base

S2825 ML133 HCl a3 L1700-14 313.82 1222781-70-5 hydrochloride

S2828 JNJ-1661010 b3 L1700-14 365.45 681136-29-8 free base

S2830 Clindamycin c3 L1700-14 424.98 18323-44-9 free base

S2832 Epiandrostero d3 L1700-14 290.44 481-29-8 free base

S2840 ARN-509 e3 L1700-14 477.43 956104-40-8 free base

S2842 SAR131675 f3 L1700-14 358.39 1433953-83-3 free base

S2843 BI-D1870 g3 L1700-14 391.42 501437-28-1 free base

S2845 Semaxanib (SUh3 L1700-14 238.28 194413-58-6 free base

S2847 Cathepsin Inhiba4 L1700-14 401.89 225120-65-0 free base

S2849 SB269970 HCl b4 L1700-14 388.95 261901-57-9 hydrochloride

S2851 Baricitinib (L c4 L1700-14 371.42 1187594-09-7 free base

S2852 BRL-54443 d4 L1700-14 230.31 57477-39-1 free base

S2853 Carfilzomib (P e4 L1700-14 719.91 868540-17-4 free base

S2854 BML-190 f4 L1700-14 426.89 2854-32-2 free base

S2855 MRS 2578 g4 L1700-14 472.67 711019-86-2 free base

S2856 SB271046 h4 L1700-14 451.99 209481-20-9 free base

S2857 MK-801 (Dizocia5 L1700-14 221.3 77086-21-6 free base

S2858 StemRegenin 1b5 L1700-14 429.54 1227633-49-9 free base

S2859 Golvatinib (E7 c5 L1700-14 633.69 928037-13-2 free base

S2860 IEM 1754 dihy d5 L1700-14 412.25 162831-31-4 dihydrobroMide

S2861 CTEP (RO49563e5 L1700-14 391.77 871362-31-1 free base

S2862 VU 0364770 f5 L1700-14 232.67 61350-00-3 free base

S2863 ML130 (Nodinitg5 L1700-14 287.34 799264-47-4 free base

S2864 IMD 0354 h5 L1700-14 383.67 978-62-1 free base

S2865 VUF 10166 a6 L1700-14 262.74 155584-74-0 free base

S2866 U-104 b6 L1700-14 309.32 178606-66-1 free base

S2867 WHI-P154 c6 L1700-14 376.2 211555-04-3 free base

S2868 Alogliptin d6 L1700-14 339.39 850649-61-5 free base

S2870 TG100713 e6 L1700-14 254.25 925705-73-3 free base

S2871 T0070907 f6 L1700-14 277.66 313516-66-4 free base

S2872 GW5074 g6 L1700-14 520.94 220904-83-6 free base

S2874 Camostat Mesilh6 L1700-14 494.52 59721-29-8 mesilate

S2875 Prucalopride a7 L1700-14 367.87 179474-81-8 free base

S2876 (-)-MK 801 Mal b7 L1700-14 337.37 121917-57-5 maleate

S2882 IKK-16 (IKK Inhic7 L1700-14 483.63 873225-46-8 free base

S2883 4-Aminohippurid7 L1700-14 194.19 61-78-9 free base

S2884 Acesulfame Poe7 L1700-14 202.25 55589-62-3 potassium

S2885 A-205804 f7 L1700-14 300.4 251992-66-2 free base

S2886 PJ34 g7 L1700-14 295.34 344458-19-1 hydrochloride

S2890 PF-562271 h7 L1700-14 507.49 717907-75-0 free base

S2892 VU 0361737 a8 L1700-14 262.69 1161205-04-4 free base

S2894 SB742457 b8 L1700-14 353.44 607742-69-8 free base

S2895 Tyrphostin 9 c8 L1700-14 282.38 10537-47-0 free base

S2896 ZM 323881 HCld8 L1700-14 411.86 193000-39-4 hydrochloride

S2897 ZM 306416 e8 L1700-14 333.74 690206-97-4 free base

S2899 GNF-2 f8 L1700-14 374.32 778270-11-4 free base

S2900 Cobicistat (GSg8 L1700-14 776.02 1004316-88-4 free base

S2901 CCG 50014 h8 L1700-14 316.35 883050-24-6 free base

S2902 S-Ruxolitinib a9 L1700-14 306.37 941685-37-6 free base

S2903 Lumiracoxib b9 L1700-14 293.72 220991-20-8 free base

S2904 PF-477736 c9 L1700-14 419.48 952021-60-2 free base

S2905 JNJ-7777120 d9 L1700-14 277.75 459168-41-3 free base

S2906 Ki16198 e9 L1700-14 488.98 355025-13-7 free base

S2907 Pirfenidone f9 L1700-14 185.22 53179-13-8 free base

S2910 Tempol g9 L1700-14 172.24 2226-96-2 free base

S2911 Go 6983 h9 L1700-14 442.51 133053-19-7 free base

S2912 WZ811 a10 L1700-14 290.36 55778-02-4 free base

S2913 BAY 11-7082 b10 L1700-14 207.25 19542-67-7 free base

S2914 Dapivirine (TMc10 L1700-14 329.4 244767-67-7 free base

S2915 GW9662 d10 L1700-14 276.68 22978-25-2 free base

S2916 ML161 e10 L1700-14 361.23 423735-93-7 free base

S2918 HC-030031 f10 L1700-14 355.39 349085-38-7 free base

S2919 IOX2 g10 L1700-14 352.34 931398-72-0 free base

S2921 PF-4981517 h10 L1700-14 456.59 1390637-82-7 free base

S2922 Icotinib a11 L1700-14 391.42 610798-31-7 free base

S2923 Salubrinal b11 L1700-14 479.81 405060-95-9 free base

S2924 CHIR-99021 (Cc11 L1700-14 501.8 252917-06-9(fr hydrochloride

S2925 Evacetrapib (Ld11 L1700-14 638.65 1186486-62-3 free base

S2927 Apoptosis Actie11 L1700-14 306.14 79183-19-0 free base

S2928 TAK-715 f11 L1700-14 399.51 303162-79-0 free base

S2929 Pifithrin-α (PF g11 L1700-14 367.3 63208-82-2 HBr

S2930 Pifithrin-μ h11 L1700-14 181.21 64984-31-2 free base

S3000 Carbazochromea1 L1700-15 322.27 51460-26-5 sodium

S3001 Clevudine b1 L1700-15 260.22 163252-36-6 free base

S3002 Rivaroxaban c1 L1700-15 435.88 366789-02-8 free base

S3005 Paroxetine HCld1 L1700-15 365.83 78246-49-8 hydrochloride

S3007 Zanamivir e1 L1700-15 332.31 139110-80-8 free base

S3008 Zaltoprofen f1 L1700-15 298.36 74711-43-6 free base

S3012 Pazopanib g1 L1700-15 437.52 444731-52-6 free base

S3015 Amoxicillin h1 L1700-15 365.4 26787-78-0 free base

S3017 Aspirin a2 L1700-15 180.16 50-78-2 free base

S3018 Niflumic acid b2 L1700-15 282.22 4394-00-7 free base

S3019 Ciclopirox eth c2 L1700-15 268.35 41621-49-2 ethanolamine

S3020 Romidepsin (FKd2 L1700-15 540.7 128517-07-7 Free BaseS3021 Rimonabant e2 L1700-15 463.79 168273-06-1 free base

S3022 Cabazitaxel f2 L1700-15 835.93 183133-96-2 free base

S3023 Bufexamac g2 L1700-15 223.27 2438-72-4 free base

S3024 Lamotrigine h2 L1700-15 256.09 84057-84-1 free base

S3025 PMSF a3 L1700-15 174.19 329-98-6 free base

S3026 Piceatannol b3 L1700-15 244.24 10083-24-6 free base

S3031 Linagliptin c3 L1700-15 472.54 668270-12-0 free base

S3032 Bindarit d3 L1700-15 324.37 130641-38-2 free base

S3033 Vildagliptin (L e3 L1700-15 303.4 274901-16-5 free base

S3034 Sitaxentan so f3 L1700-15 476.89 210421-74-2 free base

S3035 Daunorubicin g3 L1700-15 563.98 23541-50-6 hydrochloride

S3036 Pravastatin soh3 L1700-15 446.51 81131-70-6 free base

S3037 Bepotastine Bea4 L1700-15 547.06 190786-44-8 besilate

S3038 Fosaprepitant b4 L1700-15 1004.83 265121-04-8 meglumine

S3042 Purmorphaminc4 L1700-15 520.62 483367-10-8 free base

S3043 Rofecoxib d4 L1700-15 314.36 162011-90-7 free base

S3045 Cinepazide male4 L1700-15 533.57 26328-04-1 maleate

S3046 Azilsartan f4 L1700-15 456.45 147403-03-0 free base

S3047 Otilonium Bro g4 L1700-15 563.57 26095-59-0 free base

S3048 Solifenacin su h4 L1700-15 480.55 242478-38-2 succinate

S3051 Bosentan Hydra5 L1700-15 569.63 157212-55-0 hydrate

S3052 Rupatadine Fub5 L1700-15 532.03 182349-12-8 fumarate

S3053 Azelnidipine c5 L1700-15 582.65 123524-52-7 free base

S3054 Alverine Citratd5 L1700-15 473.56 5560-59-8 citrate

S3057 Azilsartan Mede5 L1700-15 568.53 863031-21-4 free base

S3060 Medetomidine f5 L1700-15 236.74 86347-15-1 hydrochloride

S3061 Epinephrine HCg5 L1700-15 219.67 55-31-2 hydrochloride

S3062 Diclofenac Poth5 L1700-15 334.24 15307-81-0 potassium

S3063 Diclofenac Diea6 L1700-15 369.29 78213-16-8 diethylamine

S3064 Ambroxol HCl b6 L1700-15 414.56 23828-92-4 hydrochloride

S3066 Naloxone HCl c6 L1700-15 363.84 357-08-4 hydrochloride

S3067 Chlorhexidine d6 L1700-15 578.37 3697-42-5 HClS3070 Piracetam e6 L1700-15 142.16 7491-74-9 free base

S3071 Vanillin f6 L1700-15 152.15 121-33-5 free base

S3073 Caspofungin Ag6 L1700-15 1213.42 179463-17-3 acetate

S3075 Dexmedetomidh6 L1700-15 200.28 113775-47-6 free base

S3076 Foscarnet Soda7 L1700-15 191.95 63585-09-1 sodium

S3078 Beclomethasonb7 L1700-15 521.04 5534/9/8 free base

S3079 Atovaquone c7 L1700-15 366.84 95233-18-4 free base

S3080 Etravirine (TM d7 L1700-15 435.28 269055-15-4 free base

S3081 Ulipristal e7 L1700-15 475.62 159811-51-5 free base

S3083 Indacaterol Maf7 L1700-15 508.56 753498-25-8 maleate

S3100 2-Thiouracil g7 L1700-15 128.15 141-90-2 free base

S3104 Moguisteine h7 L1700-15 339.41 119637-67-1 free base

S3105 Nadifloxacin a8 L1700-15 360.38 124858-35-1 free base

S3106 Pidotimod b8 L1700-15 244.27 121808-62-6 free base

S3113 Pyridoxine HClc8 L1700-15 205.64 58-56-0 hydrochloride

S3114 Vitamin C d8 L1700-15 176.12 50-81-7 free base

S3116 Sulfathiazole e8 L1700-15 255.32 72-14-0 free base

S3117 Oxybutynin chlf8 L1700-15 393.95 1508-65-2 chloride

S3121 Ornidazole g8 L1700-15 219.63 16773-42-5 free base

S3129 Trimethoprim h8 L1700-15 290.32 738-70-5 free base

S3130 Biotin (Vitamina9 L1700-15 244.31 58-85-5 free base

S3132 Sulfamerazine b9 L1700-15 264.3 127-79-7 free base

S3133 Sulfamethazin c9 L1700-15 278.33 57-68-1 free base

S3137 Sodium salicyld9 L1700-15 161.11 54-21-7 salicylate

S3138 Methylthiouracie9 L1700-15 142.18 56-04-2 free base

S3139 Methenamine f9 L1700-15 140.19 100-97-0 free base

S3140 Milnacipran HCg9 L1700-15 282.81 101152-94-7 hydrochloride

S3144 Darifenacin HBh9 L1700-15 507.46 133099-07-7 HBr

S3146 Tripelennamina10 L1700-15 291.82 154-69-8 hydrochloride

S3147 Entacapone b10 L1700-15 305.29 130929-57-6 free base

S3149 Estradiol valerc10 L1700-15 356.5 979-32-8 free base

S3150 Articaine HCl d10 L1700-15 320.84 23964-57-0 hydrochloride

S3151 Gliquidone e10 L1700-15 527.63 33342-05-1 free base

S3154 Butenafine HClf10 L1700-15 353.93 101827-46-7 hydrochloride

S3155 Mepivacaine Hg10 L1700-15 282.81 1722-62-9 hydrochloride

S3160 Ethynodiol diah10 L1700-15 384.51 297-76-7 free base

S3161 Sertaconazole na11 L1700-15 500.78 99592-39-9 nitrate

S3162 Tylosin tartrateb11 L1700-15 1066.19 74610-55-2 tartrate

S3163 Benztropine mec11 L1700-15 403.53 132-17-2 mesylate

S3167 Altrenogest d11 L1700-15 310.43 850-52-2 free base

S3170 Ampicillin sode11 L1700-15 371.39 69-52-3 sodium

S3172 Anagrelide HClf11 L1700-15 292.55 58579-51-4 hydrochloride

S3173 Antipyrine g11 L1700-15 188.23 60-80-0 free base

S3175 Atomoxetine Hh11 L1700-15 291.82 82248-59-7 hydrochloride

S3176 Betahistine 2Ha1 L1700-16 209.12 5579-84-0 2HCl

S3178 Brinzolamide b1 L1700-16 383.51 138890-62-7 free base

S3179 Carbenicillin c1 L1700-16 422.36 4800-94-6 disodium

S3180 Eletriptan HBr d1 L1700-16 463.43 177834-92-3 HBr

S3181 Flumequine e1 L1700-16 261.25 42835-25-6 free base

S3183 Amitriptyline Hf1 L1700-16 313.86 549-18-8 hydrochloride

S3185 Adrenalone HCg1 L1700-16 217.65 62-13-5 hydrochloride

S3186 Azatadine dimah1 L1700-16 522.55 3978-86-7 maleate

S3188 (+,-)-Octopami a2 L1700-16 189.64 770-05-8 hydrochloride

S3189 Ropinirole HClb2 L1700-16 296.84 91374-20-8 hydrochloride

S3190 N6-methyladenc2 L1700-16 281.27 1867-73-8 free base

S3193 Ticarcillin sod d2 L1700-16 430.41 29457-07-6 sodium

S3195 Azlocillin sodi e2 L1700-16 484.48 37091-65-9 sodium

S3196 Azacyclonol f2 L1700-16 267.37 115-46-8 free base

S3199 Reboxetine meg2 L1700-16 409.5 98769-84-7 mesylate

S3200 Triflusal h2 L1700-16 248.16 322-79-2 free base

S3201 Trifluoperazin a3 L1700-16 480.42 440-17-5 2HCl

S3202 Catharanthine b3 L1700-16 336.43 2468-21-5 free base

S3204 Meptazinol HClc3 L1700-16 269.81 59263-76-2 hydrochloride

S3208 Fexofenadine d3 L1700-16 538.12 153439-40-8 hydrochloride

S3209 Amidopyrine e3 L1700-16 231.29 58-15-1 free base

S3212 Moclobemide (f3 L1700-16 268.74 71320-77-9 free base

S3600 Schisandrin B g3 L1700-16 400.46 61281-37-6 free base

S3603 Betulinic acid h3 L1700-16 456.7 472-15-1 free base

S3604 Triptolide (PG4a4 L1700-16 360.4 38748-32-2 free base

S4000 Pergolide mesyb4 L1700-16 410.59 66104-23-2 mesylate

S4001 Cabozantinib mc4 L1700-16 635.59 1140909-48-3 MalateS4002 Sitagliptin ph d4 L1700-16 523.32 654671-77-9 phosphate

S4003 Lithocholic acie4 L1700-16 376.57 434-13-9 free base

S4004 Ethambutol HCf4 L1700-16 277.23 1070-11-7 hydrochloride

S4005 Doxycycline Hg4 L1700-16 480.9 10592-13-9 hydrochloride

S4007 Pentamidine h4 L1700-16 413.34 50357-45-4 hydrochloride

S4009 Mirabegron a5 L1700-16 396.51 223673-61-8 free base

S4010 Acebutolol HClb5 L1700-16 372.89 34381-68-5 hydrochloride

S4011 Ampiroxicam c5 L1700-16 447.46 99464-64-9 free base

S4012 Desloratadine d5 L1700-16 310.82 100643-71-8 free base

S4014 Hyoscyamine e5 L1700-16 289.37 101-31-5 free base

S4015 Cyclamic acidf5 L1700-16 179.24 100-88-9 free base

S4016 Ouabain g5 L1700-16 728.77 630-60-4 free base

S4017 Allylthiourea h5 L1700-16 116.18 109-57-9 free base

S4019 Avanafil a6 L1700-16 483.95 330784-47-9 free base

S4020 Sodium Picosulb6 L1700-16 481.41 10040-45-6 sodium

S4021 Tolcapone c6 L1700-16 273.24 134308-13-7 free base

S4022 Probenecid d6 L1700-16 285.36 57-66-9 free base

S4023 Procaine HCl e6 L1700-16 272.77 51-05-8 hydrochloride

S4024 Homatropine Mf6 L1700-16 370.28 80-49-9 MethylbromideS4025 Homatropine Bg6 L1700-16 356.25 51-56-9 bromide

S4026 Hydroxyzine 2 h6 L1700-16 447.83 2192-20-3 hydrochloride

S4027 Flavoxate HCl a7 L1700-16 427.92 3717-88-2 hydrochloride

S4031 Aclidinium Br b7 L1700-16 564.55 320345-99-1 free base

S4034 Diphemanil Metc7 L1700-16 389.51 62-97-5 methylsulfate

S4035 Vitamin D2 d7 L1700-16 396.65 50-14-6 free base

S4037 Doxapram HCle7 L1700-16 432.98 7081-53-0 hydrochloride

S4038 Dibucaine HCl f7 L1700-16 379.92 61-12-1 free base

S4039 Methazolamideg7 L1700-16 236.27 554-57-4 free base

S4040 Norethindroneh7 L1700-16 298.42 68-22-4 free base

S4041 Olsalazine So a8 L1700-16 346.2 6054-98-4 free base

S4042 Nafcillin Sodi b8 L1700-16 454.47 7177-50-6 free base

S4043 Tetrahydrozolic8 L1700-16 236.74 522-48-5 free base

S4044 Toltrazuril d8 L1700-16 425.38 69004-03-1 free base

S4045 Pheniramine Me8 L1700-16 356.42 132-20-7 maleate

S4046 Estradiol Cypi f8 L1700-16 396.56 313-06-4 Free BaseS4047 Bisacodyl g8 L1700-16 361.39 603-50-9 free base

S4048 Carbimazole h8 L1700-16 186.23 22232-54-8 free base

S4049 Valdecoxib a9 L1700-16 314.36 181695-72-7 free base

S4050 Valganciclovir b9 L1700-16 390.82 175865-59-5 hydrochloride

S4051 Nabumetone c9 L1700-16 228.29 42924-53-8 free base

S4053 Sertraline HCl d9 L1700-16 342.69 79559-97-0 hydrochloride

S4054 Spironolactonee9 L1700-16 416.57 52-01-7 free base

S4056 Retapamulin f9 L1700-16 517.76 224452-66-8 free base

S4057 Methyclothiazig9 L1700-16 360.24 135-07-9 free base

S4058 Ropivacaine Hh9 L1700-16 310.86 132112-35-7 hydrochloride

S4059 Sodium Nitropa10 L1700-16 261.92 14402-89-2 sodium

S4062 Ronidazole b10 L1700-16 200.15 7681-76-7 free base

S4063 Vitamin D3 c10 L1700-16 384.64 67-97-0 free base

S4064 Escitalopram Od10 L1700-16 414.43 219861-08-2 oxalate

S4065 Guanabenz Acee10 L1700-16 291.13 23256-50-0 acetate

S4068 Tinidazole f10 L1700-16 247.27 19387-91-8 free base

S4070 Guanidine HClg10 L1700-16 95.53 50-01-1 hydrochloride

S4071 Griseofulvin h10 L1700-16 352.77 126-07-8 free base

S4072 Decamethoniua11 L1700-16 418.29 541-22-0 bromide

S4073 Sodium 4-Aminob11 L1700-16 211.15 6018-19-5 sodium

S4074 Sodium Nitrite c11 L1700-16 69 7632-00-0 sodium

S4075 Zinc Pyrithioned11 L1700-16 317.7 13463-41-7 free base

S4076 Propranolol HCe11 L1700-16 295.8 318-98-9 hydrochloride

S4077 Mequinol f11 L1700-16 124.14 150-76-5 free base

S4078 Mefenamic Acig11 L1700-16 241.29 61-68-7 free base

S4079 Ticagrelor h11 L1700-16 522.57 274693-27-5 free base

S4080 Triamterene a1 L1700-17 253.26 396-01-0 free base

S4081 Sulfacetamide b1 L1700-17 236.22 127-56-0 sodium

S4082 Spiramycin c1 L1700-17 843.058 8025-81-8 free base

S4084 Lomerizine HCld1 L1700-17 541.46 101477-54-7 hydrochloride

S4085 Levobetaxolol e1 L1700-17 343.89 116209-55-3 hydrochloride

S4086 Loxapine Succf1 L1700-17 445.9 27833-64-3 succinate

S4088 Flumethasone g1 L1700-17 410.45 2135-17-3 free base

S4089 Halobetasol Prh1 L1700-17 484.96 66852-54-8 free base

S4090 Fenspiride HCla2 L1700-17 296.79 5053-08-7 hydrochloride

S4091 Ifenprodil Tartrb2 L1700-17 475.53 23210-58-4 tartrate

S4092 Pramoxine HClc2 L1700-17 329.86 637-58-1 hydrochloride

S4095 Difluprednate d2 L1700-17 508.55 23674-86-4 free base

S4096 Droperidol e2 L1700-17 379.43 548-73-2 free base

S4097 Dydrogesteronf2 L1700-17 312.45 152-62-5 free base

S4098 Halcinonide g2 L1700-17 454.96 3093-35-4 free base

S4099 Dexlansoprazoh2 L1700-17 369.36 138530-94-6 free base

S4100 Esmolol HCl a3 L1700-17 331.83 81161-17-3 hydrochloride

S4101 Voglibose b3 L1700-17 267.28 83480-29-9 free base

S4102 Eprosartan Mesc3 L1700-17 520.62 144143-96-4 free base

S4104 Diminazene Acd3 L1700-17 515.52 908-54-3 aceturate

S4105 Closantel Sod e3 L1700-17 685.06 61438-64-0 free base

S4106 Closantel f3 L1700-17 663.07 57808-65-8 free base

S4107 Clofazimine g3 L1700-17 473.4 2030-63-9 free base

S4109 Lorcaserin HClh3 L1700-17 232.15 846589-98-8 hydrochloride

S4110 Estradiol Benza4 L1700-17 376.49 50-50-0 Free BaseS4111 Dicloxacillin b4 L1700-17 510.32 343-55-5 sodium

S4112 Desvenlafaxinec4 L1700-17 381.46 386750-22-7 succinate

S4113 Desvenlafaxined4 L1700-17 263.38 93413-62-8 free base

S4114 Triclabendazole4 L1700-17 359.66 68786-66-3 free base

S4116 Isovaleramide f4 L1700-17 101.15 541-46-8 free base

S4118 Histamine 2HCg4 L1700-17 184.07 56-92-8 hydrochloride

S4119 Pefloxacin Mesh4 L1700-17 465.49 149676-40-4 MesylateS4120 Sulconazole Nia5 L1700-17 460.76 61318-91-0 nitrate

S4122 Tilmicosin b5 L1700-17 869.13 108050-54-0 free base

S4123 Timolol Maleatc5 L1700-17 432.49 26921-17-5 maleate

S4124 Tolazoline HCld5 L1700-17 196.68 59-97-2 free base

S4125 Sodium Phenyle5 L1700-17 186.18 1716-12-7 free base

S4128 Troxipide f5 L1700-17 294.35 30751-05-4 free base

S4131 Levodropropizg5 L1700-17 236.31 99291-25-5 free base

S4132 Deoxyarbutin h5 L1700-17 194.23 53936-56-4 free base

S4135 Clorprenaline a6 L1700-17 250.16 6933-90-0 hydrochloride

S4136 Carprofen b6 L1700-17 273.71 53716-49-7 free base

S4138 Dropropizine c6 L1700-17 236.31 17692-31-8 free base

S4139 Cyclizine 2HCld6 L1700-17 339.3 5897-18-7 hydrochloride

S4141 Dinitolmide e6 L1700-17 225.16 148-01-6 Free Base

S4143 Pentoxyverine f6 L1700-17 525.59 23142-01-0 Free BaseS4144 Amprolium HClg6 L1700-17 315.24 137-88-2 hydrochloride

S4146 Bacitracin h6 L1700-17 1408.67 1405-87-4 free base

S4148 Ampicillin Triha7 L1700-17 403.45 7177-48-2 free base

S4149 Amfenac Sodi b7 L1700-17 295.27 61618-27-7 free base

S4151 Penfluridol c7 L1700-17 523.97 26864-56-2 free base

S4152 Ethamsylate d7 L1700-17 263.31 2624-44-4 free base

S4155 Chlorzoxazonee7 L1700-17 169.57 95-25-0 free base

S4159 Bezafibrate f7 L1700-17 361.82 41859-67-0 free base

S4160 Penicillin G S g7 L1700-17 356.37 69-57-8 sodium

S4161 Benzoic Acid h7 L1700-17 122.12 65-85-0 free base

S4162 Benzethonium a8 L1700-17 448.08 121-54-0 chloride

S4163 Doxycycline Hyb8 L1700-17 512.94 24390-14-5 hyclate

S4164 Doxofylline c8 L1700-17 266.25 69975-86-6 free base

S4165 Benzydamine Hd8 L1700-17 345.87 132-69-4 hydrochloride

S4166 Chlorpropamide8 L1700-17 276.74 94-20-2 free base

S4167 Cyromazine f8 L1700-17 166.18 66215-27-8 free base

S4169 Teriflunomide g8 L1700-17 270.21 108605-62-5 free base

S4170 Coumarin h8 L1700-17 146.14 91-64-5 free base

S4171 Choline Chloria9 L1700-17 139.62 67-48-1 chloride

S4172 Cetylpyridiniu b9 L1700-17 339.99 123-03-5 chloride

S4173 1-Hexadecanolc9 L1700-17 242.44 36653-82-4 free base

S4175 Sulfaguanidined9 L1700-17 214.24 57-67-0 free base

S4176 Trometamol e9 L1700-17 121.14 77-86-1 free base

S4177 Uracil f9 L1700-17 112.09 66-22-8 free base

S4178 Climbazole g9 L1700-17 292.76 38083-17-9 free base

S4179 Mezlocillin So h9 L1700-17 561.56 42057-22-7 sodium

S4181 Nicardipine HCa10 L1700-17 515.99 54527-84-3 hydrochloride

S4182 Nifuroxazide b10 L1700-17 275.22 965-52-6 free base

S4184 Penciclovir c10 L1700-17 253.26 39809-25-1 free base

s4185 Tiratricol d10 L1700-17 621.93 51-24-1 free base

S4186 Domiphen Broe10 L1700-17 414.46 538-71-6 free base

S4187 Salicylanilide f10 L1700-17 213.23 87-17-2 free base

S4188 Sasapyrine g10 L1700-17 258.23 552-94-3 free base

S4189 Cyclandelate h10 L1700-17 276.37 456-59-7 free base

S4190 Cinchophen a11 L1700-17 249.26 132-60-5 free base

S4191 Betamipron b11 L1700-17 193.2 3440-28-6 free base

S4192 Chlorquinaldolc11 L1700-17 228.07 72-80-0 free base

S4194 Azaguanine-8 d11 L1700-17 152.11 134-58-7 free base

S4195 Broxyquinolinee11 L1700-17 302.95 521-74-4 free base

S4196 Ethacridine la f11 L1700-17 361.39 6402-23-9 lactate

S4197 Bemegride g11 L1700-17 155.19 64-65-3 free base

S4198 Aminothiazoleh11 L1700-17 100.14 96-50-4 free base

S4199 Antazoline HCla1 L1700-18 301.81 2508-72-7 hydrochloride

S4200 Tolperisone HCb1 L1700-18 281.82 3644-61-9 hydrochloride

S4201 Florfenicol c1 L1700-18 358.21 73231-34-2 free base

S4202 Verapamil HCl d1 L1700-18 491.06 152-11-4 hydrochloride

S4203 Furaltadone HCe1 L1700-18 360.75 3759-92-0 hydrochloride

S4204 Isosorbide f1 L1700-18 146.14 652-67-5 free base

S4205 Dibenzothiophg1 L1700-18 184.26 132-65-0 free base

S4206 Cysteamine HCh1 L1700-18 113.61 156-57-0 hydrochloride

S4207 Clofibric Acid a2 L1700-18 214.65 882-09-7 free base

S4208 Chromocarb b2 L1700-18 190.15 4940-39-0 free base

S4209 Chlorocresol c2 L1700-18 142.58 59-50-7 free base

S4210 Benzocaine d2 L1700-18 165.19 94-09-7 free base

S4211 Montelukast S e2 L1700-18 608.17 151767-02-1 sodium

S4213 Dirithromycin f2 L1700-18 835.07 62013-04-1 free base

S4214 Sucralose g2 L1700-18 397.63 56038-13-2 free base

S4216 Valnemulin HCh2 L1700-18 601.28 133868-46-9 hydrochloride

S4217 Liothyronine a3 L1700-18 672.96 55-06-1 free base

S4219 Azaperone b3 L1700-18 327.4 1649-18-9 free base

S4220 Bosentan c3 L1700-18 551.61 147536-97-8 Free BaseS4221 Benzbromarond3 L1700-18 424.08 3562-84-3 free base

S4222 Piperacillin S e3 L1700-18 539.54 59703-84-3 sodium

S4223 Mevastatin f3 L1700-18 390.51 73573-88-3 free base

S4224 Erythritol g3 L1700-18 122.12 149-32-6 free base

S4225 Mexiletine HClh3 L1700-18 215.72 5370-01-4 hydrochloride

S4227 Fidaxomicin a4 L1700-18 1058.04 873857-62-6 free base

S4228 Fluorometholob4 L1700-18 418.5 3801-06-7 free base

S4229 Oxybuprocainec4 L1700-18 344.88 5987-82-6 hydrochloride

S4230 Oxaprozin d4 L1700-18 293.32 21256-18-8 free base

S4231 Pilocarpine HCe4 L1700-18 244.72 54-71-7 hydrochloride

S4232 Nithiamide f4 L1700-18 187.18 140-40-9 free base

S4233 Zoxazolamine g4 L1700-18 168.58 61-80-3 free base

S4235 Phenazopyridih4 L1700-18 249.7 136-40-3 hydrochloride

S4237 Primaquine Di a5 L1700-18 455.34 63-45-6 phosphate

S4238 Cepharanthineb5 L1700-18 606.71 481-49-2 free base

S4239 Bergapten c5 L1700-18 216.19 484-20-8 free base

S4240 Doxylamine Sud5 L1700-18 388.46 562-10-7 succinate

S4242 Cetrimonium Be5 L1700-18 364.45 57-09-0 free base

S4244 Serotonin HCl f5 L1700-18 212.68 153-98-0 hydrochloride

S4245 Sodium ascorbg5 L1700-18 201.13 134-03-2 sodium

S4246 Tranylcypromih5 L1700-18 169.65 4548-34-9 hydrochloride

S4247 Prucalopride Sa6 L1700-18 485.96 179474-85-2 succinat

S4248 Bromfenac So b6 L1700-18 356.15 91714-93-1 sodium

S4249 Flopropione c6 L1700-18 182.17 2295-58-1 free base

S4250 Sulfamethoxypd6 L1700-18 280.3 80-35-3 free base

S4251 Phenothiazine e6 L1700-18 199.27 92-84-2 free base

S4252 Mechlorethamif6 L1700-18 192.51 55-86-7 hydrochloride

S4253 Epinastine HClg6 L1700-18 285.77 108929-04-0 hydrochloride

S4255 Quinacrine 2HCh6 L1700-18 472.88 69-05-6 hydrochloride

S4256 Buspirone HCla7 L1700-18 421.96 33386-08-2 hydrochloride

S4257 Alizapride HCl b7 L1700-18 351.83 59338-87-3 hydrochloride

S4258 Luliconazole c7 L1700-18 354.28 187164-19-8 free base

S4259 Vilazodone HCld7 L1700-18 477.99 163521-08-2 hydrochloride

S4260 Tamibarotene e7 L1700-18 351.44 94497-51-5 free base

S4261 EUK 134 f7 L1700-18 416.74 81065-76-1 free base

S4263 Efaproxiral So g7 L1700-18 363.38 170787-99-2 sodium

S4264 Etofibrate h7 L1700-18 363.79 31637-97-5 free base

S4265 Nicaraven a8 L1700-18 284.31 79455-30-4 free base

S4266 Brimonidine Tab8 L1700-18 442.22 70359-46-5 tartrate

S4267 Diacerein c8 L1700-18 368.29 13739-02-1 free base

S4268 Flufenamic acid8 L1700-18 281.23 530-78-9 free base

S4269 Vinorelbine Tare8 L1700-18 1079.11 125317-39-7 Salt

S4270 Oxiracetam f8 L1700-18 158.16 62613-82-5 Free Base

S4273 3-Aminobenzamg8 L1700-18 136.15 3544-24-9 Free Base

S4274 Rotigotine h8 L1700-18 315.47 99755-59-6 Free Base

S4276 Etizolam a9 L1700-18 342.85 40054-69-1 Free Base

S4277 Bambuterol HCb9 L1700-18 403.9 81732-46-9 Salt

S4278 Carteolol HCl c9 L1700-18 328.83 51781-21-6 Salt

S4279 Demeclocyclind9 L1700-18 501.31 64-73-3 Salt

S4280 Meclofenoxate e9 L1700-18 294.17 3685-84-5 Salt

S4282 Nelfinavir Mesyf9 L1700-18 663.89 159989-65-8 Salt

S4283 Cyclobenzaprig9 L1700-18 311.85 6202-23-9 Salt

S4284 Chloroprocainh9 L1700-18 307.22 3858-89-7 Salt

S4285 Ospemifene a10 L1700-18 378.89 128607-22-7 Free Base

S4286 Anidulafungin b10 L1700-18 1140.24 166663-25-8 Free Base

S4288 Chloroambucilc10 L1700-18 304.21 305-03-3 Free Base

S4289 MetoclopraMidd10 L1700-18 336.26 7232-21-5 Salt

S4290 Digoxin e10 L1700-18 780.94 20830-75-5 Free Base

S4291 Labetalol HCl f10 L1700-18 364.87 32780-64-6 Salt

S4292 Diphenidol HClg10 L1700-18 345.91 3254-89-5 Salt

S4293 Promethazine h10 L1700-18 320.88 58-33-3 Salt

S4294 Procainamide a11 L1700-18 271.79 614-39-1 Salt

S4295 Meclofenamateb11 L1700-18 318.13 6385-02-0 Free Base

S4297 Mupirocin c11 L1700-18 500.62 12650-69-0 Free Base

S4299 Dicoumarol d11 L1700-18 336.29 66-76-2 Free Base

S4420 Mefloquine HCle11 L1700-18 414.77 51773-92-3 SaltS4627 TTNPB (Arotinof11 L1700-18 348.48 71441-28-6 free base

S4900 Tenovin-6 g11 L1700-18 454.63 1011557-82-6 free base

S4901 JNK-IN-8 h11 L1700-18 507.59 1410880-22-6 Free BaseS4902 QNZ (EVP4593)a1 L1700-19 356.42 545380-34-5 free base

S4904 JZL184 b1 L1700-19 520.49 1101854-58-3 free base

S4907 SC-514 c1 L1700-19 224.3 354812-17-2 free base

S4908 SN-38 d1 L1700-19 392.4 86639-52-3 free base

S4921 MNS (3,4-Methye1 L1700-19 193.16 1485-00-3 free base

S4926 (R)-Nepicastat f1 L1700-19 331.81 195881-94-8 SaltS5001 Tofacitinib (CPg1 L1700-19 504.49 540737-29-9 citrate

S5002 Fingolimod (FTh1 L1700-19 343.9 162359-56-0 hydrochloride

S5003 Tacrolimus (FKa2 L1700-19 804.02 104987-11-3 free base

S6002 NXY-059 b2 L1700-19 381.33 168021-79-2 free base

S6003 Ataluren (PTC1c2 L1700-19 284.24 775304-57-9 free base

S6005 VX-702 d2 L1700-19 404.3 745833-23-2 free base

S7000 AP26113 e2 L1700-19 529.01 1197958-12-5 free base

S7007 MEK162 (ARRY-f2 L1700-19 441.23 606143-89-9 free base

S7008 PP2 g2 L1700-19 301.77 172889-27-9 free base

S7010 GDC-0152 h2 L1700-19 498.64 873652-48-3 free base

S7015 Birinapant a3 L1700-19 806.94 1260251-31-7 free base

S7016 VS-5584 (SB23b3 L1700-19 354.41 1246560-33-7 Free BaseS7018 CZC24832 c3 L1700-19 364.4 1159824-67-5 free base

S7023 Z-VAD-FMK d3 L1700-19 467.49 187389-52-2 Free BaseS7024 Stattic e3 L1700-19 211.19 19983-44-9 free base

S7025 Embelin f3 L1700-19 294.39 550-24-3 free base

S7028 IPI-145 (INK119g3 L1700-19 416.86 1201438-56-3 free base

S7029 AZD2461 h3 L1700-19 395.43 1174043-16-3 free base

S7033 GSK2656157 a4 L1700-19 416.45 1337532-29-2 free base

S7036 XL019 b4 L1700-19 444.53 945755-56-6 free base

S7037 Wnt-C59 (C59) c4 L1700-19 379.45 1243243-89-1 free base

S7039 PD168393 d4 L1700-19 369.22 194423-15-9 free base

S7040 AZD3514 e4 L1700-19 519.56 1240299-33-5 free base

S7041 CX-6258 HCl f4 L1700-19 498.4 1353859-00-3 SaltS7046 Brefeldin A g4 L1700-19 280.36 20350-15-6 free base

S7048 BMN 673 h4 L1700-19 380.35 1207456-01-6 free base

S7049 Oprozomib (ONa5 L1700-19 532.61 935888-69-0 free base

S7050 AZ20 b5 L1700-19 412.51 1233339-22-4 free base

S7051 CGI1746 c5 L1700-19 579.69 910232-84-7 Free BaseS7059 VX-661 d5 L1700-19 520.5 1152311-62-0 free base

S7060 PP1 e5 L1700-19 281.36 172889-26-8 free base

S7062 EPZ5676 f5 L1700-19 562.71 1380288-87-8 free base

S7065 MK-8745 g5 L1700-19 431.91 885325-71-3 free base

S7070 GSK J4 HCl h5 L1700-19 453.96 1373423-53-0(f hydrochloride

S7071 (+)-Bicucullinea6 L1700-19 367.35 485-49-4 free base

S7072 NMDA (N-Methylb6 L1700-19 147.13 6384-92-5 free base

S7076 T0901317 c6 L1700-19 481.33 293754-55-9 free base

S7077 Cilengitide d6 L1700-19 588.66 188968-51-6 free base

S7079 SGC 0946 e6 L1700-19 618.57 N/A free base

S7083 LDK378 f6 L1700-19 558.14 1032900-25-6 free base

S7085 IWP-2 g6 L1700-19 466.6 686770-61-6 Free Base

S7086 IWR-1-endo h6 L1700-19 409.44 1127442-82-3 free base

S7087 GSK2334470 a7 L1700-19 462.59 1227911-45-6 Free BaseS7088 UNC1215 b7 L1700-19 529.72 1415800-43-9 free base

S7090 GSK923295 c7 L1700-19 592.13 1088965-37-0 Free Base

S7091 Zotarolimus(A d7 L1700-19 966.21 221877-54-9 Free BaseS7092 SANT-1 e7 L1700-19 373.49 304909-07-7 free base

S7093 IPA-3 f7 L1700-19 350.45 42521-82-4 free base

S7094 PF-3758309 g7 L1700-19 490.62 898044-15-0 Free BaseS7096 KY02111 h7 L1700-19 376.86 1118807-13-8 free base

S7097 HSP990 (NVP- a8 L1700-19 379.39 934343-74-5 Free BaseS7098 PD123319 b8 L1700-19 508.61 130663-39-7 free base

S7099 (-)-Blebbistatinc8 L1700-19 292.33 856925-71-8 free base

S7102 VE-822 d8 L1700-19 463.55 1232416-25-9 free base

S7104 AZD1208 e8 L1700-19 379.48 1204144-28-4 Free BaseS7106 AZD3463 f8 L1700-19 448.95 1356962-20-3 free base

S7108 LGX818 g8 L1700-19 540.01 1269440-17-6 free base

S7110 (+)-JQ1 h8 L1700-19 456.99 1268524-70-4 free base

S7111 NLG919 a9 L1700-19 282.38 1402836-58-1 free base

S7113 Zebularine b9 L1700-19 228.2 3690-10-6 free base

S7114 NU6027 c9 L1700-19 251.28 220036-08-8 free base

S7115 AMG-517 d9 L1700-19 430.4 659730-32-2 free base

S7120 3-Deazaneplane9 L1700-19 262.26 102052-95-9 free base

S7122 XL888 f9 L1700-19 503.64 1149705-71-4 free base

S7124 SC144 g9 L1700-19 322.3 895158-95-9 free base

S7125 KPT-185 h9 L1700-19 355.31 1333151-73-7 free base

S7127 TIC10 a10 L1700-19 386.49 41276-02-2 free base

S7128 EPZ-6438 b10 L1700-19 572.74 1403254-99-8 free base

S7129 PYR-41 c10 L1700-19 371.3 418805-02-4 free base

S7130 PR-619 d10 L1700-19 223.28 2645-32-1 free base

S7132 P5091 (P00509e10 L1700-19 348.22 882257-11-6 free base

S7133 P22077 f10 L1700-19 315.32 1247819-59-5 free base

S7134 IU1 g10 L1700-19 300.37 314245-33-5 free base

S7135 LDN-57444 h10 L1700-19 397.64 668467-91-2 free base

S7136 CGK 733 a11 L1700-19 555.84 905973-89-9 free base

S7138 BMS-833923 b11 L1700-19 473.57 1059734-66-5 free base

S7139 CFTRinh-172 c11 L1700-19 409.4 307510-92-5 free base

S7140 TCID d11 L1700-19 283.92 30675-13-9 free base

S7142 NSC697923 e11 L1700-19 267.26 343351-67-7 free base

S7143 LGK-974 f11 L1700-19 396.44 1243244-14-5 free base

S7145 AZD1080 g11 L1700-19 334.37 612487-72-6 free base

S7146 DMH1 h11 L1700-19 380.44 1206711-16-1 free base

S7147 LDN-212854 a1 L1700-20 406.48 1432597-26-6 free base

S7148 ML347 b1 L1700-20 352.39 1062368-49-3 free base

S7149 NSC 319726 c1 L1700-20 234.32 71555-25-4 free base

S7152 C646 d1 L1700-20 445.42 328968-36-1 free base

S7153 10058-F4 e1 L1700-20 249.35 403811-55-2 free base

S7155 Batimastat (BBf1 L1700-20 477.64 130370-60-4 free base

S7157 Ilomastat (GM6g1 L1700-20 388.46 142880-36-2 free base

S7158 LY2835219 h1 L1700-20 602.7 1231930-82-7 mesylate

S7162 Mdivi-1 a2 L1700-20 353.22 338967-87-6 free base

S7165 UNC1999 b2 L1700-20 569.74 1431612-23-5 free base

S7167 SSR128129E c2 L1700-20 346.31 848318-25-2 free base

S7172 ONX-0914 (PR-d2 L1700-20 580.67 960374-59-8 free base

S7173 AVL-292 e2 L1700-20 423.44 1202757-89-8 free base

S7176 SKI II f2 L1700-20 302.78 312636-16-1 free base

S7177 PF-543 g2 L1700-20 465.6 1415562-82-1 Free BaseS7185 AGI-5198 h2 L1700-20 462.56 1355326-35-0 free base

S7189 I-BET-762 a3 L1700-20 423.9 1260907-17-2 free base

S7192 PF-04620110 b3 L1700-20 396.44 1109276-89-2 Free BaseS7193 1-Azakenpaull c3 L1700-20 328.16 676596-65-9 free base

S7194 GZD824 d3 L1700-20 724.77 1421783-64-3 mesylate

S7195 RKI-1447 e3 L1700-20 326.37 1342278-01-6 free base

S7198 BIO f3 L1700-20 356.17 667463-62-9 free base

S7199 DBeQ g3 L1700-20 340.42 177355-84-9 free base

S7206 CNX-2006 h3 L1700-20 545.53 1375465-09-0 Free BaseS7207 Ro 31-8220 Mesa4 L1700-20 553.65 138489-18-6 mesylate

S7208 GF109203X b4 L1700-20 412.48 133052-90-1 Free Base

S7209 GSK650394 c4 L1700-20 382.45 890842-28-1 Free BaseS7213 Thiamet G d4 L1700-20 248.3 1009816-48-1 free base

S7214 Skepinone-L e4 L1700-20 425.42 1221485-83-1 free base

S7215 Losmapimod ( f4 L1700-20 383.46 585543-15-3 Free BaseS7217 OAC1 g4 L1700-20 237.26 300586-90-7 free base

S7218 Alvelestat (AZ h4 L1700-20 545.53 848141-11-7 Free BaseS7223 RepSox a5 L1700-20 287.32 446859-33-2 free base

S7224 Deltarasin b5 L1700-20 603.75 1440898-61-2 Free BaseS7229 RGFP966 c5 L1700-20 362.4 1396841-57-8 free base

S7233 Bromosporined5 L1700-20 404.44 N/A free base

S7234 IOX1 e5 L1700-20 189.17 5852-78-8 Free BaseS7237 OG-L002 f5 L1700-20 225.29 1357302-64-7 free base

S7241 AGI-6780 g5 L1700-20 481.51 1432660-47-3 free base

S7242 Erastin h5 L1700-20 547.04 571203-78-6 free base

S7243 Ferrostatin-1 ( a6 L1700-20 262.35 347174-05-4 free base

S7248 Ro3280 b6 L1700-20 543.61 1062243-51-9 Free BaseS7251 KPT-276 c6 L1700-20 426.26 1421919-75-6 free base

S7252 KPT-330 d6 L1700-20 443.31 1393477-72-9 free base

S7253 AZD2858 e6 L1700-20 453.52 486424-20-8 free base

S7255 NMS-P937 (NMf6 L1700-20 532.52 1034616-18-6 Free BaseS7256 SGC-CBP30 g6 L1700-20 509.04 N/A free base

S7257 CNX-774 h6 L1700-20 499.5 1202759-32-7 free base

S7258 SKLB1002 a7 L1700-20 320.39 1225451-84-2 free base

S7261 Beta-Lapachonb7 L1700-20 242.27 4707-32-8 free base

S7263 AZD1981 c7 L1700-20 388.87 802904-66-1 free base

S7265 MM-102 d7 L1700-20 669.8 1417329-24-8 free base

S7266 Golgicide A e7 L1700-20 284.3 1139889-93-2 free base

S7269 PD173955 f7 L1700-20 443.35 260415-63-2 Free BaseS7270 SRPIN340 g7 L1700-20 349.35 218156-96-8 free base

S7272 4μ8C h7 L1700-20 204.18 14003-96-4 free base

S7273 SC75741 a8 L1700-20 565.67 913822-46-5 Free BaseS7276 SGI-1027 b8 L1700-20 461.52 1020149-73-8 free base

S7279 Suvorexant (Mc8 L1700-20 450.92 1030377-33-3 free base

S7280 Edoxaban d8 L1700-20 548.06 480449-70-5 free base

S7282 NMS-E973 e8 L1700-20 454.43 1253584-84-7 free base

S7284 CO-1686 (AVL-f8 L1700-20 555.55 1374640-70-6 free base

S7285 NMS-873 g8 L1700-20 520.67 1418013-75-8 free base

S7289 PFK15 h8 L1700-20 260.29 4382-63-2 Free BaseS7291 TAK-632 a9 L1700-20 554.52 1228591-30-7 free base

S7292 RG2833 (RGFPb9 L1700-20 339.43 1215493-56-3 free base

S7293 ZCL278 c9 L1700-20 584.89 587841-73-4 free base

S7295 RVX-208 d9 L1700-20 370.4 1044870-39-4 free base

S7297 AZD9291 e9 L1700-20 499.61 1421373-65-0 Free Base

S7300 PJ34 HCl f9 L1700-20 331.8 344458-15-7 SaltS7301 IWP-L6 g9 L1700-20 472.58 1427782-89-5 free base

S7303 Rilpivirine h9 L1700-20 366.42 500287-72-9 free base

S7304 CPI-203 a10 L1700-20 399.9 1446144-04-2 Free Base

S7307 GSK2606414 b10 L1700-20 451.44 1337531-36-8 Free Base

S7310 SF1670 c10 L1700-20 307.34 345630-40-2 Free BaseS7316 STF-118804 d10 L1700-20 461.53 894187-61-2 free base

S7317 WZ4003 e10 L1700-20 496.99 1214265-58-3 free base

S7319 EHop-016 f10 L1700-20 430.55 1380432-32-5 free base

S7320 TG003 g10 L1700-20 249.33 300801-52-9 free base

S7324 TMP269 h10 L1700-20 514.52 1314890-29-3 Free Base

S7325 UNC2881 a11 L1700-20 463.58 1493764-08-1 Free BaseS7326 Tasisulam b11 L1700-20 415.11 519055-62-0 free base

S7327 ID-8 c11 L1700-20 298.29 147591-46-6 free base

S7329 IOWH032 d11 L1700-20 545.18 1191252-49-9 free base

S7330 6H05 e11 L1700-20 590.14 No Free Base

S7332 K-Ras(G12C) inf11 L1700-20 513.78 1469337-91-4 Free BaseS7333 K-Ras(G12C) ing11 L1700-20 405.34 N/A free base

S7336 CW069 h11 L1700-20 500.33 Free Base

S7337 SH-4-54 a1 L1700-21 610.59 1456632-40-8 Free BaseS7338 AZ191 b1 L1700-21 429.52 N/A free base

S7340 CH5138303 c1 L1700-21 415.9 959763-06-5 Free BaseS7351 JSH-23 d1 L1700-21 240.34 749886-87-1 free base

S7353 EPZ004777 e1 L1700-21 539.67 1338466-77-5 free base

S7355 ARQ 621 f1 L1700-21 552.43 1095253-39-6 Free Base

S7356 HS-173 g1 L1700-21 422.46 1276110-06-5 Free BaseS7357 PF-562271 HClh1 L1700-21 543.95 N/A hydrochloride

S7359 K02288 a2 L1700-21 352.38 1431985-92-0 free base

S7360 OTX015 b2 L1700-21 491.99 202590-98-5 free base

S7364 Atglistatin c2 L1700-21 283.37 1469924-27-3 free base

S7365 AdipoRon d2 L1700-21 428.52 924416-43-3 free base

S7367 GNE-0877 e2 L1700-21 339.32 1374828-69-9 Free Base

S7368 GNE-9605 f2 L1700-21 449.83 1536200-31-3 Free BaseS7369 4EGI-1 g2 L1700-21 451.28 315706-13-9 free base

S7370 4E1RCat h2 L1700-21 478.45 328998-25-0 free base

S7372 PTC-209 a3 L1700-21 495.19 315704-66-6 free base

S7373 UNC669 b3 L1700-21 338.24 1314241-44-5 free base

S7378 AEBSF HCl c3 L1700-21 239.69 30827-99-7 Salt

S7379 E-64 d3 L1700-21 357.41 66701-25-5 free base

S7380 Leupeptin Hemie3 L1700-21 475.59 103476-89-7 Free Base

S7382 Phosphoramidof3 L1700-21 588.48 164204-38-0 Salt

S7383 (-)-p-Bromotet g3 L1700-21 373.22 62284-79-1 Free Base

S7391 Z-FA-FMK h3 L1700-21 386.42 197855-65-5 Free BaseS7392 Loxistatin Acida4 L1700-21 314.38 76684-89-4 free base

S7393 Aloxistatin b4 L1700-21 342.43 88321-09-9 free base

S7397 Sorafenib c4 L1700-21 464.82 284461-73-0 free base

S7399 FLI-06 d4 L1700-21 438.52 313967-18-9 free base

S7414 Caffeic Acid P e4 L1700-21 284.31 104594-70-9 free base

S7417 Puromycin 2HCf4 L1700-21 544.43 58-58-2 SaltS7421 CGP 57380 g4 L1700-21 244.23 522629-08-9 free base

S7422 KN-62 h4 L1700-21 721.84 127191-97-3 Free Base

S7423 KN-93 Phosphaa5 L1700-21 599.03 1188890-41-6 Free Base

S7424 PD 151746 b5 L1700-21 237.25 179461-52-0 Free Base

S7429 MI-2 (MALT1 inhc5 L1700-21 455.72 1047953-91-2 Free Base

S7430 SB-3CT d5 L1700-21 306.4 292605-14-2 Free Base

S7434 TAPI-1 e5 L1700-21 499.6 171235-71-5 Free BaseS7435 AR-A014418 f5 L1700-21 308.31 487021-52-3 free base

S7436 NH125 g5 L1700-21 524.56 278603-08-0 free base

S7437 Sal003 h5 L1700-21 463.21 1164470-53-4 free base

S7438 ME0328 a6 L1700-21 321.37 1445251-22-8 free base

S7440 LEE011 b6 L1700-21 434.54 1211441-98-3 free base

S7447 ZLN005 c6 L1700-21 250.34 49671-76-3 free base

S7448 CORM-3 d6 L1700-21 294.61 475473-26-8 Free BaseS7449 CRT0044876 e6 L1700-21 206.15 6960-45-8 free base

S7450 FH1(BRD-K447f6 L1700-21 282.34 2719-05-3 free base

S7451 FPH1 (BRD-612g6 L1700-21 388.82 708219-39-0 free base

S7452 FPH2 (BRD-942h6 L1700-21 353.83 957485-64-2 Free BaseS7458 VER-49009 a7 L1700-21 387.82 940289-57-6 free base

S7459 VER-50589 b7 L1700-21 388.8 747413-08-7 Free BaseS7460 BTB06584 c7 L1700-21 417.82 219793-45-0 free base

S7461 LDC000067 d7 L1700-21 370.43 1073485-20-7 Free Base

S7462 PI-1840 e7 L1700-21 394.47 1401223-22-0 Free BaseS7467 LB42708 f7 L1700-21 555.46 226929-39-1 free base

S7470 Triapine g7 L1700-21 195.24 200933-27-3 free base

S7473 Nexturastat A h7 L1700-21 341.4 1403783-31-2 free base

S7482 EHT 1864 a8 L1700-21 581.47 754240-09-0 Salt

S7484 FH535 b8 L1700-21 361.2 108409-83-2 Free BaseS7488 MPI-0479605 c8 L1700-21 407.51 1246529-32-7 free base

S7489 YH239-EE d8 L1700-21 504.41 1364488-67-4 Free Base

S7490 WIKI4 e8 L1700-21 521.59 838818-26-1 Free Base

S7493 INH1 f8 L1700-21 308.4 313553-47-8 Free Base

S7494 INH6 g8 L1700-21 322.42 1001753-24-7 Free Base

S7497 CK-636 h8 L1700-21 284.38 442632-72-6 free base

S7499 ESI-09 a9 L1700-21 330.77 263707-16-0 Free Base

S7500 HJC0350 b9 L1700-21 277.38 885434-70-8 Free Base

S7501 HO-3867 c9 L1700-21 464.55 1172133-28-6 Free BaseS7505 (S)-crizotinib d9 L1700-21 450.34 1374356-45-2 free base

S7508 JNK Inhibitor Ie9 L1700-21 332.42 312917-14-9 Free BaseS7509 ML167 f9 L1700-21 335.36 1285702-20-6 free base

S7513 Trelagliptin g9 L1700-21 357.38 865759-25-7 free base

S7515 VGX-1027 h9 L1700-21 205.21 6501-72-0 free base

S7516 Y-320 a10 L1700-21 505.01 288250-47-5 free base

S7517 AZD7545 b10 L1700-21 478.87 252017-04-2 free base

S7518 Voreloxin (SNSc10 L1700-21 401.44 175414-77-4 Free Base

S7520 Darapladib (SBd10 L1700-21 666.77 356057-34-6 Free BaseS7523 GS-9973 e10 L1700-21 411.46 1229208-44-9 free base

S7525 XMD8-92 f10 L1700-21 474.55 1234480-50-2 Free Base

S7526 GNF-5 g10 L1700-21 418.37 778277-15-9 Free Base

S7528 GNE-7915 h10 L1700-21 443.4 1351761-44-8 Free Base

S7529 ML323 a11 L1700-21 384.48 1572414-83-5 Free Base

S7534 BAPTA-AM b11 L1700-21 764.68 126150-97-8 Free Base

S7539 PTC-209 HBr c11 L1700-21 576.1 1217022-63-3 Free Base

S7546 Pritelivir (BAY d11 L1700-21 402.49 348086-71-5 Free Base

S7565 WH-4-023 e11 L1700-21 568.67 837422-57-8 Free Base

S7566 IM-12 f11 L1700-21 377.41 1129669-05-1 Free Base

S7587 INCB024360 g11 L1700-21 271.64 914471-09-3 Free Base

S7589 N6022 h11 L1700-21 414.46 1208315-24-5 Free Base

S7595 Santacruzamata1 L1700-22 278.35 1477949-42-0 Free Base

S7597 BV-6 b1 L1700-22 1205.57 1001600-56-1 Free Base

S7605 Filgotinib (GL c1 L1700-22 425.5 1206161-97-8 Free Base

S7635 Lomitapide d1 L1700-22 692.71 182431-12-5 Free BaseS8000 Tenovin-1 e1 L1700-22 369.48 380315-80-0 free base

S8001 Rocilinostat ( f1 L1700-22 433.5 1316214-52-4 free base

S8002 GSK2636771 g1 L1700-22 433.42 1372540-25-4 free base

S8003 PQ 401 h1 L1700-22 341.79 196868-63-0 free base

S8004 ZM 39923 HCl a2 L1700-22 367.91 1021868-92-7 hydrochloride

S8005 SMI-4a b2 L1700-22 273.23 438190-29-5 free base

S8006 BIX 01294 c2 L1700-22 600.02 1392399-03-9 hydrochloride

S8007 VE-821 d2 L1700-22 368.41 1232410-49-9 free base

S8009 AG-18 e2 L1700-22 186.17 118409-57-7 free base

S8010 PRX-08066 Malef2 L1700-22 517.96 866206-55-5 maleate

S8014 GW9508 g2 L1700-22 347.41 885101-89-3 free base

S8015 CEP-32496 h2 L1700-22 517.46 1188910-76-0 free base

S8016 TAK-438 a3 L1700-22 461.46 1260141-27-2 fumarate

S8019 AZD5363 b3 L1700-22 428.92 1143532-39-1 free base

S8020 GW0742 c3 L1700-22 471.49 317318-84-6 free base

S8021 Vortioxetine ( d3 L1700-22 379.36 960203-27-4 hydrobromide

S8022 Empagliflozin (e3 L1700-22 450.91 864070-44-0 free base

S8023 TCS 359 f3 L1700-22 360.43 301305-73-7 free base

S8024 Tyrphostin AGg3 L1700-22 266.29 146535-11-7 free base

S8025 GSK3787 h3 L1700-22 392.78 188591-46-0 free base

S8028 Tariquidar a4 L1700-22 646.73 206873-63-4 free base

S8029 WY-14643 (Pirinb4 L1700-22 323.8 50892-23-4 free base

S8031 NSC 23766 c4 L1700-22 530.96 1177865-17-6 hydrochloride

S8032 PRT062607 (P50d4 L1700-22 429.91 1370261-97-4 hydrochloride

S8034 Apremilast (CCe4 L1700-22 460.5 608141-41-9 free base

S8035 VU 0364439 f4 L1700-22 422.29 1246086-78-1 free base

S8036 Butein g4 L1700-22 272.25 487-52-5 free base

S8037 Necrostatin-1 h4 L1700-22 259.33 4311-88-0 free base

S8038 UPF 1069 a5 L1700-22 279.29 1048371-03-4 free base

S8039 PU-H71 b5 L1700-22 512.37 873436-91-0 Free BaseS8040 GDC-0349 c5 L1700-22 452.55 1207360-89-1 free base

S8042 GW2580 d5 L1700-22 366.41 870483-87-7 free base

S8043 Scriptaid e5 L1700-22 326.35 287383-59-9 free base

S8044 BMS-345541 f5 L1700-22 255.32 445430-58-0 free base

S8047 Dynasore g5 L1700-22 322.31 304448-55-3 free base

S8048 ABT-199 (GDC-h5 L1700-22 868.44 1257044-40-8 free base

S8049 Tubastatin A a6 L1700-22 335.4 1252003-15-8 free base

S8050 ETP-46464 b6 L1700-22 470.52 1345675-02-6 free base

S8051 Macitentan c6 L1700-22 588.27 441798-33-0 free base

S8056 Lomeguatrib d6 L1700-22 326.17 192441-08-0 free base

S8057 Pacritinib (SB1e6 L1700-22 472.58 937272-79-2 free base

S8058 P276-00 f6 L1700-22 438.3 920113-03-7 hydrochloride

S8059 Nutlin-3a g6 L1700-22 581.49 675576-98-4 Free Base

S8061 Sabutoclax h6 L1700-22 700.78 1228108-65-3 Free Base

S8065 Nutlin-3b a7 L1700-22 581.49 675576-97-3 Free BaseS8072 NSC 405020 b7 L1700-22 260.16 7497-07-6 free base

S8073 Optovin c7 L1700-22 315.41 348575-88-2 Free BaseS8076 PluriSIn #1 (N d7 L1700-22 213.24 91396-88-2 free base

S8077 RI-1 e7 L1700-22 361.61 415713-60-9 free base

S8078 Bardoxolone Mf7 L1700-22 505.69 218600-53-4 free base

TargetsBcl-2

Autophagy,Bcl-2

CSF-1R,PDGFR,VEGFR

PARP

c-Kit,VEGFR,PDGFR

Src,Bcr-Abl

HIF

MEK

VEGFR,PDGFR,FGFR

EGFR,HER2

IGF-1RProteasome

Src

VEGFR

FGFR,FLT3,c-Kit,VEGFR,PDGFR

MEK

Bcr-Abl,c-Kit,Src

mTOR

Autophagy,EGFR

EGFR

c-Kit,Bcr-Abl,PDGFR

HER2,EGFR

TNF-alpha

HDAC

VEGFR,PDGFR,c-Kit

Bcr-Abl

IGF-1R

VEGFR,PDGFR,c-Kit

MEK

PI3K,Autophagy,DNA-PK,mTOR

Autophagy,mTOR

PDGFR,Raf,VEGFR

Others

VEGFR,PDGFR,c-Kit

FLT3

mTOR

HDAC

VEGFR

Autophagy,HDAC

Aurora Kinase

Autophagy,ROCK

HSP (e.g. HSP90)

HDAC

PKC

HER2,EGFR

Bcl-2,Autophagy

PARP

E3 Ligase ,Mdm2

PDGFR,c-Kit

PI3K

MEK

TGF-beta/Smad

c-Met,ALK

HSP (e.g. HSP90)

c-Met

Bcl-2

PI3K

GSK-3

p38 MAPK

p38 MAPK

Akt

c-Met

Hedgehog/Smoothened

FGFR,VEGFR

HDAC

PARP

IGF-1R

MEKHDAC

IGF-1R

ATM/ATR

IGF-1R

c-Met

HDAC

HDAC

Others

PARP

Aurora Kinase

c-Kit,VEGFR

MEK

Aurora Kinase

Raf

Autophagy,PI3K

PDK-1

c-RET,FGFR,Bcr-Abl,Aurora Kinase

PLK

Phospholipase (e.g. PLA)

VEGFR,c-Met

c-Met

Akt

c-Met

Cathepsin K

CDK

Akt

PI3K

FLT3,Tie-2,c-Kit,c-Met,VEGFR,Axl

mTOR

Bcl-2

HDAC

IGF-1R,Trk receptor,c-Met

Sirtuin

Survivin

PARP

Aurora Kinase

JAK,Aurora Kinase,Bcr-Abl

Others

VEGFR,FGFR

Opioid Receptor

Androgen Receptor

HSP (e.g. HSP90)

HSP (e.g. HSP90)

JAK,EGFR

CFTR

CDK

Aurora Kinase

Microtubule Associated

Microtubule Associated,Autophagy

Raf

CDK

Aurora Kinase

STAT

DNA/RNA Synthesis

Proteasome

Dehydrogenase

HSP (e.g. HSP90)

Others

HSP (e.g. HSP90)

VEGFR


DNA/RNA Synthesis

EGFR,HER2

Autophagy,HDAC,GABA Receptor

PI3K

EGFR

Aurora Kinase,VEGFR

p53,E3 Ligase

EGFR

Androgen Receptor

HSP (e.g. HSP90)

MEK

c-RET,VEGFR

EGFR

Wnt/beta-catenin

Aurora Kinase,FLT3,VEGFR

HCV Protease

HIV Protease

Telomerase

Aromatase

Substance P

Androgen Receptor

Estrogen/progestogen Receptor

DNA/RNA Synthesis

TNF-alpha,E3 Ligase

HDAC,HER2,EGFR

P450 (e.g. CYP17)

Aromatase

5-alpha Reductase

Topoisomerase

DNA/RNA Synthesis

DNA Methyltransferase

Others

5-alpha Reductase

Others

PI3K,DNA-PK

Adrenergic Receptor

VEGFR,PDGFR,c-Kit

Autophagy,Topoisomerase

DNA/RNA Synthesis

DHFR

Others

DNA/RNA Synthesis

DNA/RNA Synthesis

Epigenetic Reader Domain

DNA/RNA Synthesis

PI3K

c-Kit,CSF-1R,VEGFR

DNA/RNA Synthesis

Others

Topoisomerase

DNA/RNA Synthesis

Topoisomerase

mTOR


Topoisomerase

DNA/RNA Synthesis

Topoisomerase

HIF

IGF-1R

Aromatase

Autophagy


5-HT Receptor

FLT3,c-RET,PDGFR,c-Kit

Others


CDK,Aurora Kinase

Androgen Receptor


Others

Others

Sodium Channel

Others

P2 Receptor

MT Receptor

CaSR

COX

Gamma-secretase,Beta Amyloid

VEGFR,FGFR

mTOR

Raf

Others

IκB/IKK,PDK-1

PDK-1

Others

Others

Dopamine Receptor

AMPA Receptor-kainate Receptor-NMDA Receptor

Others

5-HT Receptor,Adrenergic Receptor

RAAS

AChR

Others

Others

Topoisomerase

DNA/RNA Synthesis

Histamine Receptor

Calcium Channel

PDE


DNA/RNA Synthesis

DNA/RNA Synthesis

DNA/RNA Synthesis

Estrogen/progestogen Receptor,Androgen Receptor

DNA/RNA Synthesis

Others

LPA Receptor

Telomerase

Autophagy,IL Receptor

Adrenergic Receptor

Others

COX

GABA Receptor

Others

Others

GABA Receptor

5-HT Receptor

DNA/RNA Synthesis

5-HT Receptor

Topoisomerase,EGFR

PAFR

DPP-4

Others

PI3K

P450 (e.g. CYP17)

Proton Pump

Others

Histamine Receptor

Histamine Receptor

RAAS

PI3K,mTOR

Tie-2,VEGFR,c-Met

PLK

PDGFR,c-Kit,VEGFR


Integrase

Topoisomerase

Others

Others



JAK

Hydroxylase

HIV Protease

Others

Histamine Receptor

5-HT Receptor

Proteasome

Adrenergic Receptor

Autophagy,Proton Pump

5-HT Receptor

Sodium Channel

EGFR

Topoisomerase

Others

Sirtuin,Autophagy

AChR

Reverse Transcriptase


Others

Dehydrogenase

Others

Others

Others

Adrenergic Receptor

P2 Receptor

HDAC

Calcium Channel

Potassium Channel

PDE

PDE

5-HT Receptor

5-HT Receptor

Adrenergic Receptor

Carbonic Anhydrase

Others

5-HT Receptor

P450 (e.g. CYP17)

Others

Others

Others

Others

Aurora Kinase

Kinesin

Transferase

Aurora Kinase

PDE

Endothelin Receptor

HIV Protease

p38 MAPK

ROCK

JNK

PI3K

Topoisomerase

Others

Others

Others

Others

VEGFR,PDGFR,FGFR

MAO

ROCK

MEK

TGF-beta/Smad

ATPase

HCV Protease

P-gp

HCV Protease

Others

HDAC

PLK

HER2,VEGFR,EGFR

CDK

5-HT Receptor

PI3K

PDGFR,FGFR,VEGFR,Bcr-Abl

p38 MAPK

DHFR

Others

Dehydrogenase

Others

PDE

Others

Others

PDE

Others

HDAC

Others

Aurora Kinase

PI3K,mTOR

CDK

Wee1

FLT3

Beta Amyloid,Gamma-secretase

Aurora Kinase

MEK

MEK

Chk

Syk

Cannabinoid Receptor

PDGFR

VDA

HCV Protease

DPP-4

Sirtuin


OX Receptor

Others

SGLT

Adrenergic Receptor

PDE

mTOR

PDK-1,Akt

PDGFR,VEGFR

S6 Kinase,Akt

Axl,c-Met

CFTR

TNF-alpha

MEK

Others

ATM/ATR

CDK

ROCK,Autophagy

p38 MAPK

Gamma-secretaseOthers

Tie-2

RAAS

PKA

GSK-3

Factor Xa

Gamma-secretase

Others

Others

RAAS

Others

Others

5-HT Receptor

AChR

Others

Others

Others

Adrenergic Receptor

Sodium Channel

5-HT Receptor

Others

Others

HIV Protease

Others

Others,AChR

Others

COX

Others

Others

Others

OX Receptor

OthersOthers

Others

Others

COX

HIV Protease

Others

Others

Others

Others

COX

COX

Others

5-HT Receptor

Others

Others

Others

Others

Others

RAAS

Others

Calcium Channel


Others

Others

Others

Others

Aromatase

PDE

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Autophagy,Sodium Channel

Others

Others


Autophagy


Others


Others

Others

Others

COX

Autophagy,DNA/RNA Synthesis

Others

Others



Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

RAAS

Others

Others

Others


Others

Calcium Channel,Autophagy

Others

Others

Others

Others

Others

Others

Dopamine Receptor

Others

Others

Others

Others

Dopamine Receptor

Others


Others

Others


Others

Others

Others

Others

RAAS

Others

Others

Histamine Receptor

AMPK

AChR

Others

Others

Others

Others

Histamine Receptor

Others

Others

Sodium Channel

Others

Others

Adrenergic Receptor

Others

Others

Autophagy

Others

Others

Others

Others

Histamine Receptor

Histamine Receptor

Others

Others

Others

Others

Adrenergic Receptor

Others

Others

Others

5-HT Receptor

Others

Others

Histamine Receptor

Others

Others

Others

Calcium Channel

Others

TopoisomeraseHistamine Receptor

Others

RAAS

Others

Others

Others

5-HT Receptor

Others

Others

COX

Others

Calcium Channel

Others

Androgen Receptor

HMG-CoA Reductase

Others

AChR


Others

Others

Others

Others

Others

Others

PDE,AChR

Others

Others

Others

Others

RAAS

Others

Others

Others

Others

Others

COX

Others

Others

Others

Others

GABA Receptor

Potassium Channel

Estrogen/progestogen Receptor,Autophagy

Others

Others

5-HT Receptor

AChR

Autophagy,Potassium Channel

DNA/RNA Synthesis

Others

Others

Others

Calcium Channel

Integrase

CCR

Integrase

DHFR

Others

HDAC

FAK

CDK

Others

Others

Calcium Channel

Adrenergic Receptor

Others

Histamine Receptor

5-HT Receptor

GABA Receptor

Others

DNA/RNA Synthesis

Calcium Channel

Others

Others

Others

Others

RAAS

Adrenergic Receptor

COX

Others

Androgen Receptor

AMPA Receptor-kainate Receptor-NMDA Receptor

Histamine Receptor

Others

P450 (e.g. CYP17)

COX

RAAS

Others

AChR

Dehydrogenase

Others

Adrenergic Receptor

Others

HMG-CoA Reductase

Others

Others

Histamine Receptor

Others

Others

Others

Others

HMG-CoA Reductase

Histamine Receptor

RAAS

Calcium Channel

RAAS

Others

5-HT Receptor

Opioid Receptor

Adrenergic Receptor

AChR

Adrenergic Receptor

Adrenergic Receptor

5-HT Receptor

Others

Others

RAAS

Proteasome

MAO

Opioid Receptor

Dopamine Receptor

COX

RAAS

Adrenergic Receptor

Others

Others

Sodium Channel

Others

Others

COX

Others

Others

Others

Adrenergic Receptor

PDE


AChR

PDE

MEK

GPR

Hedgehog/Smoothened

5-alpha Reductase

Others

Others

Others

Aurora Kinase,Bcr-Abl,FLT3

Others

OX ReceptorVEGFR,Raf

JAKS6 Kinase

Dopamine Receptor

RAAS

HDAC

HydroxylaseOthers

PARP

JAK

Proteasome

Proteasome

Kinesin

EGFR

TGF-beta/Smad

P450 (e.g. CYP17)

HER2,EGFR

PLK

Syk,FLT3

Microtubule AssociatPim

RAAS

VEGFR,c-Met

Raf,Src,Bcr-Abl,VEGFR,Ephrin receptor

EGFR

PI3K

Aromatase

JAK


HER2

Topoisomerase

mTOR,Autophagy

JAK

Raf

VEGFR

Procollagen C Proteinase

E3 Ligase ,APC

PI3K

PI3K

Caspase

Others

TGF-beta/Smad

VEGFR,PDGFR,c-Kit

5-HT Receptor

ATPase

PLK

mTOR

HDACAChR

DUB,Bcr-Abl

HDAC

PI3K

Others

Others

Others

Others

Others

Others

Others

Others

Others

P450 (e.g. CYP17)

Others

Others

Others

p38 MAPK

Others

P450 (e.g. CYP17)

Others

Others

Others

Others

Others

Others

Others

Others

STAT

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Histamine Receptor,TGF-beta/Smad

Others

MEK,Akt

Others

PDE

Others

Others

Others

Others

Others

PDE

Others

Opioid Receptor

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

E3 Ligase

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Adrenergic Receptor

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

GSK-3

Others

Others

Others

PKC,Src,PI3K,Sirtuin

Others

Others

P450 (e.g. CYP17)

Others

Others

Others

Others

Others,P450 (e.g. CYP17)

Calcium Channel

Others

Others

mTOR,EGFR

Others

Others

Others

Others

Others

Others

Others

TGF-beta/Smad

Others

Others

Others

Others

Dopamine Receptor

Adrenergic Receptor

Others

Others

Potassium Channel

Others

cAMP


Dopamine Receptor

Dopamine Receptor,AChR

Dopamine Receptor,Others

cAMP

AChR

Potassium Channel,Dopamine Receptor

Others

Adrenergic Receptor,Autophagy

5-HT Receptor

Dopamine Receptor

Dopamine Receptor


Others

Others

Others

AChR


PDGFR

Others

Others

Opioid Receptor,Autophagy

Calcium Channel

Calcium Channel

ATPase,PDE

Others

Others

Others

Potassium Channel

Calcium Channel,Autophagy

Others

5-HT Receptor,Dopamine Receptor

Histamine Receptor

Adrenergic Receptor

Factor Xa

AChR

Others

Adrenergic Receptor

Sodium Channel

Others

Opioid Receptor

Others

Others

AChR

Adrenergic Receptor

Others

Others

PDE

Adrenergic Receptor

Adrenergic Receptor

Adrenergic Receptor

Adrenergic Receptor

Adrenergic Receptor

Sodium Channel

Sodium Channel

P450 (e.g. CYP17)

Others

Others

Dopamine Receptor

COX

Others

Adrenergic Receptor

Others

Others

Others

Others

Others

5-HT Receptor

AMPK

Others

Adrenergic Receptor

AChR

Others

AChR

AChR

Others

Histamine Receptor

Others

DNA/RNA Synthesis

P450 (e.g. CYP17)

PPAR

Others

Others


Others

Others

Adrenergic Receptor


Adrenergic Receptor

Calcium Channel

Others

Others

COX


RAAS

Others

Others

Histamine Receptor

Others

Others

Others

Vasopressin Receptor

Others

Others

Others

Potassium Channel

COX

Carbonic Anhydrase

Androgen Receptor

Others


Others

Others

Others

Others

Others

AChR

Others

MEK

Proteasome

PDE

CDK

DNA-PK,PDGFR,mTOR

ATPase

mTOR

Syk

Chk

HDAC

AChR

Liver X Receptor

FAAH

gp120/CD4

CaSR

Bcr-Abl

Akt

PI3K

GPR

DNA-PK,PI3K

HSP (e.g. HSP90)

HSP (e.g. HSP90)

PI3K,mTOR

AChR


mTOR

Wnt/beta-catenin

5-HT Receptor

RAAS

PPAR

FAAH

Integrase

PKA,CDK,Akt

PI3K

FAK

MEK

Transferase

5-HT Receptor

CDK

BTK

PI3K

PI3K

Chk

HSP (e.g. HSP90)

JAK

CDK

mTOR

GluR

5-HT Receptor

JAK,FLT3,c-RET

HDAC

FXR

mTOR,PI3K

AMPK

5-HT Receptor

mTOR,PI3K

Src

IGF-1R,ALK

Gamma-secretase

HSP (e.g. HSP90),Autophagy

Gamma-secretase

Phosphorylase

Aurora Kinase

Aurora Kinase

Raf

Calcium Channel

Opioid Receptor

p38 MAPK

EGFR

EGFR

GSK-3

PDGFR

Kinesin

CDK,Chk

JAK

Caspase

CDK

Akt,mTOR,PI3K

Aurora Kinase

Raf

c-Met

CETP

PI3K,mTOR

TGF-beta/Smad

CDK

HER2,EGFR

EGFR

Autophagy,ATM/ATR,PI3K

PI3K,HDAC

SGLT

c-Met

Integrase

Autophagy,PI3K

CDK

PDGFR,FGFR,c-Kit,FLT3,VEGFR

Aurora Kinase

CETP

TRPV

c-Met,PDGFR,FGFR


Dehydrogenase

Hedgehog/Smoothened


HDAC


E3 Ligase ,p53

FXR

mTOR

EGFR,HER2

Sodium Channel

Others

JAK

Others

PKC

CETP

DNA/RNA SynthesisGluR

JAK

Transferase

FGFR

P450 (e.g. CYP17),Androgen Receptor

Sirtuin

JAK

Raf

Akt

GluR

mTOR

Bcl-2

Histamine Receptor

PI3K

HER2

ATM/ATR,mTOR

HDAC


FAK

Transferase,DNA Methyltransferase

GPR

IκB/IKK

Potassium Channel

FAAH

Others

Androgen Receptor,Estrogen/progestogen Receptor

Androgen Receptor

VEGFR

S6 Kinase

VEGFR

Others

5-HT Receptor

JAK

5-HT Receptor

Proteasome


P2 Receptor

5-HT Receptor

GluR

Others

VEGFR,c-Met

GluR,5-HT Receptor

GluR

GluR

NOD1

IκB/IKK

5-HT Receptor

Carbonic Anhydrase

JAK,EGFR

DPP-4

PI3K

PPAR

Raf

Others

5-HT Receptor

GluR

IκB/IKK

Others

Others

Others

PARP

FAK

GluR

5-HT Receptor

EGFR

VEGFR

VEGFR

Bcr-Abl

P450 (e.g. CYP17)

Others

JAK

COX

Chk

Histamine Receptor

LPA Receptor

TGF-beta/Smad

Others

PKC

CXCR

IκB/IKK,E2 conjugating


PPAR

Others

Others

HIF

P450 (e.g. CYP17)

EGFR

Others

GSK-3

CETP

Caspase

p38 MAPK

p53,Autophagy

p53

Others

Others

Factor Xa

AChR,5-HT Receptor

Others

COX

PDGFR,c-Kit,VEGFR

Others

Proteasome

GABA Receptor

ATPase

HDACCannabinoid Receptor

Others

COX

Sodium Channel,5-HT Receptor

Others

Syk

DPP-4

Others

DPP-4

Endothelin Receptor

Telomerase

HMG-CoA Reductase

Histamine Receptor

Others

Hedgehog/Smoothened

COX

Others

RAAS

AChR

AChR

Endothelin Receptor

Histamine Receptor

Calcium Channel

Others

RAAS

Adrenergic Receptor

Adrenergic Receptor

Others

Others

Sodium Channel

Opioid Receptor

OthersOthers

Others

Others

Adrenergic Receptor

Others

Others

Others


Others

Adrenergic Receptor

Others

Others

Others

Others

Others

Others

Others

AChR

Others

Others

Others

Others

Others

Others

Others

Others

Others

AChR

Histamine Receptor

Histone Methyltransferase


Others

Potassium Channel

Others

Others


Others

Others

Histamine Receptor


Others

PDE

Others

5-HT Receptor

Histamine Receptor

Carbonic Anhydrase

Others

5-HT Receptor

Topoisomerase

5-HT Receptor

Adrenergic Receptor

Histamine Receptor

Others

Others

Others

Others

Others

Others

Others

COX

Autophagy

Others

Others

Histamine Receptor

Others

MAO

Others

Topoisomerase

Others

Dopamine Receptor

VEGFRDPP-4

Others

Others

MMP,Others

Others

Adrenergic Receptor

Adrenergic Receptor

COX

Histamine Receptor

AChR

Others

Sodium Channel

Others

PDE

Others

Transferase

Others

Sodium Channel

AChRAChR

Histamine Receptor

AChR

AChR

AChR

Others

Others

Sodium Channel

Carbonic Anhydrase

Others

Others

Others

Adrenergic Receptor

Others

Others

Estrogen/progestogenOthers

Others

COX

Others

COX

5-HT Receptor

Androgen Receptor

Others

Others

Others

Others

Others

Others

5-HT Receptor

Adrenergic Receptor

Others

Others


AChR

NF-κB

Others

Proton Pump

Adrenergic Receptor

Others

COX

P2 Receptor

Sodium Channel

Autophagy

Others

Others

Others

Others

Others

Others

Others

GluR

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

5-HT Receptor

OthersOthers

5-HT Receptor

5-HT Receptor

Others

Others

Histamine Receptor

TopoisomeraseOthers

Others

Adrenergic Receptor

Adrenergic Receptor

HDAC

Others

Histamine Receptor

Others

Others

Others

Others

Histamine Receptor

Others

OthersOthers

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Endothelin ReceptorOthers

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Histone demethylases

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Others

Beta Amyloid

Others

Others

Others

Others

Others

Others

Microtubule Associat

Others

PARP

Dopamine Receptor

Others

Adrenergic Receptor

Adrenergic Receptor

Others

Others

HIV Protease

Others

Others

Estrogen/progestogen

Others

DNA/RNA Synthesis

Dopamine Receptor

Sodium Channel

Adrenergic Receptor

AChR

Histamine Receptor

Sodium Channel

COX

DNA/RNA Synthesis

Others

OthersOthers

p53

JNKTNF-alpha,NF-κB

Others

IκB/IKK

Topoisomerase

p97

HydroxylaseJAK

S1P Receptor

Others

Others

CFTR

p38 MAPK

ALK

MEK

Src

IAP

IAP

PI3KPI3K

CaspaseSTAT

IAP

PI3K

PARP

PERK

JAK

Wnt/beta-catenin

EGFR

Androgen Receptor

PimATPase,Autophagy

PARP

Proteasome

ATM/ATR

BTKCFTR

Src


Aurora Kinase

Histone demethylases

GABA Receptor

GluR

Liver X Receptor

Integrin


ALK

Wnt/beta-catenin

Wnt/beta-catenin

PDK-1Epigenetic Reader Domain

Kinesin

mTORHedgehog/Smoothened

PAK

PAKWnt/beta-catenin

HSP (e.g. HSP90)RAAS

ATPase

ATM/ATR

PimALK

RAF


IDO


CDK

TRPV


HSP (e.g. HSP90)

Others

CRM1

Akt


E1 Activating

DUB

DUB

DUB

DUB

DUB

ATM/ATR

Hedgehog/Smoothened

CFTR

DUB

E2

Wnt/beta-catenin

GSK-3

BMP

BMP

BMP

p53

Histone Acetyltransferase

c-Myc

MMP

MMP

CDK

Dynamin


FGFR

Proteasome

BTK

S1P Receptor

S1P ReceptorDehydrogenase


TransferaseGSK-3

Bcr-Abl

ROCK

GSK-3

p97

EGFRPKC

PKC

OthersOthers

p38 MAPK

p38 MAPKOthers

Serine ProteaseTGF-beta/Smad

PDEHDAC


Histone demethylasesHistone demethylases

IDH2

Ferroptosis

Ferroptosis

PLKCRM1

CRM1

GSK-3

PLKEpigenetic Reader Domain

BTK

VEGFR

Topoisomerase

GPR


ATPase

BCR-ABLOthers

Others

NF-κBDNA Methyltransferase

OX Receptor

Factor Xa

HSP90

EGFR

p97

OthersRaf

HDAC

Rac


EGFR

PARPWnt/beta-catenin


Epigenetic Reader Do

PERK

OthersOthers

AMPK

Rac

CDK

HDAC

OthersCaspase

Others

CFTR

Rho

RhoRas


STATOthers

HSP (e.g. HSP90)NF-κB


Kinesin

PI3KFAK

TGF-beta/Smad

BET

ATGL

Others

LRRK2

LRRK2ELF4

ELF4

BMI

MBT

Serine ProteaseCathepsin K

Serine Protease

Others

Others

Cysteine ProteaseCysteine protease

Cysteine protease

Raf

Notch

NF-κB

OthersMNK

Others

Others

Cysteine Protease

Others

MMP

OthersGSK-3

ELF2

ELF2

PARP

CDK

Others

OthersAPE

Others

Others

OthersHSP90

HSP (e.g. HSP90)Fo-ATPase

CDK

ProteasomeFtase

ribonucleotide reductase

HDAC

Rho

Wnt/beta-cateninKinesin

Mdm2

Wnt/beta-catenin



Arp2/3

Others

Others

STATMTH

JNKCDK

DDP-4

Others

Others

PDHK

Topoisomerase

Phospholipase (e.g. Syk

ERK

Bcr-Abl

LRRK2

DUB

Others

Others

Others

Src

GSK-3

IDO

Others

HDAC

IAP

JAK

Othersp53,E3 Ligase

HDAC

PI3K

IGF-1R

JAK

Pim


ATM/ATR

EGFR

5-HT Receptor

GPR

CSF-1R,Raf

Potassium Channel

Akt

PPAR

5-HT Receptor

SGLT

FLT3

FGFR,c-Kit,PDGFR

PPAR

P-gp

PPAR

Rac

Syk

PDE

GluR

EGFR

TNF-alpha

PARP

HSP (e.g. HSP90)mTOR

CSF-1R

HDAC

IκB/IKK

Dynamin

Bcl-2

HDAC

mTOR,ATM/ATR

Endothelin Receptor


JAK

CDK

Mdm2

Bcl-2

Mdm2MMP

OthersDehydrogenase

Others

IκB/IKK

Information Smiles Max SolubC1=CC(=CC=C1 102

ABT-737 is a BH3 mimetic inhibitor of Bcl-xL, Bcl-2 and Bcl-w with EC50 of 78.7 nM, 30.C1=CC(=CC=C1 122

Linifanib (ABT-869) is a novel, potent ATP-competitive VEGFR/PDGFR inhibitor for KDRC12=CC=CC(=C 199

Veliparib (ABT-888) is a potent inhibitor of PARP1 and PARP2 with Ki of 5.2 nM and 2.9 nC1=CC=C2C(=C 69

Axitinib is a multi-target inhibitor of VEGFR1, VEGFR2, VEGFR3, PDGFRβ and c-Kit withC1(=CC=CC=C1 108

Saracatinib (AZD0530) is a potent Src inhibitor with IC50 of 2.7 nM, and potent to c-Y C1=C(C=C2C( 184

FG-4592 is an HIF α prolyl hydroxylase inhibitor, stabilizes HIF-2 and induces EPO pro C12=C(C(=NC( 201

Selumetinib (AZD6244) is a potent, highly selective MEK1 inhibitor with IC50 of 14 nM, C1=C2C(=C(C( 201

Nintedanib (BIBF 1120) is a potent triple angiokinase inhibitor for VEGFR1/2/3, FG C1=C(C=C2C(= 11

Afatinib (BIBW2992) irreversibly inhibits EGFR/HER2 including EGFR(wt), EGFR(L858RC1(=C(C=C(C= 199

BMS-536924 is an ATP-competitive IGF-1R/IR inhibitor with IC50 of 100 nM/73 nM, modest C1(=CC(=C2C( 96Bortezomib (PS-341) is a potent 20S proteasome inhibitor with Ki of 0.6 nM. C1=CN=CC(=N1 200

Bosutinib (SKI-606) is a novel, dual Src/Abl inhibitor with IC50 of 1.2 nM and 1 nM, respN1=CC(=C(C2= 188

C1(=C(C=C2C( 199

Dovitinib (TKI258, CHIR258) is a multitargeted RTK inhibitor, mostly for class III (F C1=CC=C(C2=C 76

CI-1040 (PD 184352) is an ATP non-competitive MEK1/2 inhibitor with IC50 of 17 nM, C1=C(C(=C(C( 200

N1=C(N=C(C=C 200

Ridaforolimus (Deforolimus) is a selective mTOR inhibitor with IC50 of 0.2 nM; while no[C@H]1(C[C@@ 199

Erlotinib HCl (OSI-744) is an EGFR inhibitor with IC50 of 2 nM, >1000-fold more sensit C1(=CC=CC(=C 10

Gefitinib (ZD-1839) is an EGFR inhibitor for Tyr1173, Tyr992, Tyr1173 and Tyr992 in C1(=C(C=C2C( 199

Imatinib Mesylate (STI571) is an orally bioavailability mesylate salt of Imatinib, which i C1(=CC=C(C(= 200

Lapatinib Ditosylate (GW572016, GW2016) is a potent EGFR and ErbB2 inhibitor with ICC1(=C(C=C2C( 199

Lenalidomide (CC-5013) is a TNF-α secretion inhibitor with IC50 of 13 nM. C1=CC(=C2C(= 200

Panobinostat (LBH589) is a novel broad-spectrum HDAC inhibitor with IC50 of 5 nM. P C1(=CC=C(C=C 200

Motesanib Diphosphate (AMG-706) is a potent ATP-competitive inhibitor of VEGFR1/2/3 wC1(=CN=CC=C1 175

Nilotinib (AMN-107) is a Bcr-Abl inhibitor with IC50 less than 30 nM. C1(=CC=C(C(= 50

NVP-AEW541 is a potent inhibitor of IGF-1R with IC50 of 86 nM, 27-fold greater selectivC1=CC(=CC(= 200

Pazopanib (GW786034) is a novel multi-target inhibitor of VEGFR1, VEGFR2, VEGFR3,C1(=C(C(=CC( 35

PD0325901 (PD325901) is selective and non ATP-competitive MEK inhibitor with IC50 oC1=CC(=C(C(= 199

PI-103 is a multi-targeted PI3K inhibitor for p110α/β/δ/γ with IC50 of 2 nM/3 nM/3 nM C12=C(N=C(N= 68

Rapamycin (Sirolimus, AY-22989, WY-090217) is a specific mTOR inhibitor with IC50 o[C@@H]1([C@@ 21

Sorafenib Tosylate (Bay 43-9006) is a multikinase inhibitor of Raf-1, B-Raf and VEGFR-C1(=CC=C(C=C 199

STF-62247 shows selectivtoxicity and growth inhibition of renal cells lacking VHL; 25-foN1=CC=C(C=C1 198

Sunitinib Malate is a multi-targeted RTK inhibitor targeting VEGFR2 (Flk-1) and PDGFRβC1(=CC=C2C(= 28

Tandutinib (MLN518, CT53518) is a potent FLT3 antagonist with IC50 of 0.22 μM, also C1=C(C(=CC2 10

Temsirolimus (CCI-779) is a specific mTOR inhibitor with IC50 of 1.76 μM. [C@H]1(C[C@@ 72

Trichostatin A (TSA) is an HDAC inhibitor with IC50 of ~1.8 nM – HDAC8 is the only k C1=C(C=CC(=C 76

Vandetanib (ZD6474) is a potent inhibitor of VEGFR2 with IC50 of 40 nM. C12=C(C(=NC= 10

Vorinostat (suberoylanilide hydroxamic acid, SAHA) is an HDAC inhibitor with IC50 of C1=CC=CC(=C 200

VX-680 (Tozasertib, MK-0457) is a pan-Aurora inhibitor, mostly against Aurora A with KC1(=CC(=NC(= 200

Y-27632 2HCl is a selective ROCK1 (p160ROCK) inhibitor with Ki of 140 nM, exhibits >[C@@H]1(CC[C 199

Elesclomol (STA-4783) is a novel potent oxidative stress inducer that elicits pro-apopto C1=CC=C(C=C1 199

Entinostat (MS-275) strongly inhibits HDAC1 and HDAC3 with IC50 of 0.51 μM and 1.7 C1=C(C=CC(= 199

Enzastaurin (LY317615) is a potent PKCβ selective inhibitor with IC50 of 6 nM, 6- to 2 C1=CC=C2C(=C 58

AC480 (BMS-599626) is a selective and efficacious inhibitor of HER1 and HER2 with ICC1(CN[C@@H]( 199

Obatoclax (GX15-070) is an antagonist of Bcl-2 with Ki of 0.22 μM, can assist in over C1(=CC=C2C(=C 200

Olaparib (AZD2281, KU0059436) is a selective inhibitor of PARP1/2 with IC50 of 5 nM/1C1=CC=CC2=C1 200

ABT-263 (Navitoclax) is a potent inhibitor of Bcl-xL, Bcl-2 and Bcl-w with Ki of ≤ 0.5 nM, ≤1 nM and ≤1 nM, but binds more weakly to Mcl-1 and A1. Phase 1/2.

Cediranib (AZD2171) is a highly potent VEGFR(KDR) inhibitor with IC50 of <1 nM, also inhibits Flt1/4 with IC50 of 5 nM/≤3 nM, similar activity against c-Kit and PDGFRβ, 36-, 110-fold and >1000-fold selective more for VEGFR than PDGFR-α, CSF-1R and Flt3, Phase 2/3.

Dasatinib is a novel, potent and multi-targeted inhibitor that targets Abl, Src and c-Kit, with IC50 of ＜1 nM, 0.8 nM and 79 nM, respectively.

Nutlin-3 is a potent and selective Mdm2 (RING finger-dependent ubiquitin protein ligase fN1(C(C(N=C1C 171

Masitinib is a novel inhibitor for Kit and PDGFRα/β with IC50 of 200 nM and 540 nM/80 C1(=C(C=C(C= 200

GDC-0941 is a potent inhibitor of PI3Kα/δ with IC50 of 3 nM, with modest selectivity agaC1(=CC=CC2=C 85

SL327 is a selective inhibitor for MEK1/2 with IC50 of 0.18 μM/ 0.22 μM, no activity t C1=CC=CC(=C1 11

SB431542 is a potent and selective inhibitor of ALK5 with IC50 of 94 nM, 100-fold mor C1=CC=CC(=N1 200

PF-2341066 (Crizotinib) is a potent inhibitor of c-Met and ALK with IC50 of 11 nM and 2C1(=CC(=C(N= 19

AUY922 (NVP-AUY922) is a highly potent HSP90 inhibitor for HSP90α/β with IC50 of 1C1(=CC(=C(C= 199

PHA-665752 is a potent, selective and ATP-competitive c-Met inhibitor with IC50 of 9 nMC1=CC=C(C(=C 199

HA14-1 is a non-peptidic ligand of a Bcl-2 surface pocket with IC50 of ~9 μM. C1=C(C=C2C(= 200

ZSTK474 inhibits class I PI3Kisoforms with IC50 of 37 nM, mostly PI3Kδ. N1=C(N=C(N= 50

SB216763 is a potent and selective GSK-3 inhibitor with IC50 of 34.3 nM for GSK-3α anC1=CC=CC2=C1 61

SB203580 is a p38 MAPK inhibitor with IC50 of 0.3-0.5 μM, 10-fold less sensitive to N1=CC=C(C=C1 198

SB202190 (FHPI) is a potent p38 MAPK inhibitor targeting p38α/β with IC50 of 50 nM/10C1=C(C=CC(=C 199

MK-2206 2HCl is a highly selective inhibitor of Akt1/2/3 with IC50 of 8 nM/12 nM/65 nM, C1(=CC=CC=C1 29

SU11274 is a selective Met inhibitor with IC50 of 10 nM, no effects on PGDFRβ, EGFR C1(=CC=CC(=C 161

Vismodegib (GDC-0449) is a potent, novel and specific hedgehog inhibitor with IC50 of C1(=C(C=C(C= 199

Brivanib is an ATP-competitive inhibitor against VEGFR2 with IC50 of 25 nM, modera C12=C(C(=C(C 199

Belinostat (PXD101) is a novel HDAC inhibitor with IC50 of 27 nM, with activity demonstrC1(=CC=CC(=C 201

BSI-201 (Iniparib, SAR240550) is a PARP1 inhibitor with demonstrated effectiveness inC1=CC(=C(C=C1 198

NVP-ADW742 is an IGF-1R inhibitor with IC50 of 0.17 μM, >16-fold more potent against C12=C(N=CN= 22

Refametinib (RDEA119, Bay 86-9766) is a potent, ATP non-competitive and highly selecC1(=C(C=C(C( 100PCI-24781 is a novel pan-HDAC inhibitor mostly targeting HDAC1 with Ki of 7 nM, modesC1=CC=C2C(=C 201

OSI-906 (Linsitinib) is a selective inhibitor of IGF-1R with IC50 of 35 nM; modestly p C1=C(C=C2C(= 199

KU-55933 is a potent and specific ATM inhibitor with IC50/Ki of 12.9 nM/2.2 nM, and C1=CC=C2C(=C 83

GSK1904529A is a selective inhibitor of IGF-1R and IR with IC50 of 27 nM and 25 nM, C1=C(C(=C(C= 145

PF-04217903 is a selective ATP-competitive c-Met inhibitor with IC50 of 4.8 nM, suscepC12=CC=CN=C1 13

LAQ824 (Dacinostat) is a novel HDAC inhibitor with IC50 of 32 nM and is known to acti C1(=CC=C(C=C 200

JNJ-26481585 is a novel second-generation HDAC inhibitor with highest potency for HDC1=CC=C2C(=C 200

BTZ043 racemate is a decaprenylphosphoryl-β-D-ribose 2'-epimerase (DprE1) inhibitor aC1(=CC(=C2C(= 50

Rucaparib (AG-014699, PF-01367338) is an inhibitor of PARP with Ki of 1.4 nM for PARPC1(C2C=CC(=C 199

MLN8054 is a potent and selective inhibitor of Aurora A with IC50 of 4 nM. It is more th C1=C(C=C2C(= 199

Vatalanib (PTK787) is an inhibitor of VEGFR2/KDR with IC50 of 37 nM, less potent agaC1(=CC=C2C(= 202

U0126-EtOH is a highly selective inhibitor of MEK1/2 with IC50 of 0.07 μM/0.06 μM, 1 C1(=CC=C(C(=C 199

ZM 447439 is a selective and ATP-competitive inhibitor for Aurora A and Aurora B with IO1CCN(CC1)C 200

GDC-0879 is a novel, potent, and selective B-Raf inhibitor with IC50 of 0.13 nM with actiC(CN1N=C(C(= 200

LY294002 is the first synthetic molecule known to inhibit PI3Kα/δ/β with IC50 of 0.5 μ C1=CC(=C2C(= 117

OSU-03012 is a potent inhibitor of recombinant PDK-1 with IC50 of 5 μM and 2-fold in C12=C(C=CC3= 23

Danusertib (PHA-739358) is an Aurora kinase inhibitor for Aurora A/B/C with IC50 of C1(=CC=CC=C1 200

BI2536 is a potent Plk1 inhibitor with IC50 of 0.83 nM. It shows 4- and 11-fold greater s C1(=CC=C(C(= 40

LY315920 (Varespladib) is a potent and selective human non-pancreatic secretory phospC1(N(C2=C(C= 199

Foretinib (GSK1363089) is an ATP-competitive inhibitor of HGFR and VEGFR, mostly forC1(=CC=C(C=C 200

SGX-523 is a selective Met inhibitor with IC50 of 4 nM, no activity to BRAFV599E, c-RaC1=C2C(=CC(= 10

GSK690693 is a pan-Akt inhibitor targeting Akt1/2/3 with IC50 of 2 nM/13 nM/9 nM, al C12=C(C(=CN= 91

JNJ-38877605 is an ATP-competitive inhibitor of c-Met with IC50 of 4 nM, 600-fold selecN1=CC=CC2=C1 98

Odanacatib (MK 0822) is a potent, selective, and neutral inhibitor of cathepsin K (humanC1=C(C=CC(=C1 190

PD0332991 is a highly selective inhibitor of CDK4/6 with IC50 of 11 nM/16 nM. It sho N1(=C(N=C2C( 10

Triciribine is a DNA synthesis inhibitor, also inhibits Akt and HIV-1 with IC50 of 130 nM [C@H]1([C@@H 199

XL147 is a selective and reversible class I PI3K inhibitor for PI3Kα/δ/γ with IC50 of 3 C1=CC=C2C(=C 10

Cabozantinib (XL184, BMS-907351) is a potent VEGFR2 inhibitor with IC50 of 0.035 nM aC12=C(C(=CC= 199

Everolimus (RAD001) is an mTOR inhibitor of FKBP12 with IC50 of 1.6-2.4 nM. C(O)CO[C@H]1 31

TW-37 is a novel nonpeptide inhibitor to recombinant Bcl-2, Bcl-xL and Mcl-1 with Ki of C1=CC=CC(=C1 200

Mocetinostat (MGCD0103) is a potent HDAC inhibitor with most potency for HDAC1 with ICC(C1C=CC(=CC 32

BMS-754807 is a potent and reversible inhibitor of IGF-1R/InsR with IC50 of 1.8 nM/1.7 C12N(N=C(N=C 199

SRT1720 is a selective SIRT1 activator with EC50 of 0.16 μM, but is >230-fold less pot N1(=C(C=NC2= 75

YM155 is a potent survivin suppressant by inhibiting Survivin promoter activity with IC50 oC1(=CC=C2C(= 124

INO-1001 is a potent inhibitor of PARP with IC50 of <50 nM in CHO cells and a mediatoC1=CC=C(C=C1 198

Alisertib (MLN8237) is a selective Aurora A inhibitor with IC50 of 1.2 nM. It has >200-foC1=CC=C(C(=C 52

AT9283 is a potent JAK2/3 inhibitor with IC50 of 1.2 nM/1.1 nM; also potent to Aurora AN(C(=O)NC1C( 199

Malotilate is a liver protein metabolism improved compound. C(C(C(=O)OC( 201

Brivanib alaninate (BMS-582664) is the prodrug of BMS-540215, an ATP-competitive inC12=C(C(=C(C 199

ADL5859 HCl is a δ-opioid receptor agonist with Ki of 0.8 nM, selectivity against opioid C1(=CC=C2C(= 200

Andarine is a selective non-steroidal androgen receptor (AR) agonist with Ki of 4 nM, tisC([C@@](COC1C 199

17-AAG is a potent HSP90 inhibitor with IC50 of 5 nM, having a 100-fold higher bindingC1(=C2C(C(=C 199

17-DMAG is a potent, water-soluble HSP90 inhibitor with IC50 of 62 nM. C1(=C2C(C(=C 200

AG-490 (Tyrphostin B42) is an inhibitor of EGFR with IC50 of 0.1 μM, 135-fold more seleC1(=C(C=CC(= 200

Ivacaftor (VX-770) is a potentiator of CFTR targeting G551D-CFTR and F508del-CFTR C1=C(C(=CC(= 198

SNS-032 has firstly been described as a selective inhibitor of CDK2 with IC50 of 48 nM C1(=CN=C(O1) 199

AZD1152-HQPA (Barasertib) is a highly selective Aurora B inhibitor with IC50 of 0.37 n C1(=CC=C2C(= 200

Docetaxel, an analog of taxol, is an inhibitor of depolymerisation of microtubules by bindC1=CC=CC=C1C 200

Paclitaxel is a microtubule polymer stabilizer with IC50 of 0.1 pM in human endothelial cC1=CC=CC(=C1 200

PLX4720 is a potent and selective inhibitor of B-RafV600E with IC50 of 13 nM, equally C1(=CN=C2C(= 200

Roscovitine (Seliciclib, CYC202) is a potent and selective CDK inhibitor for Cdc2, CDK N1=C2C(=C(N 200

SNS-314 Mesylate is a potent and selective inhibitor of Aurora A, Aurora B and Aurora CC12(=C(N=CN= 199

S3I-201 shows potent inhibition of STAT3 DNA-binding activity with IC50 of 86 μM, an C1(=CC=C(C=C 199

Capecitabine is a tumor-selective fluoropyrimidine carbamate which achieves higher intrN1=C(C(=CN(C 200

CEP-18770 is an orally active inhibitor of the chymotrypsin-like activity of proteasome wiC([C@@H](C(C 200

MK-8245 is an liver-targeting inhibitor of stearoyl-CoA desaturase (SCD) with IC50 of N1N(N=NC=1C2 199

Ganetespib is an HSP90 inhibitor with IC50 of 4 nM in OSA 8 cells, induces apoptosis oN1NC(N(C=1C2 109

PA-824 is an anti-tuberculosis drug for tuberculosis with MIC less than 2.8 μM. O1C2N(C[C@@H] 200

AT13387 is a selective potent Hsp90 inhibitor with IC50 of 18 nM in A375 cells, displays aC(=O)(N1CC2C 61

E7080 (Lenvatinib) is a multi-target inhibitor, mostly for VEGFR2(KDR)/VEGFR3(Flt-4 C1(=C(C=C2C( 93

ABT-751 (E7010) binds to the colchicine site on β-tubulin and inhibits polymerization of mC1=C(C=CC(=C 199

Cisplatin is an inorganic platinum complex, which is able to inhibit DNA synthesis by c [Pt](N)(Cl)(Cl)N 199

CP-724,714 is a potent, selective inhibitor of HER2/ErbB2 with IC50 of 10 nM, >640-fo C1(=CC=C2C(= 200

CCCC(C([O-])= 198

TGX-221 is a p110β-specific inhibitor with IC50 of 5 nM, 1000-fold more selective for p C1=C(C=C(C2N 32

WZ3146 is a mutant-selective irreversible inhibitor of EGFR(L858R) and EGFR(E746_A7C1(=CC=C(C=C 200

CYC116 is a potent inhibitor of Aurora A/B with Ki of 8.0 nM/9.2 nM, is less potent t C1(=NC=CC(=N 65

JNJ-26854165 acts as a HDM2 ubiquitin ligase antagonist and also induces early apoptosisC1=C2C(=CC= 200

WZ4002 is a novel, mutant-selective EGFR inhibitor for EGFR(L858R)/(T790M) with IC5C1(=CC(=C(C= 26

MK-2866 (GTx-024) is a selective androgen receptor modulator (SARM) with Ki of 3.8 nM,C([C@@](COC1 200

BIIB021 is an orally available, fully synthetic small-molecule inhibitor of HSP90 with K N1=C(N=C2C(= 200

PD98059 is a non-ATP competitive MEK inhibitor with IC50 of 2 μM, specifically inhibit C1=CC=C2C(=C 71

Regorafenib (BAY 73-4506) is a multi-target inhibitor for VEGFR1, VEGFR2, VEGFR3, C1=NC(=CC(=C 200

WZ8040 is a novel mutant-selective irreversible EGFRT790M inhibitor, does not inhibit C1(=CC=C(C=C 199

XAV-939 selectively inhibits Wnt/β-catenin-mediated transcription through tankyrase1/2C1=CC(=CC=C1 38

Valproic acid sodium salt (Sodium valproate) is a HDAC inhibitor with IC50 of 0.4 mM and also inhibits GABA-transaminase or succinicsemialdehyde dehydrogenase.

ENMD-2076 has selective activity against Aurora A and Flt3 with IC50 of 14 nM and C1(N=C(C=C(N 279

Danoprevir(ITMN-191) is a peptidomimetic inhibitor of the NS3/4A protease of hepatitis [C@@H]1(CN2[ 196

Ritonavir is an antiretroviral drug which inhibits a particular liver enzyme that normal C1=CC=CC=C1C 138

BIBR 1532 is a potent, selective, non-competitive telomerase inhibitor with IC50 of 100 C1=CC=C2C(=C 199

Anastrozole is a third-generation nonsteroidal selective aromatase inhibitor. C1=C(C=C(C=C 201

Aprepitant is a potent and selective neurokinin-1 receptor antagonist. N1NC(NC=1CN2 200

Bicalutamide is an androgen receptor (AR) antagonist with IC50 of 0.16 μM. C(C(CS(=O)(=O 199

Fulvestrant is an estrogen receptor (ER) antagonist with IC50 of 0.094 nM. C1(C=CC2[C@@] 164

Raltitrexed is a thymidylate synthase inhibitor with an IC50 of 9 nM for the inhibition of C([C@H](CCC( 200

Thalidomide was introduced as a sedative drug, immunomodulatory agent and also is inC1(N(C(C2C=C 201

CUDC-101 is a potent multi-targeted inhibitor against HDAC, EGFR and HER2 with IC50 oC12=C(N=CN= 46

TAK-700 (Orteronel) is a potent and highly selective human 17,20-lyase inhibitor with C1=C(C=C2C(= 198

Exemestane is an aromatase inhibitor, inhibits human placental and rat ovarian aromat C1(C=C[C@@]2( 182

Finasteride is an inhibitor of steroid Type II 5α-reductase. C1C(N[C@]2([C 201

Irinotecan is a topoisomerase I inhibitor for LoVo cells and HT-29 cells with IC50 of 15 N1(CCCCC1)C2 17

Cladribine is an adenosine deaminase inhibitor for U266, RPMI8226, and MM1.S cells wN1=C(C2=C(N= 199

Decitabine is a potent inhibitor of DNA methylation with IC50 of 438 nM and 4.38 nM in [C@H]1(O[C@@ 201

Dimesna is an uroprotective agent used to decrease urotoxicity. S(CCSSCCS([O-] 199

Dutasteride is a dual 5-α reductase inhibitor that inhibits conversion of testosterone to C1C(N[C@]2([C 117

Melatonin is a hormone produced in the brain by the pineal gland from the amino acid t C1=CC(=CC2= 202

PIK-75 is a p110α inhibitor with IC50 of 5.8 nM (200-fold more potently than p110β), is C1(C(=CN2C(C= 10

Bisoprolol is a selective type β1 adrenergic receptor blocker. C1(=C(C=CC(= 199

Tivozanib (AV-951) is a potent and selective VEGFR inhibitor for VEGFR1/2/3 with IC5 C1(=CC=C(C(= 43

Doxorubicin (Adriamycin) is an antibiotic agent that inhibits DNA topoisomerase II an C1(=CC=C2C(= 172

Fluorouracil (5-Fluoracil, 5-FU) is an DNA/RNA synthesis inhibitor, which interrupts nuclC1(NC(C(=CN1 199

Methotrexate is an antimetabolite and antifolate drug, which acts by inhibiting the metaboN1=C(N=C2C(= 200

Bendamustine HCL is a DNA-damaging agent with IC50 of 50 μM. C1(=C(C=C2C(= 200

Nelarabine is a purine nucleoside analog and DNA synthesis inhibitor with IC50 from 0.N1C(=NC2=C(C 201

Bleomycin Sulfate is a glycopeptide antibiotic and an anticancer agent for squamous c S(=O)(=O)(O) 66

PFI-1 is a selective BET (bromodomain-containing protein) inhibitor for BRD4 with IC50C1(=CC=C2C(= 198

Clofarabine inhibits the enzymatic activities of ribonucleotide reductase (IC50 = 65 n N1=C(N=C2C(= 200

YM201636 is a selective PIKfyve inhibitor with IC50 of 33 nM, less potent to p110α and iC1C(=CC=C(N= 74

OSI-930 is a potent inhibitor of Kit, KDR and CSF-1R with IC50 of 80 nM, 9 nM and 15 nMC1=CC=C2C(=C 200

Dacarbazine is an antineoplastic chemotherapy drug used in the treatment of various c C1=NC(=C(N1)/ 16

A cardioprotective agent N1(C(CN(CC1= 200

Epirubicin HCl, a semisynthetic L-arabino derivative of doxorubicin, is an antineoplasti C1(=CC=C2C(= 200

Oxaliplatin inhibits DNA synthesis by conforming DNA adducts. [Pt+2].[O-]C( 35

Etoposide is a semisynthetic derivative of podophyllotoxin, which inhibits DNA synthesis v[C@@]12([C@@ 169

KU-0063794 is a potent and highly specific dual-mTOR inhibitor of mTORC1 and mTORCN1=C(N=C2C(= 34

Raloxifene is estrogen antagonists, inhibits human cytosolic aldehyde oxidase-catalyzed C1(C=CC2=C(C 199

Idarubicin HCl is a hydrochloride salt form of Idarubicin which is an anthracycline antibi C1(=CC=C2C(= 187

Fludarabine Phosphate is an analogue of adenosine and deoxyadenosine, which is able N1C(=NC2=C(C 199

Topotecan (NSC 609699) is a topoisomerase I inhibitor for MCF-7 Luc cells and DU-145 C1(C=CC2C(C= 200

2-Methoxyestradiol depolymerizes microtubules and blocks HIF-1α nuclear accumulation C1(=C(C=C2C(= 201

AG-1024 (Tyrphostin) inhibits IGF-1R autophosphorylation with IC50 of 7 μM, is less poC(C(C#N)=CC1C 199

Letrozole is a third generation inhibitor of aromatase with IC50 of 0.07-20 nM. C1=CC(=CC=C1 199

Temozolomide is a DNA damage inducer. N1(N=NC2N(C1 200

Vincristine is an inhibitor of polymerization of microtubules by binding to tubulin with IC C1(=CC2=C(C= 108

Agomelatine is classified as a norepinephrine-dopamine disinhibitor (NDDI) due to its C(C)(=O)NCCC 201

Amuvatinib (MP-470) is a potent and multi-targeted inhibitor of c-Kit, PDGFRα and Flt3 C1=CC=C2C(=C 71

Leflunomide is an immunosuppressant agent. Its active metabolite is Teriflunomide. C1(=CC=C(C=C 199

Vinblastine inhibits microtubule formation and supresses nAChR activity with IC50 of 8 C123[C@]4(N( 83

JNJ-7706621 is pan-CDK inhibitor with the highest potency on CDK1/2 with IC50 of 9 nM/C1(=CC=C(C=C 200

Enzalutamide (MDV3100) is an androgen-receptor (AR) antagonist with IC50 of 36 nM.C1(=C(C=CC(=C 200

Dienogest is an orally active synthetic progesterone (or progestin). C1(CCC2=C3CC[ 199

Entecavir hydrate belongs to the family of medicines called antivirals. N1(=C(NC2=C( 199

Nepafenac is a non-steroidal anti-inflammatory agent. C(CC1C(=C(C= 200

Rufinamide, a triazole derivative, is an anticonvulsant medication. C1=CC=C(C(=C 201

C1(=CC=C(C=C 199

A novel platelet inhibitor C(C(C1C(=CC= 80

Ramelteon is a novel melatonin receptor agonist for human MT1 and MT2 receptors and cC1=C2C(=C3C( 200

AMG-073 represents a new class of compounds for the treatment of hyperparathyroidisC1(=C(C=C(C= 200

Celecoxib is a selective COX-2 inhibitor with IC50 of 40 nM. C1(=CC=C(C=C1 199

Avagacestat (BMS-708163) is a potent, selective, orally bioavailable γ-secretase inhibi C1(=C(C=C(C= 199

PD173074 is a potent FGFR1 inhibitor with IC50 of ~25 nM and also inhibits VEGFR2 wN1=C(N=C2C(= 190

WYE-354 is a potent, specific and ATP-competitive inhibitor of mTOR with IC50 of C1=C(C=CC(=C 199

Vemurafenib (PLX4032, RG7204) is a novel and potent inhibitor of B-RafV600E with ICC1(=CN=C2C(= 200

Acarbose is an anti-diabetic drug used to treat type 2 diabetes mellitus and, in some cou[C@@H]1([C@@ 199

BX795 is a potent and specific PDK1 inhibitor with IC50 of 6 nM, 140- and 1600-fold m N1(CCCC1)C(= 169

BX912 is a potent and specific PDK1 inhibitor with IC50 of 12 nM, 9- and 105- fold greaN1(CCCC1)C(= 199

Adapalene is a third-generation topical retinoid primarily used in the treatment of acne. C1(=C(C=CC(= 19

Altretamine is an anti-neoplastic agent. N1=C(N=C(N=C 71

Amisulpride is an atypical antipsychotic used to treat psychosis in schizophrenia and epC1C(N(CC1)CC 200

Aniracetam is a nootropics and neuroprotective drug. C1(=CC=C(C=C 200

Artemisinin is a drug used to treat multi-drug resistant strains of falciparum malaria. [C@@]12(O[C@@ 201

Asenapine inhibits adrenergic receptor (α1, α2A, α2B, α2C) with Ki of 0.25-1.2 nM and alC12(=C([C@@]3 199

Benazepril is a medication used to treat high blood pressure. N1(C([C@H](C 199

Biperiden is an antiparkinsonian agent of the anticholinergic type. C1(=CC(=CC=C 10

Budesonide is a glucocorticoid steroid for the treatment of asthma, non-infectious rhinitiC1C(C=C2[C@]( 199

Bumetanide (Bumex) is a loop diuretic of the sulfamyl category to treat heart failure. C1=C(C(=C(C= 200

Camptothecin is a specific inhibitor of DNA topoisomerase I (Topo I) with IC50 of 0.68 O1C([C@@](C2 10

Carmofur is a pyrimidine analogue used as an antineoplastic agent. C1(C(NC(N(C= 202

Cetirizine DiHCl is an antihistamine. C1(=CC=CC=C1 199

Cilnidipine is a calcium channel blocker. C1=CC=C(C=C1 201

Cilostazol is a potent cyclic nucleotide phosphodiesterase type 3 (PDE3) inhibitor with C1C(NC2=C(C 200

Epothilone A is a Taxol-like microtubule-stabilizing agent with EC0.01 of 2 μM. O1[C@@H]2CCC 200

Floxuridine is a prodrugs of floxuridine and an oncology agent with an GI50 of 5.1 μM f O1[C@@H]([C@ 199

FT-207 (NSC 148958) is a substance being used in the treatment of some types of cancN1C(N(C=C(C1 199

Ifosfamide is a nitrogen mustard alkylating agent used in the treatment of cancer. C1COP(N(C1)C 199

Megestrol Acetate is a synthetic progesteronal agent with an IC50 of 260 μM for the inhC1C(C=C2[C@]( 85

Mercaptopurine is a widely used antileukemic agent and immunosuppressive drug that inN1=CNC2=C(C 197

Streptozotocin is a glucosamine-nitrosourea derivative, which is a methylating, carcinog[C@H]1([C@@H 199

Ki16425 is a competitive, potent and reversible antagonist to LPA1, LPA2 and LPA3 witC1=CC=CC(=C1 200

Costunolide, a natural sesquiterpene compound with multiple biological activities; inhib C1C/C(=C/[C@ 202

Dexamethasone is an anti-inflammatory and immunosuppressant. C1C(C=C2[C@]( 201

Doxazosin mesylate is an alpha-1 adrenergic receptor blocker. C12(=CC(=C(C 27

Posaconazole is a sterol C14ɑ demethylase inhibitor with an IC50 of 0.25 nM.

Edaravone, a strong novel free radical scavenger, is used for treatment of patients with aC1(CC(N(N=1) 200

Etodolac (Lodine) is a COX inhibitor with an IC50 of 53.5 nM. C1=CC2=C(C(= 201

Etomidate is a GABAA receptors agonist at GABAA receptors. N1(C(=CN=C1) 200

Felbamate (Felbatol) is an anticonvulsant drug used in the treatment of epilepsy. C1=CC=CC=C1 201

Fluconazole is a triazole antifungal drug used in the treatment and prevention of superfiC1(=C(C=C(C= 199

Flumazenil is a benzodiazepine antagonist. C1=C(C=C2C(= 16

Fluoxetine HCl is an antidepressant of the selective serotonin reuptake inhibitor (SSRI)C1(=CC=C(C=C 199

Flupirtine maleate is the salt form of Flupirtine, which is a centrally acting non-opioi C1(=CC=C(C=C 199

Fluvoxamine maleate is a selective serotonin (5-HT) reuptake inhibitor (SSRI). C1(=CC=C(C=C1 200

Genistein, a phytoestrogen found in soy products, is a highly specific inhibitor of prot C1(=CC2=C(C( 199

Ginkgolide B is a PAFR antagonist with IC50 of 3.6 μM. C123[C@@H]([ 200

Glimepiride is a medium-to-long acting sulfonylurea anti-diabetic compound with an EDC1=C(C=CC(=C 22

Ivermectin is a broad-spectrum antiparasitic medication. [C@]12([C@]3( 199

TG100115 is a PI3Kγ/δ inhibitor with IC50 of 83 nM/235 nM, with little effect on PI3Kα/βC1(=C(N=C2C( 25

Ketoconazole inhibits cyclosporine oxidase and testosterone 6 beta-hydroxylase with I C1(=CC=C(C=C 10

Lansoprazole is a proton-pump inhibitor (PPI) which prevents the stomach from producinC1=CC=C2C(=C 200

Levetiracetam is an antiepileptic compound. C1(N(CCC1)[C 199

Lidocaine is a selective inverse peripheral histamine H1-receptor agonist with an IC50 C1=CC=C(C(=C 200

Loratadine is a selective inverse peripheral histamine H1-receptor agonist with an IC50 C1CN(CCC1=C2 44

Losartan is an angiotensin II receptor antagonist, competes with the binding of angiotenC1(=CC(=CC=C 199

GSK1059615 is a dual inhibitor of PI3Kα/β/δ/γ (reversible) and mTOR with IC50 of 0.4 C1(=CC=C2C(= 10

MGCD-265 is a potent, multi-target and ATP-competitive inhibitor of c-Met and VEGFR1/C1(=CC=CC=C1 200

Rigosertib (ON-01910) is a non-ATP-competitive inhibitor of PLK1 with IC50 of 9 nM. It sC1(=C(C=C(C=C 200

Ki8751 is a potent and selective inhibitor of VEGFR2 with IC50 of 0.9 nM, >40-fold se C1=CN=C2C(=C 100

Epothilone B is a Taxol-like microtubule-stabilizing agent with EC0.01 of 1.8 μM. Phase O1[C@@]2(CCC 200

BMS-707035 is a specific HIV-I integrase (IN) inhibitor with IC50 of 15 nM. Phase 2. C1(=CC=C(C=C 92

Amonafide produces protein-associated DNA-strand breaks through a topoisomerase IIC12C=C(C=C3C 201

Acitretin is a second generation retinoid used for psoriasis. C1=C(C(=C(C(= 61

Doripenem Hydrate is an ultra-broad spectrum injectable antibiotic. C1([C@]([C@]2 82

Gestodene is a progestogen hormonal contraceptive. C1C(C=C2[C@]( 199

Drospirenone is a synthetic progestin that is an analog to spironolactone. C1C(C=C2[C@]( 199

INCB018424 is the first potent, selective, JAK1/2 inhibitor to enter the clinic with IC50 N1=CN=C2C(= 199

It was developed to be used as a chemotherapy medication for the treatment of brain c C(/C=C(\C=C\C 199

Lopinavir is a potent HIV protease inhibitor with Ki of 1.3 pM. C1=CC=C(C(=C 200

Meropenem is an ultra-broad spectrum injectable antibiotic. N12C(C(C1=O) 200

Mianserin HCl is a psychoactive agent of the tetracyclic antidepressant. C12(N3C(C4=C 199

Mosapride Citrate is a gastroprokinetic agent that acts as a selective 5HT4 agonist. C1(=C(C=C(C( 146

Nafamostat Mesylate is an anticoagulant.Phase 4. C1(=CC=C(C=C1 37

Naftopidil DiHCl is a selective 5-HT1A and α1-adrenergic receptor antagonist with IC50 C1(=C2C(=CC= 88

Omeprazole(Prilosec) is a proton pump inhibitor used in the treatment of dyspepsia. C1=C(C=C2C(= 199

Ondansetron HCl is a serotonin 5-HT3 receptor antagonist. C1(=CC=C2C(= 200

Oxcarbazepine inhibits the binding of [3H]BTX to sodium channels with IC50 of 160 μM aN1(C2=C(C(CC 27

Pelitinib (EKB-569) is a potent irreversible EGFR inhibitor with IC50 of 38.5 nM. Phase2C1(=C(C=C2C( 27

Pirarubicin is an anthracycline agent. [C@@H]1([C@H 159

Pizotifen Malate is a benzocycloheptane based agent used for recurrent migraine head C1(C2=C(CCC3 48

Resveratrol is a phytoalexin produced naturally by several plants with anti-cancer, anti- C1(=CC=C(C=C 201

Rocuronium Bromide is an aminosteroid non-depolarizing neuromuscular blocker or mus[C@H]1([C@H]( 200

Stavudine is a nucleoside analog reverse transcriptase inhibitor (NARTI) active against O1C(C=CC1CO) 200

Tenofovir disoproxil fumarate belongs to nucleotide analogue reverse transcriptase inhibN1(C=NC2=C(C 201

Tigecycline is bacteriostatic and is a protein synthesis inhibitor by binding to the 30S r C1(=CC(=C(C2= 170

Trilostane is an inhibitor of 3 β-hydroxysteroid dehydrogenase used in the treatment of C1(=C([C@@]2( 200

Vecuronium Bromide is a muscle relaxant in the category of non-depolarizing blocking C1(CCN(CC1)[C 200

Bimatoprost is a prostaglandin analog used topically (as eye drops) to control the pro C1=CC=C(C=C1 86

Linezolid is a synthetic antibiotic used for the treatment of serious infections. C1=C(C(=CC(= 201

Alfuzosin(Uroxatral) is an alpha1 receptor antagonist used to treat benign prostatic hyp C1(=C(C=C2C( 199

Clopidogrel (Plavix) is an oral, thienopyridine class antiplatelet agent. C1(=CC=CC(=C 200

Droxinostat (CMH, 5809354) is a selective inhibitor of HDAC, mostly for HDACs 6 and 8 C1=C(C=C(C(= 201

Ranolazine 2HCl, is an antianginal medication. C1(=C(C(=C(C 199

Repaglinide is for the treatment of type II diabetes. C1(=C(C=CC(= 201

Rolipram is a PDE4-inhibitor and an anti-inflammatory agent.Phase 1. C1(=C(C=CC(= 199

Sildenafil, a selective inhibitor of cyclic guanosine monophosphate (cGMP)-specific phosC1(=CC=C(C(= 34

Sumatriptan Succinate is a triptan sulfa drug containing a sulfonamide group for the tr C1(=CC=C2C(= 200

Tianeptine is a selective serotonin reuptake enhancer (SSRE) compound used for treatC12(=C(C(C3C( 200

Tizanidine HCl is an α2-adrenergic receptor agonist and inhibits neurotransmitter rele C1(C=CC2C(C= 34

Topiramate is an anticonvulsant compound. [C@H]12[C@H]( 200

Tranilast is an antiallergic compound. C1(=C(C=CC(= 201

Venlafaxine is an arylalkanolamine serotonin-norepinephrine reuptake inhibitor (SNRI). C1(CCCCC1(C( 176

Voriconazole is a new triazole derivative similar to fluconazole and itraconazole that C1=C(C(=CC(= 200

Zileuton is an orally active inhibitor of 5-lipoxygenase, and thus inhibits leukotrienes C1=CC=C2C(=C 198

Ziprasidone HCl was the fifth atypical antipsychotic. C1(=CC=CC2=C 200

Zonisamide is a sulfonamide anticonvulsant approved for use as an adjunctive. C12=CC=CC=C 197

Nanchangmycin (dianemycin) is a polyether antibiotic with similar structure to dianemy [O-]C([C@H](C 194

Aurora A Inhibitor I is a novel, potent, and selective inhibitor of Aurora A with IC50 of 3 N1=CC(=C(N=C 200

Ispinesib (SB-715992, CK0238273) is a potent, specific and reversible inhibitor of kin C1=CC(=CC=C1 199

Tipifarnib (R115777) is a potent and specific farnesyltransferase (FTase) inhibitor with IC1=CC(=CC=C1 28

PHA-680632 is potent inhibitor of Aurora A, Aurora B and Aurora C with IC50 of 27 nM C1(=CC=C(C=C 199

Cilomilast is a potent PDE4 inhibitor with IC50 of about 110 nM, has anti-inflammatory acC1(=C(C=CC(= 200

Zibotentan (ZD4054) is a specific Endothelin (ET)A antagonist with IC50 of 21 nM, exhibC1(C(=CC=CN= 56

Atazanavir is a HIV protease inhibitor with Ki of 2.66 nM. O(C(N[C@H](C 129

VX-745 is a potent and selective inhibitor of p38α with IC50 of 10 nM, 22-fold greater seC1=C(C=CC(=C 34

Thiazovivin (Tzv) is a novel ROCK inhibitor with IC50 of 0.5 μM, promotes hESC survival C1(SC=C(N=1 48

SP600125 is a broad-spectrum JNK inhibitor for JNK1, JNK2 and JNK3 with IC50 of 40 nC1C=CC2=C(C 199

AZD6482 is a PI3Kβ inhibitor with IC50 of 10 nM, 8-, 87- and 109-fold more selective C(C1C(=CC=CC 200

Moxifloxacin is a fourth-generation synthetic fluoroquinolone antibacterial agent. C1(=C(C(=C2C( 200

Calcitriol is the hormonally active form of vitamin D. [C@@H]1(C[C@ 199

Doxercalciferol is a synthetic analog of vitamin D. C1[C@@H](C(/C 201

Alfacalcidol is a non-selective VDR activator medication. C1[C@H](C[C@ 199

Calcifediol is a major circulating metabolite of vitamin D3 and acts as a competitive i C1[C@H](CCC(C 199

SU6668 has greatest potency against PDGFR autophosphorylation with Ki of 8 nM, but alsC1=CC=C2C(=C 199

Safinamide Mesylate is mesylate salt of Safinamide, selectively and reversibly inhibits C1(=CC=CC(=C 200

GSK429286A is a selective inhibitor of ROCK1 and ROCK2 with IC50 of 14 nM and 63 nC1(CC(C(=C(N 201

AS-703026 is a highly selective, potent, ATP non-competitive allosteric inhibitor of ME C1=C(C=CC(=C 199

SB525334 is a potent and selective inhibitor of TGFβ receptor I (ALK5) with IC50 of 14.C1(=CC=C2C(= 200

Oligomycin A is an inhibitor of ATP synthase, inhibits oxidative phosphorylation and a C1C[C@@]2(O[ 12

VX-222 (VCH-222) is a novel, potent and selective inhibitor of HCV polymerase with IC50[C@H]1(CC[C@ 199

Zosuquidar (LY335979) is a potent modulator of P-glycoprotein-mediated multi-drug resC12(=C(C=CC= 156

BMS-790052 is a highly selective inhibitor of HCV NS5A with EC50 of 9-50 pM, for a broC1=CC(=CC=C1 200

Iloperidone is an atypical antipsychotic for the treatment of schizophrenia. C1(=C(C=CC(= 63

MC1568 is a selective HDAC inhibitor for maize HD1-A with IC50 of 100 nM. It is 34-fo C1=CC(=CC(=C1 41

HMN-214 is a prodrug of HMN-176, which alters the cellular spatial orientation of Plk1. C1=CC=CC(=C1 28

AEE788 is a potent inhibitor of EGFR and HER2/ErbB2 with IC50 of 2 nM and 6 nM, lesC1=NC(=C2C(= 199

PHA-793887 is a novel and potent inhibitor of CDK2, CDK5 and CDK7 with IC50 of 8 nM, N1N=C(C2=C1C 199

Naratriptan (Amerge) is a triptan agent that is used for the treatment of migraine heada C1(=CC=C2C(= 198

PIK-93 is the first potent, synthetic PI4K (PI4KIIIβ) inhibitor with IC50 of 19 nM; shown C1(=C(C=C(C= 200

Ponatinib (AP24534) is a novel, potent multi-target inhibitor of Abl, PDGFRα, VEGFR2, C1C=NN2C(C=1 56

LY2228820 is a novel and potent inhibitor of p38 MAPK with IC50 of 7 nM, does not alt CC(C1=NC(=C( 57

Pralatrexate(Folotyn) is an antifolate, and structurally a folate analog. Its IC50 is < 300 N1=C(N=C2C(= 58

Betamethasone is a glucocorticoid steroid with anti-inflammatory and immunosuppressivC1C(C=C2[C@]( 201

Mycophenolate Mofetil is a non-competitive, selective and reversible inhibitor of inos C12=C(C(=C(C 200

Cefalexin is a cephalosporin antibiotic. C1=CC=C(C=C1 10

Dyphylline is a xanthine derivative with bronchodilator and vasodilator effects. N1(C(N(C2=C( 200

Aztreonam is a synthetic monocyclic beta-lactam antibiotic. [C@H]1(C(N([C 199

Alprostadil is used as a drug in the treatment of erectile dysfunction and has vasodilator[C@@H]1([C@@ 200

Tadalafil is a PDE-5 inhibitor with IC50 of 1.8 nM. N1(CC(N2[C@@ 200

Cyclosporine (Neoral) is an immunosuppressant drug. C1(N(C)C(C(NC 123

SB939 is a potent pan-HDAC inhibitor with IC50 of 40-140 nM with exception for HDAC6. C1(=CC=C2C(= 200

Natamycin is a naturally occurring antifungal agent. [C@@H]1([C@@ 10

CCT129202 is an ATP-competitive pan-Aurora inhibitor for Aurora A, Aurora B and AuroC1(=CN=C2C(= 10

SAR245409 (XL765) is a dual inhibitor of mTOR/PI3K, mostly for p110γ with IC50 of 9 C12=CC=CC=C1 20

AT7519 is a multi-CDK inhibitor for CDK1, 2, 4, 6 and 9 with IC50 of 10-210 nM. It is le C1=C(C(=C(C= 26

MK-1775 is a potent and selective Wee1 inhibitor with IC50 of 5.2 nM; hinders G2 DN C1=CC(=NC(=C 159

Quizartinib (AC220) is a second-generation FLT3 inhibitor for Flt3(ITD/WT) with IC50 C1=C(C=CC(=C 59

LY2811376 is the first orally available non-peptidic β-secretase(BACE1) inhibitor with C1=NC=C(C=N1 49

Hesperadin potently inhibits Aurora B with IC50 of 250 nM. It markedly reduces the ac C1(=CC=C2C(= 199

BIX02188 is a selective inhibitor of MEK5 with IC50 of 4.3 nM, also inhibits ERK5 catal C1=C(C=C2C(= 104

BIX02189 is a selective inhibitor of MEK5 with IC50 of 1.5 nM, also inhibits ERK5 catal C1=C(C=C2C(= 199

AZD7762 is a potent and selective inhibitor of Chk1 with IC50 of 5 nM. It is equally po C1(=CC=CC(=C 137

R406 (free base) is a potent Syk inhibitor with IC50 of 41 nM, strongly inhibits Syk but noC1(=C(C=C(C= 44

Org 27569 is an allosteric modulator of cannabinoid CB1 receptor, induces a CB1 receptoC1(=CC=C2C(= 200

CP 673451 is a selective inhibitor of PDGFRα/β with IC50 of 10 nM/1 nM, exhibits >450-foC1=CC(=C2C(= 100

DMXAA (Vadimezan) is a vascular disrupting agents (VDA) and competitive inhibitor of C12=C(C(=CC= 24

Telaprevir (VX-950) is an HCV NS3-4A serine protease inhibitor with IC50 of 0.35 μM. [C@@]12([C@] 200

Saxagliptin is a selective and reversible DPP4 inhibitor with IC50 of 26 nM. C1C2CC3(CC1CC 199

EX 527 is a potent and selective SIRT1 inhibitor with IC50 of 38 nM, exhibits >200-fold N1C2=C(C3=C1 201

AM-1241 is a selective cannabinoid CB2 receptor agonist with Ki of 3.4 nM, exhibits 82-fC1=CC2=C(C=C 200

SB408124 (Tocris-1963) is a non-peptide antagonist for OX1 receptor with Ki of 57 nM aC1=C(C=C2C(= 101

Febuxostat is selective xanthine oxidase inhibitor with Ki of 0.6 nM. C1(=C(C=CC(= 199

Dapagliflozin is a potent and selective hSGLT2 inhibitor with EC50 of 1.1 nM, exhibitin C1(=CC=C(C(= 200

Nebivolol selectively inhibits β1-adrenoceptor with IC50 of 0.8 nM. C1(=C(C=C2C(= 199

Pimobendan is a selective inhibitor of PDE3 with IC50 of 0.32 μM. C1=C2C(=CC=C 200

C1(=C(C=CC(= 199

PHT-427 is a dual Akt and PDPK1 inhibitor (high affinity binding for the PH domains of C1=C(C=CC(= 200

KRN 633 is an ATP-competitive inhibitor of VEGFR1/2/3 with IC50 of 170 nM/160 nM/125C1(=C(C=C2C( 21

AT7867 is a potent ATP-competitive inhibitor of Akt1/2/3 and p70S6K/PKA with IC50 of 3C1(=CC=C(C=C 201

AZD8055 is a novel ATP-competitive mTOR inhibitor with IC50 of 0.8 nM with excellent selectivity (∼1,000-fold) against PI3K isoforms and ATM/DNA-PK. Phase 1.

BMS-777607 is a Met-related inhibitor for c-Met, Axl, Ron and Tyro3 with IC50 of 3.9 nMC1(=C(N=CC=C 91

VX-809 acts to correct CFTR mutations common in cystic fibrosis by increasing muta C12=C(C=C(C= 201

Pomalidomide inhibits LPS-induced TNF-α release with IC50 of 13 nM. C1=CC=C2C(=C 201

PD318088 is a non-ATP competitive allosteric MEK1/2 inhibitor, binds simultaneously witC1=C(C(=C(C( 199

Tazarotene is a prescription topical retinoid sold as a cream or gel. C1CC(C2=C(S1 28

KU-60019 is an improved analogue of KU-55933, with IC50 of 6.3 nM for ATM, 270- and C1=C(C=CC2=C 73

BS-181 is a highly selective CDK7 inhibitor with IC50 of 21 nM. It is more than 40-fold sC1(=CC(=NC2N 199

Fasudil (HA-1077) is a potent inhibitor of ROCK-II, PKA, PKG, PKC, and MLCK with KiC1(=C2C(=C(C 15

BIRB 796 (Doramapimod) is a highly selective p38α MAPK inhibitor with Kd of 0.1 nM, 3C1=C(C2=C(C( 200

RO4929097 is a γ secretase inhibitor with IC50 of 4 nM, inhibiting cellular processing O=C1NC2=C(C3 94Sulfasalazine is a sulfa agent and a derivative of mesalazine used primarily as an anti- C1(NS(C2=CC= 200

Tie2 kinase inhibitor is an optimized compound of SB-203580, selective to Tie2 with IC C12=C(C=CC(= 79

Candesartan is an angiotensin II receptor antagonist with IC50 of 0.26 nM. C1(=CC=C(C= 199

H 89 2HCl is a potent PKA inhibitor with Ki of 48 nM, 10-fold selective for PKA than PKGC1(=CC=C(C2= 200

TWS119 is a GSK-3β inhibitor with IC50 of 30 nM; capable of inducing neuronal differentC1=CC=C(C=C 201

Apixaban is a highly selective, reversible inhibitor of Factor Xa with Ki of 0.08 nM and N1=C(C2=C(N1 39

Semagacestat (LY450139) is a γ-secretase blocker for Aβ42, Aβ40 and Aβ38 with IC50 oC([C@@H](C(N 199

Reserpine is an indole alkaloid antipsychotic and antihypertensive drug that has been usC12=C([C@@]3 21

Furosemide(Lasix) is a loop diuretic used in the treatment of congestive heart failure a C1(=CC(=C(C= 199

Olmesartan medoxomil is a compound which is hydrolyzed to olmesartan that is a selectN1(CC2=CC=C( 159

Cefdinir(Omnicef) is a bacteriocidal antibiotic. [C@]12(N(C(=C 199

Clotrimazole is a synthetic, antifungal and broad-spectrum derivate of imidazole. C1=CC=CC(=C1 31

Rizatriptan Benzoate(Maxalt) is a 5-HT1 agonist triptan drug for the treatment of migra C1(=CC(=CC2= 51

Pyridostigmine Bromide is a parasympathomimetic and a reversible cholinesterase inhibiC1(=C(C=CC=[N 199

Methimazole(Tapazole, Northyx) is an antithyroid medicine. N1C=CN(C1=S) 201

Metolazone(Zaroxolyn) is primarily used to treat congestive heart failure and high bloodC1(=C(C=C2C( 199

Cefoperazone is a cephalosporin antibiotic for inhibition of rMrp2-mediated [3H]E217β C1(CS[C@]2(N 199

Silodosin(Rapaflo) is an α1-adrenoceptor antagonist with high uroselectivity. C1=CC=C(C(=C 199

Riluzole is a drug used to treat amyotrophic lateral sclerosis. C12=C(C=CC(=C 200

Risperidone(Risperdal) is an atypical antipsychotic used to treat schizophrenia. C1(=C(C(N2C( 10

Sulfameter(Bayrena) is a long-acting sulfonamide antibacterial. C1(=CC=C(C=C 199

Prilocaine is a local anesthetic of the amino amide type. C1=CC=CC(=C1 199

Darunavir Ethanolate is an HIV protease inhibitor. [C@@]12([C@]( 200

Prednisone (Adasone) is a synthetic corticosteroid agent that is particularly effectiv C1C(C=C2[C@]( 200

Acetylcysteine is a pharmaceutical drug and nutritional supplement used primarily as C(C)(N[C@](C( 202

Ethynyl estradiol is an orally bio-active estrogen used in almost all modern formulations C1=C(C=C2C(=C 199

Naproxen is a COX inhibitor for COX-1 and COX-2 with IC50 of 8.7 μM and 5.2 μM, respC1(=C(C=C2C(= 11

Nitazoxanide is a synthetic nitrothiazolyl-salicylamide derivative and an antiprotozoal a C1=CC=CC(=C1 201

Triamcinolone Acetonide is a more potent type of triamcinolone, being about 8 times as C1C(C=C2[C@]( 200

Orlistat is a general lipase inhibitor with IC50 of 122 ng/ml for PL from human duodenal C1([C@H]([C@ 199

Allopurinol (Zyloprim) is a xanthine oxidase inhibitor with an IC50 of 7.82±0.12 μM. N1=CN=C2C(C 198

Allopurinol Sodium is a xanthine oxidase inhibitor with an IC50 of 7.82±0.12 μM. C1(=NC2=C(C(N 32Zafirlukast is a leukotriene receptor antagonist (LTRA). (IC50=0.6μM, IC50=7.0 µM fo C12=C(C=C(C= 173

Erythromycin is a macrolide antibiotic that has an antimicrobial spectrum similar to or sliC1[C@H](C([C 200

Amphotericin B is a polyene, antifungal antibiotic produced from a strain of Streptom [C@@H]1([C@H 23

Ibuprofen (Dolgesic) is an anti-inflammatory inhibitor targeting COX-1 and COX-2 with C1=C(C=CC(=C 198

Amprenavir is an HIV protease inhibitor with IC50 of 14.6 ng/mL in wild-type HIV isolateC1=C(C=CC(=C 31

Albendazole is a member of the benzimidazole compounds used as a drug indicated for thC1(=CC=C2C(= 64

Chlorothiazide is a diuretic and antihypertensive. (IC50=3.8 mM) C1(=C(C=C2C(= 199

Ursodiol reduces cholesterol absorption and is used to dissolve (cholesterol) gallstone C1[C@H](C[C@@ 201

Nitrofural is a topical anti-infective agent with an IC50 of 22.83 ± 1.2 μM. (Rat LD50 = C1(=CC=C(O1)/ 201

Ketoprofen (Actron) is a non-selective NSAID with IC50 of 0.5 μM and 2.33 μM for hu C1=CC=CC(=C1 200

Ketorolac (Ketorolac tromethamine) is a non-selective COX inhibitor of COX-1 and COX-C1(=CC=C(C=C 199

Adenosine is a nucleoside composed of a molecule of adenine attached to a ribose sugaO1[C@@H]([C@ 44

Zolmitriptan(Zomig) is a selective serotonin receptor agonist. C1=C(C=CC2=C 201

Telbivudine is an antiviral agent used in the treatment of hepatitis B infection. N1C(C(=CN(C1 198

Monobenzone is a compound used as a topical agent for medical depigmentation. C1=C(C=CC(= 199

All−trans Retinoic acid (ATRA), whith is a ligand for both the retinoic acid receptor (RA C1CCC(=C(C1(C 199

Phenylbutazone(Butazolidin, Butatron) is used as a non-steroidal anti-inflammatory agentN1(N(C(C(C1= 201

Ezetimibe (Zetia) is a compound that lowers cholesterol. C1=C(C=CC(=C 200

Enalaprilat is an angiotensin-converting enzyme (ACE) inhibitor with IC50 of 1.94 nM. C1(=CC=CC(=C 200

Dofetilide(Tikosyn) is a class III antiarrhythmic agent. C1=C(C=CC(=C 199

Isradipine(Dynacirc) is a calcium channel blocker with an IC50 of 34±8 μM. C1C=C(C2C(C= 199

Estrone is an estrogenic hormone. C1=C(C=C2C(=C 199

Flucytosine (5-Fluorocytosine, 5-FC) is an antifungal drug with IC50 of 0.93 μM in C. al C1(NC=C(C(=N 61

Trichlormethiazide(Achletin) is a diuretic with properties similar to those of hydrochlorot C1(=C(C=C2C(= 141

Loteprednol etabonate is an anti-inflammatory corticosteroid used in ophthalmology. C1C(C=C2[C@]( 199

NCCCCCC(O)= 45

Aminoglutethimide is an aromatase inhibitor with IC50 of 10 μM. C1(=CC=C(C=C 86

Aminophylline is a competitive nonselective phosphodiesterase inhibitor with an IC50 o NCCN.N1(C(N( 126

Lubiprostone(Amitiza) is a gastrointestinal agent used for the treatment of idiopathic chrC1(C[C@H]([C 199

Amorolfine hydrochloride is a antifungal reagent. C1(=C(C=CC(= 79

Chloramphenicol is a bacteriostatic antimicrobial. C1=C(C=CC(=C1 201

Flurbiprofen is a member of the phenylalkanoic acid derivative family of non-steroidal C1(=C(C=CC(= 200

Disulfiram is an agent used to support the treatment of chronic alcoholism by producing aCCN(C(SSC(N( 198

Mesalamine is an anti-inflammatory compound. C1=C(C(=CC=C 202

Ipratropium bromide is a muscarinic antagonist, bronchodilator, N-Isopropyl salt of atrop[Br-].C12CCC( 201

Sulfanilamide (Sulphanilamide) is a competitive inhibitor for bacterial enzyme dihydrop C1(=CC=C(C=C 197

Meprednisone is a glucocorticoid and a methylated derivative of prednisone. C1C(C=C2[C@]( 201

Praziquantel is an anthelmintic effective against flatworms. C1=CC=C2C(=C 201

Busulfan(Myleran, Busulfex) is a cell cycle non-specific alkylating antineoplastic agent. CS(OCCCCOS(C 198

Carbamazepine (Carbatrol) is a sodium channel blocker with IC50 of 131 μM in rat bra N1(C(=O)N)C2 198

Hydrocortisone is a steroid hormone or glucocorticoid produced by the adrenal gland. C1C(C=C2[C@]( 201

Desonide is a low potency topical corticosteroid. C1C(C=C2[C@]( 199

Didanosine(Videx, Videx EC) is a reverse transcriptase inhibitor with an IC50 of 0.49 μM[C@H]1(CC[C@ 198

Divalproex sodium consists of a compound of sodium valproate and valproic acid in a 1:1C(C([O-])=O)( 199

Emtricitabine (Emtriva) is a nucleoside reverse transcriptase inhibitor with an IC50 of 2 N1=C(C(=CN(C 198

Progesterone is a C-21 steroid hormone. C1C(C=C2[C@]( 69

Lamivudine(Epivir) is a potent nucleoside analog reverse transcriptase inhibitor with an N1=C(C=CN(C1 200

Hydrochlorothiazide is a first line diuretic compound of the thiazide class. C1(=C(C=C2C(= 201

Estradiol is the predominant sex hormone. C1C(=CC2=C(C= 198

Deferasirox(Exjade) is a rationally-designed oral iron chelator. C1=CC(=CC=C 200

Piroxicam (Feldene) is a non-selective COX inhibitor with an IC50 of 6 mM. C1=CN=C(C=C1 199

Gemcitabine(Gemzar) belongs to the group of medicines called antimetabolites.Phase 3N1=C(C=CN(C1 56

Glipizide(Glucotrol) is used to treat high blood sugar levels caused by a type of diabetesC1(=CC=C(C=C 199

Glyburide (Diabeta) is an anti-diabetic compound in a class of medications known as sulfC1CCCC(C1)NC 200

（6-）ε- Aminocaproic acid is a derivative and analogue of the amino acid lysine.

Adefovir Dipivoxil(Preveon, Hepsera) works by blocking reverse transcriptase, an enzyme C12=C(N=CN=C 199

Zalcitabine is a nucleoside analog HIV reverse transcriptase inhibitor (NARTI). [C@H]1(CC[C@ 198

Azathioprine(Azasan, Imuran) is a drug that suppresses the immune system and is usedN1=CN=C2C(=C 194

Indomethacin(Indocid, Indocin) is a non-steroidal anti-inflammatory compound commonly C1=C(C=C2C(= 201

Terbinafine(Lamisil, Terbinex) is used to treat infections caused by a fungus. It works by C1=CC=C2C(=C 199

Levonorgestrel(Levonelle) is a synthetic progestogen used as an active ingredient in s C1C(C=C2[C@]( 144

Gemfibrozil (Lopid) is a compound used to lower lipid levels. C1=CC(=CC(=C 199

Indapamide(Lozol) is a non-thiazide sulphonamide diuretic compound, generally used in C1=C(C=C(C(= 199

Mitotane(Lysodren), is an antineoplastic medication used in the treatment of adrenocortC1=C(C=CC(=C1 199

Methylprednisolone is a synthetic corticosteroid with anti-inflammatory and immunomoduC1C(C=C2[C@]( 200

Meloxicam (Mobic) is a nonsteroidal anti-inflammatory agent with analgesic and fever reC1(N(S(C2=C( 85

Mesna(Uromitexan, Mesnex), a sulfhydryl compound that is used to reduce the incidenceSCCS([O-])(=O) 200

Methocarbamol(Robaxin) is a central muscle relaxant used to treat skeletal muscle spaC1=CC=CC(=C 198

Prednisolone(Hydroretrocortine) is a synthetic glucocorticoid with anti-inflammatory a C1C(C=C2[C@]( 199

Telmisartan (Micardis) is an angiotensin II receptor antagonist (ARB) used in the mana C1=C(C(=CC=C 25

Thiabendazole inhibites the mitochondrial helminth-specific enzyme, fumarate reductase,N1=CSC=C1C2 198

Guaifenesin(Guaiphenesin) is thought to act as an expectorant. C1=CC(=C(C=C 201

Rifabutin(Mycobutin) is a semisynthetic ansamycin antibiotic with potent antimycobacteri[C@@H]1([C@H 70

Nevirapine(Viramune) is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used tN1(C2CC2)C3= 199

Nicotinic Acid is a water-soluble vitamin belonging to the vitamin B family. C1=CN=CC(=C1 203

Nimodipine(Nimotop) is a dihydropyridine derivative and an analogue of the calcium chanC1(=C(C(C(=C( 200

Nisoldipine (Sular) is a calcium channel blocker belonging to the dihydropyridines class,C1(=C(C(C(=C( 200

Enoxacin(Penetrex)is an oral broad-spectrum fluoroquinolone antibacterial agent used inC1(=C(N=C2C( 10

Pitavastatin calcium is a novel member of the medication class of statins. [Ca+2].C1(=C 57

Rifapentine (Priftin) is an antibiotic compound used in the treatment of tuberculosis. C1(=C2C(=C3C 114

Suprofen(Profenal) is an NSAID. C1(=CC=C(C=C 199

Pyrazinamide is an agent used to treat tuberculosis. C1=CN=CC(=N1 203

Quetiapine fumarate(Seroquel) is an atypical antipsychotic used in the treatment of schizOC(/C=C/C(O) 40

Rifampin is a bactericidal antibiotic agent of the rifamycin group. C1(=C2C(=C3C 200

Beta Carotene is an organic compound and classified as a terpenoid. It is a precursor (inC1CCC(C(=C1C) 10

Cefditoren pivoxil is used to treat uncomplicated skin and skin structure infections, etc. N12[C@](SCC( 199

Sulfadiazine is a sulfonamide antibiotic. C1=CC=NC(=N1 199

Chlorprothixene has strong binding affinities to dopamine and histamine receptors, su C1=CC=C2C(=C 18

Oxytetracycline(Terramycin) was the second of the broad-spectrum tetracycline group of C1(=C([C@H]([ 199

Toremifene Citrate is an oral selective estrogen receptor modulator (SERM) which helpsC1(=C(C=CC(= 200

Ethionamide(2-ethylthioisonicotinamide) is an antibiotic used in the treatment of tubercuC1=CN=C(C=C1 198

Trifluridine (Viroptic) is an anti-herpesvirus antiviral agent used primarily on the eye. N1C(N(C=C(C1 199

Azacitidine is a nucleoside analogue of cytidine that specifically inhibits DNA methylat [C@H]1([C@H] 200

Vidarabine(Vira-A) is an antiviral drug which is active against herpes simplex and varicelC1=NC(=C2C(= 198

Teniposide(Vumon)is a chemotherapeutic medication mainly used in the treatment of chC1=C2C(=CC3= 60

Rifaximin(Xifaxan), an orally administered, semi-synthetic, nonsystemic antibiotic derived[C@@H]1([C@H 59

Simvastatin is a competitive inhibitor of HMG-CoA reductase with Ki of 0.1-0.2 nM . C1[C@H](C=C2 200

Ramipril is an angiotensin-converting enzyme (ACE) inhibitor with IC50 of 5 nM. C1=CC=CC=C1C 199

Fenofibrate (Tricor, Trilipix) is a compound of the fibrate class and fibric acid derivative.C1=C(C=CC(=C 199

Ranolazine(Ranexa) is an antianginal medication. C1=CC=C(C(= 201

Ranitidine is a histamine H2-receptor antagonist with IC50 of 3.3 ± 1.4 μM. N(CC1=CC=C(O1 199

Acadesine results in accumulation of ZMP, which mimics the stimulating effect of A [C@@H]1([C@H 10

The chemical compound acetylcholine (ACh) is a neurotransmitter in both the periphe CC(OCC[N+](C)( 198

Acipimox is a niacin derivative used as a hypolipidemic agent. C1=C([N+](=CC 201

Acyclovir is a synthetic nucleoside analogue active against herpesviruses. OCCOCN1C2=C( 199

Nifedipine(Adalat), a potent vasodilator agent with calcium antagonistic action. C1=CC(=C(C=C1 199

Amiloride hydrochloride(Midamor), a pyrazine compound inhibiting sodium reabsorption tC1(=C(N=C(C(= 199

Chlorpheniramine (Chlorpheniramine maleate, Chlorphenamine) is an histamine H1 receC1(=CC=CC(=N1 199

Fenoprofen calcium is a nonsteroidal, anti-inflammatory antiarthritic agent. [Ca+2].O(C1=C 200

Erdosteine is a mucolytic which is used in treatment of excessive viscous mucus. S1C(C(CC1)NC 200

Proparacaine HCl is a voltage-gated sodium channels antagonist with ED50 of 3.4 mM.C1(=C(C=CC(= 36

Pranlukast is a selective cysteinyl leukotriene receptor antagonist. C12=C(C=C(C 22

Oxfendazole is the sulfoxide form of fenbendazole which is a broad spectrum benzimidaS(C1=CC2=C(C 31

Carvedilol is a non-selective beta blocker/alpha-1 blocker with an IC50 of 3.8 μM for inhiC12=CC=CC(= 199

Atracurium Besylate is a neuromuscular blocking agent with ED95 of 0.2 mg/kg. C1(=C(C=C2C( 10

Butoconazole nitrate is an anti-fungal agent for IL-2, TNFα, IFN and GM-CSF with IC50C1(=CC=C(C(=C 200

Azithromycin is an antibiotic for inhibition of parasite growth with IC50 of 8.4 μM. [C@@H]1([C@@ 133

Albendazole Oxide is a tubulin polymerization or assembly inhibitor. C1(C=CC2=C(C 39

Chloroxine is a synthetic antibacterial compound that is effective in the treatment of d C1=C(C2=C(C( 200

Lomustine inhibits cancer cells by damaging the DNA and stops cells from dividing. C1CCCC(C1)NC 201

Chenodeoxycholic acid is a naturally occurring human bile acid. C1[C@H](C[C@@ 201

Cimetidine(Tagamet), a histamine congener, competitively inhibits histamine binding to C1(=C(N=CN1) 202

Clemastine Fumarate (Clemastine) is a selective histamine H1 receptor antagonist withC1(=C(C=CC(= 76

Curcumin is the principal curcuminoid of the popular Indian spice turmeric, which is a mC1(=C(C=CC(= 200

Daidzein belongs to the group of isoflavones. C1=C(C=C2C(= 200

Bifonazole is an antifungal agent and a prostatic aromatase activity inhibitor with IC50 oC1=CC=CC(=C 199

Pefloxacin mesylate is a synthetic chemotherapeutic agent and an antibacterial agent wC1(=C(C=C2C(= 32

Metoprolol tartrate is a cardioselective β-adrenergic receptor blocker with IC50 of 42 ng[C@H](C(O)=O 146

Diethylstilbestrol, a synthetic nonsteroidal estrogen used in the treatment of menopau C1(=CC=C(C=C 201

Diltiazem HCl (Tiazac) is a benzothiazepine derivative with vasodilating action due to i C12(N(C([C@@ 199

Diphenhydramine HCl (Benadryl), a histamine H1 antagonist used as an antiemetic, antituC1(=CC(=CC=C 198

Dapoxetine hydrochloride is a short-acting novel selective serotonin reuptake inhibitor. C1(=CC=C2C(= 198

Valaciclovir hydrochloride is an antiviral drug used in the management of herpes simpleN1(C(=O)C2=C 38

Ganciclovir is an antiviral drug for feline herpesvirus type-1 with IC50 of 5.2 μM. N1C(=NC2=C( 195

Roxatidine Acetate HCl is a specific and competitive histamin H2-receptor antagonist, witC(C1=CC(=CC= 200

Protionamide is a drug used in the treatment of tuberculosis. C1(=NC=CC(=C 199

Idoxuridine is an antiviral agent for feline herpesvirus type-1 with IC50 of 4.3 µM. C1(=CN(C(NC1 10

Sparfloxacin is a fluoroquinolone antibiotic, shows broad and potent antibacterial activity[C@@H]1(N[C@ 22

Felodipine is a selective L-type Ca2+ channel blocker with IC50 of 0.15 nM. C1(=C(NC(=C( 200

Deflazacort(Calcort) is a glucocorticoid used as an anti-inflammatory and immunosupprC1C(C=C2[C@]( 199

Mitoxantrone is a type II topoisomerase inhibitor with IC50 of 2.0 μM, 0.42 mM for Hep C1=CC(=C2C( 89Nizatidine is a histamine H2 receptor antagonist with IC50 of 6.7 nM for AChE. S1C(=NC(=C1)C 199

Carbidopa is an aromatic-L-amino-acid decarboxylase inhibitor with an IC50 of 29 ± 2 μC1(=C(C=CC(=C 17

Valsartan (Diovan) is an angiotensin II receptor antagonist with IC50 of ranging from 3 C1(=CC=C(C=C 199

Dipyridamole (Persantine) is a phosphodiesterase inhibitor that blocks uptake and metabN1C(=NC2=C( 200

Hydroxyurea is an antineoplastic agent that inhibits DNA synthesis through the inhibiti N(C(N)=O)O 197

Potassium iodide is used to treat overactive thyroid and to protect the thyroid gland from[K+].[I-] 198

Tropisetron is a selective 5-HT3 receptor antagonist and α7-nicotinic receptor agonist wC1(=CC=C2C(=C 109

Nicotinamide (Vitamin B3) is a water-soluble vitamin and is part of the vitamin B group. C1=CN=CC(=C1 196

Vitamin B12 is a water soluble vitamin with a key role in the normal functioning of the b [C@H]1([C@](C 55

Diclofenac Sodium is a non-selective COX inhibitor with IC50 of 60 and 220 nM for ovinC1(=C(C(=C(C= 201

Avobenzone is an oil soluble ingredient used in sunscreen products to absorb the full C1=C(C=CC(=C 199

Amlodipine(Norvasc) is a long-acting calcium channel blocker with an IC50 of 1.9 nM. N1C(=C(C(C(= 200

Metronidazole(Flagyl)is a nitroimidazole antibiotic medication used particularly for anaeN1(CCO)C(=CN= 198

Flutamide is an antiandrogen drug, with its active metablolite binding at androgen receptC1(=C(C=C(C=C1 199

Fluvastatin Sodium inhibits HMG-CoA reductase activity with IC50 of 8 nM. C12(=C(C=CC=C 200

Tioconazole is an antifungal medication with an average IC50 of 1.7 μM. C1=C(C(=CC=C 201

Tropicamide is an anticholinergic and a muscarinic receptor subtype M4-preferring antaC1=CC=CC(=C1 200

Pregnenolone is an endogenous steroid hormone for inhibition of M1 receptor- and M3 rC1[C@@H](CC2[ 69

Sulfamethoxazole is a sulfonamide bacteriostatic antibiotic with an IC50 of 2.7 μM. C1=C(C=CC(=C 201

Sulfisoxazole is a sulfonamide antibacterial with an oxazole substituent. C1=C(C=CC(=C 198

Crystal violet is a triarylmethane dye. C1(=CC(=CC=C1 200

Haloperidol (Haldol) is an antipsychotic and butyrophenone. C1(=CC=C(C=C 199

Phenindione is an anticoagulant which functions as a Vitamin K antagonist. C1=CC=C2C(=C 197

Alibendol is an antispasmodic,choleretic, and cholekinetic. C1=C(C(=C(C= 198

Irsogladine is an anti-gastric ulcer agent that facilitates gap-junctional intercellular c C1=CC(=C(C=C 10

Triamcinolone is a glucocorticoid given, as the free alcohol or in esterified form, orally, C1C(C=C2[C@]( 200

Nystatin (Mycostatin) is a polyene antifungal agent to which many molds and yeasts are[C@@H]1([C@H 20

Isoniazid is a prodrug and must be activated by bacterial catalase. C1=CN=CC=C1 196

Levofloxacin is a synthetic fluoroquinolone (fluoroquinolones) antibacterial agent. C12=C3C=C(C( 66

Enalapril Maleate, the active metabolite of enalapril, competes with angiotensin I for bi C1(=CC=CC(=C 201

Menadione, a synthetic naphthoquinone without the isoprenoid side chain and biological aC1=CC=C2C(=C 197

Methoxsalen (Oxsoralen) a naturally occurring furocoumarin compound found in several spC1C(OC2=C(C= 198

Miconazole is an imidazole antifungal agent that is used topically and by intravenous infC1(=C(C=C(C(= 200

Sulfamethizole(Proklar) is a sulfathiazole antibacterial agent. C1=C(C=CC(=C 199

Sulbactam is a beta-lactamase inhibitor with an average IC50 of 0.8 μM. C1(C[C@@]2(N1 201

Tolfenamic acid is a COX-2 inhibitor with IC50 of 0.2 μM. C1(NC2=CC=CC 198

Pranoprofen is a PGE2 inhibitor with IC50 of 7.5 μM. C1=CN=C2C(=C 199

Sulphadimethoxine is a non-reducing glucuronide. N(C1=NC(=NC( 199

Rimantadine (Flumadine) is an anti-influenza virus drug for T. brucei with IC50 of 7 μM.C1C2CC3CC1(C 184

Primidone(Mysoline) is an anticonvulsant of the pyrimidinedione class. C1NC(C(C(N1) 201

Nefiracetam is a GABAergic, cholinergic, and monoaminergic neuronal systems enhanceC(N1C(CCC1)= 198

Nicorandil is potassium channel activator. C1=CN=CC(=C1) 198

Tamoxifen Citrate is an antagonist of the estrogen receptor by competitive inhibition of C1(=CC=C(C=C 177

Cyclocytidine is the prodrug of cytarabine, which is a pyrimidine nucleoside analog that C1(=CC(N=C2N 10

Meglumine is an amino sugar derived from sorbitol for THP-1 cells with IC50 of 22 μg/mCNC[C@@H]([C 199

Aripiprazole is a human 5-HT1A receptor partial agonist with a Ki of 4.2 nM. C1=C(C=C2C(= 200

Methscopolamine (Pamine) is a muscarinic acetylcholine receptor blocker. [Br-].[C@]12( 200

Amiodarone HCl is an antiarrhythmic drug for inhibition of ATP-sensitive potassium chaC1(=C(C=C(C= 33

Adenine hydrochloride is a hydrochloride salt form of adenine which is a purine derivativC12(=C(C(=NC= 46

Mometasone furoate is a glucocorticosteroid used topically to reduce inflammation of theC1C(C=C2[C@]( 11

Propylthiouracil is a thyroperoxidase and 5'-deiodinase inhibitor. C1=C(NC(NC1= 199

Fluticasone propionate (Flonase, Veramyst) is a synthetic corticosteroid which is derived C1C(C=C2[C@]( 199

Lacidipine (Lacipil, Motens) is a L-type calcium channel blocker. C1=CC=CC(=C1 199

Elvitegravir (EVG, JTK-303/GS-9137) is an HIV integrase inhibitor for HIV-1 IIIB, HIV C1=CC(=C(C(= 200

Maraviroc is a CCR5 antagonist for MIP-1α, MIP-1β and RANTES with IC50 of 3.3 nM, 7C1=CC=CC(=C1 194

Raltegravir (MK-0518) is a potent integrase (IN) inhibitor for WT and S217Q PFV IN witN1(C(=NC(=C( 200

Pyrimethamine is a dihydrofolate reductase(DHFR) inhibitor with an IC50 of 15.4 nM. N1=C(N=C(C(= 40

Sulindac (Clinoril) is a non-steroidal anti-inflammatory agent of the arylalkanoic acid claC1=CC(=CC=C1 199

PCI-34051 is a potent and specific HDAC8 inhibitor with IC50 of 10 nM. It has greater N1(C=CC2C=CC 199

PF-573228 is an ATP-competitive inhibitor of FAK with IC50 of 4 nM, ~50- to 250-fold N1C(CCC2C=C( 52

BMS-265246 is a potent and selective CDK1/2 inhibitor with IC50 of 6 nM/9 nM. It is 25C(=O)(C1C(=C 57

Suplatast Tosilate is a novel capsular anti-asthmatic agent that suppresses both IgE pr C1(=CC(=CC=C 200

Mirtazapine is a potent tetracyclic antidepressant. C1C2=C(N3C(C 199

Benidipine HCl is a hydrochloride salt form of benidipine which is a dihydropyridine cal C1([C@H]2C(= 14

Formoterol hemifumarate is a potent, selective and long-acting β2-adrenoceptor agonist OC(/C=C/C(O) 243

C1=C(C=CC(=C 200

Ketotifen fumarate (Zaditor) is a fumaric acid salt of ketotifen which is a H1-antihistaminC12(C(CC3=C( 18

Urapidil hydrochloride is a hydrochloride salt form of urapidil which is α1-adrenoceptor N1(C(N(C(=CC 56

Ginkgolide A is an extract from in Ginkgo biloba and a g-aminobutyric acid (GABA) antagO=C1[C@]([C@] 200

Diclazuril is an anti-coccidial drug. C1=C(C=CC(=C 39

Uridine is a nucleoside, contains a uracil attached to a ribose ring via a β-N1-glycosidic C1N(C(NC(C=1 200

Flunarizine dihydrochloride is a dihydrochloride salt form which is a calcium channel bloC1(=CC=C(C=C 10

Fenticonazole nitrate is an azole antifungal agent. C(OCC1=CC=C( 200

Rebamipide is a cholecystokinin type 1 (CCK1) receptor inhibitor for inhibiting [125I]B C1(C(NC(CC2= 199

Epalrestat is an aldose reductase inhibitor with IC50 of 72 nM. C1=CC=CC(=C1 10

Aspartame is an artificial, non-saccharide sweetener used as a sugar substitute in so C(C[C@@H](C( 112

Candesartan Cilexetil is a specific nonpeptide Ang II receptor (ATR) antagonist and t C1CCCC(C1)OC 199

Phentolamine Mesylate is a nonselective alpha-adrenergic antagonist with IC50 of 0.1 C1(N(C2=CC=C 201

Nimesulide is a relatively COX-2 selective inhibitor with IC50 of 26 μM. C1=CC(=CC(=C 201

Dyclonine hydrochloride is a hydrochloride salt form of dyclonine which is an oral anaestC1(=C(C=CC(= 46

Cyproterone acetate is an androgen receptor (AR) antagonist with IC50 of 7.1 nM, as wel[C@H]12C(C=C3 199

Memantine hydrochloride (Namenda) is a CYP2B6 and CYP2D6 inhibitor for recombinanCl.C12(CC3CC( 199

Cyproheptadine hydrochloride (Periactin) is a hydrochloride salt form of cyproheptadineC1(=C2CCN(CC 200

Doxifluridine is a thymidine phosphorylase activator for PC9-DPE2 cells with IC50 of 0. N1C(C(=CN(C1 199

Pioglitazone HCl is a hydrochloride salt form of pioglitazone which is a cytochrome C1(=CC=C(N=C 201

Lornoxicam is a COX-1 and COX-2 inhibitor with IC50 of 5 nM and 8 nM, respectively. N(C1=NC=CC=C 10

Captopril is an angiotensin-converting enzyme (ACE) inhibitor with IC50 of 6 nM. C([C@@H]1N(C 197

Cytidine is a nucleoside molecule that is formed when cytosine is attached to a ribose r C1(N(C=CC(=N 201

Orphenadrine citrate is a skeletal muscle relaxant, it acts in the central nervous system C1(C(OCCN(C) 199

Gimeracil is an inhibitor of dihydropyrimidine dehydrogenase, which inhibits the early C1(=CNC(C=C1 199

Tolnaftate is a synthetic thiocarbamate used as an anti-fungal agent. C1(N(C(OC2=C 201

Hytrin (terazosin) is an alpha-adrenergic blocker used to treat high blood pressure and C12(=C(C(=NC 56

Bromhexine hydrochloride is a medication prescribed for coughs which works by dissol C1(=CC(=C(C(= 14

Lovastatin is an inhibitor of HMG-CoA reductase with IC50 of 3.4 nM, used for lowering C1[C@H](C=C2 19

Tiopronin is a US Food and Drug Administration (FDA)-approved drug for the treatment of C(CNC(C(C)S)= 196

Balofloxacin is quinolone antibiotic, inhibiting the synthesis of bacterial DNA by inter N1(C2=C(C3=C 12

Lafutidine, a newly developed histamine H(2)-receptor antagonist, inhibits gastric acid sC1=C(N=CC=C 199

Moxonidine is a selective agonist at the imidazoline receptor subtype 1, used as antihy N1=C(N=C(C(= 99

Ozagrel HCl is a selective thromboxane A2 synthetase enzyme inhibitors with IC50 of 1C1(=C(C=CC(= 200

Argatroban is an anticoagulant that is a small molecule direct thrombin inhibitor. NC(NCCC[C@@] 17

Mecarbinate is a chemical intermediate of arbidol hydrochloride. C1=C(C=C2C(= 201

Atorvastatin (Lipitor) is an inhibitor of HMG-CoA reductase used as a cholesterol-loweri [Ca+2].N1(CC 86

Famotidine is a histamine H2–receptor antagonist with IC50 of 0.6 mM, commonly used tNS(NC(CCSCC1 198

Moexipril HCl is a potent orally active non-sulfhydryl angiotensin converting enzyme inhC1(=C(C=C2C( 37

Cleviprex (Clevidipine) is a dihydropyridine calcium channel blocker use as agent for th CCCC(OCOC(C1 199

Cilazapril is a angiotensin-converting enzyme (ACE) inhibitor used for the treatment of C1(=CC=C(C=C 199

Chlormezanone(Trancopal)，a non-benzodiazepine that is used in the management of anxiety. It has been suggested for use in the treatment of muscle spasm.

Adiphenine is a nicotinic receptor inhibitor with IC50 of 15 µM, used as an antispasmodiC(C(C1=CC=CC 86

Duloxetine is a serotonin-norepinephrine reuptake inhibitor with Ki of 4.6 nM, used for C1(=CC(=C2C( 200

Trimebutine is an agonist of peripheral mu, kappa and delta opiate receptors, used as sC1(=C(C(=CC( 129

Ivabradine HCl, a new If inhibitor with IC 50 of 2.9 μM which acts specifically on the pacC1(=C2C(=CC( 199

Rivastigmine Tartrate, a cholinesterase inhibitor with IC50 of 5.5 μM, ues as a parasymC1(=CC=CC(=C 104

Betaxolol is a selective beta1 adrenergic receptor blocker used in the treatment of hyp C1=CC(=CC=C 201

Detomidine produce dose-dependent sedative and analgesic effects, mediatated by actiC1(=CC=CC(=C 202

Almotriptan Malate is a selective 5-hydroxytryptamine1B/1D (5-HT1B/1D) receptor agonistC1(=CC=C2C(= 200

Ambrisentan, a highly selective antagonist of the endothelin-1 type A receptor with IC50[C@@H](OC1=N 200

Bexarotene is a retinoid specifically selective for retinoid X receptors, used as an oral C12=C(C=C(C( 22

Temocapril HCl is the hydrochloride of Temocapril, which is a long-acting angiotensin-cC1(=CC=CC(=C 200

Gabexate is a serine protease inhibitor with IC50 of 0.19 μM which is used therapeuticalC1(=CC=C(C=C 198

Rasagiline Mesylate is a new MAO-B inhibitor for the treatment of idiopathic Parkinson' C1(=CC=C2C(= 198

Naltrexone is an opioid receptor antagonist with IC50 of 8 nM used primarily in the C1(=C(C2=C3C 37

Levosulpiride is a selective antagonist for D2 dopamine receptors used as an antipsychoC1=CC(=C(C=C 202

Flunixin meglumine is a potent inhibitor of the enzyme cyclooxygenase used as analgesicC1(C(=CC=CN=1 199

Imidapril HCl is a angiotensin-converting enzyme (ACE) inhibitor with IC50 of 2.6 nM, usCCOC(=O)[C@@ 199

Cisatracurium Besylate is a nondepolarizing neuromuscular blocking agent, antagonizingC1(=C(C=C2C( 200

Dronedarone HCl is a therapy for the treatment of patients with paroxysmal and persistent atrC1(=CC=C2C(= 134

Conivaptan is a non-peptide inhibitor of antidiuretic hormone (vasopressin receptor antaC(NC1=CC=C(C 199

Ibutilide Fumarate is a Class III antiarrhythmic agent that is indicated for acute cardioconCS(=O)(=O)NC 100

Probucol is an anti-hyperlipidemic drug by lowering the level of cholesterol in the blood C1(=C(C(=CC(= 199

Arbidol is an antiviral treatment for influenza infection. C1(=C(C=C2C( 200

Licofelone is a dual COX/LOX inhibitor being considered as a treatment for osteoarthritiC1(C2=CC=C(C 200

Dextrose, a simple sugar (monosaccharide), is an important carbohydrate in biology. OC[C@H]([C@H 199

Xylose is a sugar first isolated from wood. OC[C@H]([C@@ 199

Mestranol is the 3-methyl ether of ethinylestradiol. It was the estrogen used in many of thC1C(=CC2=C(C= 48

Naftopidil (Flivas) is a selective α1-adrenergic receptor antagonist or alpha blocker withC1(=C2C(=CC 201

S-(+)-Rolipram inhibits human monocyte cyclic AMP-specific PDE4 with IC50 of 0.75 μM, C1(=C(C=C(C= 199

Bazedoxifene HCl is a novel, non-steroidal, indole-based estrogen receptor modulator C1(N(C2=CC=C 199

Atropine sulfate monohydrate is a competitive muscarinic acetylcholine receptor antagonOS(O)(=O)=O.O 200

Roflumilast is a selective inhibitor of PDE4 with IC50 of 0.2-4.3 nM. N1=CC(=C(C(= 200

AZD8330 is a novel, selective, non-ATP competitive MEK 1/2 inhibitor with IC50 of 7 n C1=C(C=CC(=C 199

GSK1292263 is a novel GPR119 agonist, showing potential for the treatment of type 2 C1(C=CC(=CN= 74

LDE225 (NVP-LDE225) is a Smoothened (Smo) antagonist, inhibiting Hedgehog (Hh) sigC1(=CC=C(N=C 199

CGS 21680 HCl is an adenosine A2 receptor agonist with IC50 of 22 nM, exhibits 140-foC12(=C(N=C(N 199

Dabigatran Etexilate is the prodrug of dabigatran, a potent, nonpeptidic small molecule thC1(=CC=C(C=C 200

LY2608204 activates glucokinase (GK) with EC50 of 42 nM. C1=C(C=CC(=C 200

LY2886721 is an BACE inhibitor used for the treatment of Alzheimer's Disease. C1=C(C=CC(=N 23

KW-2449 is a multiple-targeted inhibitor, mostly for Flt3 with IC50 of 6.6 nM, modestl C1=CC=CC2=C 201

Tebipenem pivoxil is a novel oral carbapenem antibiotic with an IC50 of 100 μg/ml for [C@]1(C(N2[C@ 198

Almorexant HCl is an orally active, dual orexin receptor antagonist with IC50 of 6.6 n C1(=CC(=CC=C 72RAF265 (CHIR-265) is a potent selective inhibitor of C-Raf/B-Raf/B-Raf V600E with IC5C12=C(C=CC(= 192

AZD1480 is a novel ATP-competitive JAK2 inhibitor with IC50 of 0.26 nM, selectivity agC1(=NC(=NC=C 69PF-4708671 is a cell-permeable inhibitor of p70 ribosomal S6 kinase (S6K1 isoform) withN1C(=NC2=C1C 76

PD 128907 HCl is a potent and selective dopamine D3 receptor agonist, with EC50 of 0.6C1(=CC=C2C(=C 41

Rosuvastatin Calcium is a competitive inhibitor of HMG-CoA reductase with IC50 of 11 [Ca+2].N1(=C( 199

Givinostat (ITF2357) is a potent HDAC inhibitor for HDAC2, HDAC1B and HDAC1A withC1(=CC2=C(C= 199

Telotristat Etiprate (LX 1606 Hippurate) is an orally bioavailable, tryptophan hydroxylaseC1(=C(C=CC(= 100Dichlorphenamide is a sulfonamide and a carbonic anhydrase inhibitor of the meta-Dis C1(=C(C(=CC(= 199

AG14361 is a potent inhibitor of PARP1 with Ki of <5 nM. It is at least 1000-fold more C12=C3C=CC= 37

LY2784544 is a potent JAK2 inhibitor with IC50 of 3 nM, effective in JAK2V617F, 8- an C1C(=NN2C(C= 200

MLN2238 inhibits the chymotrypsin-like proteolytic (β5) site of the 20S proteasome with IC1=CC(=CC(=C 199

MLN9708 immediately hydrolyzed to MLN2238, the biologically active form, on exposure toC1=CC(=CC(=C 199

SB743921 is a kinesin spindle protein (KSP) inhibitor with Ki of 0.1 nM, almost no affi C1(=CC(=CC=C 200

AST-1306 is a novel irreversible inhibitor of EGFR and ErbB2 with IC50 of 0.5 nM and 3C(C=C)(=O)NC 199

SB505124 is a selective inhibitor of TGFβR for ALK4, ALK5 with IC50 of 129 nM and 47 nMC1(=CC=CC(=N 199

Avasimibe inhibits ACAT with IC50 of 3.3 μM, also inhibits human P450 isoenzymes C1=C(C=C(C(= 199

AZD8931 is a reversible, ATP competitive inhibitor of EGFR, ErbB2 and ErbB3 with IC50C1(=C(C=C2C( 84

GSK461364 inhibits purified Plk1 with Ki of 2.2 nM. It is more than 1000-fold selective aC1N(CCN(C1)C 18

R406 is a potent Syk inhibitor with IC50 of 41 nM, strongly inhibits Syk but not Lyn, 5-folC1(=C(C=C(C= 200

CYT997 (Lexibulin) is a potent microtubule polymerization inhibitor with IC50 of 10-100 N1=CC(=C(N=C 87SGI-1776 is a novel ATP competitive inhibitor of Pim1 with IC50 of 7 nM, 50- and 10-folC1C(=NN2C(C= 199

Aliskiren hemifumarate is a direct renin inhibitor with IC50 of 1.5 nM. C(/C=C/C(O)= 163

BMS-794833 is a potent ATP competitive inhibitor of Met/VEGFR2 with IC50 of 1.7 nM/1N1=C(C(=C(C= 200

NVP-BHG712 is a specific EphB4 inhibitor with ED50 of 25 nM that discriminates betweeC12=C(N=C(N= 200

OSI-420 is the active metabolite of Erlotinib (EGFR inhibitor with IC50 of 2 nM). C1(=C(C=CC=C 199

PIK-293 is a PI3K inhibitor, mostly for PI3Kδ with IC50 of 0.24 μM, 500-, 100- and 50-folC1(N(C(C2=C( 201

Formestane(Lentaron(R)) is a second generation selective aromatase inhibitor with an C1C(C(=C2[C@] 201

AZ 960 is a novel ATP competitive JAK2 inhibitor with IC50 and Ki of <3 nM and 0.45 nMC1=C(C(=NC(= 200

DAPT (GSI-IX) is a novel γ-secretase inhibitor, which inhibits Aβ production with IC50 oC1(=CC(=CC(= 198

Mubritinib (TAK-165) is a potent inhibitor of HER2/ErbB2 with IC50 of 6 nM; no activi C1=C(C=CC(=C 27

Irinotecan prevents DNA from unwinding by inhibition of topoisomerase 1. C1(CCN(CC1)C 199

PP242 is a selective mTOR inhibitor with IC50 of 8 nM; targets both mTOR complexes wiN1=CN=C2C(=C 201

CYT387 is an ATP-competitive inhibitor of JAK1/JAK2 with IC50 of 11 nM/18 nM, ~10-folC1=C(C=CC(=C 200

SB590885 is a potent B-Raf inhibitor with Ki of 0.16 nM, 11-fold greater selectivity for BN1C(=C(NC=1C 11

Apatinib is an orally bioavailable, selective VEGFR2 inhibitor with IC50 of 1 nM. S(=O)(O)(C)= 44

UK-383367 is a procollagen C-proteinase inhibitor with IC50 of 44 nM, has excellent seC1([C@H](CCC 200

Tosyl-L-Arginine Methyl Ester (TAME) is an APC inhibitor. C1=C(C=CC(=C 201

CAL-101 (Idelalisib, GS-1101) is a selective p110δ inhibitor with IC50 of 2.5 nM; show C1=CC=C2C(=C 199

PIK-294 is a highly selective p110δ inhibitor with IC50 of 10 nM, 1000-, 49- and 16-fold N1=CN=C2C(=C 200

VX-765 is a potent and selective inhibitor of caspase-1 with Ki of 0.8 nM. C1(=CC(=C(C= 196

Eltrombopag is a member of the biarylhydrazone class, which is a nonpeptide agonist ofC1=C(C(=C(C= 201

LY2157299 is a potent TGFβ receptor I (TβRI) inhibitor with IC50 of 56 nM. Phase 2. C1(=CC=CC(=N 200

Telatinib is a potent inhibitor of VEGFR2/3, c-Kit and PDGFRβ with IC50 of 6 nM/4 nM, N1=C(C2=C(C( 200

Ketanserin (Vulketan Gel) is specific 5-HT2A serotonin receptor antagonist with a Ki o C1=CC=C2C(=C 10

Esomeprazole sodium (Nexium) is a sodium salt of esomeprazole that is a potent protonC1(=CC=C2C(=C 201

BI6727 (Volasertib) is a highly potent Plk1 inhibitor with IC50 of 0.87 nM. It shows 6- an[C@H]1(C(N(C 80

Palomid 529 inhibits both the mTORC1 and mTORC2 complexes, reduces phosphorylatC1=C(C=CC(=C 199

Tubacin is a highly potent and selective, reversible, cell-permeable HDAC6 inhibitor wi [C@@H]1(C[C@ 100Fesoterodine fumarate (Toviaz) is an antimuscarinic agent and is rapidly de-esterified toC1(=C(C=CC=C 200

WP1130 (Degrasyn) is a selective deubiquitinase (DUB: USP5, UCH-L1, USP9x, USP14, anC1(=CC=CC(=N 200

AR-42 is an HDAC inhibitor with IC50 30 nM. C1=CC=C(C=C1 201

BKM120 is a selective PI3K inhibitor of p110α/β/δ/γ with IC50 of 52 nM/166 nM/116 nMC1=C(N=CC(=C 199

CX-4945 is a potent and selective inhibitor of CK2 (casein kinase 2) with IC50 of 1 nM, C1=NC=C2C(=C 45

(-)-Epigallocatechin Gallate is the main catechin extraction of green tea, which shows mulC1(=C(C(=CC( 200

(+)-Usniacin is a naturally occurring dibenzofuran derivative found in several lichen specC1(C(C=C2[C@ 10

3-Indolebutyric acid(IBA) is a plant hormone in the auxin family and is an ingredient in C1=CC=CC2=C 201

4-Methylumbelliferone is a hyaluronic acid (HA) synthesis inhibitor with an IC50 of 0.4 C1=C(C=CC2= 198

Esculin is a glucoside found in horse chestnuts. C1(=C(C=C2C( 199

Aloe-emodin is an interferon-inducing agent with IC50 of about 1 μg/mL for JEV and of C12=C(C=C(C= 10

Laetrile is a glycoside initially isolated from the seeds of the tree Prunus dulcis, also k [C@H]1([C@H] 201

Andrographolide is a labdane diterpenoid that is the main bioactive component of the me[C@@H]1([C@] 199

Apigenin is a potent P450 inhibitor for CYP2C9 with IC50 of 23 pM. C1=C(C2=C(C= 199

Arbutin is a tyrosinase inhibitor with an IC50 of 1.09 mM. [C@H]1([C@H] 202

Artemether is an antimalarial for the treatment of resistant strains of falciparum malaria.[C@]12([C@]34 201

Artesunate is a part of the artemisinin group of agents with an IC50 of < 5 μM for small c[C@]12([C@]34 200

Asiatic acid is the aglycone of asiaticoside isolated from the plant Centella asiatica, c [C@@H]1([C@@H 200

Azomycin is an antimicrobial antibiotic produced by a strain of Nocardia mesenterica. O=[N+](C1=NC= 203

Baicalein is a CYP2C9 and prolyl endopeptidase inhibitor. C1(=C(C(=C2C 199

Baicalin is a known prolyl endopeptidase inhibitor and affects the GABA receptors. [C@@H]1([C@@ 199

Bergenin is trihydroxybenzoic acid glycoside and the C-glycoside of 4-O-methyl gallic ac[C@H]1([C@H]( 201

Berberine Hydrochloride is a quaternary ammonium salt from the group of isoquinoline aC1(=C(C(=C2C( 199

Bilobalide is a biologically active terpenic trilactone present in Ginkgo biloba. O1C([C@@]23C4 199

Caffeic acid is a hydroxycinnamic acid, a naturally occurring organic compound. C1=C(C(=CC(=C 10

Chlorogenic acid is a hydroxycinnamic acid and a member of a family of naturally occu C1[C@H]([C@H 10

Chrysin is a naturally occurring flavone chemically extracted from the blue passion floweC1=C(C2=C(C= 10

Cinchonidine is an alkaloid used in asymmetric synthesis in organic chemistry. C1=C2C(=CC=C1 200

Cryptotanshinone (CPT) is a STAT3 inhibitor with IC50 of 4.6 μM, strongly inhibits ph C1CC(C2C(C1) 40

Cyclosporin A is an immunosuppressive agent, binds to the cyclophilin and then inhibits N1(C(=O)[C@@ 200

Cytisine is a nicotinic acetylcholine receptor agonist. C12N(C(C=CC 199

Dihydroartemisinin (DHA) is a semi-synthetic derivative of artemisinin and isolated fromC1C[C@@]2([C@ 200

Diosmin is a semisynthetic phlebotropic agent and a member of the flavonoid family. [C@@H]1([C@H 10

DL-Carnitine hydrochloride is a quaternary ammonium compound biosynthesized from thOC(CC(O)C[N+]( 202

Emodin is a purgative resin, 6-methyl-1,3,8-trihydroxyanthraquinone, from rhubarb, th C12=C(C(C3=C 199

Enoxolone is a pentacyclic triterpenoid derivative of the beta-amyrin type obtained from C1[C@@](C([C@ 199

Fisetin (Fustel) is a potent sirtuin activating compound (STAC) and an agent that modulaC12=C(C=C(C= 199

Formononetin is a phytoestrogen from the root of Astragalus membranaceus and an O-mC12=C(C=C(C= 201

Ferulic Acid is a hydroxycinnamic acid and a type of organic compound found in the FerC1=C(C(=CC(= 10

Glycyrrhizic acid is a widely used anti-inflammatory agent isolated from the licorice root.C1[C@@H](C([ 142

Gossypol is a polyphenolic aldehyde that permeates cells and acts as an inhibitor for C1(=C(C(=C(C 10

Gramine is a naturally occurring indole alkaloid present in several plant species. C12=C(C=CC=C 200

Gynostemma Extract is a saponins extract derived from the Gynostemma pentaphyllumC1[C@@H](C([ 206

Hesperetin is a bioflavonoid and, to be more specific, a flavanone. C1(=CC(=C2C( 10

Hesperidin is a flavanone glycoside found abundantly in citrus fruits. [C@H]1([C@H] 199

Honokiol is the active principle of magnolia extract that inhibits Akt-phosphorylation C1(=C(C=C(C= 198

Hyodeoxycholic(HDCA) acid is a secondary bile acid, one of the metabolic byproducts of C1[C@H](C[C@@ 201

Icariin is a cGMP-specific PDE5 inhibitor with IC50 of 0.432 μM, 167-fold more selecti [C@H]1([C@H] 73

Indole-3-carbinol is produced by the breakdown of the glucosinolate glucobrassicin, whicC1=CC=CC2=C 197

Kaempferol is a natural flavonol, a type of flavonoid, that has been isolated from plant sC1(=CC(=C2C( 199

Kinetin is a type of cytokinin, a class of plant hormone that promotes cell division. C12=C(C(=NC 199

L(+)-Rhamnose (Rham) is a naturally-occurring deoxy sugar that is found primarily in p [C@H]1([C@H] 10

Limonin is a triterpenoid enriched in citrus fruits, which has antivirus and antitumor abilitC1(O[C@H]([C@ 93

Luteolin is a flavonoid found in Terminalia chebula, which is a non-selective phispho C1(=CC(=C2C( 199

Magnolol is a bioactive lignin found in the bark of the Houpu magnolia (Magnolia officinaC1=CC(=C(C= 199

Matrine((+)-Matrine) is an alkaloid found in plants from the Sophora family, which has a C1CCN2[C@]3([ 10

Methyl Hesperidin is a flavanone glycoside (flavonoid) (C28H34O15) found abundantly in c[C@H]1([C@H] 10

Morin hydrate(Aurantica) is a flavonoid isolated from Maclura pomifera (Osage orange),C1(=CC(=C2C( 199

Myricetin(Cannabiscetin) is a flavonoid found in many grapes, berries, fruits, vegetablesC1(=CC(=C2C( 201

Myricitrin, a flavonoid compound isolated from the root bark of Myrica cerifera, which exeC1(=CC(=C2C( 200

Nalidixic acid(NegGram) is a synthetic 1,8-naphthyridine antimicrobial agent with a limiteC1=C(C(C2=C( 25

Naringin is a flavanone glycoside, which exerts a variety of pharmacological effects suchC1=C(C=C2C(= 199

Neohesperidin, a flavanone glycoside found in citrus fruits, is an antioxidant agent. C1=C(C=C2C(= 199

Nobiletin, a citrus flavonoid isolated from citrus peels like in tangerine, which has anti-i C1(=C(C(=C2C 201

Oleanolic Acid is a non-toxic, hepatoprotective triterpenoid found in Phytolacca AmericaC1[C@@H](C([C 45

Oridonin, a diterpenoid purified from Rabdosia rubescens, is an antitumor agent. [C@]12(C(CC[C 200

Orotic acid(6-Carboxyuracil) is a heterocyclic compound and an acid. C1=C(NC(NC1= 10

Osthol is an O-methylated coumarin, which is found in the plants such as Cnidium monnC1(=CC=C2C(= 200

Oxymatrine is a quinolizidine alkaloid extracted from the root of Sophora flavescens, whiC1CC[N+]2([C@ 200

Paeonol (Peonol), a phenolic compound extracted from Chinese herbs Paeonia suffrut C1(=C(C=C(C= 198

(-)-Parthenolide is a sesquiterpene lactone which occurs naturally in the plant feverfe C1C[C@@]2([C 10

Phloretin is a dihydrochalcone found in apple tree leaves, which shows beneficial effectC1(=CC(=C(C( 200

Phlorizin is a dihydrochalcone found in the bark of pear (Pyrus communis), apple, cherry C1(=CC(=CC(= 199

Piperine (1-Piperoylpiperidine) is the alkaloid responsible for the pungency of black pe C1CN(CCC1)C( 199

Puerarin (Kakonein), an isoflavones found in the root of Radix puerariae, is a 5-HT2C r C12=C(C(=C(C 10

Quercetin, a polyphenolic flavonoid found in a wide variety of plant-based foods, such as C1(=CC(=C2C( 201

Rutaecarpine is an indolopyridoquinazolinone alkaloid isolated from Evodia rutaecarpa N12C(=NC3=C( 83

Rutin, a flavonol glycoside found in many plants including buckwheat; tobacco; forsythiaC1(=C(C(C2=C 199

Salicin is a phenol β-glycosid produced from willow bark that shows anti-inflammatory ef[C@H]1([C@H] 199

Sclareol, a labdane-type diterpene isolated from clary sage (Salvia sclarea), exerts growtC1[C@@]([C@@ 10

Sclareolide(Norambreinolide) is a sesquiterpene lactone natural product derived from va[C@@]12([C@@] 10

Shikimic acid(Shikimate), more commonly known as its anionic form shikimate, is an imC1C(C([C@@H] 10

Silibinin, the main flavonoid extracted from the milk thistle Silybum marianum, displays h[C@H]1([C@H] 10

Silymarin (Silybin B), a polyphenolic flavonoid extracted from the seeds of Silybum mariaC1(=CC(=CC=C 201

Sinomenine, a pure alkaloid extracted from the chinese medical plant Sinomenium acutumC1(=C(C2=C(C 200

Synephrine, a natural protoalkaloid in the extract of bitter orange and other citrus spec C1=C(C=CC(=C 10

Tangeretin, a natural polymethoxylated flavone concentrated in the peel of citrus fruits, iC1(=C(C(=C2C 21

Tanshinone I, an active principle isolated from Salvia miltiorrhiza (Danshen), is structur C1=CC=C2C(=C 83

Tanshinone IIA(Tanshinone B) is the most abundant diterpene quinone in Danshen, SalviaeC1CC(C2=C(C1 16

Taxifolin is a flavonoid in many plants such as Taxus chinensis, Siberian larch, Cedrus C1(=CC(=C2C( 10

Tetrahydropapaverine, one of the TIQs and an analogue of salsolinol and tetrahydropapC1(=C(C=C2C( 18

Troxerutin (Trihydroxyethylrutin), a natural bioflavonoid isolated from Sophora japonica C1=C(C=C2C(= 10

Ursolic acid (Malol) is a pentacyclic triterpene acid, used in cosmetics. C1[C@@H](C([C 199

Vanillylacetone is similar in chemical structure to other flavor chemicals such as vanilli C1=C(C(=CC(= 10

Xanthone is an organic compound, which can be prepared by the heating of phenyl salicC1=CC=C2C(=C 10

Yohimbine has been used as a mydriatic and in the treatment of impotence. It is also alN1(C2=C(C3=C1 10

5-Hydroxytryptophan (5-HTP), also known as oxitriptan (INN), is a naturally occurring a C1(=CC=C2C(= 199

Aloin, a natural anthracycline from Aloe vera, is a tyrosinase inhibitor. [C@@H]1(O[C@ 200

Ammonium Glycyrrhizinate is a unique product derived from Licorice root and has an ex[C@@]1(CC[C@] 200

Biochanin A, an O-methylated isoflavone from Trifolium pratense, inhibits protein tyros C1(=CC(=C2C( 200

Butylscopolamine bromide, is a peripherally acting antimuscarinic, anticholinergic agen [Br-].C1=C(C= 199

Dioscin is a saponin extracted and isolated from Polygonatum Zanlanscianense Pamp, sh[C@H]1([C@H]( 200

Diosmetin is a bioflavonoid found in spearmint, oregano, and many other plants. C1(=CC(=C2C( 199

D-Mannitol is an osmotic diuretic agent and a weak renal vasodilator. OC[C@H]([C@H 197

Gastrodin, an anti-inflammatory polyphenol extracted from Chinese natural herbal Gast [C@@H]1([C@@ 174

Hematoxylin (Hydroxybrazilin) is a compound that forms strongly colored complexes with cer[C@]12([C@@]( 201

Hordenine (N,N-dimethyl-4-hydroxyphenylethylamine) is a phenylethylamine alkaloid with C1=C(C=CC(=C 199

Indirubin is a potent cyclin-dependent kinases and GSK-3β inhibitor with IC50 of abou C1=CC=C2C(=C 202

Lappaconite Hydrobromide is a kind of alkaloid extracted from Aconitum sinomontanum C1(C[C@@]2([ 42

Naringin Dihydrochalcone(Naringin DC) is a new-style sweetening agent and an artificiaC1(=CC(=C(C( 10

Polydatin is a crystal component extracted from the root stem of perennial herbage P [C@@H]1([C@@ 199

Quercetin is a natural flavonoid present in vegetables, fruit and wine and is a PI3K inhi C1(=CC(=C2C( 10

Sesamin, a lignan isolated from the bark of Fagara plants and from sesame oil, exhibits C12=C(C=CC(= 200

Sorbitol is a sugar alcohol and a sugar substitute. OC[C@H]([C@H 197

Naringenin is a natural predominant flavanone derived from plant food, which is consid C1(=CC(=C2C( 10

Physcion is a anthraquinone from roots of Rheum officinale Baill. C1(=CC(=C2C( 21

Salidroside, a phenylpropanoid glycoside isolated from Rhodiola rosea, has been repor[C@H]1([C@H] 10

Palmatine hydrochloride (Palmatine chloride (6CI,7CI); Fibrauretin) is a hydrochloride saC1(=C(C(=C2C( 201

Dihydromyricetin (Ampelopsin, Ampeloptin) is a natural antioxidant flavonoid from Amp C1(=CC(=C2C( 199

Sodium Danshensu is a mono sodium of danshensu, which is a natural phenolic acid of cafC1(=C(C=CC(=C 10

Tetrandrine, a bis-benzylisoquinoline alkaloid derived from Stephania tetrandra, is a ca C1=C2C3=C(C( 22

Isoliquiritigenin, an anti-tumor flavonoid from the root of Glycyrrhiza glabra, inhibits a C1=C(C=CC(=C 199

Sophocarpine, a major ingredient of Sophora alopecuroides, has a wide range of pharmaC1=CC(N2[C@]( 198

Chrysophanic acid (Chrysophanol), a natural anthraquinone isolated from Dianella longC1=CC(=C2C(= 10

Curcumol is a pure monomer isolated from Rhizoma Curcumaeis with antitumor activitieC1([C@]2([C@] 198

Cephalomannine is an active anti-cancer agent obtained from Taxus yunnanensis and hasC1=CC=CC(=C1 132

10-Deacetylbaccatin-III is an antineoplastic agent and an anti-cancer intermediate. [C@@]12([C@@] 200

Paeoniflorin is a herbal constituent extracted from the root of Paeonia albiflora Pall. [C@H]1([C@H] 199

Geniposide is an iridoid glycoside isolated from the fruit of Gardenia jasminoides Ellis. [C@H]1([C@H] 10

Genipin is an active aglycone derived from an iridoid glycoside called geniposide, which iO1C=C([C@@]2( 198

Geniposidic acid is an effective anticancer and radioprotection agent. C1O[C@H]([C@ 42

Astragaloside A (Astragaloside IV) is the primary pure saponin isolated from Astragal [C@@H]1([C@@ 10

20-Hydroxyecdysone (Ecdysterone, 20E) is a naturally occurring ecdysteroid hormone w[C@H]1([C@@H] 199

Aloperine is exhibits anti-inflammatory, antibacterial, antiviral, and anti-tumor properties.C1CCC[C@]2(N1 10

Ipriflavone (7-Isopropoxyisoflavon) is used to inhibit bone resorption. C1=C(C=C2C(= 10

Apocynin is a selective NADPH-oxidase inhibitor with IC50 of 10 μM. C1(C=C(C=CC= 10

Rotundine (L-tetrahydropalmatine, L-THP) is a selective dopamine D1 receptor antagoniC1=C(C(=C2C( 10

SynephrineHCl (Oxedrine, p-Synephrine) is a sympathomimetic α-adrenergic receptor (C1(=C(C=CC(=C 68

Guanosine is a purine nucleoside comprising guanine attached to a ribose (ribofuranoseC12N([C@@H]3 10

Inosine is a nucleoside that is formed when hypoxanthine is attached to a ribose ring vi O1[C@@H]([C@ 10

Tolbutamide is an inhibitor of cAMP with IC50 of 4 mM. C1(C=CC(=CC= 10

Levosimendan is a calcium sensitizer acting through calcium-dependent binding to cardiaC(C(C#N)=NNC 199

Forskolin is a ubiquitous activator of eukaryotic adenylyl cyclase (AC), commonly used tC1CC([C@]2([C 199

C1[C@@H](CC2 198

Amantadine HCl is used to treat or prevent infections of the respiratory tract caused by aC12(CC3CC(C1) 202

Amfebutamone HCl is a selective norepinephrine-dopamine reuptake inhibitor with IC50 C1(=CC=CC(=C1 28

Benserazide HCl is a peripherally-acting aromatic L-amino acid decarboxylase (AAAD) C1(=C(C(=C(C= 200

Bupivacaine hydrochloride(Marcain) is a more potent cAMP production inhibitor with anC1(=CC=C(C(= 200

Bethanechol chloride is a selective muscarinic receptor agonist without any effect on nic[N+](CC(OC(N)= 198

Chlorpromazine HCl is a dopamine and potassium channel inhibitor with IC50 of 6.1 andC1(=CC2=C(C=C 199

Equol ,a metabolite of soybeans, is an important isoflavone in humans，specifically binds to 5α-DHT, has a modest affinity for recombinant estrogen receptor ERβ. Phase 2.

Clindamycin hydrochloride(Dalacin) is the hydrated hydrochloride salt of clindamycin whi[C@H]1([C@H] 199

Clonidine hydrochloride(Catapres) is a direct-acting α2 adrenergic agonist with an ED5 C1(=CC=C(C(=C 198

Clozapine (Clozaril) is a potent 5-HT1C receptor antagonist with an IC50 of 110 nM for N1C2=C(C(=NC 198

Pramipexole is a partial/full D2S, D2L, D3, D4 receptor agonist with a Ki of 3.9, 2.2, 0. [C@@H]1(CCC2 198

Domperidone(Motilium) is a dopamine blocker and an antidopaminergic reagent. C(CCN1CCC(CC 112

Estriol is an antagonist of the G-protein coupled estrogen receptor in estrogen receptor-C1=C(C=C2C(=C 197

Famciclovir(Famvir) is a guanine analogue antiviral drug used for the treatment of varioN1=C(N=C2C(= 199

Fenbendazole(Panacur) is a broad spectrum benzimidazole anthelmintic used against gasC1=CC=C(C=C1 13

Fluocinolone Acetonide is a corticosteroid that binds to the cytosolic glucocorticoid receC1C(C=C2[C@]( 198

Gallamine triethiodide(Flaxedil) is a cholinergic receptor blocker with an IC50 of 68.0 ± C1(=CC=CC(=C1O 112

Hexestrol binds to ERα and ERβ with EC50 of 0.07 nM and 0.175 nM, respectively. C1=CC(=CC=C1 155

Imatinib is a multi-target inhibitor of v-Abl, c-Kit and PDGFR with IC50 of 0.6 μM, 0.1 μ N1=C(N=C(C=C 10

Itraconazole is a triazole antifungal agent. C1=CC(=CC=C1 10

Lincomycin hydrochloride(Lincocin) is the monohydrated salt of lincomycin, a substanc[C@@H]1([C@@ 200

Loperamide HCl is an opioid-receptor agonist with an ED50 of 0.15 mg/kg. C1(=C(C=CC(= 42

Manidipine (Manyper) is a lipophilic, third-generation, highly vasoselective dihydropyrid C1(=CC(=CC=C 199

Manidipine 2HCl is a HCl salt form of Manidipine, which is a calcium channel blocker witC1(=CC(=CC=C 30

Milrinone is a potent and selective phosphodiesterase 3 inhibitor with an IC50 of 0.42 μM N1=CC=C(C=C1 198

Mitoxantrone HCl is a classic folic acid antagonist. C1(=CC(=C2C( 172

Moroxydine HCl is a synthetic antiviral compound chemically belonging to the series of C1(OCCN(C1)C( 202

Mycophenolic acid is an immunosuppressant agent used to prevent rejection in organ trC12=C(C(=C(C 199

Nateglinide is an insulin secretagog agent that lowers blood glucose levels by stimulatinC1[C@H](CC[C 198

Nitrendipine is a dihydropyridine calcium channel blocker with an IC50 of 95 nM. C1=CC(=CC(=C1 199

Novobiocin(Albamycin) is a very potent bacterial DNA gyrase and human organic anion [C@H]1([C@H] 200

Olanzapine is a high affinity for 5-HT2 serotonin and D2 dopamine receptor antagonist. N1C2=C(C(=NC 201

Olopatadine hydrochloride(Opatanol) is a histamine blocker and mast cell stabilizer wit C1(=C\CCN(C) 200

Oxymetazoline hydrochloride is an α1 and α2 adrenergic receptor agonist. C1(=C(C(=C(C( 198

Ozagrel is a potent and selective thromboxane A2 synthetase inhibitor with an IC50 of C1=C(C=CC(=C 201

Pancuronium dibromide is a competitive acetylcholine antagonist with an IC50 of 5.5 ± [C@H]1([C@H]( 136

D-Pantothenic acid is a water-soluble vitamin and an essential nutrient for for many ani OCC([C@](C(NC 200

Phenoxybenzamine HCl is a non-specific, irreversible alpha antagonist with an IC50 of C1(=CC=C(C=C 199

Propafenone HCl is a classic anti-arrhythmic medication, which treats illnesses associatC1=CC=CC(=C 182

Quinine hydrochloride dihydrate is a natural white crystalline alkaloid having antipyretic (C1(=CC2=C(C=C 199

Racecadotril is a peripherally acting enkephalinase inhibitor with an IC50 of 4.5 μM C1=CC=C(C=C1 57

Ribavirin (Copegus) is an anti-viral agent indicated for severe RSV infection (individually)O1[C@@H]([C@ 200

Roxithromycin is a semi-synthetic macrolide antibiotic. It is used to treat respiratory trac[C@@]1([C@H] 199

Scopolamine hydrobromide is a competitive muscarinic acetylcholine receptor with an I O(C([C@@H](C1 200

Sotalol (Betapace) is a non-selective beta blocker and a potassium channel blocker wit C1(=CC=C(C=C1 200

Spectinomycin HCl is a new parenteral antibiotic prepared from Streptomyces spectabili[C@H]1([C@@H] 244

Tenoxicam is a good HO. radicals scavenger with an IC50 of 56.7 μM C1=CC=C(N=C1 201

Vardenafil HCl Trihydrate is a new type PDE inhibitor with IC50 of 0.7 and 180 nM for C1(N(CCN(C1) 200

Xylazine HCl is α2 class of adrenergic receptor agonist. C1(=CC=C(C(= 194

Maprotiline hydrochloride (Deprilept, Ludiomil, Psymion) is a selective noradrenalin re-upC1(=CC=C2C(= 200

Naphazoline hydrochloride (Naphcon) is an ocular vasoconstrictor and imidazoline der C12(=CC=CC(= 68

Epinephrine Bitartrate is alpha- and beta-adrenergic receptor stimulator. C1(=C(C=CC(= 201

L-Adrenaline belongs to a group of the compounds known as catecholamines. C1(=C(C=CC(= 21

Phenytoin sodium is an inactive voltage-gated sodium channel stabilizer. N1(C(C(N=C1[O 116

Phenytoin is an inactive voltage-gated sodium channel stabilizer. C1(NC(NC1=O) 198

Alizarin strongly inhibits P450 isoform CYP1A1, CYP1A2 and CYP1B1 with IC50 of 6. C1=CC=C2C(=C 199

Methacycline HCl is a tetracycline antibiotic. C1(=CC(=C2C(= 10

Ciclopirox (Penlac) is a synthetic antifungal agent. C1CCCC(C1)C2 202

Dopamine hydrochloride (Inotropin) is a catecholamine neurotransmitter present in a wiC1(=C(C=CC(= 200

Asaraldehyde is a natural COX-2 inhibitor, exhibiting 17-fold selectivity over COX-1. C1(=C(C=C(C( 198

Ascorbyl palmitate is an ester formed from ascorbic acid and palmitic acid creating a fatO1[C@@](C(=C 200

Ritodrine hydrochloride (DU 21220; Miolene; NSC 291565; Pre-Par) is a hydrochloride salC1(=C(C=CC(=C 200

Isoconazole nitrate (Travogen) is an azole antifungal reagent. C1(=C(C=C(C(= 85

Econazole nitrate (Spectazole) is an imidazole class antifungal medication. C1(=C(C=C(C(= 200

Miconazole (Monistat) is an imidazole antifungal agent. C1(=CC=C(C(=C 199

Secnidazole (Flagentyl) is a nitroimidazole anti-infective. N1(CC(C)O)C(= 199

Acetanilide is an aniline derivative and has possess analgesic. CC(=O)NC1=C 199

Clomipramine hydrochloride (Anafranil) is a hydrochloride salt of clomipramine which isC(N1C2=C(CCC 199

Phenformin hydrochloride is a hydrochloride salt of phenformin that is an anti-diabetic dC1(=CC=C(C=C 198

Ceftiofur hydrochloride is a hydrochloride of ceftiofur that is a broad spectrum cephalospN12([C@](SCC( 199

Scopine is the metabolite of anisodine, which is a α1-adrenergic receptor agonist and us[C@]12([C@@]3 199

Tiotropium Bromide hydrate is a monohydrate of tiotropium bromide (Spiriva; Tiova; BA [Br-].O.[C@]1 16

Scopine HCl is the hydrochloride of Scopine, which is the metabolite of anisodine, whichCl.[C@]12([C@ 198

Trospium chloride (Sanctura) is a competitive muscarinic cholinergic receptor antagonis[Cl-].[C@]12( 95

Tolterodine tartrate (Detrol LA) is a tartrate salt of tolterodine that is a competitive muscC1(=C(C=C(C( 199

Sulbactam sodium (Unasyn) is an irreversible β-lactamase inhibitor. C1(C[C@@]2(N1[ 11

Azelastine hydrochloride (Astelin) is a potent, second-generation, selective, histamine aC1(=CC=C2C(= 200

5-Aminolevulinic acid is an intermediate in heme biosynthesis in the body and the univerNCC(CCC(O)=O 202

Daphnetin, a natural coumarin derivative, is a protein kinase inhibitor, inhibits EGFR, C1(=CC=C2C(= 202

Clarithromycin (Biaxin, Klacid) is a macrolide antibiotic and a CYP3A4 inhibitor. [C@@]1([C@H] 10

Rosiglitazone (Avandia) is a potent antihyperglycemic agent and a potent thiazolidinedioC1=CC=NC(=C1 201

Terbinafine hydrochloride (Lamisil) is a hydrochloride salt of terbinafine that is a synth C1(=CC2=C(C=C 201

Cortisone acetate (Cortone) is an acetate salt form of cortisone that is a steroid hormonC1C(C=C2[C@]( 17

Clomifene citrate (Serophene) is a selective estrogen receptor modulator. C1(=CC=CC(=C 200

Cloxacillin Sodium is a sodium salt of cloxacillin that is a penicillinase-resistant, acid res[C@H]1(C(N2[C 115

Amoxicillin Sodium is a moderate- spectrum, bacteriolytic, β-lactam antibiotic. C1(=CC=C(C=C1 201

Isoprenaline is a non-selective β-adrenoceptor, inhibits the 3H-inositol phosphate accu C1(=C(C(=CC(= 201

Medroxyprogesterone acetate is a progestin, a synthetic variant of the human hormone C1C(C=C2[C@]( 31

Phenylephrine hydrochloride is a selective α1-adrenergic receptor agonist. C1(=CC=CC(=C1 201

Tetracaine hydrochloride (Pontocaine) is a hydrochloride salt form of tetracaine which is C1(=C(C=CC(= 199

Tetracycline hydrochloride is a hydrochloride salt of tetracycline that is a broad-spectrumC1(=CC=C2C(=C 10

Xylometazoline is an α-adrenoceptor agonist commonly used as nasal decongestant, exC1(=C(C=C(C(= 96

Phenacetin is a non-opioid analgesic without anti-inflammatory properties. C1=C(C=CC(=C 200

Zidovudine (Retrovir) is a reverse transcriptase inhibitor. N1C(N(C=C(C1 10

Quinapril hydrochloride (Accupril) is the hydrochloride salt of quinapril that is an angio C1(=CC=CC(=C 37

Thiamphenicol is an antimicrobial antibiotic and a methyl-sulfonyl analogue of chlorampC1=C(C=CC(=C1 10

Clobetasol propionate is a anti-inflammatory corticosteroid used to treat various skin disC1C(C=C2[C@]( 199

Brompheniramine hydrogen maleate is a histamine H1 receptors antagonist. C1(C(CCN(C)C 10

Dimethyl fumarate is a promising novel oral therapeutic option shown to reduce disease acC(/C=C/C(=O)O 201

Miglitol is an oral anti-diabetic drug. [C@@H]1(CN([ 14

Pioglitazone (Actos) is a selective peroxisome proliferator-activated receptor gamma stiC1(=CC=C(N=C 42

Tolvaptan is a selective, competitive arginine vasopressin receptor 2 antagonist with anC(C1=C(C=C(C 200

Pramiracetam is a more potent nootropic drug derived from piracetam. C(C(=O)NCCN( 200

Clindamycin palmitate HCl is a water soluble hydrochloride salt of the ester of clindamycC1(C(OC(C(C1 200

L-Thyroxine is a synthetic form of thyroxine and a hormone replacement drug. C1(=C(C=C(C=C 199

Gliclazide (Diamicron) is a whole-cell beta-cell ATP-sensitive potassium currents block C1=C(C=CC(=C 200

Acemetacin is a non-steroidal anti-inflammatory drug and a glycolic acid ester of indomeCC1N(C2=C(C= 10

Tioxolone is a metalloenzyme carbonic anhydrase I inhibitor with a Ki of 91 nM. C1(=CC=C2C(= 202

Dehydroepiandrosterone(DHEA) is a 19-carbon endogenous natural steroid hormone.PC1[C@@H](CC2[ 10

Idebenone is a synthetic analog of coenzyme Q10 (CoQ10) and a brain stimulant. C1(C(=C(C(C( 200

Mifepristone is a remarkably active antagonist of progesterone receptor and glucocorticC1C(C=C2C(C1) 200

Buflomedil is a vasodilator used to treat claudication or the symptoms of peripheral arterC1(=CC(=C(C( 90

Fluocinonide (Vanos) is a potent glucocorticoid steroid used topically as anti-inflammat C1C(C=C2[C@]( 200

Lonidamine is an orally administered small molecule hexokinase inactivator with an IC5C1=CC=C2C(=C 199

Ribitol is a crystalline pentose alcohol and is formed by the reduction of ribose which is OC[C@H]([C@H 203

Clorsulon is used in the treatment of Fasciola hepatica infections in calves and sheep. C1(=C(C=C(C(= 199

Arecoline is a muscarinic acetylcholine receptor agonist. N1(CCC=C(C1) 199

Noradrenaline bitartrate monohydrate is a direct alpha-adrenergic receptors stimulator. C1(=C(C=CC(=C 189

TAK-733 is a potent and selective MEK allosteric site inhibitor for MEK1 with IC50 of N1(C=NC2=C(C 200

MG-132 is an inhibitor of proteasome with IC50 of 100 nM, and also inhibits calpain wit C1=CC=C(C=C1 199

GSK256066 is a selective PDE4B(equal affinity to isoforms A-D) inhibitor with IC50 of C1=CC(=CC(=C 10

AZD5438 is a potent inhibitor of CDK1/2/9 with IC50 of 16 nM/6 nM/20 nM. It is less po C1=C(C=CC(=C 199

PP-121 is a multi-targeted inhibitor of PDGFR, Hck, mTOR, VEGFR2, Src and Abl with C1(=CN=C2C(= 200

Omecamtivmecarbil (CK-1827452) is a specific cardiac myosinactivator and a clinical drug C1(=NC=C(C=C 199

OSI-027 is a selective and potent dual inhibitor of mTORC1 and mTORC2 with IC50 of N1C=NN2C(C=1 44

Fostamatinib (R788), a prodrug of the active metabolite R406, is a Syk inhibitor with IC50C1(=C(C(=CC( 199

LY2603618 is a selective Chk1 inhibitor with potential anti-tumor activity. C1=C(C(=CC(= 29

Tubastatin A is a potent and selective HDAC6 inhibitor with IC50 of 15 nM. It is select C1(=C(C=CC(= 198

PNU-120596 is a positive allosteric modulator of α7 nAChR with EC50 of 216 nM. C1(=C(C=C(C( 198

GW3965 is a potent, selective LXRagonist for hLXRα and hLXRβ with EC50 of 190 and C1(=C(C=C(C= 200

URB597 is a potent, orally bioavailable FAAH inhibitor with IC50 of 4.6 nM, with no activC1=C(C=C(C=C 200

BMS-378806 selectively inhibits the binding of HIV-1 gp120 to the CD4receptor with EC5C1=CNC2C(=C1 199

NPS 2143 is a novel potent and selective antagonist of Ca(2+) receptor with IC50 of 43C1(=CC=CC(=C 200

DCC-2036 is a conformational control Bcr-Abl inhibitor for Abl1(WT) and Abl1(T315I) w C1(=C(C=C(C= 200

CCT128930 is a potent, ATP-competitive and selective inhibitor of Akt2 with IC50 of 6 nMN1=CN=C2C(=C 198

A66 is a potent and specific p110α inhibitor with IC50 of 32 nM, >100 fold selectivity fo C1SC(=NC=1C2 200

TAK-875 is a selective GPR40 agonist with EC50 of 14 nM, 400-fold more potent than olC1(=C(C=C(C= 187

NU7441 is a highly potent and selective DNA-PK inhibitor with IC50 of 14 nM and also iC1=C(OC2=C( 10

SNX-2112 selectively binds to the ATP pocket of HSP90α and HSP90β with Ka of 30 n C1=CC(=CC(=C 200

PF-04929113 (SNX-5422) is a potent and selective HSP90 inhibitor with Kd of 41 nM anN1(C2=C(C(=N 199

GSK2126458 is a highly selective and potent inhibitor of p110α/β/δ/γ, mTORC1/2 with C1(C(=CC(=CC 197

5-hydroxymethyl tolterodine (PNU 200577) is a new muscarinic receptor antagonist withC1=CC=CC=C1[ 199

MK-0752 is a moderately potent γ-secretase inhibitor, which reduces Aβ40 production wC1=CC(=CC=C1 200

WYE-125132 is a highly potent, ATP-competitive mTOR inhibitor with IC50 of 0.19 nM; C1(=NC(=NC2= 200

ICG-001 antagonizes Wnt/β-catenin/TCF-mediated transcription and specifically binds to C1=CC=C(C=C1 182

WAY 100635 is a potent and selective 5-HT1A receptor agonist with pIC50 of 8.87, exhibC1(N2CCN(CC2 157

Clinofibrate inhibits hydroxymethylglutaryl coenzyme A reductase (HMGCR) with IC50 of 0.C1CC(CCC1)(C 200

Ciprofibrate is a peroxisome proliferator-activated receptor agonist. C1=C(C=CC(=C1 200

PF-3845 is a potent, selective and irreversible FAAH inhibitor with Ki of 230 nM, showinC1(=CN=C(C=C 199

S/GSK1349572 (GSK1349572) is a two-metal-binding HIV integrase inhibitor with IC50 C1(=CC(=C(C= 200

A-674563 is an Akt1 inhibitor with Ki of 11 nM, modest potent to PKA and >30-fold selecC1=CC=CC(=C 200

AS-252424 is a novel, potent PI3Kγ inhibitor with IC50 of 30 nM with 30-fold selectivity C1(=CC(=C(C= 199

PF-00562271 is the benzenesulfonate salt of PF-562271, which is a potent, ATP-competitiC1(=NC(=C(C= 21

Trametinib (GSK1120212) is a highly specific and potent MEK1/2 inhibitor with IC50 of 0.C1(N(C(=C2C( 162

A 922500 is an inhibitor for human and mouse DGAT-1 with IC50 of 7 nM and 24 nM, respeC1=CC=C(C=C1 200

BRL-15572 is a 5-HT1D receptor antagonist with pKi of 7.9, also shows a considerable afC1(=CC=C(C=C 200

Flavopiridol competes with ATP to inhibit CDKs including CDK1, CDK2, CDK4 and CDK6 witC1(=C(C(=C2C( 200

Ibrutinib is a potent and highly selective Btk inhibitor with IC50 of 0.5 nM, modestly C1=NC(=C2C(= 199

AS-604850 is a selective, ATP-competitive PI3Kγ inhibitor with IC50 of 250 nM, over 80-C12=C(C=CC(= 199

CAY10505 is dehydroxyl of AS-252424, which is a PI3Kγ inhibitor with IC50 of 33 nM. C1(=CC=C(C=C 200

CHIR-124 is a novel and potent Chk1 inhibitor with IC50 of 0.3 nM. It shows 2,000-fold sC1(C(=C(C2=C 16

KW-2478 is a nonansamycin HSP90 inhibitor with IC50 of 3.8 nM. Phase 1/2 C1=C(C(=C(C( 200

NVP-BSK805 is a potent and selective ATP-competitive JAK2 inhibitor with IC50 of 0.5 C1(=CC=C2C(= 200

R547 is a potent ATP-competitive inhibitor of CDK1/2/4 with Ki of 2 nM/3 nM/1 nM. It is N1=C(N=CC(=C 135

WAY-600 is a potent, ATP-competitive and selective inhibitor of mTOR with IC50 of C12=C(C=CC( 44

ADX47273 is a potent and specific mGlu5 positive allosteric modulator(PAM) with EC50 C1(=CC=C(C=C 200

BMY 7378 is a multi-targeted inhibitor of α2C-adrenoceptor and α1D-adrenoceptor with pKC1(=CC=C(C(= 200

TG101209 is a selective JAK2 inhibitor with IC50 of 6 nM, less potent to Flt3 and RE C1=C(C=C(C=C 200

Resminostat dose-dependently and selectively inhibits HDAC1/3/6 with IC50 of 42.5 n C1=C(C=CC(=C 200

XL335 is a potent, selective FXR agonist with EC50 of 4 nM, highly selective versus o C1=CC=C2C(=C 75

GDC-0980 (RG7422) is a potent, class I PI3K inhibitor for PI3Kα/β/δ/γ with IC50 of 5 n C1(=CN=C(N=C 40

A-769662 is a potent, reversible AMPK activator with EC50of 0.8 μM, little effect on GPC1(=CC=C(C=C 199

RS-127445 is a selective 5-HT2B receptor antagonist with pKi of 9.5 and pIC50 of 10.4, eC1=CC(=C2C(= 199

CH5132799 inhibits class I PI3Ks, particularly PI3Kα with IC50 of 14 nM; less potent to N1=C(N=CC(=C 31

KX2-391 (KX01), the first clinical Src inhibitor (peptidomimetic class) that targets the peC1=C(C=CC(= 199

GSK1838705A is a potent IGF-1R inhibitor with IC50 of 2.0 nM, modestly potent to IR and N1=C(N=C2C(= 200

YO-01027 (Dibenzazepine, DBZ) is a dipeptidic γ-secretase inhibitor with IC50 of 2.6 C1(=CC(=CC(= 200

Geldanamycin is a natural existing HSP90 inhibitor with Kd of 1.2 μM, specifically disru C1(C(C=C2NC( 199

LY411575 is a potent γ-secretase inhibitor with IC50 of 0.078 nM/0.082 nM (membrane/ceC1(=CC(=CC(= 200

CP-91149 is a selective glycogen phosphorylase (GP) inhibitor with IC50 of 0.13 μM in tC1(=CC=C2C(= 200

TAK-901 is a novel inhibitor of Aurora A/B with IC50 of 21 nM/15 nM. It is not a potent inC1N(CCC(C1)N 200

AMG 900 is a potent and highly selective pan-Aurora kinases inhibitor for Aurora A/B/C C1=CC(=C(N=C 198

ZM 336372 is a potent and selective c-Raf inhibitor with IC50 of 70 nM, 10-fold selecti C1(=CC=CC(=C 200

Nilvadipine is a potent calcium channel blocker with an IC50 of 0.03 nM. C1(NC(=C(C(C= 199

JTC-801 is a selective opioid receptor-like1 (ORL1) receptor antagonist with IC50 of 94 C1(=CC=C(C(= 200

PH-797804 is a novel pyridinone inhibitor of p38α with IC50 of 26 nM; 4-fold more sele C1(=C(C=CC(= 201

PF-299804 is a potent, irreversible pan-ErbB inhibitor, mostly to EGFR with IC50 of 6 C(/C=C/C(NC1 40

AG-1478 (Tyrphostin AG-1478) is a selective EGFR inhibitor with IC50 of 3 nM, almost C1=C2C(=CC(= 79

SB415286 is a potent GSK3α inhibitor with IC50/Ki of 78 nM/31 nM with equally effectivC1(C(=C(C(N1) 200

Crenolanib (CP-868596) is a potent and selective inhibitor of PDGFRα/β with Kd of 2. C1=CC(=C2C(= 200

AZ3146 is a selective Mps1 inhibitor with IC50 of ~35 nM, contributes to recruitment of C1(=CC(=C(C= 61

SCH 900776 is a selective Chk1 inhibitor with IC50 of 3 nM. It shows 500-fold selectivi C12N=C(C(=C( 10

TG-101348 (SAR302503) is a selective inhibitor of JAK2 with IC50 of 3 nM, 35- and 33 C1(=CC=C(C=C 190

PAC-1 is a potent procaspase-3 activator with EC50 of 0.22 μM and the first small moleC1(CN2CCN(CC 198

PHA-767491 is a potent ATP-competitive dual Cdc7/CDK9 inhibitor with IC50 of 10 nM anC1=NC=CC(=C1 112

PF-04691502 is an ATP-competitive PI3K(α/β/δ/γ)/mTOR dual inhibitor with Ki of 1.8 n N1=C(N=C2C(= 32

CCT137690 is a highly selective inhibitor of Aurora A, Aurora B and Aurora C with IC50 C1(=CN=C2C(= 10

AZ628 is a new pan-Raf inhibitor for BRAF, BRAFV600E, and c-Raf-1 with IC50 of 105 C1(=CC=CC(=C 199

AMG 458 is a potent c-Met inhibitor with Ki of 1.2 nM, ~350-fold selectivity for c-Met th N1(N(C(C(=C1 38

Anacetrapib (MK0859) is a potent, selective, reversible rhCETP and mutant CETP(C13S)C1=C(C=C(C(=C 199

NVP-BGT226 is a novel class I PI3K/mTOR inhibitor for PI3Kα/β/γ with IC50 of 4 nM/6 C(/C=C\C(=O) 46

GW788388 is a potent and selective inhibitor of ALK5 with IC50 of 18 nM, also inhibits TGFC(C1C=CC(=CC 77

PHA-848125 is a potent, ATP-competitive CDK inhibitor for CDK2 with IC50 of 45 nM. It C12CC(C3=C(C 199

ARRY-380 is a potent and selective HER2 inhibitor with IC50 of 8 nM, equipotent agai N1C=NC(=C2C= 200

ARRY334543 is a selective and potent ErbB1(EGFR) and ErbB2(HER2) inhibitor with ICC12=C(C(=NC= 12

Wortmannin is a PI3K with IC50 of 3 nM, first described PI3K inhibitors, but little sel C1(C2C3[C@]( 200

CUDC-907 is a dual PI3K and HDAC inhibitor for PI3Kα and HDAC1/2/3/10 with IC50 ofC1=NC(=NC=C1 200

Canagliflozin is a highly potent and selective SGLT2 inhibitor for hSGLT2 with IC50 of 2[C@H]1([C@H] 200

NVP-BVU972 is a selective and potent Met inhibitor with IC50 of 14 nM. C1C(=NN2C(C= 199

MK-2048 is a potent inhibitor of integrase (IN) and INR263K with IC50 of 2.6 nM and 1.5N1N(C(C2=C(C 19

3-Methyladenine is a selective PI3K inhibitor for Vps34 and PI3Kγ with IC50 of 25 μM anN1=CN=C2N(C= 26

Dinaciclib (SCH727965) is a novel and potent CDK inhibitor for CDK2, CDK5, CDK1 and C1C[C@H](N(C 199

Dovitinib Dilactic acid (TKI258 Dilactic acid) is the Dilactic acid of Dovitinib, which N1(C(C(=C(C2 157

MK-5108 (VX-689) is a highly selective Aurora A inhibitor with IC50 of 0.064 nM and is 22N1=C(C=CC=C1 199

Dalcetrapib (JTT-705) is a rhCETP inhibitor with IC50 of 0.2 μM that increases the pla C1=CC=CC(=C1 200

SB705498 is a TRPV1 antagonist for hTRPV1, antagonizes capsaicin, acid, and heat acN(C(=O)N[C@H 200

C12=C(C(C3=C 199

Nocodazole is a rapidly-reversible inhibitor of microtubule polymerization, also inhibit C(NC1=NC2C(N 23

CPI-613, a lipoate analog, inhibits mitochondrial enzymes pyruvate dehydrogenase (PDS(CCC(SCC1= 200

PF-5274857 is a potent and selective Smoothened (Smo) antagonist, inhibits Hedgehog (C1(=CC(=C(N= 212

GW842166X is a potent and highly selective agonist of cannabinoid receptor CB2 receptC1(N=C(C(=CN 44

M344 is a potent HDAC inhibitor with IC50 of 100 nM and able to induce cell differentiatC1(=CC=C(C=C 201

I-BET151 (GSK1210151A) is a novel selective BET inhibitor for BRD2, BRD3 and BRD4 wC1(=C(C=C2C( 199

RITA (NSC 652287) induces both DNA-protein and DNA-DNA cross-links with no detectabO1C(=CC=C1C2 198

GW4064 is an agonist of farnesoid X receptor (FXR) with EC50 of 65 nM. C1=CC=C(C=C1 200

AZD2014 is a novel mTOR inhibitor with IC50 of 2.8 nM; highly selective against multiplC1=C(N=C2C(= 82

TAK-285 is a novel dual HER2 and EGFR(HER1) inhibitor with IC50 of 17 nM and 23 nM, C12=C(C(=NC= 200

A-803467 is a selective NaV1.8 channel blocker with IC50 of 8 nM, blocks tetrodotoxin-O1C(=CC=C1C2 201

Laquinimod is a potent immunomodulator. N1(C(C(=C(C2 170

Tofacitinib is a novel inhibitor of JAK3 with IC50 of 1 nM, 20- to 100-fold less potent a N1=CN=C2C(=C 198

Istradefylline is a selective adenosine A2A receptor (A2AR) antagonist with Ki of 2.2 nMN1(C(=NC2N(C 15

Sotrastaurin is a potent and selective pan-PKC inhibitor, mostly for PKCθ with Ki of 0.2 N1C(C(=C(C1= 198

Torcetrapib is a CETP inhibitor with IC50 of 37 nM, elevates HDL-C and reduces nonH C12=C(N([C@@H 199

Sofosbuvir (PSI-7977, GS-7977) is a HCV NS5B polymerase inhibitor for the treatment of[C@H]1([C@H] 100VU0357121 is a novel positive allosteric modulator (PAM) of mGlu5 with EC50 of 33 nM, C1=C(C=CC(=C 199

WP1066 is a novel inhibitor of JAK2 and STAT3 with IC50 of 2.30 μM and 2.43 μM in C(/C(=C/C1C= 202

Lonafarnib is an orally bioavailable FPTase inhibitor for H-ras, K-ras-4B and N-ras with C1CC2=C([C@H 198

AZD4547 is a novel selective FGFR inhibitor targeting FGFR1/2/3 with IC50 of 0.2 nM/ C1(=CC(=CC(= 198

Galeterone is a selective CYP17 inhibitor and androgen receptor (AR) antagonist with I [C@]12(C(C3C 61

Sirtinol is a specific SIRT1 and SIRT2 inhibitor with IC50 of 131 μM and 38 μM, respectiC(C1C(=CC=CC 58

CEP33779 is a selective JAK2 inhibitor with IC50 of 1.8 nM, >40- and >800-fold versu C1(=CC=CC(=C 201

Dabrafenib (GSK2118436) is a mutant BRAFV600 specific inhibitor with IC50 of 0.8 nM, wC1(C(=CC=CC= 57

GDC-0068 is a highly selective pan-Akt inhibitor targeting Akt1/2/3 with IC50 of 5 nM/1 C1CN(CCN1C([ 200

MPEP is a selective mGlu5 receptor antagonist with IC50 of 36 nM, exhibits no appreciaC1(C=CC=C(N 201

INK 128 is a potent and selective mTOR inhibitor with IC50 of 1 nM; >200-fold less pot N1=CN=C2C(=C 200

AT101, the R-(-) enantiomer of Gossypol acetic acid, binds with Bcl-2, Bcl-xL and Mcl- C1(C(=C(C=C2C 200

Ciproxifan is a highly potent and selective histamin H3-receptor antagonist with IC50 of C(=O)(C1C=CC 139

MK-2461 is a potent, multi-targeted inhibitor for c-Met(WT/mutants) with IC50 of 0.4-2.5 nM, less potent to Ron, Flt1; 8- to 30-fold greater selectivity of c-Met targets versus FGFR1, FGFR2, FGFR3, PDGFRβ, KDR, Flt3, Flt4, TrkA, and TrkB. Phase 1/2..

BYL719 is a potent and selective PI3Kα inhibitor with IC50 of 5 nM, and minimal effect N1([C@@H](CCC 199

Tyrphostin AG 879 potently inhibits HER2/ErbB2 with IC50 of 1 μM, 100- and 500-fold C(/C(=C/C1C=C 113

Torin 2 is a potent and selective mTOR inhibitor with IC50 of 0.25 nM; 800-fold great N1(C(C=CC2C= 46

CI-994 (Tacedinaline) is an anti-cancer drug which inhibits HDAC1 with IC50 of 0.57 μMC1(=CC=C(C=C 200

AM251 block the inhibitory effects of endocannabinoids and synthetic cannabinoid agonisN1(N=C(C(=C1 72

NVP-TAE226 is a potent FAK inhibitor with IC50 of 5.5 nM and modestly potent to Pyk2,C1(=CC(=C(C= 200

RG108 is an inhibitor of DNA methyltransferase with IC50 of 115 nM, does not cause tr [C@@](N1C(C2 200

OC000459 is a potent and selective D prostanoid receptor 2 (DP2) antagonist with IC50C1(=CC=C2C(= 11

TPCA-1 is an inhibitor of IKK-2 with IC50 of 17.9 nM, inhibits NF-κB pathway, exhibits 22C1(=C(C=C(S1 200

ML133 is a selective potassium channel inhibitor for Kir2.1 with IC50 of 1.8 μM (pH 7.4)C1(=CC2=C(C= 200

JNJ-1661010 is a potent and selective FAAH inhibitor with IC50 of 10 nM (rat) and 12 N1(CCN(CC1)C 98

Clindamycin inhibits protein synthesis by acting on the 50S ribosomal. [C@H]1([C@H] 200

Epiandrosterone is a steroid hormone with weak androgenic activity, is a natural metab C1[C@@H](C[C@ 199

ARN-509 is a selective and competitive androgen receptor inhibitor with IC50 of 16 nM, S=C1N(C(C2(N 37

SAR131675 is a VEGFR3 inhibitor with IC50/Ki of 23 nM/12 nM, about 50- and 10-fold mC12C(N(C(=C( 83

BI-D1870 is an ATP-competitive inhibitor of S6 ribosome for RSK1/2/3/4 with IC50 of C1(=C(C=C(C= 199

Semaxanib (SU5416) is a potent and selective VEGFR(Flk-1/KDR) inhibitor with IC50 oC1=CC=C2C(=C 92

Cathepsin Inhibitor 1 is an inhibitor of Cathepsin (L, L2, S, K, B) with pIC50 of 7.9, 6.7, 6N1(N=C(C=C1C 199

SB269970 HCl is a hydrochloride salt form of SB-269970, which is a 5-HT7 receptor antagoN1([C@H](CCC 28

Baricitinib is a selective JAK1 and JAK2 inhibitor with IC50 of 5.9 nM and 5.7 nM, ~70 CCS(=O)(=O)N 199

BRL 54443 is a 5-HT1E and 5-HT1F receptor agonist with pKi of 8.7 and 9.25, respectivN1C=C(C2C=C( 199

Carfilzomib (PR-171) is an irreversible proteasome inhibitor with IC50 of <5 nM, displayed C1CN(CCO1)CC 69

BML-190 is a selective cannabinoid CB2 receptor inverse agonist with Ki of 435 nM, withC(CC1=C(N(C2 51

MRS2578 is a potent P2Y6 receptor antagonist with IC50 of 37 nM, exhibits insignifica C(NC1=CC(N=C 88

SB271046 is a potent, selective and orally active 5-HT6 receptor antagonist with pKi of 8C12C(C(=C(S1 88

Dizocilpine is a potent N-methyl-D-aspartate (NMDA) receptor antagonist with Ki of 30. C12=C([C@]3( 302

StemRegenin 1 is an AhR inhibitor with IC50 of 127 nM. C1(C=CC(=CC= 200

Golvatinib (E7050) is a dual c-Met and VEGFR-2 inhibitor with IC50 of 14 nM and 16 n C1=C(C=CC(=C 31

IEM 1754 dihydrobroMide is a selective AMPA/kainate receptor blockers for GluR1 andC(CCCCNCC12C 198

CTEP is a novel, long-acting, orally bioavailable allosteric antagonist of mGlu5 recepto C1(=CC=NC(=C 199

VU 0364770 is a positive allosteric modulator(PAM) of mGlu4 with EC50 of 1.1 μM, exhibitC1(C=CC=CN=1 202

ML130 is a potent and selective inhibitor of NOD1 with IC50 of 0.56 μM, inhibits NF-κB aC1=CC=C2C(=C 198

IMD-0354 is an IKKβ inhibitor and blocks IκBα phosphorylation in NF-κB pathway. C1=CC(=CC(=C1 26

VUF10166 is a novel, potent and competitive antagonist for 5-HT3A receptor with Ki of 0.0C1=CC=C2C(=C 79

U-104 is a potent carbonic anhydrase (CA) inhibitor for CA IX and CA XII with Ki of 45.1 N(C(NC1=CC=C 200

WHI-P154 is a potent JAK3 inhibitor with IC50 of 1.8 μM, no activity against JAK1 or N1C=NC(=C2C= 199

Alogliptin is a potent, selective inhibitor of DPP-4 with IC50 of <10 nM, exhibits greate C(C1C(=CC=CC 200

TG100713 is a pan-PI3K inhibitor against PI3Kγ, PI3Kδ, PI3Kα and PI3Kβ with IC50 of C1(C=C(C=CC= 10

T0070907 is a potent and selective PPARγ inhibitor with IC50 of 1 nM, with a >800-fol C(C1C(=CC=C(C 93

GW5074 is a potent and selective c-Raf inhibitor with IC50 of 9 nM, no effect on the C1=C2C(=CC=C1 199

Camostat is a trypsin-like protease inhibitor, inhibits airway epithelial sodium channel ( C1(C(OC2C=CC 200

Prucalopride is a selective, high affinity 5-HT receptor agonist for 5-HT4A and 5-HT4B rC1(C2=C(CCO2 163

MK-801 is a potent, selective and non-competitive NMDA receptor antagonist with Kd o[C@@]12(C3=C( 201

IKK 16 is a selective IκB kinase (IKK) inhibitor for IKK-2, IKK complex and IKK-1 with C1(C=CC(=CC= 200

4-Aminohippuric acid is a typical substrate of organic anion transport systems. C(CNC(=O)C1C 200

Acesulfame potassium is a non-nutritive sweetener. O1(S(NC(C=C1C 197

A-205804 is a potent and selective inhibitor of E-selectin and ICAM-1 expression with C12=C(C(=CN= 199

PJ-34 is a PARP inhibitor with EC50 of 20 nM and is equally potent to PARP1/2. C12C3=C(C(NC 94

PF-562271 is a potent, ATP-competitive, reversible inhibitor of FAK with IC50 of 1.5 nMC1=NC(=C(C=C 199

VU 0361737 is a selective positive allosteric modulator (PAM) for mGlu4 receptor with C1(C=CC=CN=1 201

SB742457 is a highly selective 5-HT6 receptor antagonist with pKi of 9.63, exhibits >100C1C=CC=CC=1 220

Tyrphostin 9 is firstly designed as an EGFR inhibitor with IC50 of 460 μM, but is also C1(C(=C(C=C(C 198

ZM 323881 is a potent and selective VEGFR2 inhibitor with IC50 of <2 nM, almost n C1(C(=CC(=C( 24

ZM 306416 is a VEGFR (Flt and KDR) inhibitor for VEGFR1 with IC50 of 0.33 μM, but alC12C(C=C(C(= 200

GNF-2 is a highly selective non-ATP competitive inhibitor of Bcr-Abl, shows no activi C1=CC(=CC(=C 200

Cobicistat (GS-9350) is a potent and selective inhibitor of CYP3A with IC50 of 30-285 nC1(CN(C(N[C@ 10

CCG 50014 is a potent and selective inhibitor of RGS4 with IC50 of 30 nM. C1(=CC=C(C=C 199

S-Ruxolitinib is the chirality of INCB018424, which is the first potent, selective, JAK1/2 N1C2=C(C(=NC 199

Lumiracoxib is a novel, selective COX-2 inhibitor with IC50 and Ki of 0.14 μM and 0.06 C1=CC=C(C(=C 200

PF-477736 is a selective, potent and ATP-competitive Chk1 inhibitor with Ki of 0.49 n C1=C(C=C2C3= 14

JNJ-7777120 is the first potent and selective non-imidazole histamine H4 receptor antagonC1(=CC=C2C(= 201

Ki16198 is the methyl ester of Ki16425, which is a LPA antagonist and inhibits LPA1- a C1=CC(=CC=C1 196

Pirfenidone is an inhibitor for TGF-β production and TGF-β stimulated collagen productiN1(C2C=CC=CC 199

TEMPOL is a superoxide scavenger that displays neuroprotective, anti-inflammatory andC1(N(C(CC(C1)O 197

Go 6983 is a pan-PKC inhibitor against for PKCα, PKCβ, PKCγ and PKCδ with IC50 of 7C1(=CC=C2C(= 133

WZ811 is a highly potent competitive CXCR4 antagonist with EC50 of 0.3 nM. C1(C=CC(=CC 103

BAY 11-7082 is a NF-κB inhibitor, inhibits TNFα-induced IκBα phosphorylation with IC5C1(S(/C=C/C#N 197

Dapivirine is a non-nucleoside inhibitor for HIV reverse transcriptase with IC50 of 24 nMN1=C(N=CC=C1 103

GW9662 is a selective PPAR antagonist for PPARγ with IC50 of 3.3 nM, with at least 10C1(=CC(=CC=C1 198

ML-161 is an allosteric inhibitor of PAR1 with IC50 of 0.26 μM. C1=CC=C(C(=C 199

HC-030031 is a selective TRPA1 channel blocker that antagonizes AITC- and formalin-evC12N(C=NC(N( 90

IOX2 is a potent inhibitor of HIF-1α prolyl hydroxylase-2 (PHD2) with IC50 of 21 nM, C(CNC(=O)C1C 19

PF-4981517 is a potent and selective inhibitor of CYP3A4 (P450) with IC50 of 0.03 μM,C1(C2C3C(=NC 199

Icotinib is a potent and specific EGFR inhibitor with IC50 of 5 nM, including the C1=C(C=CC=C 199

Salubrinal is a selective inhibitor of eIF2α dephosphorylation and inhibits ER stress-m C12C(NC(NC(N 200

CHIR-99021 HCl (CT99021) is hydrochloride of CHIR-99021, which is a GSK-3α/β inhibitC1(=NC=C(C(= 185

Evacetrapib (LY2484595) is a potent and selective inhibitor of CETP with IC50 of 5.5 n C1(=CC(=CC(=C 20

Apoptosis Activator 2 strongly induces caspase-3 activation, PARP cleavage, and DNA fC12=C(C=CC=C 199

TAK-715 is a p38 MAPK inhibitor for p38α with IC50 of 7.1 nM, 28-fold more selective C(C1C=CC=CC= 200

Pifithrin-α is an inhibitor of p53, inhibiting p53-dependent transactivation of p53-respon C1(CCC2=C(C1 182

Pifithrin-μ is a specific p53 inhibitor by reducing its affinity to Bcl-xL and Bcl-2, and al C1=CC=CC(=C1 198

Carbazochrome is an antihemorrhagic for use in the treatment of hemorrhoids. N1(C(CC2=C/C( 198

Clevudine is an antiviral drug for the treatment of hepatitis B. N1C(C(=CN(C1 199

Rivaroxaban is a direct inhibitor of Factor Xa with Ki and IC50 of 0.4 nM and 0.7 nM, reC1=C(C=CC(=C 199

Paroxetine is an antidepressant drug of the SSRI type. [C@@H]1([C@@ 199

Zanamivir is a neuraminidase inhibitor used in the treatment and prophylaxis of influenz[C@@H]1(C=C(O 10

Zaltoprofen is an inhibitor of Cox-1 and Cox-2 for treatment of arthritis. C1=CC=C2C(=C 201

Pazopanib is a novel multi-target inhibitor of VEGFR1, VEGFR2, VEGFR3, PDGFR, FGFRC1(C(=CC=C(C 201

Amoxicillin is a moderate-spectrum, bacteriolytic, β-lactam antibiotic used to treat bact [C@H]1(C(N2[ 10

Aspirin is a salicylate drug, often used as an analgesic to relieve minor aches and painsC1=CC=CC(=C1 199

Niflumic acid is an inhibitor of cyclooxygenase-2 used for joint and muscular pain. C1(C(=CC=CN= 198

Ciclopirox ethanolamine (Ciclopirox olamine, HOE 296) is a broad-spectrum antifungal aC1(=C(C=C(N( 22

Romidepsin (FK228, depsipeptide) is a potent HDAC1 and HDAC2 inhibitor with IC50 ofS1SC[C@H]2NC 10Rimonabant is a selective antagonist of CB1 with IC50 of 13.6 nM and EC50 of 17.3 N1(N=C(C(=C1 53

Cabazitaxel (XRP6258) is a semi-synthetic derivative of a natural taxoid. [C@@]12([C@@ 119

Bufexamac is a COX inhibitor for IFN-α release with EC50 of 8.9 μM. C1(C=CC(=CC= 201

Lamotrigine is a novel anticonvulsant drug for inhibition of 5-HT with IC50 of 240 μM N1=NC(=NC(=C 39

PMSF is an irreversible serine/cysteine protease inhibitor. C1(C=CC=CC=1 200

Piceatannol, a natural stilbene, is a selective Syk inhibitor and ~10-fold selectivity versuC1(C(=CC(=CC 196

Linagliptin is a highly potent, selective DPP-4 inhibitor with IC50 of 1 nM. C1=CC=C2C(=C 35

Bindarit exhibits selective inhibition against monocyte chemotactic proteins MCP-1 C(C(C)(OCC1= 200

Vildagliptin (LAF-237) inhibits DPP−4 with IC50 of 2.3 nM. C1N([C@@H](C 197

Sitaxentan sodium is a selective endothelin A receptor (ETA) antagonist with IC50 and KC1(=C(C=CS1)S 83

Daunorubicin HCl inhibits both DNA and RNA synthesis and inhibits DNA synthesis withC1(=CC=C2C(= 200

Pravastatin sodium is an HMG-CoA reductase inhibitor against sterol synthesis with IC5C1([C@@H](C= 199

Bepotastine is a non-sedating, selective antagonist of histamine 1 (H1) receptor with pI N1(CCC(CC1)O 199

Fosaprepitant is a water-soluble phosphoryl prodrug for Aprepitant which is a NK1 antagC1(=CC=C(C=C 200

Purmorphamine, which directly binds and activates Smoothened, blocks BODIPY-cyclopamiC12=C(C(NC3 10

Rofecoxib is a COX-2 inhibitor with IC50 of 18 nM. C1=C(C=CC(=C 200

Cinepazide maleate is a maleate salt form of cinepazide which is a vasodilator. N1(CCN(CC1)C 200

Azilsartan is an angiotensin II type 1 (AT1) receptor antagonist with IC50 of 2.6 nM. C1(=NC2C(N1C 199

Otilonium bromide is an antimuscarinic. C(COC(C1C=CC 200

Solifenacin succinate is a urinary antispasmodic of the antimuscarinic class. [C@H]1(N(CCC 10

Bosentan is an endothelin (ET) receptors antagonist for ET-A and ET-B with Ki of 4.7 n C1(C=CC(=CC= 198

Rupatadine is an inhibitor of PAFR and histamine (H1) receptor with Ki of 550 nM and 1C12(C(=CC=CN 16

Azelnidipine is a dihydropyridine calcium channel blocker. C1(=C(C(C(=C 200

Alverine citrate is a drug used for functional gastrointestinal disorders. C1(C=CC=CC=1 10

Azilsartan Medoxomil is a potent angiotensin II type 1 (AT1) receptor antagonist, inhibi C1(=NC2C(N1C 200

Medetomidine is a selective α2-adrenoceptor agonist, with Ki of 1.08 nM, exhibts 1620-fC1(=C(C(C)=C 50

Epinephrine HCl is a hormone and a neurotransmitter. C1(C(=CC(=CC= 200

Diclofenac potassium is a nonsteroidal anti-inflammatory drug taken to reduce inflammatC1(=CC=C(C(=C 206

Diclofenac diethylamine is a nonsteroidal anti-inflammatory drug taken to reduce inflamC1(=CC=C(C(= 200

AmbroxolHCl is a potent inhibitor of the neuronal Na+ channels, inhibits TTX-resistant [C@@H]1(CC[C 10

Naloxone HCl is an opioid inverse agonist drug used to counter the effects of opiate ov C12([C@]34[C 200

Chlorhexidine hydrochloride is an antiseptic effective against a wide variety of gram-n C(NC(NCCCCCC 100Piracetam is a cyclic derivative of the neurotransmitter gamma-aminobutyric acid (GABAN1(C(CCC1)=O 506

Vanillin, 4-hydroxy-3-methoxybenzaldehyde, is a food additive. C(C1C=C(C(=C 10

Caspofungin acetate is a lipopeptide antifungal drug. [C@@H]1(CN2[ 200

Dexmedetomidine is a sedative medication used by intensive care units and anesthetistC1=C(C(=C(C= 199

Foscarnet Sodium inhibits viral RNA polymerases, reverse transcriptase, and DNA polyP(C(=O)[O-])([O 36

Beclomethasone dipropionate is a potent glucocorticoid steroid used for the treatment of C1C(C=C2[C@]( 199

Atovaquone is a medication used to treat or prevent for pneumocystis pneumonia, toxopC1([C@@H]2CC 13

Etravirine (TMC125) is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used foC1(N=C(N=C(C 96

Ulipristal is a selective SPRM for emergency contraception after an unprotected intercou[C@H]1(C2[C@] 174

Indacaterol is an ultra-long-acting β-adrenoceptor agonist with pKi of 7.36. N1(C(C=CC2C( 200

2-Thiouracil is a thiolated uracil derivative that is a known antihyperthyroid agent. N1C(=S)NC(=O 202

Moguisteine is a novel peripheral non-narcotic antitussive drug. C1=C(C(=CC=C 200

Nadifloxacin is a topical fluoroquinolone antibiotic for the treatment of acne vulgaris. C12C(C(=CN3C 55

Pidotimod is an immunostimulant. S1CN([C@@H]( 200

Pyridoxine HCl is a form of vitamin B6. C1(C(=C(C(=C( 199

Vitamin C is a water-soluble vitamin indicated for the prevention and treatment of scurvyOC1[C@@H]([C 198

Sulfathiazole is an organosulfur compound that has been used as a short-acting sulfa dC1(C=CC(=CC= 199

Oxybutynin is an anticholinergic medication used to relieve urinary and bladder difficultiC1(=CC=CC=C1 200

Ornidazole is a 5-nitroimidazole derivative with antiprotozoal and antibacterial propertieC1=C(N(C(=N1)C 200

Trimethoprim is a bacteriostatic antibiotic mainly used in the prophylaxis and treatment ofC1(N=C(C(=CN 199

Biotin is a water-soluble B-vitamin and is necessary for cell growth, the production of f C1(N[C@@]2([C 200

Sulfamerazine is a sulfonamide antibacterial. C1(C=CC(=CC= 200

Sulfamethazine is a sulfonamide antibacterial. C1=C(C=CC(=C 201

Sodium salicylate is used in medicine as an analgesic and antipyretic. C(C1C(=CC=CC= 198

Methylthiouracil is an antithyroid preparation. C1(NC(C=C(N1 196

Methenamine is an antibiotic used for the treatment of urinary tract infection. C1N2CN3CN1C 199

Milnacipran inhibits both norepinephrine transporter (NET) and norepinephrine transpor[C@H]1([C@@] 201

Darifenacin is a selective M3 muscarinic receptor antagonist with pKi of 8.9. C1(=CC=C2C(= 230

Tripelennamine is a widely used H1 antagonist, inhibiting PhIP glucuronidation with IC5C(CN(C1C=CC= 10

Entacapone inhibits catechol-O-methyltransferase(COMT) with IC50 of 151 nM. C(/C(=C/C1C=C 199

Estradiol is a synthetic ester used to treat menopausal symptoms and hormone deficienC1=C(C=C2C(=C 199

Articaine is a dental local anesthetic which contains an additional ester group that is m C1(=C(C(=CS1) 199

Gliquidone is an ATP-sensitive K+ channel antagonist with IC50 of 27.2 nM. C1(C=CC(=CC= 199

Butenafine HCl is a synthetic benzylamine antifungal, works by inhibiting the synthesis oC1(C=CC=C2C= 197

Mepivacaine is a tertiary amine used as a local anesthetic. N1(C(CCCC1)C 10

Ethynodiol diacetate is one of the first synthetic progestogens used in contraceptive pillsC1[C@@H](C=C2 200

Sertaconazole nitrate is a topical broad-spectrum antifungal that is developed to provideC1(=NC=CN1CC( 199

Tylosin tartrate is a macrolide antibiotic approved for the control of mycoplasmosis in po[C@H]1([C@H] 281

Benztropine is a dopamine transporter (DAT) inhibitor with IC50 of 118 nM. C1(C[C@@H]2C 123

Altrenogest is a progestogen structurally related to veterinary steroid trenbolone. C1C(C=C2C(C1) 199

Ampicillin is a beta-lactam antibiotic that is part of the aminopenicillin family. N12([C@H](C(S 99

Anagrelide is a drug used for the treatment of essential thrombocytosis. C1(=C(C(=C2C( 47

Antipyrine is an analgesic and antipyretic agent. N1(N(C(C=C1C 201

Atomoxetine is a selective norepinephrine (NE) transporter inhibitor with Ki of 5 nM, wi C(C[C@H](C1C 198

Betahistine is a histamine H3 receptors inhibitor with IC50 of 1.9 μM. C1(C=CC=CN=1 181

Brinzolamide is a potent carbonic anhydrase II inhibitor with IC50 of 3.19 nM. S1(N(C[C@@H] 200

Carbenicillin is a semi-synthetic penicillin antibiotic which interferes with cell wall synth N12([C@H](C(S 11

Eletriptan is a selective 5-HT1B and 5-HT1D receptor agonist with Ki of 0.92 nM and 3.1N1(C=C(C2C=C 200

Flumequine is a synthetic chemotherapeutic antibiotic, inhibiting topoisomerase II with C12C(C(=CN3C 11

Amitriptyline inhibits serotonin receptor, norepinephrine receptor, 5-HT4, 5-HT2 and s C(CC=C1C2C(C 200

Adrenalone is an adrenergic agonist used as a topical vasoconstrictor and hemostatic, O=C(CNC)C1(C= 202

Azatadine is an histamine and cholinergic inhibitor with IC50 of 6.5 nM and 10 nM, respeC12(C(=CC=CN 200

Octopamine (OA), a biogenic monoamine structurally related to noradrenaline, acts as C1(=C(C=CC(=C 200

Ropinirole a selective dopamine D2 receptors inhibitor with IC50 of 29 nM. N1(C(CC2C(=C 33

N6-methyl adenosine (N6-methyl ATP) is a base modified analog of adenosine and is foOC[C@@H]1[C 10

Ticarcillin is a semisynthetic antibiotic with a broad spectrum of bactericidal activity N12(C(C(SC(C( 199

Azlocillin is an acylampicillin with a broad spectrum against bacteria. N12(C(C(SC(C 200

Azacyclonol, also known as γ-pipradol, is a drug used to diminish hallucinations in psychN1CCC(CC1)C( 198

Reboxetine is a norepinephrine reuptake inhibitor with Ki of 8.2 nM. C1(=CC(=C(C= 200

Triflusal irreversibly inhibits the production of thromboxane-B2 in platelets by acetylati C(C1C(=CC(=CC 201

Trifluoperazine is a dopamine D2 receptor inhibitor with IC50 of 1.1 nM. C1(C(=CC=C2S 183

Catharanthine inhibits nicotinic receptor mediated diaphragm contractions with IC50 of C1=CC=C2C(=C1 199

Meptazinol is a unique centrally active opioid analgesic, which inhibits [3H]dihydromorpC1(C=C(C=CC= 200

Fexofenadine inhibits histamine H1 receptor with IC50 of 246 nM. C1(CCN(CC1)C 198

Amidopyrine is white crystalline substance used as an analgesic and antipyretic. N1(N(C(C(=C1 198

Moclobemide is MAO-A (5-HT) inhibitor with IC50 of 6.1 μM. C(C1C=CC(=CC 197

Schisandrin B is the most abundant dibenzocyclooctadiene lignan present in the traditioC12C3=C(C=C( 10

Betulinic acid, a pentacyclic triterpenoid from Syzigium claviflorum, is a inhibitor of HI [C@@]12([H])[ 10

Triptolide is a diterpene triepoxide, immunosuppresive agent extracted from the Chinese [C@@]123[C@@ 10

Pergolide mesylate is an antiparkinsonian agent which functions as a dopaminergic agonC12(C3[C@@]4 24

Cabozantinib malate is the malate of Cabozantinib, a potent VEGFR2 inhibitor with IC50C12(=C(C(=CC 100Sitagliptin phosphate is a potent inhibitor of DPP-IV with IC50 of 19 nM in Caco-2 cell exC1(=C(C(=CC(= 191

Lithocholic acid is a toxic secondary bile acid, causes intrahepatic cholestasis, has tumo[C@@]12([C@]3 199

Ethambutol is a bacteriostatic antimycobacterial agent, which obstructs the formation of c[C@H](NCCN[C 201

Doxycycline HCL is a tetracycline antibiotic that commonly used to treat a variety of inf Cl.C1=CC(=C2C 10

Pentamidine is an inhibitor of PRL Phosphatases and also inhibits synthesis of C1(C=CC(=CC= 287

Mirabegron is a selective β3-adrenoceptor agonist with EC50 of 22.4 nM. S1C(=NC(=C1) 199

Acebutolol is a β-adrenergic receptors antagonist used in the treatment of hypertensionC1(=C(C=C(C= 201

Ampiroxicam is a nonselective cyclooxygenase inhibitor uesd as anti-inflammatory drugC1(C2=C(S(N( 201

Desloratadine is a potent antagonist for human histamine H1 receptor with IC50 of 51 C1CC(CCN1)=C 83

Hyoscyamine is an AChR inhibitor with IC50 of 7.5 nM. C1(CC2N(C(C1 200

Cyclamic acid in the form of its sodium or calcium salt is one of the most widely used artC1(NS(O)(=O) 200

Ouabain is a selective Na+/K+, -ATPase inhibitor, binds to α2 /α3 subunit with Ki of 41 [C@]12([C@]3 200

Allylthiourea is a metabolic inhibitor that selective inhibits ammonia oxidation. N(C(N)=S)CC= 197

Avanafil is a highly selective PDE5 inhibitor with IC50 of 1 nM. C(NCC1N=CC=C 200

Sodium Picosulfate inhibits absorption of water and electrolytes, and increases their secC(C1=CC=C(C=C 199

Tolcapone is a selective, potent and reversible of catechol-O-methyl transferase (COMT) C1(C(C2=CC=C( 201

Probenecid is a classical competitive inhibitor of organic anion transport, which is als C1=C(C=CC(=C 199

Procaine is an inhibitor of sodium channel, NMDA receptor and nAChR with IC50 of 60 μC1(C(OCCN(CC 201

Homatropine Methylbromide is muscarinic AChR antagonist, inhibits endothelial and s [Br-].[C@]12( 74Homatropine Bromide is muscarinic AChR antagonist, inhibits endothelial and smooth [C@@H]1(C[C@@ 199

Hydroxyzine is a histamine H1-receptor antagonist, inhibits binding of [3H]pyrilamine/ C(N1CCN(CC1) 10

Flavoxate is a muscarinic AChR antagonist with IC50 of 12.2 μM. C12(=C(C(C(= 10

Aclidinium Bromide inhibits human muscarinic AChR M1, M2, M3, M4 and M5 with Ki of C(C(O[C@H]1C 200

Diphemanil Methylsulfate is a quaternary ammonium anticholinergic, it binds muscarini C(=C1CC[N+](C 64

Vitamin D2 is a selective inhibitors of mammalian DNA polymerase A (pol A) with IC50 [C@]12([C@](/ 50

Doxapram HCl inhibits TASK-1, TASK-3, TASK-1/TASK-3 heterodimeric channel functionC1(C(C(CCN2C 200

Dibucaine HCl is a local anesthetics. C12(=C(C=C(N 200

Methazolamide is a carbonic anhydrase inhibitor with Ki of 50 nM, 14 nM and 36 nM for C1(/SC(S(N)(= 198

Norethindrone is a synthetic progestin, which mimic the actions of the endogenous ova [C@@]12([C@@] 201

Olsalazine Sodium is a anti-inflammatory prodrug, which consists of two 5-ASA moietieC1(=CC(=CC=C1 11

Nafcillin sodium reversibly inhibits β-lactamase with Kd of 33 mM. C12(=C(C=CC( 200

Tetrahydrozoline HCl is an imidazoline derivative with alpha receptor agonist activity. N1(=C(NCC1)C 50

Toltrazuril is an antiprotozoal agent that acts upon Coccidia parasites. C1=C(C=CC(=C 199

Pheniramine Maleate is an antihistamine with anticholinergic properties used to treat alleC1(=CC=CC(=C 199

Estradiol cypionate is the 17 β-cyclopentylpropinate ester of estradiol, which inhibits ETC1=C(C=C2C(=C 79Bisacodyl (INN) is a stimulant laxative drug that works directly on the colon to produc C1(=CC=C(C=C 199

Carbimazole is an imidazole antithyroid agent. C1N(C(N(C=1) 204

Valdecoxib is a potent and selective inhibitor of COX-2 with IC50 of 5 nM. C1=CC=CC(=C1 200

Valganciclovir HCl is a prodrug for ganciclovir with antiviral activity used to treat cytomeC(C)(C)[C@@H 199

Nabumetone is a non-steroidal anti-inflammatory drug and its active metabolite inhibits C1(=CC=C2C(= 201

Sertraline HCl is a 5-HT antagonist with Ki of 13 nM. C12(=C([C@@H 201

Spironolactone is a potent antagonist of the androgen receptor with IC50 of 77 nM. C1C(C=C2[C@]( 199

Retapamulin is a topical antibiotic, which binds to both E. coli and S. aureus ribosomes [C@]12(CC[C@@ 200

Methyclothiazide is a substituted benzothiadiazide, used to treat high blood pressure anC1(=C(C=C2C(= 199

Ropivacaine HCl is an anaesthetic agent and blocks impulse conduction in nerve fibres thC1(CC[C@H](N 199

Sodium Nitroprusside is a potent vasodilator working through releasing NO spontaneous[Fe](C#N)(C#N) 229

Ronidazole is an antiprotozoal agent. C1(N(C(=NC=1) 199

Vitamin D3 is a form of vitamin D, binds and activates a H305F/H397Y mutant vitamin C1[C@H](CCC( 200

Escitalopram Oxalate is a selective serotonin (5-HT) reuptake inhibitor (SSRI) with Ki o C12(=CC=C(C= 200

Guanabenz Acetate is an selective agonist of α2a-adrenergic receptor, α2b-adrenergic rC1(=CC=C(C(=C 199

Tinidazole is an anti-parasitic drug. C1N=C(N(C=1[N 198

Guanidine HCl, the crystalline compound of strong alkalinity formed by the oxidation of NC(N)=N.Cl 198

Griseofulvin, a production from some strains of the mold Penicillium griseofulvumam, is abC1=C(C(=C2C( 141

Decamethonium Bromide is a nicotinic AChR partial agonist and neuromuscular blockin[N+](CCCCCCCCC 81

Sodium 4-Aminosalicylate is an antibiotic used to treat tuberculosis via NF-κB inhibition[O-]C(C1=C(C= 198

Sodium nitrite is a myeloperoxidase inhibitor with IC50 of 1.3 μM. [O-]N=O.[Na+] 10

Zinc pyrithione is an antifungal and antibacterial agent disrupting membrane transport C1=CC=C2[N+](= 94

Propranolol HCl is a competitive non-selective beta-adrenergic receptors inhibitor with C1(=CC=C2C(= 199

Mequinol (4-Methoxyphenol) is a depigmentation agent. C1=CC(=CC=C 201

Mefenamic acid is a competitive inhibitor of COX-1 and COX-2. C(C1C(=CC=CC 198

Ticagrelor is the first reversibly binding oral P2Y12 receptor antagonist, also inhibits N1(C2=C(C(N[ 200

Triamterene blocks epithelial Na+ channel (ENaC) in a voltage-dependent manner with C1(=NC2=C(C( 78

Sulfacetamide Sodium is an anti-biotic. C1(=C(C=CC(=C 80

Spiramycin is a 16-membered ring macrolide (antibiotic). C1[C@H](OC(C 118

Lomerizine dihydrochloride is a relatively new L- and T-type calcium channel blocker useC(N1CCN(CC1) 10

Levobetaxolol exhibits a higher affinity at cloned human β1 and β2 receptors with Ki va C1(C=CC(=CC= 200

Loxapine Succinate is a D2DR and D4DR inhibitor, serotonergic receptor antagonist andC1(C2=C(OC3= 199

Flumethasone is a glucocorticoid receptor agonist, this complex binds to the nucleus cauC1C(C=C2[C@]( 199

Halobetasol Propionate is an anti-inflammatory and a dermatologic agent commonly usedC1C(C=C2[C@]( 200

Fenspiride is a bronchodilator with anti-inflammatory properties, inhibiting phosphodies C1(=CC=CC=C1 30

Ifenprodil is an atypical noncompetitive antagonist at the NMDA receptor, it interacts w C1(=CC=C(C=C 199

Pramoxine is a topical local anesthetic that has been shown to have antipruritic propertiCl.C1=C(C=C 200

Difluprednate (difluoroprednisolone butyrate acetate, or DFBA) is a synthetic difluorinateC1(C=C2[C@](C 200

Droperidol is a potent antagonist of dopamine subtype 2 receptors in the limbic system.C1C=CC2=C(C= 200

Dydrogesterone is an orally active progestogen which acts directly on the uterus, prod C1C(C=C2[C@@] 201

Halcinonide is a high potency corticosteroid used in topical preparations as an anti-inf C1C(C=C2[C@]( 200

Dexlansoprazole, the dextrorotatory enantiomer of lansoprazole, is a proton pump inhibiC1(=CC=NC(=C 200

Esmolol is a cardioselective b-blocker, used to control rapid heartbeats or abnormal heaC1(=C(C=CC(= 198

Voglibose is an N-substituted derivative of valiolamine, excellent inhibitory activity a [C@@H]1([C@@ 276

Eprosartan is a nonpeptide angiotensin II receptor antagonist, [3H]-eprosartan binds to C1(=C(C=CC(= 199

Diminazene is a di-amidine also known as 4,4-(1-Triazene–1,3–diyl)bis(benzenecarboximC1(=C(C=CC(= 36

Closantel is gram positive antibacterial activity inhibitor, inhibiting the KinA/Spo0F syst C1(C(C2=CC=C( 10

Closantel is gram positive antibacterial activity inhibitor, inhibiting the KinA/Spo0F syst C1(C(C2=CC=C( 150

Clofazimine is a rhimophenazine dye, originally developed for the treatment of tuberculosN1(C2C(=NC3= 10

Lorcaserin HCl is a selective full agonist of human 5-HT2C receptor with Ki of 15 nM. C1(NC[C@@H](C 198

Estradiol benzoate is an estradiol analog which binds to the human, murine and chicke C1=C(C=C2C(=C 75Dicloxacillin is a β-lactamase resistant penicillin similar to oxacillin and it has activity C1(=C(C=CC=C 195

Desvenlafaxine Succinate is a new serotonin (5-HT) transporter and norepinephrine (NE)C1(C(CCCC1)( 209

Desvenlafaxine is a serotonin (5-HT) and norepinephrine (NE) reuptake inhibitor with KiC1C(CCCC1)(C 140

Triclabendazole is a benzimidazole, it binds to tubulin impairing intracellular transport C1=C(C(=C(C= 200

Isovaleramide is an anticonvulsant molecule isolated from Valeriana pavonii, it inhibits CC(CC(N)=O)C 197

Histamine is an organic nitrogen compound, acts on target cells in mammalian brain via C1(CCN)(=CNC= 16

Pefloxacin Mesylate Dihydrate is the third generation of fluoroquinolone class of antibacC12(=C(C(C(=C 9Sulconazole Nitrate is an imidazole derivative with broad-spectrum antifungal activity. C1(=NC=CN1CC( 199

Tilmicosin is a macrolide antibiotic. [C@@H]1([C@@ 115

Timolol Maleate is a non-selective, beta-adrenergic receptor antagonist for β1/β2 with KC1(C(OC[C@H]( 198

Tolazoline is a non-selective competitive α-adrenergic receptor antagonist. C1(CC2NCCN=2 198

Sodium Phenylbutyrate is a transcriptional regulators that act by altering chromatin struC(CCCC1C=CC= 42

Troxipide is a novel systemic non-antisecretory gastric cytoprotective agent with anti- C1(=CC(=C(C( 61

Levodropropizine possess anti-allergic and inhibits histamine receptor, reduces cough byC1=CC=CC(=C1 198

DeoxyArbutin is a reversible tyrosinase inhibitor, inhibiting tyrosinase activity with IC50 C1=C(C=CC(= 200

Clorprenaline HCl is a β2-receptor agonist, it has a significant expansion of the bronchialC1(=CC=C(C(=C 199

Carprofen inhibits canine COX2 with IC50 of 0.03 mM. OC(C(C1C=CC2 200

Dropropizine is a racemic non-opiate antitussive agent, it is used as a cough suppressaN1(C2=CC=CC= 198

Cyclizine 2HCl is a piperazine derivative with Histamine H1 receptor antagonist activity.C1(CN(CCN1C) 20

Dinitolmide is a broad-spectrum anticoccidial drug. C1(=C(C(=CC(=C 45

Pentoxyverine Citrate is an antitussive (cough suppressant) commonly used for cough aC1(=CC=C(N=C1 100Amprolium chloride is a thiamin antagonist, which prevents carbohydrate synthesis by bC1(=CC=C[N+]( 10

Bacitracin is a mixture of related cyclic polypeptides produced by organisms of the licheC(C)(C)[C@H] 70

Ampicillin Trihydrate is a β-lactam antibiotic, which inhibits bacterial cell-wall synthesi C1(=CC=C(C=C 200

Amfenac Sodium monohydrate is a non-steroidal analgesic anti-inflammatory drug with aC1(C(C2=CC=CC 199

Penfluridol is a highly potent, first generation diphenylbutylpiperidine antipsychotic. C1(C2(CCN(CC 190

Ethamsylate is a haemostatic drug, which inhibits biosynthesis and action of prostaglandC1(C(=CC=C(C= 201

Chlorzoxazone is a muscle-relaxing drug,and a probe for human liver cytochrome P-450C12=C(NC(O1) 200

Bezafibrate is the first clinically tested dual and pan-PPAR co-agonism. C1=C(C=CC(=C 198

Penicillin G Sodium is a β-lactam antibiotic produced by Penicillin spp N12([C@@]([C@ 199

Benzoic acid is a colorless crystalline solid and a simple aromatic carboxylic acid, used C1=CC=CC(=C1 196

Benzethonium chloride is a potent inhibitor of nAChRs, it inhibits α4β2 nAChRs and α7 C1(=C(C=CC(=C 200

Doxycycline is a member of the tetracycline antibiotics group, and is commonly used to trC1(=CC=C2C(=C 194

Doxofylline is a phosphodiesterase inhibitor and a xanthine derivative drug for asthma. N1(C(N(C2=C( 199

Benzydamine hydrochloride is a topical nonsteroidal anti-inflammatory drug (NSAID) with C1(=CC=C2C(= 199

Chlorpropamide is a sulfonylurea class drug for type 2 diabetes mellitus. C1=C(C=CC(=C 198

Cyromazine is a triazine insect growth regulator used as an insecticide and an acaricideN1=C(N=C(N=C 198

Teriflunomide is the active metabolite of leflunomide, inhibiting pyrimidine de novo C1(=CC=C(C=C1 118

Coumarin is a secondary phytochemical with hepatotoxic and carcinogenic properties. O1C(=O)C=CC 198

Choline chloride is a quaternary ammonium salt used as an additive for animal feed. C([N+](C)(C)C)C 200

Cetylpyridinium chloride is a cationic quaternary ammonium compound used as orophary[N+]1(=CC=CC 200

1-Hexadecanol is a fatty alcohol used to make other chemicals. C(CCCCCCCO 280

Sulfaguanidine is a sulfonamide used as an anti-infective agent. C1(S(=O)(=O) 200

Trometamol is a proton acceptor used to treat academia. C(CO)(CO)(CO 16

Uracil is one of the four nucleobases in the nucleic acid of RNA can be used for drug d N1C(C=CNC1= 196

Climbazole is a broad-spectrum imidazole antifungal agent that can provide anti-dandrufC(N1C=CN=C1) 201

Mezlocillin sodium is a penicillin beta-lactam antibiotic used in the treatment of bacteri N1(C(N(CC1)C( 178

Nicardipine is a dihydropyridine calcium-channel blocking agent used for the treatment oC1(=C(NC(=C( 193

Nifuroxazide is a cell-permeable and orally available nitrofuran-based antidiarrheal agenC1=C(OC(=C1)/ 199

Penciclovir is a purine acyclic nucleoside analogue with potent antiviral activity. N1=C(NC2=C( 134

Tiratricol (also known as TRIAC or triiodothyroacetic acid) is a thyroid hormone analoguC1(=CC=C(C=C 160

Domiphen bromide is a quaternary ammonium antiseptic with actions as a cationic surfaC(CCCCCCCCCC 200

Salicylanilides are a group of compounds with a wide range of biological activities includiC(C1C(=CC=CC 201

Sasapyrine (salsalate) is a nonsteroidal oral anti-inflammatory agent. C(C1C(=CC=CC 201

Cyclandelate is an effective inhibitor of rat hepatic acycloenzyme A: cholesterol acyltr C1C(CC(CC1OC 199

Cinchophen is an analgesic drug that is frequently used to treat gout. N1C(=CC(=C2C 200

Betamipron is a chemical compound which is used together with panipenem to inhibit paC1=C(C=CC=C1 201

Chlorquinaldol is an antimicrobial agent used for local antisepsy. N1C(=CC=C2C(= 201

Azaguanine-8 is a purine analogs showing antineoplastic activity by competing with guaC1(NC(C2=C(N 39

Broxyquinoline is an antiprotozoal agent and able to release oxygen free radicals fro C1=C(C(=C2C( 56

Ethacridine lactate monohydrate is an aromatic organic compound based on acridine useC1(=C(C=C2C( 199

Bemegride is a central nervous system stimulant and antidote for barbiturate poisoning.C1(CC(CC(N1) 199

Aminothiazole can be used as a thyroid inhibitor and it has antibacterial activity. C1=CSC(=N1)N 199

Antazoline HCl is a first generation antihistamine, binding to the histamine H1 receptor C1(=CC=C(C=C 132

Tolperisone HCl is an ion channel blocker and centrally-acting muscle relaxant. C1(=C(C=CC(= 198

Florfenicol is a fluorinated synthetic analog of thiamphenicol with broad-spectrum, primariC1(=CC=C(C=C1 200

Verapamil HCl is an L-type calcium channel blocker that is a class IV anti-arrhythmia agCl.C1=C(C=C( 199

Furaltadone HCl is an antibacterial and has distinct curative effect in the treatment of coC1(CN(CCO1)CC 47

Isosorbide is a heterocyclic compound that is derived from glucose, used as a diuretic. [C@@H]1(CO[C@ 198

Dibenzothiophene (DBT) is a model compound for organic sulfur in fossil fuels. C1=CC=C2C(= 200

Cysteamine is an agent for the treatment of nephropathic cystinosis and an antioxidant.C(CS)N.Cl 202

Clofibric acid is a PPARα agonist and hypolipidemic agent. C1=C(C=CC(=C1 200

Chromocarb is a vasoprotectant. C1=CC=C2C(=C 199

Chlorocresol is an activator of ryanodine receptor C1(=C(C=CC(=C 203

Benzocaine is the ethyl ester of p-aminobenzoic acid (PABA), it is a local anesthetic co C1(=CC=C(C=C 199

Montelukast selectively antagonizes leukotriene D 4 (LTD4) by binding to it so that blocN1(C2C=C(Cl) 164

Dirithromycin is a macrolide glycopeptide antibiotic by binding to the 50S subunit of the C1[C@@H]([C@ 13

Sucralose is an artificial and noncaloric sweetener, not broken down by the body. [C@H]1([C@@H 201

Valnemulin HCl is a broad-spectrum bacteriostatic agent inhibiting protein synthesis in [C@]12([C@]3 166

Liothyronine Sodium is the most potent form of thyroid hormone acting on the body to incC1(OC2C=C(C(= 148

Azaperone is a pyridinylpiperazine and butyrophenone neuroleptic drug with sedative and N1(C2=CC=CC= 198

Bosentan is an endothelin (ET) receptor antagonist for ET-A and ET-B with Ki of 4.7 nMN1=C(N=C(C(= 100Benzbromarone is a CYP2C9 inhibitor, it binds to CYP2C9 with Ki value of 19.3 nM. C1(C2=C(C=CC 200

Piperacillin is a semisynthetic, broad-spectrum, ampicillin derived ureidopenicillin anti [C@@H]12(N([ 185

Mevastatin is a competitive inhibitor of HMG-Coenzyme A (HMG-CoA) reductase with a biC1(O[C@@H](C 199

Erythritol is a sugar alcohol used as low-calorie sweetener. [C@H]([C@H]( 196

Mexiletine HCl belongs to Class IB anti-arrhythmic group of medicines, inhibits sodium C1(C(=CC=CC= 199

Fidaxomicin is a narrow spectrum macrocyclic antibiotic that inhibits RNA polymerase s[C@@H]1(/C=C( 94

Fluorometholone Acetate is a synthetic corticosteroid, used in the treatment of steroid [C@]12([C@]([ 200

Oxybuprocaine HCl is a local anesthetic, which is used especially in ophthalmology andC1(C=C(C(=CC 200

Oxaprozin is a non-narcotic, non-steroidal anti-inflammatory drug (NSAID) used to relieve C1(=C(N=C(O1 201

Pilocarpine HCl is a nonselective muscarinic acetylcholine receptor agonist used to pr [C@H]1([C@@H 200

Nithiamide is a non-5-nitroimidazole drugs. C1(SC([N+](=O 197

Zoxazolamine is a centrally acting myorelaxant, which is formerly used as an antispasmoC12=C(N=C(O1 201

Phenazopyridine HCl a local analgesic that has been used in urinary tract disorders. C1(=CC=C(C=C1 200

Primaquine Diphosphate is a transmission-blocking anti-malarial clinically available, di C1(=CC(=C2C( 199

Cepharanthine is a biscoclaurine alkaloid inhibiting tumor necrosis factor (TNF)-α-med C1(=C2C=C3C( 164

Bergapten is a psoralen that can be photoactivated and is capable of crossing-linking DNAC1C(OC2=C(C= 23

Doxylamine succinate competitively inhibits histamine at H1 receptors with substantial seC1(=CC(=CC=C 200

Cetrimonium Bromide is a known component of the broad-spectrum antiseptic cetrimide, CCCCCCCCCCCC 13

Serotonin HCl is a monoamine neurotransmitter and Endogenous 5-HT receptor agonistC1(=CC=C2C(= 202

Sodium Ascorbate is a more bioavailable form of vitamin C that is an alternative to taki [C@@]1(C(C(C( 10

Tranylcypromine is a monoamine oxidase inhibitor, which inhibits CYP2A6 with Ki of Cl.C1=CC=CC( 200

Prucalopride is a selective, high affinity 5-HT4 receptor agonist, inhibiting human 5-HT C(CCC(=O)O)( 199

Bromfenac is a nonsteroidal anti-inflammatory drug (NSAID), which has anti-inflammator[Na+].C(CC1C( 199

Flopropione is a spasmolytic or antispasmodic agent, and acts as a 5-HT1A receptor anC1(=C(C=C(C= 197

Sulfamethoxypyridazine is a long-acting sulfonamide for treatment of Dermatitis herpetifC1(C=CC(=CC= 199

Phenothiazine is a dopamine-2 (D2) receptor antagonist therefore decreases the effect C12=C(SC3C(N 200

Mechlorethamine is the prototype of alkylating agents, it works by binding to DNA, crossClCCN(C)CCCl. 202

Epinastine is an antihistamine and mast cell stabilizer that is used in eye drops to treat alN12(C(C3C(CC 199

C1(=C2C(=NC3 29

C1(=CC=NC(=N 199

C12(=C(C=C(C 119

C1([C@H]2S/C( 200

C12(=C(NC=C1 200

Tamibarotene, also called retinobenzoic acid, is orally active, synthetic retinoid, develo C12=C(C=C(C= 199

EUK 134, a synthetic superoxide dismutase (SOD)/catalase mimetic, exhibits potent antioxiC12=CC=CC(=C( 199

C1(=CC(=CC(=C 200

C1=C(C=CC(=C 200

C1(C(NCC(NC( 200

C1(=NC2C(=CC 198

C12=C(C=C(C= 130

C(C1C(=CC=CC 199

Vinorelbine Tartrate is a semi-synthetic vinca alkaloid, and inhibits mitosis through interaC1(=C(C=C2C( 100

Oxiracetam, a cyclic derivative of gamma-aminobutyric acid (GABA), is used as a nootrN1(CC(O)CC1= 31

C(C1C=C(C=CC 27

C1C[C@@H](C 63

C12=C(C(=NCC 26

C1(=CC(=CC(=C 80

C1(=CC(=C2C(= 65

C1(=CC(=C2C(= 100

C1(=C(C=CC(=C 58

C1(CC[C@]2([C 100

C12(=C(C(C3= 62

NC1(C=CC(C(OC 61

C1=C(C=CC(=C 75

[C@H]1([C@H] 100

C1(=CC=C(C=C 60

C1(=C(C=C(C(= 67

[C@H]1([C@@H] 100

C1(=C(C=CC(= 72

C1(=CC=CC(=C 69

C1(=CC=C2C(= 64

C1(=C(C=CC(= 54

C1=CC(=C(C(= 63

[C@H]1([C@]( 100

C1=CC=C2C(=C 67

Cl.C1=CC=C2C( 82TTNPB (Arotinoid Acid) is a potent RAR agonist, and inhibits binding of [3H]tRA with I C12=C(C=CC(= 43

Tenovin-6 is a small molecule activator of p53 transcriptional activity. CC(C)(C)C1=C 215

3-Aminobenzamide is a competitive PARP inhibitor with Ki of 1.8 μM.

Rotigotine is a dopamine receptor agonist, used in the treatment of Parkinson's disease and restless legs syndrome.

Etizolam is a specific platelet-activating factor (PAF) antagonist with anti-anxiety activity.

Bambuterol HCl is a potent β-adrenoceptor agonist, used in the treatment of asthma.

Carteolol HCl is a β-adrenoceptor antagonist, used for the treatment of glaucoma.

Demeclocycline HCl is a tetracycline antibiotic via inhibition of protein synthesis by bacteria, used for the treatment of bacterial infections.

Meclofenoxate (Centrophenoxine) HCl is an anti-aging drug used to treat the symptoms of senile dementia and Alzheimer's disease, and also inhibits the activity of cholinephosphotransferase.

Nelfinavir Mesylate is a potent HIV protease inhibitor with Ki of 2 nM.

Cyclobenzaprine HCl is a muscle relaxant by blocking pain sensations, used for the treatment of muscle spasms.

Chloroprocaine HCl is a local anesthetic during surgical procedures.

Ospemifene is a non-hormonal selective estrogen receptor modulator (SERM), used for the treatment of dyspareunia.

Anidulafungin (LY303366), an echinocandin derivative, inhibits glucan synthase activity, used as an antifungal drug.

Chlorambucil is a nitrogen mustard alkylating agent, used in the treatment of chronic lymphocytic leukemia.

MetoclopraMide HCl is a selective dopamine D2 receptor antagonist, used for the treatment of nausea and vomiting.

Digoxin is a sodium-potassium pump inhibitor, used in the treatment of atrial fibrillation and heart failure.

Labetalol HCl is a dual antagonist for both selective alpha1-adrenergic and nonselective beta-adrenergic receptors, used in the treatment of high blood pressure.

Diphenidol HCl is a potent antagonist of muscarinic M2 and M3 receptor with pKb of 6.72 and 7.02, respectively, used in the treatment of vomiting and vertigo.Promethazine HCl is a potent histamine H1 receptor antagonist, used as a sedative and antiallergic medication.

Procainamide HCl is a sodium channel blocker, and also a DNA methyltransferase inhibitor, used in the treatment of cardiac arrhythmias.

Meclofenamate Sodium is a dual COX-1/COX-2 inhibitor with IC50 of 40 nM and 50 nM, respectively, used in the treatment of joint, muscular pain, arthritis and dysmenorrhea.

Mupirocin is an isoleucyl t-RNA synthetase inhibitor, used of the treatment of bacterial skin infections.

Dicoumarol is a competitive NADH quinone oxidoreductase (NQO1) inhibitor,and used as an anticoagulant by interfering with the metabolism of vitamin K.

Mefloquine HCl is a blood schizonticide by inhibiting hemozoin formation, used as an antimalarial drug.

JNK-IN-8 is the first irreversible JNK inhibitor for JNK1, JNK2 and JNK4 with IC50 of 4 C(C1C=C(C=CC 100QNZ (EVP4593) shows potent inhibitory activity toward both NF-κB activation and TNF-αN1C=NC(=C2C 14

JZL 184 is the first selective inhibitor of monoacylglycerol lipase (MAGL) with IC50 of 8 N1(CCC(CC1)C 192

SC-514 is an orally active, ATP-competitive IKK-2 inhibitor with IC50 of 3-12 μM, block C1(=CC(=C(S1 200

SN-38 is an active metabolite of CPT-11, inhibits DNA topoisomerase I, DNA synthesis C12C3N(C(C4= 53

MNS is a tyrosine kinases inhibitor, inhibits Syk, Src, p97 with IC50 of 2.5 μM, 29.3 μM C12=C(C=CC(=C 201

(R)-Nepicastat HCl, the R-enantiomer of Nepicastat HCl, is a potent and selective inhib C1(=CC(=C2C( 66Tofacitinib citrate (CP-690550 citrate) is a novel inhibitor of JAK3 with IC50 of 1 nM, 2 N1(=CN=C2C(= 198

Fingolimod (FTY720) is a S1P antagonist with IC50 of 0.033 nM. C1(=CC=C(C=C 200

FK-506 is a 23-membered macrolide lactone, it reduces peptidyl-prolyl isomerase activ [C@H]1(C[C@@ 200

NXY-059 is a novel nitrone, shows efficacious neuroprotective effects. C1(=CC=C(C=C1S 199

PTC124 (Ataluren) selectively induces ribosomal read-through of premature but not no C1=C(C=CC=C1 200

VX-702 is a highly selective inhibitor of p38α MAPK, 14-fold higher potency against th C1=CC(=C(C(=C 200

AP26113 is a potent ALK inhibitor with IC50 of 0.62 nM, demonstrated ability overcomeC1(N=C(C(=CN 85

ARRY-438162 is a potent inhibitor of MEK1/2 with IC50 of 12 nM. C12=C(C=C(C( 199

PP2 is Src family kinase inhibitor, potently inhibits Lck/Fyn with IC50 of 4 nM/5 nM, ~ N1=CN=C2C(=C 198

GDC-0152 is a potent antagonist of XIAP-BIR3, ML-IAP-BIR3, cIAP1-BIR3 and cIAP2-BIRS1N=NC(=C1NC 198

Birinapant is a SMAC mimetic antagonist, mostly to cIAP1 with Kd of <1 nM, less potentCN[C@H](C(N[ 123

VS-5584 (SB2343) is a potent and selective dual PI3K/mTOR inhibitor for mTOR, PI3Kα/N1=CC(=CN=C1 71CZC24832 is the first selective PI3Kγ inhibitor with IC50 of 27 nM, with 10-fold selecti C1(=CN=CC(=C1 13

Z-VAD-FMK is a cell-permeable, irreversible pan-caspase inhibitor, blocks all features oC([C@@H](C(N 93Stattic, the first nonpeptidic small molecule, potently inhibits STAT3 activation and nucl C1(=CC=C2C(=C 198

Embelin, a quinone isolated from the Japanese Ardisia herb, is an inhibitor of X-linked C1(C(C(=CC(C 10

IPI-145 (INK1197) is a novel and selective PI3K δ/γ inhibitor with Ki and IC50 of 23 pM C1=CC=C2C(=C 201

AZD2461 is a novel PARP inhibitor with low affinity for Pgp than Olaparib. Phase 1. C1=CC=C2C(=C 199

GSK2656157 is an ATP-competitive and highly selective inhibitor of PERK with IC50 of 0N/A 76

XL019 is a potent and selective JAK2 inhibitor with IC50 of 2.2 nM, exhibiting >50-fold C1=CC(=CC=C 35

Wnt-C59 (C59) is a PORCN inhibitor for Wnt3A-mediated activation of a multimerized TCFN1=C(C=C(C=C 200

PD168393 is an irreversible EGFR inhibitor with IC50 of 0.70 nM, irreversibly alkylate C1=C(C=C2C(= 200

AZD3514 is a potent and oral androgen receptor downregulator with Ki of 2.2 μM and hasC1=C(C=CC(=C 192

C1(=CC=CC(=C 57Brefeldin A is a lactone antibiotic and ATPase inhibitor for protein transport with IC50 o C1C[C@@H](OC( 14

BMN 673 is a novel PARP inhibitor with IC50 of 0.58 nM. It is also a potent inhibitor o C1=C(C=C2C3= 199

Oprozomib (ONX 0912) is an orally bioavailable inhibitor for CT-L activity of 20S pro N([C@H](C(N[ 200

AZ20 is a novel potent and selective inhibitor of ATR kinase with IC50 of 5 nM, 8-fold s C1=C(N=C(N=C 201

CGI1746 is a potent and highly selective small-molecule inhibitor of the Btk with IC50 ofC1(=NC(=CN(C 100VX-661 is a second F508del CFTR corrector and is believed to help CFTR protein reach C12=CC=C(C=C 192

PP1 is a potent and selective Src inhibitor for Lck/Fyn with IC50 of 5 nM/ 6 nM. N1=CN=C2C(=C 14

EPZ-5676 is an S-adenosyl methionine (SAM) competitive inhibitor of protein methyltranN(C(C)C)(C[C 177

MK-8745 is a potent and selective Aurora A inhibitor with IC50 of 0.6 nM, more than 450-C1(=CC=CC(=C 199

GSK J4 HCl is a cell permeable prodrug of GSK J1, which is the first selective inhibit C1(C2=C(CCN( 185

(+)-Bicuculline is a competitive antagonist of GABAA receptors with IC50 of 2 μM, also [C@]1(C2C(=C 201

[C@@H](CC(O) 33

T0901317 is a potent and selective agonist for both LXR and FXR, with EC50 of ~50 nMC1=CC=CC(=C1) 199

Cilengitide is a potent integrin inhibitor for αvβ3 receptor and αvβ5 receptor with IC50 oN1(C([C@H](N 10

SGC 0946 is a highly potent and selective DOT1L methyltransferase inhibitor with IC50C1(=CC=C(C=C 161

LDK378 is potent inhibitor against ALK with IC50 of 0.2 nM, shows 40- and 35-fold selecC1=CC(=C(C=C 35

IWP-2 is an inhibitor of Wnt processing and secretion with IC50 of 27 nM, selective blo C12=C(C(N(C( 29

CX-6258 HCl is a potent, orally efficacious pan-Pim kinase inhibitor with IC50 of 5 nM, 25 nM and 16 nM for Pim1, Pim2, and Pim3, respectively.

NMDA（N-Methyl-D-aspartic acid）is a specific agonist for NMDA receptor mimicking the action of glutamate, the neurotransmitter which normally acts at that receptor. Phase 4.

IWR-1 (endo-IWR 1) is a Wnt pathway inhibitor with IC50 of 180 nM, induces Axin2 prote[C@@]12([C@] 73

GSK2334470 is a novel PDK1 inhibitor with IC50 of ~10 nM, with no activity at other cl C1(=NC(=NC(= 90UNC1215 is a potent and selective MBT (malignant brain tumor) antagonist, which bin C1CCN(C1)C2C 188

GSK923295 is a first-in-class, specific allosteric inhibitor of CENP-E kinesin motor ATP C(C1C=C(C(=C 100

Zotarolimus (ABT-578) is an analogue of rapamycin, and inhibits FKBP-12 binding with [C@H]1(CC[C@ 100SANT-1 directly binds to Smoothened (Smo) receptor with Kd of 1.2 nM and inhibits SmoC1=CC=CC=C1N 56

IPA-3 is a selective non-ATP competitive Pak1 inhibitor with IC50 of 2.5 μM, no inhibiti S(SC1C(=CC= 199

PF-03758309 is a potent, ATP-competitive, pyrrolopyrazole inhibitor of PAK4 with IC50C12=C(N=C(N= 98KY02111 promotes differentiation of hPSCs to cardiomyocytes by inhibiting Wnt signa C1(C=C(C(=CC 199

NVP-HSP990 (HSP990) is a novel, potent and selective HSP90 inhibitor for HSP90α/β wN1=C(C=CC=C1 75PD 123319 is a potent, selective AT2 angiotensin II receptor antagonist with IC50 of 34N1([C@@H](CC 196

(-)-Blebbistatin is a cell-permeable inhibitor for non muscle myosin II ATPase with IC50 oC1(C=CC=CC=1 198

VE-822 is an ATR inhibitor with IC50 of 19 nM. N1=CC(=NC(=C 77

C1=CC=C(C(=C 75AZD3463 is a novel orally bioavailable ALK inhibitor with Ki of 0.75 nM, which also inhi C12=C(C=CC=C 53

LGX818 is a highly potent RAF inhibitor with selective anti-proliferative and apoptotic CC(C)N1C=C(C 185

(+)-JQ1 is a BET bromodomain inhibitor, with IC50 of 77 nM/33 nM for BRD4(1/2), bindiN1=C(N2C(=N1 199

NLG919 is a potent IDO (indoleamine-(2,3)-dioxygenase) pathway inhibitor with Ki/EC5C1=CC2=C(C=C 198

Zebularine is a DNA methylation inhibitor that forms a covalent complex with DNA methyl[C@@H]1(O[C@ 201

NU6027 is a potent ATR/CDK inhibitor, inhibits CDK1/2, ATR and DNA-PK with Ki of 2.5 C1CCCC(C1)CO 198

AMG 517 is a potent and selective TRPV1 antagonist, antagonizes capsaicin, proton, aC1(=CC=C(C=C 199

3-deazaneplanocin A (DZNeP), an analog of adenosine, is a competitive inhibitor of S- C1=NC(=C2C(= 198

XL888 is an ATP-competitive inhibitor of HSP90 with IC50 of 24 nM. C1(=NC=C(C=C 198

SC144 is an orally active small-molecule gp130 inhibitor. C1=CC=C2N1C 86

KPT-185 is a selective CRM1 inhibitor. C1(=CC(=CC(=C 199

TIC10 inactivates Akt and ERK to induce TRAIL through Foxo3a, possesses superior drug C1=CC=CC(=C1 28

EPZ-6438 is a potent, and selective EZH2 inhibitor with Ki and IC50 of 2.5 nM and 11 nM,C1CC(CCO1)N( 50

PYR-41 is the first cell-permeable inhibitor of ubiquitin-activating enzyme E1, with no actN1N(C(/C(C1=O 199

PR-619 is a non-selective, reversible inhibitor of the deubiquitinylating enzymes (DUBs C1(=C(N=C(C( 201

P5091(P005091) is a selective and potent inhibitor of ubiquitin-specific protease 7 (U C1=C(SC(=C1[N 80

P22077 is an inhibitor of ubiquitin-specific protease USP7 with EC50 of 8.6 μM, also inhC1=C(SC(=C1[N 199

IU1 is a cell-permeable, reversible and selective proteasome inhibitor of human USP14 wiC1=C(C=CC(=C 199

LDN-57444 is a reversible, competitive proteasome inhibitor for Uch-L1 with IC50 of 0.8C1(=CC=C2C(=C 27

CGK 733 is a potent and selective inhibitor of ATM/ATR with IC50 of ~200 nM. C1=C(C(=CC(=C 179

BMS-833923 is an orally bioavailable Smoothened antagonist. Phase 2. C1=CC=C2C(=C 200

CFTRinh-172 is a voltage-independent, selective CFTR inhibitor with Ki of 300 nM, showC1=C(C=CC(=C1 200

TCID is a DUB inhibitor for ubiquitin C-terminal hydrolase L3 with IC50 of 0.6 μM, 125-foC1(=C(C(=C2C( 81

NSC697923 is a cell-permeable and selective inhibitor of the Ub-conjugating enzyme CC1=CC=C(C=C1 198

LGK-974 is a potent and specific PORCN inhibitor, and inhibits Wnt signaling with IC50C1(=C(C=C(C= 199

AZD1080 is a selective, orally active, brain permeable GSK3 inhibitor, inhibits huma C1=C(C=C2C(= 155

DMH1 is a selective BMP receptor inhibitor with IC50 of 107.9 nM for ALK2, exhibiti CC(C)OC1=CC= 84

LDN-212854 is a potent and selective BMP receptor inhibitor with IC50 of 1.3 nM for ALC1CN(CCN1)C2 199

ML347 is a selective BMP receptor inhibitor with IC50 of 32 nM for ALK2, >300-fold selecCOC1=CC=C(C 28

NSC319726 is a p53(R175) mutant reactivator, exhibits growth inhibition in cells expresC1=CC=CC(=N1 81

C646 is an inhibitor for histone acetyltransferase, and inhibits p300 with a Ki of 400 nM.CC1=C(C=C(C( 29

10058-F4 is a c-Myc inhibitor that specificallly inhibits the c-Myc-Max interaction and p C1=C(C=CC(=C 200

Batimastat (BB-94) is a potent, broad spectrum matrix metalloprotease (MMP) inhibit ONC([C@H]([C 200

GM6001 (galardin, ilomastat) is a broad spectrum matrix metalloprotease (MMP) inhi C1=CC=C2C(=C 200

AZD1208 is a potent, and orally available Pim kinase inhibitor with IC50 of 0.4 nM, 5 nM, and 1.9 nM for Pim1, Pim2, and Pim3, respectively. Phase 1.

LY2835219 is a potent and selective inhibitor of CDK4 and CDK6 with IC50 of 2 nM andC1(=CC=C(N=C 137

Mdivi-1 is a selective cell-permeable inhibitor of mitochondrial division DRP1 (dynami N1=C(N(C(C2C 201

UNC1999 is a potent, orally bioavailable and selective inhibitor of EZH2 and EZH1 with C1=C(N=CC(=C 175

SSR128129E is an orally-active and allosteric FGFR1 inhibitor with IC50 of 1.9 μM, whilC1=CC2N(C(=C 199

ONX-0914 (PR-957) is a potent and selective immunoproteasome inhibitor with minimal crN([C@H](C(N[ 172

AVL-292 is a covalent, orally active, and highly selective BTK inhibitor with IC50 of <0. C1(=CN=C(N=C 200

SKI II is a highly selective and non ATP-competitive S1P receptor inhibitor with IC50 o C1(C2=CC=C(C 201

PF-543, a novel sphingosine-competitive inhibitor of SphK1, inhibits SphK1 with IC50 anC1=CC=CC(=C1 93AGI-5198 is the first highly potent and selective inhibitor of IDH1 R132H/R132C mutantC1CCC(CC1)NC 51

I-BET-762 is an inhibitor for BET proteins with IC50 of ~35 nM, suppresses the product N12C([C@@H]( 200

PF-04620110 is an orally active, selective and potent diglyceride acyltransferase-1 (DGN1=CN=C2C(=C 491-Azakenpaullone is a potent and selective GSK-3β inhibitor with IC50 of 18 nM, >100- C1C2=C(C3=C( 201

GZD824 is a novel orally bioavailable Bcr-Abl inhibitor for Bcr-Abl(WT) and Bcr-Abl(T31C1(=CC(=CC(= 137

RKI-1447 is a potent inhibitor of ROCK1 and ROCK2, with IC50 of 14.5 nM and 6.2 nM, reC1=NC=CC(=C1 199

BIO (6-bromoindirubin-3'-oxime) is a specific inhibitor of GSK-3 with IC50 of 5 nM for G C1=CC=C2C(=C 199

DBeQ is a selective, potent, reversible, and ATP-competitive p97 inhibitor with IC50 of C1=CC=C2C(= 199

CNX-2006 is a novel irreversible mutant-selective EGFR inhibitor with IC50 of < 20 nM, C1(=CN=C(N=C 100Ro 31-8220 is a pan-PKC inhibitor with IC50 of 5 nM, 24 nM, 14 nM, 27 nM, and 24 n C1(=C2C(=CC= 180

GF109203X is a potent PKC inhibitor with IC50 of 20 nM, 17 nM, 16 nM, and 20 nM for C1=C2C(=CC=C 82

GSK650394 is a serum- and glucocorticoid-regulated kinase-1 inhibitor with IC50 of C1(=CN=C2C(= 76Thiamet G is a potent, selective O-GlcNAcase inhibitor with Kiof 21 nM, while exhibiti [C@H]1([C@H]( 201

Skepinone-L is a selective p38α-MAPK inhibitor with IC50 of 5 nM. C12C(C(C3C(C 199

Losmapimod (GW856553X) is a selective, potent, and orally active p38 MAPK inhibitor wiC1(=CC(=C(C( 76OAC1 (Oct4-activating compound 1) can enhance the efficiency of reprogramming. C1=CC=CC(=C1 198

C1=C(C=C(C(N 100RepSox is a potent and selective inhibitor of the TGFβR-1/ALK5 with IC50 of 23 nM an N1C(=CC=C2N= 198

C1=CC=C2C(= 100RGFP966 is an HDAC3 inhibitor with IC50 of 0.08 μM, exhibits > 200-fold selectivity o C1(=CC=C(C=C 198

Bromosporine is a broad spectrum inhibitor for bromodomains with IC50 of 0.41 μM, C1=CC(=C(C=C 10

IOX1 is a potent and broad-spectrum inhibitor of 2OG oxygenases, including the JmjC C1=CC=C2C(=N 37OG-L002 is a potent and specific LSD1 inhibitor with IC50 of 20 nM, exhibiting 36- and C1C(C1N)C2=C 199

AGI-6780 is a potent and selective inhibitor of IDH2 R140Q mutant with IC50 of 23 nM. C1CC1NS(=O)( 199

Erastin is a ferroptosis activator by acting on mitochondrial VDAC, exhibiting selectivit C1=CC=CC2=C1 34

Ferrostatin-1 (Fer-1) is a potent and selective inhibitor of ferroptosis with EC50 of 60 nMC1(=CC=C(C= 198

RO3280 is a potent, highly selective inhibitor of Polo-like kinase 1 (PLK1) with IC50 of C1(=CC(=C(C= 100KPT-276 is an orally bioavailable selective CRM1 inhibitor. C1(=CC(=CC(=C 46

KPT-330 is an orally bioavailable selective CRM1 inhibitor. C1(=CC(=CC(=C 200

AZD2858 is a selective GSK-3 inhibitor with an IC50 of 68 nM, activating Wnt signaling,C1=C(N=C(C(= 15

C1(=CC=C(C=C 42SGC-CBP30 is a potent CREBBP/EP300 inhibitor with IC50 of 21 nM and 38 nM, respecC1=C(C=C2C(= 196

CNX-774 is an irreversible, orally active, and highly selective BTK inhibitor with IC50 of C1=C(C=C(C=C 200

SKLB1002 is a potent and ATP-competitive VEGFR2 inhibitor with IC50 of 32 nM. CC1=NN=C(S1) 21

Beta-Lapachone is a selective DNA topoisomerase I inhibitor, exhibiting no inhibitory acC1=CC=C2C(=C 198

AZD1981 is a potent, selective CRTh2 (DP2) receptor antagonist with IC50 of 4 nM, shoC1=CC(=C2C(= 28

MM-102 is a high-affinity peptidomimetic MLL1 inhibitor with IC50 of 0.4 μM. C1CC(CC1)(NC 149

Golgicide A is a potent and rapidly reversible GBF1 inhibitor. N1=CC=CC(=C1 200

PD173955 is a potent Bcr-Abl inhibitor with IC50 of 1-2 nM, also inhibiting Src activity wC1(C(=CC2C(N 15SRPIN340 is a selective SRPK inhibitor with Ki of 0.89 μM for SRPK1, showing no significC1=CC(=C(C=C 200

Alvelestat (AZD9668) is an oral, highly selective inhibitor of neutrophil elastase (NE) with IC50 and Ki of 12 nM and 9.4 nM, at least 600-fold more selective over other serine proteases. Phase 2.Deltarasin is a small molecular inhibitor of KRAS-PDEδ interaction with Kd of 38 nM for binding to purified PDEδ.

NMS-P937 (NMS1286937) is an orally available, selective Polo-like Kinase 1 (PLK1) inhibitor with IC50 of 2 nM, 5000-fold selectivity over PLK2/PLK3. Phase 1.

4μ8C is a potent and selective IRE1 Rnase inhibitor with IC50 of 76 nM. C1(=CC=C2C(= 93

SC75741 is a potent NF-κB inhibitor with EC50 of 200 nM. N1=CN=C2C(=C 35SGI-1027 is a DNMT inhibitor with IC50 of 6, 8, 7.5 μM for DNMT1, DNMT3A, and DN N1=CC=C(C2=C 199

Suvorexant (MK-4305) is a potent dual OX receptor antagonist with Ki of 0.55 nM and 0C1=C(C=C2C(= 22

Edoxaban is a selective factor Xa inhibitor with Ki of 0.561 nM, >10 000-fold selectivity C(N[C@@H]1[C 182

NMS-E973 is a potent and selective Hsp90 inhibitor with DC50 of <10 nM for Hsp90 bindiCN1CCC(CC1)N 198

CO-1686 is an irreversible, mutant-selective EGFR inhibitor with Ki of 21.5 nM and C1(=CN=C(N=C 180

NMS-873 is an allosteric and specific p97 inhibitor with IC50 of 30 nM. C1=CC=NC=C1N 192

PFK15 is a potent and selective 6-phosphofructo-2-kinase (PFKFB3) with IC50 of 207 C1=NC=CC(=C1 19TAK-632 is a potent pan-Raf inhibitor with IC50 of 8.3 nM and 1.4 nM for B-Raf(wt) and CC12=C(C(=C(C 180

RG2833 (RGFP109) is a brain-penetrant HDAC inhibitor with IC50 of 60 nM and 50 nMC1(=CC=C(C= 200

ZCL278 is a selective Cdc42 GTPase inhibitor with Kd of 11.4 μM. C1=C(N=C(N=C 170

RVX-208 is a potent BET bromodomain inhibitor with IC50 of 0.510 μM for BD2, about 17C1(=CC(=C2C( 199

AZD9291 is an oral, irreversible, and mutant-selective EGFR inhibitor with IC50 of C1=CN=C(N=C1 99

PJ34 HCl is the hydrochloride salt of PJ34, which is a PARP inhibitor with EC50 of 20 C12(C3=C(C(N 66IWP-L6 is a highly potent Porcn inhibitor with EC50 of 0.5 nM. C12=C(C(N(C( 52

Rilpivirine is a non-nucleoside reverse transcriptase inhibitor (NNRTI), and used to treatN1C(=NC=CC=1 199

C1(=C(C2=C(S 79

GSK2606414 is an orally available, potent, and selective PERK inhibitor with IC50 of 0.4C1=C(C=C2C(= 90

C12=C(C(C(C3 29STF-118804 is a highly specific NAMPT inhibitor. C1=NC=C(C=C1 132

WZ4003 is a highly specific NUAK kinase inhibitor with IC50 of 20 nM and 100 nM for NUN1=C(N=C(C(= 14

EHop-016 is a specific Rac GTPase inhibitor with IC50 of 1.1 μM for Rac1, equally potentC1(N=C(C=CN= 199

TG003 is a potent and ATP-competitive Cdc2-like kinase (Clk) inhibitor with IC50 of 20 C12N(/C(=C/C 24

TMP269 is a potent, selective class IIa HDAC inhibitor with IC50 of 157 nM, 97 nM, C1(=CC=CC(=C 100

UNC2881 is a specific Mer tyrosine kinase inhibitor with IC50 of 4.3 nM, about 83- and 58N1=C(N=CC(= 92Tasisulam is an antitumor agent and an apoptosis inducer via the intrinsic pathway. Ph C(C1=C(C=C(C= 199

ID-8 is a DYRK inhibitor, and sustains embryonic stem cell self-renewal in long-term culN1(C(=C(C2C=C 201

IOWH032 is a synthetic CFTR inhibitor with IC50 of 1.01 μM in CHO-CFTR cell based aC1=CC=C(C=C1 183

C1(=CC=C(C=C 100

C1(=C(C=C(C(= 53K-Ras(G12C) inhibitor 6 is an allosteric, and selective inhibitor of oncogenic K-Ras(G12N/A 199

CW069 is an allosteric, and selective inhibitor of microtubule motor protein HSET with ICC1(=CC=C(C(= 100

C1CCCC(C1)C2 100AZ191 is a potent and selective DYRK1B inhibitor with IC50 of 17 nM, about 5- and 110C1=NC=C2C(=C 200

C1=C2C3=C(C( 83JSH-23 is an inhibitor of NF-κB transcriptional activity with IC50 of 7.1 μM. C1(C(=CC(=CC 199

EPZ004777 is a potent, selective DOT1L inhibitor with IC50 of 0.4 nM. C(CNC(NC1=CC 185

C12=C(N=C(N( 100

HS-173 is a potent PI3Kα inhibitor with IC50 of 0.8 nM. C1=NC=C(C=C1 84PF-562271 HCl is the hydrochloride salt of PF-562271, which is a potent, ATP-competitivN/A 183

K02288 is a potent, and selective type I BMP receptor inhibitor with IC50 of 1.1, 1.8, N1=CC(=CC(=C 198

OTX015 is a potent BET bromodomain inhibitor with EC50 ranging from 10 to 19 nM f CC1=C(SC2=C1 199

Atglistatin is a highly potent, and selective inhibitor of adipose triglyceride lipase (ATGL CN(C)C1=CC=C 201

AdipoRon is a novel, and orally bioavailable adiponectin receptor agonist with KD of 1 C1=CC=CC(=C1 233

GNE-0877 is a highly potent and selective leucine-rich repeat kinase 2 (LRRK2) inhibitorN1=C(N=C(C(=C 67

N1=C(N=C(C(= 894EGI-1 is a competitive eIF4E/eIF4G interaction inhibitor by binding to eIF4E with KD oC1C(N=C(S1)N 199

CPI-203 is a potent BET bromodomain inhibitor with IC50 of 37 nM for BRD4.

SF1670 is a highly potent and specific PTEN inhibitor with IC50 of 2 μM.

6H05 is a selective, and allosteric inhibitor of oncogenic K-Ras(G12C).

K-Ras(G12C) inhibitor 9 is an allosteric inhibitor of oncogenic K-Ras(G12C).

SH-4-54 is a potent STAT inhibitor with KD of 300 nM and 464 nM for STAT3 and STAT5, respectively.

CH5138303 is an orally available Hsp90 inhibitor with Kd of 0.48 nM.

ARQ 621 is an allosteric, and selective Eg5 mitotic motor protein inhibitor. Phase 1.

GNE-9605 is a highly potent and selective leucine-rich repeat kinase 2 (LRRK2) inhibitor with Ki and IC50 of 2 nM and 19 nM, respectively.

4E1RCat is a dual inhibitor of eIF4E:eIF4G and eIF4E:4E-BP1 interaction, and inhibits tC1=CC=C(C=C1 200

PTC-209 is a potent and selective BMI-1 inhibitor with IC50 of 0.5 μM, and results in irrevCC1=C(N2C=CC 199

UNC669 is a potent and selective MBT (malignant brain tumor) inhibitor with IC50 of C1CCN(C1)C2C 32

C1(=CC(=CC=C1 47E-64 is an irreversible and selective cysteine protease inhibitor with IC50 of 9 nM for paC1(=CC=C2C(=C 198

C(C)(C)C[C@H] 95

C1(=CC=C2C(= 100

OC(C(O)=O)=O 74

Z-FA-FMK is an irreversible cysteine protease inhibitor, and also inhibits effector caspa [C@H](CC1=CC 77Loxistatin Acid (E-64C), a derivative of E-64, is an irreversible and membrane-permeant CC(C)CCNC(=O 197

Aloxistatin is an irreversible and membrane-permeable cysteine protease inhibitor. CCOC(=O)C1C( 198

Sorafenib is a multikinase inhibitor of Raf-1, B-Raf and VEGFR-2 with IC50 of 6 nM, 22 C1(C(F)(F)F) 200

FLI-06 is a novel inhibitor of Notch signaling with EC50 of 2.3 μM. CC1=C(C(C2=C 200

Caffeic acid phenethyl ester is a potent and specific inhibitor of NF-κB activation, and C(/C=C/C1C=C 200

Cl.Cl.N1C=NC 100CGP 57380 is potent MNK1 inhibitor with IC50 of 2.2 μM, exhibiting no inhibitory activi C1=CC(=CC=C 196

KN-62 is a potent and specific inhibitor of Ca2+/calmodulin-dependent protein kinase II C12C(S(N([C@ 100

KN-93 Phosphate is a potent and specific inhibitor of Ca2+/calmodulin-dependent proteiC1(N(S(C2=CC= 100

C1=C(C=C2C(= 47

N1=C(N=C(N1C 91

C1=CC=CC(=C1 61

C1=CC=C2C(=C 99AR-A014418 is an ATP-competitive, and selective GSK3β inhibitor with IC50 and Ki of 10C1=C(SC(=N1)N 201

NH125 is a selective eEF-2 kinase inhibitor with IC50 of 60 nM, >125-fold selectivity ov CCCCCCCCCCCC 190

Sal003 is a potent and cell-permeable eIF-2α phosphatase inhibitor. C1=CC=C(C=C1) 200

ME0328 is a potent and selective PARP inhibitor with IC50 of 0.89 μM for PARP3, aboutCC(C1=CC=CC 10

LEE011 is an orally available, and highly specific CDK4/6 inhibitor. CN(C)C(=O)C 16

ZLN005 is a potent and tissue-specific PGC-1α transcriptional activator. C1=CC=C2C(=C 147

CORM-3 is a water-soluble carbon monoxide-releasing molecule with anti-inflammatory a[Ru]1(C=O)(C= 38CRT0044876 is a potent and selective APE1 inhibitor with IC50 of ~3 μM. C1=CC2=C(C(=C 198

FH1(BRD-K4477) is a small molecule, which promotes differentiation of iPS-derived he CC(=O)NC1=CC 198

FPH1 (BRD-6125) is a small molecule, which promotes expansion of iPS-derived hepatCC1=C(C=C(C= 200

C1=C(C=C(C(= 70VER-49009 is a potent HSP90 inhibitor with IC50 of 47 nM for HSP90β. CCNC(=O)C1=C 198

N1=C(C(=C(O1 77BTB06584 is an IF1-dependent, selective inhibitor of the mitochondrial F1 Fo-ATPase. C1=CC=C(C=C1) 201

C1=C(C=C(C=C 74

C1=C(C=CC(=C 78LB42708 is an orally active farnesyltransferase (FTase) inhibitor with IC50 of 0.8, 1.2, C1COCCN1C(= 180

Triapine is a potent ribonucleotide reductase inhibitor with broad spectrum antitumor actC1=CC(=C(N=C 199

Nexturastat A is a potent and selective HDAC6 inhibitor with IC50 of 5 nM, >190-fold seCCCCN(CC1=C 199

O1(C(=CC(C(= 100

C1=CC(=C(C=C1 72MPI-0479605 is an ATP competitive and selective inhibitor of mitotic kinase Mps1 with ICCC1=C(C=CC( 152

C1=C(C=CC(=C 100

C1=CC2=C3C(= 7

C(NC1SC=C(N= 61

C1(=CC(=C(C( 64

AEBSF HCl is a broad spectrum, irreversible serine protease inhibitor.

Leupeptin Hemisulfate is a reversible inhibitor of serine and cysteine proteases.

Phosphoramidon Disodium Salt is a metalloendopeptidase inhibitor, widely used as a biochemical tool.

(-)-p-Bromotetramisole Oxalate is a potent and non-specific alkaline phosphatase inhibitor.

Puromycin 2HCl is an aminonucleoside antibiotic, which acts as a protein synthesis inhibitor.

PD 151746 is a selective, cell-permeable calpain inhibitor with Ki of 0.26 μM for μ-Calpain, about 20-fold selectivity over m-calpain.

MI-2 (MALT1 inhibitor) is an irreversible MALT1 inhibitor with IC50 of 5.84 μM.

SB-3CT is an effective and selective gelatinase inhibitor with Ki of 13.9 nM and 600 nM for MMP-2 and MMP-9, respectively.

TAPI-1 is an ADAM17/TACE inhibitor, which blocks shedding of cytokine receptors.

FPH2 (BRD-9424) is a small molecule, which promotes differentiation of iPS-derived hepatocytes.

VER-50589 is a potent HSP90 inhibitor with IC50 of 21 nM for HSP90β.

LDC000067 is a highly selective CDK9 inhibitor with IC50 of 44 nM, 55/125/210/ >227/ >227-fold selectivity over CDK2/1/4/6/7.

PI-1840 is a reversible and selective chymotrypsin-like (CT-L) inhibitor with IC50 of 27 nM with little effects on the other two major proteasome proteolytic activities, trypsin-like (T-L) and postglutamyl-peptide-hydrolysis-like (PGPH-L).

EHT 1864 is a potent Rac family GTPase inhibitor with Kd of 40 nM, 50 nM, 60 nM and 250 nM for Rac1, Rac1b, Rac2 and Rac3, respectively.

FH535 is a Wnt/β-catenin signaling inhibitor and also a dual PPARγ and PPARδ antagonist.

YH239-EE, the ethyl ester of YH239, is a potent p53-MDM2 antagonist and an apoptosis inducer.

WIKI4 is a novel Tankyrase inhibitor with IC50 of 15 nM for TNKS2, and leads to inhibition of Wnt/beta-catenin signaling.

INH1 is a cell-permeable Hec1 inhibitor, which specifically disrupts the Hec1/Nek2 interaction.

INH6 is a potent Hec1 inhibitor, which specifically disrupts the Hec1/Nek2 interaction and causes chromosome mis-alignment.

CK-636 is an Arp2/3 complex inhibitor with IC50 of 4 μM, 24 μM and 32 μM for inhibitio CC1=C(C2=CC 200

C1=C(C=CC=C1 66

C1=C(C(=C(C= 52

C1(/CN(C/C(C1 13(S)-crizotinib, the (S)-enantiomer of crizotinib, is a potent MTH1 (NUDT1) inhibitor with CC(C1=C(C=CC 99

JNK inhibitor IX is a selective and potent JNK inhibitor with pIC50 of 6.5 and 6.7 for J C1CCC2=C(C1) 20ML167 is a highly selective Cdc2-like kinase 4 (Clk4) inhibitor with IC50 of 136 nM, >10-CC1=CC=C(O1 199

Trelagliptin is a highly selective, long-acting DPP-4 inhibitor. Phase 3. CN1C(=O)C=C( 198

VGX-1027 is an orally active immunomodulator. Phase 1. C1C(ON=C1C2 199

Y-320 is an orally active immunomodulator, and inhibits IL-17 production by CD4 T cellsCC1=C(C=NN1C 21

AZD7545 is a potent PDHK inhibitor with IC50 of 36.8 nM and 6.4 nM for PDHK1 and PCC(C(=O)NC1=C 198

Voreloxin is a potent Topoisomerase II inhibitor with broad-spectrum anti-tumor activity C12=C(C=CC(= 20

C1(N=C(N(C2= 100GS-9973 is an orally bioavailable, selective Syk inhibitor with IC50 of 7.7 nM. Phase 2. C1COCCN1C2= 199

C1CC(CCN1C2= 73

GNF-5 is a selective and allosteric Bcr-Abl inhibitor with IC50 of 220 nM. C(C1C=C(C=CC 83

C1(=CN=C(N=C 22

C1(=C(C=CC=C 76

BAPTA-AM is a selective, membrane-permeable calcium chelator. C1(N(CC(OCOC 20

C1(=CC(=C(C( 100

C1=CN=C(C=C1 80

C1(=CC(=CC=C 12

C1(C(=C(C(N1 75

C1(=CC=C(C(=C 54

C1=CC(=CC(=C 82

C1=C(C=CC=C 55

CN[C@H](C(N[ 100

C1C=CC2N(C=1 85

N1(CCC(CC1)N 100Tenovin-1 protects against MDM2-mediated p53 degradation, which involves ubiquitination,C1=C(C=CC(=C 200

Rocilinostat (ACY-1215) is a selective HDAC6 inhibitor with IC50 of 5 nM. It is >10-fol C1=CC=CC(=C 200

GSK2636771 is a potent, orally bioavailable, PI3Kβ-selective inhibitor, sensitive to PTENC1=C(C=C2C(= 64

PQ401 inhibits autophosphorylation of IGF-1R domain with IC50 of <1 μM. N(C(=O)NC1C= 93

ZM 39923 is an JAK1/3 inhibitor with pIC50 of 4.4/7.1, almost no activity to JAK2 and mC(CCN(C(C)C) 81

SMI-4a is a potent inhibitor of Pim1 with IC50 of 17 nM, modest potent to Pim-2, does not S1C(NC(C/1=C\ 201

BIX01294 is an inhibitor of G9a histone methyltransferase with IC50 of 2.7 μM, reduces N1(C(=NC(=C2 163

VE-821 is a potent and selective ATP competitive inhibitor of ATR with Ki/IC50 of 13 C1(C(=NC=C(N 200

AG-18 inhibits EGFR with IC50 of 35 μM. C1(C=C(C#N)C 198

PRX-08066 is a selective 5-HT2B receptor antagonist with IC50 of 3.4 nM, prevents the C(/C=C\C(=O) 200

GW9508 is a potent and selective agonist for FFA1 (GPR40) with pEC50 of 7.32, 100-folC(=O)(CCC1= 198

CEP-32496 is a highly potent inhibitor of BRAF(V600E/WT) and c-Raf with Kd of 14 nM/N(C(=O)NC1=N 17

TAK-438 is a novel P-CAB (potassium-competitive acid blocker) that reversibly inhibits N(CC1=CN(C(= 134

AZD5363 potently inhibits all isoforms of Akt(Akt1/Akt2/Akt3) with IC50 of 3 nM/8 nM/ N1(CCC(CC1)( 200

GW0742 is a potent and highly selective PPARβ/δ agonist, with IC50 of 1 nM, with 100 N1=C(SC(=C1C 199

Vortioxetine (Lu AA21004) is a multimodal serotonergic agent, inhibits 5-HT1A, 5-HT1 C1(=CC=C(C(= 200

Empagliflozin (BI-10773) is a potent and selective SGLT-2 inhibitor with IC50 of 3.1 nM,[C@H]1([C@H] 199

TCS 359 is a potent FLT3 inhibitor with IC50 of 42 nM. C12=C(C(=C(S 41

Tyrphostin AG 1296 is an inhibitor of PDGFR with IC50 of 0.3-0.5 μM, no activity to EG N1C(=CN=C2C= 22

ESI-09 is a specific exchange protein directly activated by cAMP (EPAC) inhibitor with IC50 of 3.2 μM and 1.4 μM for EPAC1 and EPAC2, respectively, >100-fold selectivity over PKA.

HJC0350 is a potent and selective EPAC2 inhibitor with IC50 of 0.3 μM, exhibiting no inhibition on Epac1.

HO-3867, an analog of curcumin, is a selective STAT3 inhibitor.

Darapladib (SB-480848) is a reversible lipoprotein-associated phospholipase A2 (Lp-PLA2) inhibitor with IC50 of 0.25 nM. Phase 3.

XMD8-92 is a potent and selective BMK1/ERK5 inhibitor with Kd of 80 nM.

GNE-7915 is a highly potent, selective, and brain-penetrable leucine-rich repeat kinase 2 (LRRK2) inhibitor, with IC50 and Ki of 9 nM and 1 nM, respectively.

ML323 is a highly potent and selective USP1-UAF1 inhibitor with IC50 of 76 nM.

PTC-209 HBr is the hydrobromide salt of PTC-209, which is a potent and selective BMI-1 inhibitor with IC50 of 0.5 μM, and results in irreversible reduction of cancer-initiating cells (CICs).

Pritelivir (BAY 57-1293) is a potent helicase primase inhibitor, exhibiting antiviral effect on herpes simplex virus (HSV) with IC50 of 20 nM for both HSV-1 and HSV-2.

WH-4-023 is a potent and orally active Lck/Src inhibitor with IC50 of 2 nM and 6 nM, respectively.

IM-12 is a selective GSK-3β inhibitor with IC50 of 53 nM, and also enhances canonical Wnt signalling.

INCB024360 is a potent, competitive IDO1 (indoleamine-(2,3)-dioxygenase) inhibitor with IC50 of 67 nM. Phase 2.

N6022 is a selective, and reversible inhibitor of S-nitrosoglutathione reductase (GSNOR) with IC50 of 8 nM and Ki of 2.5 nM. Phase 1/2.

Santacruzamate A (CAY10683) is a potent and selective HDAC inhibitor with IC50 of 119 pM for HDAC2, >3600-fold selectivity over other HDACs.

BV-6 is a SMAC mimetic, dual cIAP and XIAP inhibitor.

Filgotinib (GLPG0634) is a selective JAK1 inhibitor with IC50 of 10 nM, 28 nM, 810 nM, and 116 nM for JAK1, JAK2, JAK3, and TYK2, respectively. Phase 2.

Lomitapide is a potent microsomal triglyceride transfer protein (MTP) inhibitor, used in the treatment of familial hypercholesterolemia.

GSK3787 is as a selective and irreversible antagonist of PPARδ with pIC50 of 6.6, wit C1=NC(=CC=C1 201

Tariquidar (XR9576) is a potent and selective noncompetitive inhibitor of P-glycoprotei C1=CC=C2C(=C 199

WY 14643 (Pirinixic Acid) is a potent peroxisome proliferator and activator of PPARα w C1(NC2C(=C(C 200

NSC 23766 is an inhibitor of Rac GTPase targeting Rac activation by guanine nucleotideN1(C(=CC(=C2C 199

PRT062607 (P505-15) HCl is a novel, highly selective Syk inhibitor with IC50 of 1 nM, N1(=C(N=C(C( 200

Apremilast (CC-10004) is a potent and orally active PDE4 and TNF-α inhibitor with IC50C1=CC2=C(C(N 199

VU 0364439 is a mGlu4 positive allosteric modulator (PAM), with EC50 of 19.8 nM. C1=CC=CC(=N1 201

Butein, a plant polyphenol isolated from Rhus verniciflua, is able to inhibit the C1(=C(C=C(C= 10

Necrostatin-1 is a specific RIP1 inhibitor and inhibits TNF-α-induced necroptosis with C1=CC=C2C(=C 200

UPF 1069 is a selective PARP2 inhibitor with IC50 of 0.3 μM. It is ~27-fold selective a C1=CC(=C2C(= 200

PU-H71 is a potent and selective inhibitor of HSP90 with IC50 of 51 nM. Phase 1. N1=CN=C2C(=C 100GDC-0349 is a potent and selective ATP-competitive inhibitor of mTOR with Ki of 3.8 nMN(C(=O)NC1C= 201

GW2580 is a selective CSF-1R inhibitor for c-FMS with IC50 of 30 nM, 150- to 500-fo N1=C(N=CC(=C 131

Scriptaid is an inhibitor of HDAC. It shows a greater effect on acetylated H4 than H3. C1=CC=C2C3=C 199

BMS-345541 is a highly selective inhibitor of the catalytic subunits of IKK-2 and IKK-1 C1(=CC=C2C(= 35

Dynasore is a cell-permeable, reversible non-competitive dynamin inhibitor of GTPase acC1(=C(C=C(C= 198

ABT-199 (GDC-0199) is a Bcl-2-selective inhibitor with Ki of <0.01 nM, >4800-fold more C1=C(C=CC(=C 115

Tubastatin A is a potent and selective HDAC6 inhibitor with IC50 of 15 nM. It is selecti C1=C(C=CC(=C 10

ETP-46464 is a potent and selective inhibitor of ATR with IC50 of 25 nM. C1=CC(=CC2=C 12

Macitentana (Actelion-1, ACT-064992) is an orally active, non-peptide, dual ETA/ETB ( C1(=CN=C(N=C 169

Lomeguatrib is a potent inhibitor of O6-alkylguanine-DNA-alkyltransferase with IC50 of N1C2=C(NC=N2 199

Pacritinib (SB1518) is a potent and selective inhibitor of Janus Kinase 2 (JAK2) and F C1=CN=C2N=C 23

p276-00 is a novel CDK1, CDK4 and CDK9 inhibitor with IC50 of 79 nM, 63 nM and 20 nC1(=CC(=C(C= 200

Nutlin-3a, the active enantiomer of Nutlin-3, inhibits the p53/MDM2 interaction with IC5 N1(C(=N[C@H] 100

Sabutoclax(BI-97C1) is a pan-Bcl-2 inhibitor, including Bcl-xL, Bcl-2, Mcl-1 and Bfl-1 w C1(=C(C(=C2C 100

Nutlin-3b is a p53/MDM2 antagonist or inhibitor with IC50 value of 13.6 μM, 150-fold lesN1(C(=N[C@@H 100NSC 405020 is a noncatalytic inhibitor of MT1-MMP, directly interacts with PEX domai C1=C(C(=CC(=C 199

C1=CC=C(C=N1 63PluriSIn #1 is an inhibitor of the stearoyl-coA desaturase 1 (SCD1), which is able to sel C1=CC(=CC=N 201

RI-1 is a RAD51 inhibitor with IC50 ranging from 5 to 30 μM. C1(=CC(=CC=C 138

Bardoxolone Methyl is an IKK inhibitor, showing potent proapoptotic and anti-inflammatorC1C(CC[C@@]2( 41

Optovin is a reversible photoactivated TRPA1 activator.

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