Compound List
| Compound | Smiles | Mol |
|---|---|---|
|
C1405
|
Cc1cccc(Oc2ccc(NC(=O)CCl)cc2)c1 |
|
|
C1406
|
CN(C(=O)CCl)c1nccs1 |
|
|
C1407
|
O=Cc1cn(Cc2ccccc2)nc1-c1cccs1 |
|
|
C1408
|
CCOC(=O)c1ccccc1NC |
|
|
C1409
|
CC(C)Oc1ccc(C(=O)NCC(=O)O)cc1 |
|
|
C1410
|
CCNc1cccc(OC)c1 |
|
|
C1411
|
Sc1nnnn1Cc1ccccc1 |
|
|
C1412
|
Cc1ccc(S(=O)(=O)NCC2CCCNC2)cc1 |
|
|
C1413
|
COCCNC1CCS(=O)(=O)C1 |
|
|
C1414
|
NC1CCSc2ccc(Cl)cc21 |
|
|
C1415
|
CC(N)C1CCCN(C(=O)OC(C)(C)C)C1 |
|
|
C1416
|
CC(Cl)C(=O)NCC1CCCCC1 |
|
|
C1417
|
Cc1cc(C=O)c(C)n1-c1ccc2c(c1)CCC2 |
|
|
C1418
|
CNC(=O)C(C)N1CCNCC1 |
|
|
C1419
|
CCOCc1nnc(N)o1 |
|
|
C1420
|
CCOC(=O)c1sc2ncc(S(=O)(=O)Cl)cc2c1C |
|
|
C1421
|
CS(=O)(=O)NC1CC(N)C1 |
|
|
C1422
|
OCc1sc2ccccc2c1Cl |
|
|
C1423
|
CCc1cccc2c(C3=CCNCC3)c[nH]c12 |
|
|
C1424
|
N=C(N)c1cccs1 |
|
|
C1425
|
Cn1c(-c2ccccc2)cnc1S |
|
|
C1426
|
O=C(O)C1CCCN(c2ccccn2)C1 |
|
|
C1427
|
O=C(O)CNC(=O)C1CCCC1 |
|
|
C1428
|
CCOC(=O)C(C#N)C(C)C |
|
|
C1429
|
COC(=O)c1cc(C(C)(C)C)sc1N |
|
|
C1430
|
OCCc1cc2cc(Br)ccc2o1 |
|
|
C1431
|
Cc1cc(C)nc(SCC(=O)NN)n1 |
|
|
C1432
|
Fc1cccc(CC2CCCN2)c1 |
|
|
C1433
|
FC(F)(F)c1ccccc1OCC1CO1 |
|
|
C1434
|
CC(=O)N(c1ccc(Cl)cc1)c1nc(C=O)cs1 |
|
|
C1435
|
Cc1ccc(NC(=O)CCl)cc1S(N)(=O)=O |
|
|
C1436
|
Cc1cccc([N+](=O)[O-])c1I |
|
|
C1437
|
CS(=O)(=O)C1(C(=O)O)CCCC1 |
|
|
C1438
|
O=C(O)C1COc2ccc(Cl)cc2C1 |
|
|
C1439
|
NCCCN1CCc2ccccc2C1 |
|
|
C1440
|
O=c1nccc[nH]1 |
|
|
C1441
|
C1CCC(CN2CCNCC2)CC1 |
|
|
C1442
|
NCc1cccc(C(=O)NCc2ccco2)c1 |
|
|
C1443
|
CC(C)CNC(N)=O |
|
|
C1444
|
CC1CCc2nc3ccccc3c(C(=O)O)c2C1 |
|
|
C1445
|
COc1ccc(-c2noc(CCCC(=O)O)n2)cc1 |
|
|
C1446
|
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccncc1 |
|
|
C1447
|
OCc1cccc(OCC(F)(F)F)c1 |
|
|
C1448
|
CCN(C)CCC(=O)O |
|
|
C1449
|
Cc1ccc(Cl)c(OC(C)C(=O)O)c1 |
|
|
C1450
|
O=Cc1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1 |
|
|
C1451
|
Nc1nc2cc(S(=O)(=O)N3CCCC3)ccc2o1 |
|
|
C1452
|
CC1CCCCN1CCCCN |
|
|
C1453
|
CCCCNc1nc2ccccc2[nH]1 |
|
|
C1454
|
O=C(CCCl)NC(=O)NCc1ccccc1 |
|
|
C1455
|
NCC(N)C1CCCCC1 |
|
|
C1456
|
Brc1cccc(OCc2cccnc2)c1 |
|
|
C1457
|
CN1CCCCCC1=NS(=O)(=O)c1ccc(N)cc1 |
|
|
C1458
|
OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1 |
|
|
C1459
|
NCc1cnn(-c2cccc(Cl)c2)c1 |
|
|
C1460
|
CCc1noc2ncc(C(=O)O)cc12 |
|
|
C1461
|
Cc1cccc(CSCC(=O)O)c1 |
|
|
C1462
|
c1cnc(N2CCCNCC2)nc1 |
|
|
C1463
|
CCOC(=O)c1c(N)c(C#N)cn1C |
|
|
C1464
|
Cc1cccc(-n2cc(C(=O)O)nn2)c1 |
|
|
C1465
|
COC(=O)CSCc1cccc(N)c1 |
|
|
C1466
|
N#CCCN(C(=O)CCC(=O)O)c1ccccc1 |
|
|
C1467
|
CN(C)C(=O)Cn1ccc2cc(N)ccc21 |
|
|
C1468
|
COc1ccc(Cl)cc1-c1nnc(N)o1 |
|
|
C1469
|
O=[N+]([O-])c1ccccc1-n1cc(Br)cn1 |
|
|
C1470
|
C=CCCC(=O)CCC |
|
|
C1471
|
O=C(O)COCc1ccccc1 |
|
|
C1472
|
CC(C)Oc1ccccc1Cl |
|
|
C1473
|
Cc1n[nH]c(C)c1C(C)C(=O)O |
|
|
C1474
|
Nc1ccc(Cl)nn1 |
|
|
C1475
|
Fc1cccc(Cl)c1CNCCCn1ccnc1 |
|
|
C1476
|
Cc1ccc(-n2c(C)cc(CC(=O)O)c2C)cc1 |
|
|
C1477
|
COc1ccc(C(=O)NNC(=O)CCl)cc1OC |
|
|
C1478
|
Clc1ccc(COCC2CO2)cc1 |
|
|
C1479
|
CCCNC1CCN(C(=O)OC(C)(C)C)C1 |
|
|
C1480
|
N#Cc1cccc(NC(=O)OCC(F)(F)F)c1 |
|
|
C1481
|
Cc1cccc2c1OCCC2=O |
|
|
C1482
|
CC1CCCC(C)N1C(=O)COc1ccc(C(=O)O)cc1 |
|
|
C1483
|
Cc1ccccc1SCC(=O)O |
|
|
C1484
|
CCC(NCC(OC)OC)c1ccccc1 |
|
|
C1485
|
NC1(C(F)(F)F)Oc2ccccc2O1 |
|
|
C1486
|
CCC(C)Sc1ccc(N)c(C(F)(F)F)c1 |
|
|
C1487
|
O=C(O)CCCSc1nc2ccccc2[nH]1 |
|
|
C1488
|
NCCCCCN1CCCCC1 |
|
|
C1489
|
Fc1ccc(C2=CCNCC2)cc1 |
|
|
C1490
|
O=C(O)c1c2c(nc3ccccc13)C(=Cc1ccco1)CC2 |
|
|
C1491
|
NCCN1C(=O)Cc2ccccc21 |
|
|
C1492
|
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 |
|
|
C1493
|
FC(F)(F)c1cccc(-c2csc(NCC3CCCO3)n2)c1 |
|
|
C1494
|
Nc1ccc(N2CCc3sccc3C2)nc1 |
|
|
C1495
|
O=C1CCCN1c1ccccc1 |
|
|
C1496
|
CCOc1cccc(C(C)=O)c1 |
|
|
C1497
|
CC(C)(C)c1nc2cc(N)ccc2[nH]1 |
|
|
C1498
|
COc1c(F)cc(N)cc1F |
|
|
C1499
|
Cc1nn(C)c(Oc2ccccc2)c1C=O |
|
|
C1500
|
C=CS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 |
|
|
C1501
|
Oc1ncnc2cccc(F)c12 |
|
|
C1502
|
COc1cc(CN)ccc1OCC(F)(F)F |
|
|
C1503
|
CSC1=NCCN1 |
|
|
C1504
|
COc1ccc(CN)cc1O |
|