| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 5401 |
EN300-225053_2_1 |
|
COc1cnc(nc1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5402 |
EN300-1694031_1_1 |
|
Cc1c(nnn1[C@@H]2CCOC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|
| 5403 |
EN300-260816_4_1 |
|
CN1CC[C@@H](C1=O)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.4
|
| 5404 |
EN300-861925_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)O[C@H](CO)F |
−9.4
± 0.3
|
| 5405 |
EN300-128463_2_1 |
|
CNC(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5406 |
EN300-66494_1_1 |
|
CNC(=O)NCCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5407 |
EN300-10414_2_1 |
|
C[C@@]1(CCS(=O)(=O)C1)NC(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5408 |
EN300-110134_1_1 |
|
Cn1c(c(cn1)NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−9.4
± 0.3
|
| 5409 |
EN300-110134_1_1 |
|
Cn1c(c(cn1)NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−9.4
± 0.3
|
| 5410 |
EN300-190026_2_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H](CO)[C@@H]5CCCO5 |
−9.4
± 0.4
|
| 5411 |
EN300-91401_2_1 |
|
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5412 |
EN300-195756_4_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@H]5CCC(=O)N5 |
−9.4
± 0.3
|
| 5413 |
EN300-783124_4_4 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]([C@H]5CCOC5)F |
−9.4
± 0.3
|
| 5414 |
EN300-1694031_1_2 |
|
Cc1c(nnn1[C@H]2CCOC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|
| 5415 |
EN300-6491795_1_2 |
|
C[C@H]1C2(CC(C2)(O1)CO)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.4
|
| 5416 |
EN300-7455508_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC56CCC(C5)[C@@H]([C@@H]6O)O |
−9.4
± 0.3
|
| 5417 |
EN300-219496_3_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCCN(C5)S(=O)(=O)N |
−9.4
± 0.4
|
| 5418 |
EN300-6493972_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@]56C[C@H]5[C@@H](C6)O |
−9.4
± 0.2
|
| 5419 |
EN300-76841_4_2 |
|
C[C@](COC)(C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.4
± 0.4
|
| 5420 |
EN300-188650_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCc5[nH]ccn5 |
−9.4
± 0.4
|
| 5421 |
EN300-366180_1_1 |
|
Cn1c(ccn1)C2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)O |
−9.4
± 0.3
|
| 5422 |
EN300-862647_1_1 |
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−9.4
± 0.2
|
| 5423 |
EN300-125769_4_1 |
|
COCCCOCC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
| 5424 |
EN300-141809_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CC56CCS(=O)(=O)CC6 |
−9.4
± 0.3
|
| 5425 |
EN300-147887_2_1 |
|
Cn1c(cnn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
| 5426 |
EN300-25986_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCn5cccn5 |
−9.4
± 0.4
|
| 5427 |
EN300-314410_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C[C@H]5C(=O)N)O |
−9.4
± 0.3
|
| 5428 |
EN300-314410_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C[C@H]5C(=O)N)O |
−9.4
± 0.3
|
| 5429 |
EN300-1932780_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](C(F)F)O |
−9.4
± 0.2
|
| 5430 |
EN300-370967_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCN5CCOC5=O |
−9.4
± 0.3
|
| 5431 |
EN300-370967_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCN5CCOC5=O |
−9.4
± 0.3
|
| 5432 |
EN300-114133_4_1 |
|
CCC(=O)N1CC[C@@H](C1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.6
|
| 5433 |
EN300-861925_2_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@H](CO)F |
−9.4
± 0.2
|
| 5434 |
EN300-1179690_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC(C(=O)N)(F)F |
−9.4
± 0.3
|
| 5435 |
EN300-158383_2_1 |
|
CN1C[C@@H](CC1=O)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
| 5436 |
EN300-36845_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CNC(=O)C5CCCC5 |
−9.4
± 0.3
|
| 5437 |
EN300-262008_1_1 |
|
CON1CCC(CC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5438 |
EN300-104422_2_1 |
|
Cn1c(ncn1)CCNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5439 |
EN300-42683_1_1 |
|
CC(C)(CNC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N |
−9.4
± 0.3
|
| 5440 |
EN300-1587757_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCCNS5(=O)=O |
−9.4
± 0.3
|
| 5441 |
EN300-154700_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)(CO)CO |
−9.4
± 0.3
|
| 5442 |
EN300-220194_4_1 |
|
C[C@@H]([C@@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)OC |
−9.4
± 0.4
|
| 5443 |
EN300-51244_2_1 |
|
Cc1cc(n(n1)C)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5444 |
EN300-41473_3_2 |
|
C[C@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)N5CCOCC5 |
−9.4
± 0.5
|
| 5445 |
EN300-154158_1_2 |
|
COC[C@]1(CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.4
± 0.4
|
| 5446 |
EN300-248895_1_4 |
|
C[C@H]1[C@H](CCC(=O)N1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5447 |
EN300-156995_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCCc5c[nH]nn5 |
−9.4
± 0.3
|
| 5448 |
EN300-1238839_3_1 |
|
CS(=O)(=O)NCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5449 |
EN300-1238839_3_1 |
|
CS(=O)(=O)NCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5450 |
EN300-1238839_3_1 |
|
CS(=O)(=O)NCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5451 |
EN300-199290_2_1 |
|
Cn1c(cnn1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
| 5452 |
EN300-124918_4_1 |
|
Cn1c(=O)[nH]c(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5453 |
EN300-157158_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC/C=C/CO |
−9.4
± 0.2
|
| 5454 |
EN300-172179_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CN5CCOC5=O |
−9.4
± 0.3
|
| 5455 |
EN300-189672_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)Cc5ccc(=O)[nH]c5 |
−9.4
± 0.4
|
| 5456 |
EN300-69876_1_1 |
|
Cn1cnnc1CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5457 |
EN300-6498726_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](CO)CF |
−9.4
± 0.3
|
| 5458 |
EN300-112872_2_1 |
|
CC(C)(C)[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−9.4
± 0.6
|
| 5459 |
EN300-132615_2_1 |
|
C[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)N |
−9.4
± 0.3
|
| 5460 |
EN300-217526_2_1 |
|
CCn1c(c(nn1)C)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.4
|
| 5461 |
EN300-91401_1_4 |
|
C[C@H]1CCNC(=O)[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
| 5462 |
EN300-19016_2_1 |
|
COCCNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5463 |
EN300-7355979_2_1 |
|
Cn1cnc2c(c1=O)[nH]nc2C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|
| 5464 |
VLA-UCB-1dbca3b4-15_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.40
± 0.04
|
| 5465 |
EN300-149975_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5(CCC5)CO |
−9.4
± 0.4
|
| 5466 |
EN300-42252_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn6cccnc6n5 |
−9.4
± 0.3
|
| 5467 |
EN300-70323_1_1 |
|
Cc1nnc(n1C)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5468 |
EN300-70323_1_1 |
|
Cc1nnc(n1C)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5469 |
EN300-65383_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5cc[nH]c(=O)c5=O |
−9.4
± 0.3
|
| 5470 |
EN300-235010_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)C#N |
−9.4
± 0.3
|
| 5471 |
EN300-62449_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCNC(=O)C5CCC5 |
−9.4
± 0.4
|
| 5472 |
EN300-82539_1_1 |
|
CCOC(=O)C[C@@H](CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.4
± 0.3
|
| 5473 |
EN300-82539_1_1 |
|
CCOC(=O)C[C@@H](CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.4
± 0.3
|
| 5474 |
EN300-295372_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCn5ccnn5 |
−9.4
± 0.3
|
| 5475 |
EN300-53395_2_1 |
|
CCS(=O)(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
| 5476 |
EN300-253462_2_1 |
|
CN(C)C(=O)[C@@H]1C[C@@H]1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5477 |
EN300-1703852_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C[C@H]5COC(=O)N5 |
−9.4
± 0.4
|
| 5478 |
EN300-6504697_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5CC6(CC6)S(=O)(=O)N5 |
−9.4
± 0.2
|
| 5479 |
EN300-87334_1_1 |
|
Cn1c(ncn1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
| 5480 |
EN300-366233_1_1 |
|
CCN([C@@H](C)C(=O)NC)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.2
|
| 5481 |
EN300-47657_3_2 |
|
C[C@H](C(=O)N(C)C)NC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.5
|
| 5482 |
EN300-62192_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5CC(=O)NC(=O)C5 |
−9.4
± 0.4
|
| 5483 |
EN300-155362_2_3 |
|
C[C@@H]1CC(=O)N[C@H]1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5484 |
EN300-260696_1_8 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5C[C@H]([C@H]5n6cccn6)O |
−9.4
± 0.3
|
| 5485 |
EN300-321703_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCOC5COC5 |
−9.4
± 0.3
|
| 5486 |
EN300-378836_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CN5CCCCS5(=O)=O |
−9.4
± 0.4
|
| 5487 |
EN300-69727_2_1 |
|
CC(C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)OC |
−9.4
± 0.4
|
| 5488 |
EN300-47046_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CCN(CC5)C(=O)C6CC6 |
−9.4
± 0.3
|
| 5489 |
EN300-22879_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)N5CCCC[C@@H]5C(=O)N |
−9.4
± 0.3
|
| 5490 |
EN300-7355737_2_1 |
|
Cn1cc(c(n1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)N |
−9.4
± 0.4
|
| 5491 |
EN300-56202_2_1 |
|
CC(=O)N1CSC[C@@H]1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
| 5492 |
EN300-104746_4_2 |
|
CC[C@](C)(C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.4
± 0.3
|
| 5493 |
EN300-182579_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CN(C5)CC(F)F |
−9.4
± 0.3
|
| 5494 |
EN300-6504697_2_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5CC6(CC6)S(=O)(=O)N5 |
−9.4
± 0.3
|
| 5495 |
EN300-1651623_2_1 |
|
CN(C[C@@H](CF)O)C(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
| 5496 |
EN300-16582_1_1 |
|
CC(C)[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−9.4
± 0.3
|
| 5497 |
EN300-3044054_4_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CCC(=O)N5C6CC6 |
−9.4
± 0.3
|
| 5498 |
EN300-113218_4_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CS[C@H]5CCOC5=O |
−9.4
± 0.4
|
| 5499 |
EN300-30419_1_1 |
|
CS(=O)(=O)NCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
| 5500 |
EN300-182935_1_2 |
|
Cn1cnnc1[C@H]2CN(CCO2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|