Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
5301 |
EN300-1425608_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(C(C5)CO)CCO |
−8.8
± 0.2
|
6.4
± 0.2
|
5302 |
EN300-235974_1
|
|
Cc1nc2[nH]cc(c(=O)n2n1)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.4
|
6.4
± 0.3
|
5303 |
EN300-267469_2
|
|
CS(=NC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(=O)C |
−8.8
± 0.3
|
6.4
± 0.2
|
5304 |
EN300-864080_2
|
|
C[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)NC |
−8.8
± 0.3
|
6.4
± 0.2
|
5305 |
EN300-92664_2
|
|
COCCn1c(ccn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.3
|
5306 |
EN300-224499_1
|
|
CCc1[nH]c(nn1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5307 |
EN300-243828_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)c5cnncc5O |
−8.8
± 0.3
|
6.4
± 0.2
|
5308 |
EN300-28340_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NCC(=O)N5CCCC5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5309 |
BEN-DND-c852c98b-2
|
|
c1cc2cncc(c2cc1OC(F)(F)F)NC(=O)C3CCOc4c3cc(cc4)Cl |
−8.80
± 0.07
|
6.41
± 0.05
|
5310 |
EN300-128277_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C(=O)NCC(F)F |
−8.8
± 0.3
|
6.4
± 0.2
|
5311 |
EN300-396372_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)CC(CNC6=O)O |
−8.8
± 0.2
|
6.4
± 0.2
|
5312 |
EN300-98737_1
|
|
CC(CN(C)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)NC |
−8.8
± 0.4
|
6.4
± 0.3
|
5313 |
EN300-322400_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5[C@H](OCCO5)C(F)(F)F |
−8.8
± 0.2
|
6.4
± 0.1
|
5314 |
EN300-1265432_2
|
|
Cn1ccnc1CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.1
|
5315 |
EN300-142240_2
|
|
Cn1c(cc(n1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−8.8
± 0.3
|
6.4
± 0.2
|
5316 |
EN300-91401_2
|
|
CC1CCNC(=O)C1NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.1
|
5317 |
EN300-99743_2
|
|
CN1CC(C(=O)N1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5318 |
EDJ-MED-e4b030d8-1
|
|
C[C@@]1(c2cc(ccc2OCC1=O)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.1
|
6.41
± 0.08
|
5319 |
DAR-DIA-0d514e7d-2
|
|
C[C@@H]1COc2c(cc(cc2OC)Cl)[C@@H]1C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
5320 |
EN300-146491_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CCCC(=O)N5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5321 |
EN300-153245_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H](C[C@H]5CO)O |
−8.8
± 0.3
|
6.4
± 0.2
|
5322 |
EN300-301721_2
|
|
CC(C1CN(C1)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.2
|
6.4
± 0.2
|
5323 |
EN300-152739_2
|
|
CCN(C)C(=O)CNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
5324 |
EN300-101189_1
|
|
C[C@H](C(=O)NC)NC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
5325 |
EN300-151411_2
|
|
CCn1c(c(nn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−8.8
± 0.3
|
6.4
± 0.2
|
5326 |
EN300-6763470_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC(C(=O)N)C(F)(F)F |
−8.8
± 0.2
|
6.4
± 0.2
|
5327 |
EN300-7209468_2
|
|
CCC1(COCCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−8.8
± 0.2
|
6.4
± 0.2
|
5328 |
EN300-204507_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(C5)(CO)F |
−8.8
± 0.2
|
6.4
± 0.2
|
5329 |
EN300-150749_2
|
|
Cn1c(=O)cc([nH]1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5330 |
EN300-206255_2
|
|
CC(C)C(C)(C(=O)N)NC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
5331 |
EN300-307155_1
|
|
Cn1cnnc1C(CO)NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5332 |
EN300-256739_1
|
|
CNC(=O)C1CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5333 |
EN300-60837_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc6nncn6c5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5334 |
EN300-180575_1
|
|
CC1CCS(=O)(=O)CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5335 |
EN300-7438345_2
|
|
CN(C(=O)C1(CC1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−8.8
± 0.3
|
6.4
± 0.2
|
5336 |
EN300-221418_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)CN6CCOCC6 |
−8.8
± 0.4
|
6.4
± 0.3
|
5337 |
EN300-702579_2
|
|
CS(=O)(=O)CC1CN(CCO1)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5338 |
EN300-722418_2
|
|
CC(CN(CC(C)O)C(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.2
|
6.4
± 0.2
|
5339 |
EN300-7543132_2
|
|
CN(C)CCn1cc(nn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5340 |
EN300-258435_1
|
|
CC1(CCC(=O)NC1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5341 |
EN300-7537340_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5(CCC(=O)NC5=O)CO |
−8.8
± 0.3
|
6.4
± 0.2
|
5342 |
MAT-POS-11b63608-1
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cc(cc4)Br |
−8.77
± 0.05
|
6.39
± 0.04
|
5343 |
EN300-23221_4
|
|
CC(C)NC(=O)CNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.3
|
5344 |
EN300-1592151_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc6ncnn6c5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5345 |
EN300-51887_3
|
|
CNS(=O)(=O)CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.2
|
5346 |
EN300-794464_2
|
|
CN(C[C@@H]1CCC(=O)N1)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5347 |
EN300-15308_1
|
|
CS(=O)(=O)N1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5348 |
EN300-251867_4
|
|
COCCn1cc(nn1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.3
|
5349 |
EN300-7473309_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C[C@@H]6CCCN6C(=O)N5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5350 |
EN300-194199_2
|
|
COCCn1cc(cn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5351 |
EN300-6499164_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(=O)NC6C5CC6 |
−8.8
± 0.2
|
6.4
± 0.1
|
5352 |
EN300-6735076_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC56CCC(C5)(CO6)CO |
−8.8
± 0.3
|
6.4
± 0.2
|
5353 |
EN300-52528_4
|
|
CCN1CCN(CC1)CC(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5354 |
EN300-6277108_2
|
|
COC(C1CCCO1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5355 |
EN300-43206_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CN5CCCS5(=O)=O |
−8.8
± 0.3
|
6.4
± 0.2
|
5356 |
EN300-704039_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5CC(C56CCOCC6)O |
−8.8
± 0.2
|
6.4
± 0.2
|
5357 |
EN300-82453_3
|
|
CC(=O)N[C@@H](CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N |
−8.8
± 0.4
|
6.4
± 0.3
|
5358 |
EN300-182084_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CNC(=O)c5cscn5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5359 |
EN300-137786_2
|
|
CC1CCCN(C1)C(=O)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5360 |
EN300-10170_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C(CO)NC(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
5361 |
EN300-187385_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCc5ccc(=O)[nH]c5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5362 |
EN300-10747_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CN5CSCC5=O |
−8.8
± 0.3
|
6.4
± 0.2
|
5363 |
EN300-1718364_2
|
|
CC1(CS(=O)(=O)C1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.1
|
5364 |
EN300-152739_1
|
|
CCN(C)C(=O)CNC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
5365 |
EN300-256939_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5CCOC5 |
−8.8
± 0.2
|
6.4
± 0.1
|
5366 |
EN300-189495_2
|
|
CC(=O)NCC(C)(C)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.2
|
5367 |
EN300-114607_2
|
|
COC(CNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)CO |
−8.8
± 0.2
|
6.4
± 0.2
|
5368 |
EN300-794473_2
|
|
CC1(C(CS(=O)(=O)N1C)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−8.8
± 0.2
|
6.4
± 0.2
|
5369 |
EN300-147499_2
|
|
Cc1cc(c(=O)[nH]n1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5370 |
EN300-105267_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)Nc5cnccn5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5371 |
EN300-393827_2
|
|
CNC(=O)NC1CCCN(C1)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5372 |
EN300-212795_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCC5CNC(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
5373 |
EN300-128464_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CC(=O)NC5CC5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5374 |
EN300-12567_2
|
|
CCNC(=O)CNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
5375 |
EN300-1221960_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC6(C5)CCS(=O)(=O)C6 |
−8.8
± 0.4
|
6.4
± 0.3
|
5376 |
EN300-814032_2
|
|
Cn1c(=O)n2c(n1)CN(CC2)C(=O)CC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.2
|
6.4
± 0.2
|
5377 |
EN300-1072972_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CC5CCOC5=O |
−8.8
± 0.3
|
6.4
± 0.2
|
5378 |
EN300-151268_2
|
|
CC(C)NS(=O)(=O)NC(C)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
5379 |
EN300-97453_4
|
|
COCCCS(=O)(=O)NCCOCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.6
|
6.4
± 0.4
|
5380 |
EN300-84476_2
|
|
C[C@@H](CNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.3
|
6.4
± 0.2
|
5381 |
EN300-39405_4
|
|
CC(C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)C |
−8.8
± 0.3
|
6.4
± 0.2
|
5382 |
EN300-7427921_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(C5)n6cnnc6 |
−8.8
± 0.3
|
6.4
± 0.2
|
5383 |
EN300-255791_1
|
|
CN(C)CCn1ccc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5384 |
EN300-6734334_2
|
|
Cc1[nH]cc(c(=O)n1)CCC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5385 |
EN300-755481_3
|
|
Cn1ccnc1CCC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5386 |
EN300-114643_3
|
|
CN(C)C(C1CC1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5387 |
EN300-373476_4
|
|
CC1(CCCS1(=O)=O)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
5388 |
EN300-125874_2
|
|
Cn1cnnc1N(C)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5389 |
EN300-201164_3
|
|
CC(C)(C)C(C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−8.8
± 0.2
|
6.4
± 0.2
|
5390 |
DAR-DIA-0d514e7d-9
|
|
C[C@H]1COc2c(cc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)c5ccccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
5391 |
EN300-103144_2
|
|
CSCCC(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.4
|
6.4
± 0.3
|
5392 |
EN300-136870_2
|
|
CN(C)c1[nH]c(=O)cc(n1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
5393 |
EN300-41425_2
|
|
Cc1cc(n[nH]1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.4
± 0.2
|
5394 |
EN300-6760278_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC5CC6C(O5)CCO6 |
−8.7
± 0.1
|
6.37
± 0.08
|
5395 |
EN300-1693852_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H]([C@@H](C5)F)CO |
−8.7
± 0.3
|
6.4
± 0.2
|
5396 |
EN300-304771_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CN5CCN(C5=O)C6CC6 |
−8.7
± 0.4
|
6.4
± 0.3
|
5397 |
EN300-255086_1
|
|
CN(C)CCn1cc(cn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
5398 |
EN300-124383_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOCC5C(=O)N |
−8.7
± 0.3
|
6.4
± 0.3
|
5399 |
EN300-81512_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC5(CC5)CO |
−8.7
± 0.3
|
6.4
± 0.2
|
5400 |
EN300-142130_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](CO)C(F)(F)F |
−8.7
± 0.7
|
6.4
± 0.5
|