Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
1401 |
EN300-6729747_1_1
|
|
CC1NNC2[N@H+]1C[C@@H](C2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1402 |
MAT-POS-fce787c2-8
|
|
c1ccc2c(c1)cncc2NC(=O)C(C#N)c3ccc(c(c3)Cl)Cl |
−10.4
± 0.3
|
7.6
± 0.2
|
1403 |
EN300-96175_3_1
|
|
CC(C)(C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)N5CCOC5=O |
−10.4
± 0.5
|
7.6
± 0.3
|
1404 |
DAR-DIA-5ff57136-2
|
|
C[C@H]1COc2ccc(cc2[C@@H]1C(=O)N(c3cncc4c3cccc4)C(=O)C=C)Cl |
−10.4
± 0.2
|
7.6
± 0.1
|
1405 |
EN300-137784_1_1
|
|
CC1CCN(CC1)C(=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1406 |
EN300-6738732_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@]56COC[C@H]5C6(F)F |
−10.4
± 0.2
|
7.6
± 0.2
|
1407 |
EN300-31077_1_1
|
|
Cn1c(ccn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.2
|
7.6
± 0.2
|
1408 |
EN300-31183_1_2
|
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)COC |
−10.4
± 0.3
|
7.6
± 0.2
|
1409 |
EN300-7457159_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCc5cc(on5)C6(COC6)O |
−10.4
± 0.4
|
7.6
± 0.3
|
1410 |
CHO-MSK-5891c1ff-8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)NC5CC5 |
−10.4
± 0.2
|
7.6
± 0.1
|
1411 |
EDJ-MED-d203f206-14
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOC[C@@H]5c6[nH]nnn6 |
−10.4
± 0.4
|
7.6
± 0.3
|
1412 |
EN300-33657_3_1
|
|
CC(=O)N(C)CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.2
|
7.6
± 0.2
|
1413 |
EN300-261056_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn(cn5)c6ncccn6 |
−10.4
± 0.2
|
7.6
± 0.2
|
1414 |
EN300-224741_1_1
|
|
CC[C@@H](CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−10.4
± 0.2
|
7.6
± 0.2
|
1415 |
EN300-208959_1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CNC(=O)C[C@H]5C(F)(F)F |
−10.4
± 0.3
|
7.6
± 0.2
|
1416 |
EN300-1723663_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCN(C(=O)C5)CCO |
−10.4
± 0.3
|
7.6
± 0.3
|
1417 |
EDJ-MED-d203f206-17
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5nnnn5c6cccnc6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1418 |
EN300-214800_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCCN5CCNC5=O |
−10.4
± 0.3
|
7.6
± 0.2
|
1419 |
EN300-1387145_1_1
|
|
CS(=O)(=O)[C@@H]1CCC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1420 |
EN300-6729572_1_1
|
|
C[C@@H]([C@@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1421 |
EN300-318284_1_1
|
|
CC(C)[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−10.4
± 0.2
|
7.6
± 0.2
|
1422 |
EDJ-MED-d203f206-24
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)Cn6ccnn6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1423 |
EN300-24949_1_1
|
|
COC(=O)CCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.2
|
7.6
± 0.2
|
1424 |
EN300-257945_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5[C@H]6[C@@H]5COC6 |
−10.4
± 0.2
|
7.6
± 0.2
|
1425 |
EN300-1723214_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc6c(c5)c(=O)[nH]c(=O)[nH]6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1426 |
EN300-102071_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccnc(c5)C(=O)N |
−10.4
± 0.2
|
7.6
± 0.2
|
1427 |
EN300-212266_1_1
|
|
CC(C)C(=O)N[C@@H](CO)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.3
|
7.6
± 0.2
|
1428 |
EN300-204133_3_1
|
|
COC1(CCOCC1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1429 |
EN300-96886_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C[C@@H](C5)O)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1430 |
EN300-73102_1_2
|
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C5CCOCC5 |
−10.4
± 0.4
|
7.6
± 0.3
|
1431 |
EN300-202757_3_1
|
|
C[C@@H](CC(=O)N)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.3
|
7.6
± 0.2
|
1432 |
EN300-314890_1_1
|
|
CN(C)C(=O)[C@@H]1CC[C@@H](O1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.4
|
7.6
± 0.3
|
1433 |
EN300-52467_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCOCCO |
−10.4
± 0.1
|
7.6
± 0.1
|
1434 |
EN300-188377_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccnc6c5n[nH]n6 |
−10.4
± 0.2
|
7.6
± 0.2
|
1435 |
EN300-306047_1_1
|
|
Cn1cc(nn1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1436 |
EN300-97758_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCF |
−10.4
± 0.3
|
7.6
± 0.2
|
1437 |
EN300-6486576_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCc5nnc(o5)N6CCOCC6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1438 |
EN300-321597_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CC[C@H](C5)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1439 |
EN300-297561_1_1
|
|
CC(C)[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5cnnn5 |
−10.4
± 0.2
|
7.6
± 0.2
|
1440 |
CHO-MSK-5891c1ff-10
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CCC5 |
−10.4
± 0.2
|
7.6
± 0.1
|
1441 |
EN300-1644723_3_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5[C@H]6[C@@H]5COCC6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1442 |
EN300-105693_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(COC5)CO |
−10.4
± 0.3
|
7.6
± 0.2
|
1443 |
EDG-MED-4c68219f-15
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5cc[nH]n5 |
−10.4
± 0.2
|
7.6
± 0.1
|
1444 |
EN300-260816_1_1
|
|
CN1CC[C@@H](C1=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.2
|
7.6
± 0.2
|
1445 |
EN300-204936_3_1
|
|
Cn1c(cnn1)C(=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1446 |
EN300-44821_4_1
|
|
C=CCOCC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.3
|
7.6
± 0.2
|
1447 |
EN300-2923949_1_4
|
|
c1ccc(cc1)[C@H]([C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1448 |
EN300-88656_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCCS5(=O)=O |
−10.4
± 0.3
|
7.6
± 0.2
|
1449 |
EN300-85413_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](CC(=O)N)C5CC5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1450 |
EN300-47606_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)NC[C@H]5CCS(=O)(=O)C5 |
−10.4
± 0.4
|
7.6
± 0.3
|
1451 |
EN300-28871_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCn5ccnn5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1452 |
EN300-7355519_3_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@H]5C[C@H]6[C@@H](O5)CCO6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1453 |
EN300-1273362_1_2
|
|
C[C@]1(CN(C1=O)C)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1454 |
EN300-7385389_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cnc(n5)C(F)(F)F |
−10.4
± 0.3
|
7.6
± 0.2
|
1455 |
EN300-212814_1_4
|
|
C[C@H]1CN(C[C@H](O1)CCO)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1456 |
EN300-7461217_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5C[C@H]([C@@H](C5)F)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1457 |
EN300-21258_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCO |
−10.4
± 0.4
|
7.6
± 0.3
|
1458 |
EN300-97300_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5C[C@@H]5F |
−10.4
± 0.2
|
7.6
± 0.2
|
1459 |
EN300-219531_3_1
|
|
CCC[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−10.4
± 0.3
|
7.6
± 0.2
|
1460 |
EN300-261210_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@]5(CCOC5)C#N |
−10.4
± 0.3
|
7.6
± 0.2
|
1461 |
EN300-139167_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H]5COCCO5 |
−10.4
± 0.1
|
7.6
± 0.1
|
1462 |
EN300-222357_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCc5cn[nH]n5 |
−10.4
± 0.4
|
7.6
± 0.3
|
1463 |
EN300-373791_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5ccnn5CC#N |
−10.4
± 0.3
|
7.6
± 0.2
|
1464 |
EN300-1081277_1_1
|
|
CNC(=O)CCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.3
|
7.6
± 0.2
|
1465 |
EN300-02067_1_2
|
|
C[C@H](COC)NC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.3
|
7.6
± 0.2
|
1466 |
EN300-2983332_1_2
|
|
CC(C)[C@H]1CNC(=O)CN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1467 |
EN300-1138792_3_1
|
|
Cn1cnnc1CCC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1468 |
EN300-74089_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C5(CCOCC5)C#N |
−10.4
± 0.4
|
7.6
± 0.3
|
1469 |
EN300-52983_3_2
|
|
CN1C[C@H](CCC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1470 |
EN300-26147_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5cncn5 |
−10.4
± 0.3
|
7.6
± 0.2
|
1471 |
EN300-181492_1_2
|
|
C=C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−10.4
± 0.2
|
7.6
± 0.2
|
1472 |
EN300-6479181_1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@H]6N5C(=O)CC6 |
−10.4
± 0.3
|
7.6
± 0.2
|
1473 |
EN300-5638430_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC5CS(=O)(=O)C5 |
−10.4
± 0.3
|
7.5
± 0.2
|
1474 |
EN300-370280_1_1
|
|
C[C@]1(CCC(=O)N1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.2
|
7.5
± 0.2
|
1475 |
EN300-154201_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOC[C@@H]5CO |
−10.4
± 0.2
|
7.5
± 0.2
|
1476 |
EN300-6734171_3_2
|
|
C[C@]1(CCC(=O)N(C1)C)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.4
|
7.5
± 0.3
|
1477 |
EN300-197715_4_1
|
|
Cc1nnnn1CCCOCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.5
± 0.2
|
1478 |
EN300-94900_4_1
|
|
CS(=O)(=O)Cc1nc(on1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.3
|
7.5
± 0.2
|
1479 |
EN300-2855057_1_1
|
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N5CCOCC5 |
−10.4
± 0.3
|
7.5
± 0.2
|
1480 |
EN300-325738_1_2
|
|
CN1[C@H](CCCC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.4
± 0.2
|
7.5
± 0.2
|
1481 |
EN300-128431_1_1
|
|
Cn1c2c(cc(cn2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)nn1 |
−10.4
± 0.2
|
7.5
± 0.2
|
1482 |
EN300-18561_1_1
|
|
CC(=O)NCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.4
± 0.2
|
7.5
± 0.2
|
1483 |
EN300-75875_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccnnc5 |
−10.4
± 0.2
|
7.5
± 0.2
|
1484 |
EN300-193399_1_1
|
|
CC(C)(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)C5CC5 |
−10.4
± 0.3
|
7.5
± 0.2
|
1485 |
EDG-MED-ba1ac7b9-1
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC5C(=O)N |
−10.4
± 0.3
|
7.5
± 0.2
|
1486 |
EDJ-MED-d203f206-37
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[S+](CC5)[O-] |
−10.4
± 0.3
|
7.5
± 0.2
|
1487 |
EN300-260603_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5c[nH]c(=O)[nH]5 |
−10.3
± 0.3
|
7.5
± 0.2
|
1488 |
EN300-203940_1_1
|
|
[cH-]1cnc2c(c[nH+]n2c1=O)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.3
± 0.3
|
7.5
± 0.2
|
1489 |
EN300-321790_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H]6C[C@H]5CO6 |
−10.3
± 0.3
|
7.5
± 0.2
|
1490 |
EN300-31387_1_1
|
|
CS(=O)(=O)CCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.3
± 0.3
|
7.5
± 0.2
|
1491 |
EN300-214552_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc6c([nH]c(=O)[nH]6)nc5 |
−10.3
± 0.3
|
7.5
± 0.2
|
1492 |
EDJ-MED-d203f206-35
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]6[C@@H](C5)C(=O)NC6=O |
−10.3
± 0.3
|
7.5
± 0.2
|
1493 |
EN300-1708620_3_1
|
|
C[NH+](C)CCSCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.3
± 0.4
|
7.5
± 0.3
|
1494 |
EN300-7473354_3_1
|
|
Cc1ncn(n1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.3
± 0.4
|
7.5
± 0.3
|
1495 |
EN300-207959_1_1
|
|
C[C@@]1(CCNC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.3
± 0.3
|
7.5
± 0.2
|
1496 |
EN300-265285_1_2
|
|
C[C@H]1Cn2c(cc(n2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)C(=O)N1 |
−10.3
± 0.3
|
7.5
± 0.2
|
1497 |
EN300-113218_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CS[C@H]5CCOC5=O |
−10.3
± 0.4
|
7.5
± 0.3
|
1498 |
EN300-77359_1_2
|
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)OCCOC |
−10.3
± 0.2
|
7.5
± 0.2
|
1499 |
MIC-UNK-d36ab305-5
|
|
CN(C)c1ccc(cc1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.3
± 0.3
|
7.5
± 0.2
|
1500 |
EN300-20496_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@@H]5CCOC5=O |
−10.3
± 0.2
|
7.5
± 0.2
|