Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
3401 |
EN300-7351945_1_2
|
|
CC1(C[C@H](CNC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.2
± 0.2
|
6.7
± 0.2
|
3402 |
EN300-98018_1_1
|
|
CC(=O)N1CC[C@@](C1)(C)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.4
|
6.7
± 0.3
|
3403 |
EN300-152705_3_1
|
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3404 |
EN300-91609_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H]6[C@@H]5C6 |
−9.2
± 0.3
|
6.7
± 0.2
|
3405 |
EN300-14767_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCCN(C5)C(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3406 |
EDJ-MED-ee07cf00-10
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3cccc(c3)Cl)NC(=O)Cn4cnc(n4)C(F)(F)F |
−9.2
± 0.3
|
6.7
± 0.3
|
3407 |
EDG-MED-90036822-92
|
|
CN(CCC#N)CC(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(F)F |
−9.2
± 0.2
|
6.7
± 0.2
|
3408 |
EN300-254840_1_1
|
|
C[C@@H]([C@@H]1CN(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.4
|
6.7
± 0.3
|
3409 |
ED_-GRI-5b13fbe2-20
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5CNC[C@@H](O5)CO |
−9.2
± 0.4
|
6.7
± 0.3
|
3410 |
EN300-2855057_3_1
|
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N5CCOCC5 |
−9.2
± 0.5
|
6.7
± 0.3
|
3411 |
EN300-257405_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@](C5)(CC#N)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3412 |
EN300-103187_4_1
|
|
CCOCCNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
6.7
± 0.3
|
3413 |
MIC-UNK-5a93dd5f-12
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3cccc(c3)Cl)N4CCC(C4)N5CCCCC5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3414 |
EN300-303908_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@]6(C[C@H]6C5)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3415 |
EN300-1717166_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CC56CC(C6)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3416 |
ED_-GRI-5b13fbe2-30
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCNCCO |
−9.2
± 0.6
|
6.7
± 0.4
|
3417 |
DAR-DIA-23e5a6a0-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@@H]5CCC6([NH2+]5)CCC6)Cl |
−9.2
± 0.4
|
6.7
± 0.3
|
3418 |
EN300-98648_2_1
|
|
CN1CC[C@@H](C1=O)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.2
|
6.7
± 0.1
|
3419 |
EN300-6489145_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCNS(=O)(=O)CC5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3420 |
EN300-7445396_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5Cc6c[nH]cc6S5(=O)=O |
−9.2
± 0.4
|
6.7
± 0.3
|
3421 |
EN300-76541_1_3
|
|
CC[C@@H](C)[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−9.2
± 0.5
|
6.7
± 0.3
|
3422 |
EN300-142333_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C6(C5)CC6)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3423 |
MIC-UNK-45817b9b-1
|
|
c1ccc2c(c1)cncc2NC(=O)C3CC(=O)Nc4c3cc(cc4)Cl |
−9.2
± 0.3
|
6.7
± 0.2
|
3424 |
EN300-1709295_1_1
|
|
Cc1cnc(cn1)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3425 |
EN300-302290_3_1
|
|
CS(=O)(=O)N1CC(C1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3426 |
ADA-UCB-dc2b944c-16_1
|
|
CC1(C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4)C |
−9.2
± 0.1
|
6.70
± 0.07
|
3427 |
EDJ-MED-d203f206-1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5nnco5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3428 |
BEN-DND-a7517465-3
|
|
c1cc2cncc(c2c(c1)Cl)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.2
± 0.2
|
6.7
± 0.2
|
3429 |
EN300-87536_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCCN5C(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3430 |
EN300-118760_2_2
|
|
C[C@](C1CC1)(C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.3
|
6.7
± 0.3
|
3431 |
EN300-14949_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(cc5)OCC(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3432 |
EN300-59487_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC(=O)NC5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3433 |
EN300-90142_3_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCC[C@H](C5)C(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3434 |
EN300-173006_4_1
|
|
C[C@@H](c1nnnn1C)OCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.4
|
6.7
± 0.3
|
3435 |
EDG-MED-90036822-81
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(CC5CNC5)F |
−9.2
± 0.4
|
6.7
± 0.3
|
3436 |
EN300-175487_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)CO |
−9.2
± 0.4
|
6.7
± 0.3
|
3437 |
EN300-225165_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC5CC(=O)NC(=O)C5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3438 |
EDG-MED-5d232de5-1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.19
± 0.05
|
6.69
± 0.04
|
3439 |
ALP-UNI-dbbfd3db-11
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)C#N |
−9.2
± 0.4
|
6.7
± 0.3
|
3440 |
EN300-381149_1_1
|
|
Cn1c(ncn1)C2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3441 |
EN300-49064_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5COC5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3442 |
ADA-UCB-dc2b944c-16
|
|
CC1(C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4)C |
−9.19
± 0.10
|
6.69
± 0.07
|
3443 |
EN300-217107_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@@H]5C(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3444 |
EN300-222969_4_2
|
|
CN1C[C@H](OC1=O)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.5
|
6.7
± 0.3
|
3445 |
EN300-25986_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCn5cccn5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3446 |
EN300-141224_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCn6c(ncn6)C5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3447 |
ALP-POS-d3acb8cc-1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.18
± 0.09
|
6.69
± 0.07
|
3448 |
EN300-7431629_3_2
|
|
CC1NNC2[N@H+]1CC[C@]2(C)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.2
± 0.7
|
6.7
± 0.5
|
3449 |
EN300-65839_4_2
|
|
CC[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.4
|
6.7
± 0.3
|
3450 |
EN300-172020_1_2
|
|
Cn1cc(cn1)C[C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3451 |
EN300-119126_4_1
|
|
Cc1[nH]nc(n1)CC(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.4
|
6.7
± 0.3
|
3452 |
EN300-212814_1_1
|
|
C[C@@H]1CN(C[C@@H](O1)CCO)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3453 |
EN300-132963_3_2
|
|
CN1[C@H](CCC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3454 |
EN300-223964_3_1
|
|
CC[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[NH+](C)C |
−9.2
± 0.4
|
6.7
± 0.3
|
3455 |
EN300-246747_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5CC(=O)NC5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3456 |
MAT-POS-fce787c2-6
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3ccc(c(c3)Cl)Cl)(F)F |
−9.2
± 0.3
|
6.7
± 0.2
|
3457 |
LAU-MED-88a3970a-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4CCCCO)Cl |
−9.2
± 0.2
|
6.7
± 0.1
|
3458 |
EN300-1212475_1_1
|
|
CC1(CC(=O)NC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.2
± 0.2
|
6.7
± 0.2
|
3459 |
EN300-6482296_3_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CO[C@@H]6[C@H]5COC6 |
−9.2
± 0.3
|
6.7
± 0.2
|
3460 |
EN300-1664603_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCc5ccn[nH]5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3461 |
DAR-DIA-9e4459de-11
|
|
c1cc2c(cc1OCCOCCOCNC3=CC=CC4C3C(=O)N(C4=O)C5CCC(=O)NC5=O)cncc2NC(=O)C6CCOc7c6cc(cc7)Cl |
−9.2
± 0.2
|
6.7
± 0.1
|
3462 |
EDJ-MED-e4b030d8-3_1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.17
± 0.09
|
6.68
± 0.07
|
3463 |
EN300-67191_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCN5CCCC5=O |
−9.2
± 0.3
|
6.7
± 0.2
|
3464 |
EN300-19242_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CO |
−9.2
± 0.3
|
6.7
± 0.2
|
3465 |
EN300-6729572_1_2
|
|
C[C@H]([C@@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.2
|
6.7
± 0.2
|
3466 |
EN300-17381_4_2
|
|
C[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.2
|
6.7
± 0.1
|
3467 |
BEN-DND-c852c98b-5_1
|
|
CS(=O)(=O)c1ccc2cncc(c2c1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.17
± 0.09
|
6.68
± 0.07
|
3468 |
EN300-201551_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@@H+]5CC(F)(F)F |
−9.2
± 0.3
|
6.7
± 0.2
|
3469 |
EN300-206592_1_1
|
|
CCC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)N |
−9.2
± 0.2
|
6.7
± 0.2
|
3470 |
EN300-77092_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC5OCCO5 |
−9.2
± 0.4
|
6.7
± 0.3
|
3471 |
EN300-6764893_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H](C5)OCCO |
−9.2
± 0.3
|
6.7
± 0.2
|
3472 |
EN300-226964_3_1
|
|
Cc1ccn(n1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3473 |
MIC-UNK-644c43c7-2
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)CCNC(C(F)(F)F)C(F)(F)F |
−9.2
± 0.5
|
6.7
± 0.4
|
3474 |
EN300-310022_1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H](C[N@@]5c6ccncn6)O |
−9.2
± 0.3
|
6.7
± 0.2
|
3475 |
EN300-294602_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccsc5S(=O)(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3476 |
EN300-6498856_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC[C@@H]5C(=O)NC(=O)N5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3477 |
EN300-637424_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn(nn5)[C@@H]6COC[C@H]6O |
−9.2
± 0.4
|
6.7
± 0.3
|
3478 |
EN300-1072199_2_1
|
|
CO[C@@]1(CCCOC1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3479 |
EN300-260760_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5cc(=O)[nH][nH]5 |
−9.2
± 0.3
|
6.7
± 0.2
|
3480 |
EN300-2007620_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H](OCC5)CO |
−9.2
± 0.3
|
6.7
± 0.2
|
3481 |
EN300-1179673_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5cccc(c5)C(=O)N |
−9.2
± 0.3
|
6.7
± 0.2
|
3482 |
EN300-139167_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5COCCO5 |
−9.2
± 0.1
|
6.67
± 0.10
|
3483 |
EN300-104088_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)OCCO |
−9.2
± 0.3
|
6.7
± 0.2
|
3484 |
EN300-331993_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)Nc5[nH]ccn5 |
−9.2
± 0.2
|
6.7
± 0.2
|
3485 |
EN300-92031_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCc5nc(no5)c6[nH]ncn6 |
−9.2
± 0.3
|
6.7
± 0.2
|
3486 |
EN300-27268_3_1
|
|
Cc1nc(on1)CCC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3487 |
EN300-126548_1_1
|
|
CN1CN(CC1=O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.2
|
6.7
± 0.2
|
3488 |
EN300-262204_1_1
|
|
CS(=O)(=O)CC1(COC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3489 |
EN300-61021_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5nnc6n5cccn6 |
−9.1
± 0.3
|
6.7
± 0.2
|
3490 |
EDG-MED-ba1ac7b9-14
|
|
CN1CCN(CC1C#N)C(=O)CC2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.1
|
6.7
± 0.1
|
3491 |
EN300-124052_1_1
|
|
C[C@@H]1CN(C[C@@H]1O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3492 |
EN300-718785_1_1
|
|
CCN1[C@@H](CCC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3493 |
FRA-DIA-b66f7109-2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3COc4c3cc(cc4Cl)OC5CC(=O)N5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3494 |
EN300-104493_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](CO)[C@@H]5CCOC5 |
−9.1
± 0.3
|
6.7
± 0.3
|
3495 |
JAG-UCB-706446eb-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC(F)(F)F |
−9.1
± 0.2
|
6.7
± 0.2
|
3496 |
EN300-367405_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)n6ccnn6 |
−9.1
± 0.2
|
6.7
± 0.1
|
3497 |
EN300-39305_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C[NH+]5CCS(=O)(=O)CC5 |
−9.1
± 0.3
|
6.7
± 0.2
|
3498 |
EN300-71558_1_1
|
|
COC(=O)NCCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.2
|
6.7
± 0.2
|
3499 |
EN300-36089_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CNC(=O)c5ccncc5 |
−9.1
± 0.4
|
6.7
± 0.3
|
3500 |
EN300-66800_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CNC(=O)c5ccc(cc5)O |
−9.1
± 0.3
|
6.7
± 0.2
|