| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 5401 |
EN300-68794_2_1_1 |
|
CS(=O)(=O)CCCOC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.2
|
| 5402 |
EN300-1262608_2_1_1 |
|
CCNC(=O)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.3
|
| 5403 |
RAL-THA-05e671eb-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(c(c4)Cl)Cl |
−8.3
± 0.1
|
| 5404 |
EN300-23214_3_2_1 |
|
CCCNC(=O)[C@H](C)NC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.3
|
| 5405 |
EN300-36158_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5COCCO5 |
−8.3
± 0.3
|
| 5406 |
EN300-71126_1_1_1 |
|
Cc1nnc2n1CCN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.3
± 0.3
|
| 5407 |
EDG-MED-4c68219f-1_4
|
|
C[C@H](CN1C(=O)[C@H](CO1)[NH3+])CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.4
|
| 5408 |
EDJ-MED-00c1612e-1_1
|
|
COc1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl |
−8.31
± 0.09
|
| 5409 |
EN300-37077_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccn[nH]5 |
−8.3
± 0.3
|
| 5410 |
RAL-THA-c11c1343-1_1
|
|
CC(=O)N1CC[C@@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.3
|
| 5411 |
EN300-65839_4_1_1 |
|
CC[C@@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.4
|
| 5412 |
EN300-35843_1_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5[NH2+]NC(=O)N5 |
−8.3
± 0.2
|
| 5413 |
EN300-217107_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CC[C@@H]5C(=O)N |
−8.3
± 0.2
|
| 5414 |
ALP-UNI-76695c4f-2_1
|
|
Cn1c(nnn1)C2CCN(CC2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.3
± 0.4
|
| 5415 |
ED_-GRI-5b13fbe2-62_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCOCCOC5C[NH2+]C5 |
−8.3
± 0.3
|
| 5416 |
EDG-MED-90036822-73_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5[C@@H]6[N@H+]5CCC6 |
−8.3
± 0.4
|
| 5417 |
EN300-260262_1_1_1 |
|
Cn1cc(nn1)CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5418 |
PET-UNK-c9c1e0d8-4_2
|
|
c1ccc2c(c1)cncc2N3CC[C@H](C3=O)c4cccc(c4)Cl |
−8.30
± 0.09
|
| 5419 |
EN300-100689_3_2_1 |
|
CC(=O)N1CCO[C@H](C1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5420 |
MAT-POS-e69ad64a-3_1
|
|
C=CC(=O)N(c1cncc2c1cccc2)C(=O)Cc3ccc(c(c3)Cl)Cl |
−8.3
± 0.3
|
| 5421 |
ED_-GRI-5b13fbe2-29_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCOCCOCC[NH3+] |
−8.3
± 0.5
|
| 5422 |
EN300-113507_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C(=O)N |
−8.3
± 0.2
|
| 5423 |
EN300-73772_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5[NH2+]NC(=O)N5 |
−8.3
± 0.3
|
| 5424 |
EN300-331476_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@@H]5COC[C@@H]5O |
−8.3
± 0.3
|
| 5425 |
RAL-THA-2d450e86-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(c(c3)Cl)F |
−8.3
± 0.2
|
| 5426 |
EN300-7444533_2_2_1 |
|
C[C@H]1C[C@@H](C(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5427 |
BEN-DND-f2e727cd-6_3
|
|
C[N@@H+]1Cc2ccc(cc2[C@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−8.3
± 0.4
|
| 5428 |
EN300-60330_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN6[C@@H](C5)CCC6=O |
−8.3
± 0.3
|
| 5429 |
EN300-35642_1_1_1 |
|
C[N@@](CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)C |
−8.3
± 0.4
|
| 5430 |
DAR-DIA-0d514e7d-31_4
|
|
C[C@H]1CCO[C@H]2C=CC(=C[C@@H]2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−8.3
± 0.2
|
| 5431 |
MAK-UNK-c749d764-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C4CC4 |
−8.3
± 0.4
|
| 5432 |
EN300-1725538_3_1_1 |
|
Cn1cc(nc1)C[C@@H](C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.3
± 0.3
|
| 5433 |
EN300-2008120_1_1_1 |
|
C[C@H]1[C@H](CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.3
± 0.3
|
| 5434 |
EN300-2008120_1_1_1 |
|
C[C@H]1[C@H](CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.3
± 0.3
|
| 5435 |
EDG-MED-ba1ac7b9-7_3
|
|
C[C@@H]1N(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5436 |
RAL-THA-8416115c-6_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)Cc5ccn[nH]5 |
−8.3
± 0.3
|
| 5437 |
EN300-113234_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H]5CC(=O)OC5 |
−8.3
± 0.3
|
| 5438 |
EN300-6494158_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@H]5C[C@@H](CO5)CO |
−8.3
± 0.4
|
| 5439 |
EDG-MED-90036822-83_2
|
|
C[N@H+]1CC[C@@H](C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.4
|
| 5440 |
EN300-247428_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn(nn5)CC6CC6 |
−8.3
± 0.3
|
| 5441 |
MAT-POS-e9e99895-3_2
|
|
C[C@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)[C@@H]4CCC(=O)NC4 |
−8.3
± 0.3
|
| 5442 |
EN300-321110_2_1_1 |
|
C[C@@H]1[C@@H](CCS1(=O)=O)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5443 |
EN300-254105_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](CO)[C@@H]5CCCOC5 |
−8.3
± 0.4
|
| 5444 |
EN300-90206_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H]6C[C@@H](C5)C6O |
−8.3
± 0.3
|
| 5445 |
MIC-UNK-5a93dd5f-3_10
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)[N@@H+]4CC[C@@H]5CCCC[C@H]5C4 |
−8.3
± 0.5
|
| 5446 |
EDG-MED-ba1ac7b9-23_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6C[C@H]5C[N@]6CC(F)F |
−8.3
± 0.3
|
| 5447 |
EN300-259063_2_2_1 |
|
CC(=O)N1CCC[C@](C1)(CC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.3
± 0.3
|
| 5448 |
RAL-THA-2d450e86-25_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3F)Cl |
−8.3
± 0.3
|
| 5449 |
EN300-96175_1_1_1 |
|
CC(C)(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)N5CCOC5=O |
−8.3
± 0.5
|
| 5450 |
DAR-DIA-0d514e7d-26_1_1
|
|
C[C@@H]1COc2c(cc(cc2OC)Cl)[C@]1(C)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.3
|
| 5451 |
EN300-104746_2_1_1 |
|
CC[C@@](C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.3
± 0.3
|
| 5452 |
EN300-342226_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)Cc5cnc[nH]5 |
−8.3
± 0.3
|
| 5453 |
ALP-UNI-76695c4f-5_2
|
|
C[C@H](C(=O)N)[NH+]1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5454 |
EN300-1425677_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@]5(CCCO5)CO |
−8.3
± 0.4
|
| 5455 |
EN300-154168_1_1_1 |
|
COCCN1CCCN(CC1=O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5456 |
EN300-224499_2_1_1 |
|
CCc1nc([nH]n1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.3
± 0.3
|
| 5457 |
EN300-6764836_2_5_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5C[C@H]6[C@@H]([C@H]([C@@H]5O6)O)O |
−8.3
± 0.3
|
| 5458 |
JOH-UNI-a38a7bdd-6_4
|
|
c1ccc2c(c1)cncc2N(C(=O)Cc3cccc(c3)Cl)C(=O)[C@H]4C[C@H]4C(F)(F)F |
−8.3
± 0.5
|
| 5459 |
EDG-MED-ba1ac7b9-23_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6C[C@H]5C[N@@]6CC(F)F |
−8.3
± 0.5
|
| 5460 |
EN300-98038_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@H]5[NH2+]NC(=O)N5 |
−8.3
± 0.2
|
| 5461 |
ALP-UNI-3496895b-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ccn(n5)[C@H]6CCNC6=O |
−8.3
± 0.3
|
| 5462 |
EDG-MED-90036822-74_5
|
|
C[N@@H+]1C[C@@H](C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−8.3
± 0.4
|
| 5463 |
EN300-7448078_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)[C@H](C[C@@H]6O)O |
−8.3
± 0.3
|
| 5464 |
EN300-6488240_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cc5nncs5 |
−8.3
± 0.3
|
| 5465 |
EN300-6494361_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)CNC(=O)O6 |
−8.3
± 0.3
|
| 5466 |
EN300-6494361_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)CNC(=O)O6 |
−8.3
± 0.3
|
| 5467 |
EN300-113507_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C(=O)N |
−8.3
± 0.3
|
| 5468 |
EN300-74306_2_1_1 |
|
C[C@@](CCOC)(CNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.3
± 0.2
|
| 5469 |
DAR-DIA-6a508060-5_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4C[C@@H]5CC(=O)N5)Cl |
−8.3
± 0.4
|
| 5470 |
FRA-DIA-b66f7109-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCNc4c3cc(cc4Cl)O[C@H]5CC(=O)N5 |
−8.3
± 0.3
|
| 5471 |
EDJ-MED-40433386-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@]5CC(F)(F)F |
−8.3
± 0.3
|
| 5472 |
MIC-UNK-d36ab305-1_2
|
|
CC(=O)Nc1ccc(cc1)[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.3
± 0.4
|
| 5473 |
EN300-62192_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CC(=O)NC(=O)C5 |
−8.3
± 0.3
|
| 5474 |
EN300-386200_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5CC[C@H]([C@H](CC5)O)O |
−8.3
± 0.3
|
| 5475 |
MIC-UNK-5a93dd5f-3_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)[N@@H+]4CC[C@H]5CCCC[C@@H]5C4 |
−8.3
± 0.4
|
| 5476 |
VLA-UCB-34f3ed0c-1_1_1
|
|
C[C@@H](C#N)C(=O)N(c1cncc2c1cccc2)C(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.3
± 0.2
|
| 5477 |
ALP-POS-e0fe77e5-13_1
|
|
c1ccc2c(c1)cncc2N3CCC[C@@]4(C3=O)CCNc5c4cc(cc5)Cl |
−8.3
± 0.2
|
| 5478 |
EN300-217499_1_2_1 |
|
C[C@](C1CCOCC1)(C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.2
± 0.3
|
| 5479 |
EDG-MED-90036822-14_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](CC[NH+]5CCOCC5)O |
−8.2
± 0.3
|
| 5480 |
EDG-MED-90036822-74_2
|
|
C[N@H+]1C[C@@H](C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−8.2
± 0.3
|
| 5481 |
MAT-POS-e9e99895-13_5
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)[C@@H]4CC[N@H+](C4)C |
−8.2
± 0.7
|
| 5482 |
EN300-80522_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)COC[C@@H]5CCOC5 |
−8.2
± 0.2
|
| 5483 |
EN300-48886_2_1_1 |
|
CC(=O)N[C@@H]1CCCN(C1)C(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.2
± 0.3
|
| 5484 |
EN300-36158_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCCO5 |
−8.2
± 0.2
|
| 5485 |
MAK-UNK-ffc90da7-7_1
|
|
CC(C)OC[C@@H]([C@@H](c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3)[NH2+]C |
−8.2
± 0.5
|
| 5486 |
EN300-152337_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCC(=O)NCC5 |
−8.2
± 0.3
|
| 5487 |
EN300-31210_3_1_1 |
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−8.2
± 0.5
|
| 5488 |
EDG-MED-90036822-23_1
|
|
C[C@@H](CCc1c(n[nH]n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)[NH3+] |
−8.2
± 0.4
|
| 5489 |
EN300-817873_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@]6(C5)COCCO6 |
−8.2
± 0.3
|
| 5490 |
EN300-1608240_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(=O)N6[C@H]5COCC6 |
−8.2
± 0.4
|
| 5491 |
EN300-93474_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H]5C[C@H](C=C5)CO |
−8.2
± 0.3
|
| 5492 |
MAT-POS-8d5af1ef-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CC(=O)Nc4c3cc(cc4)Br |
−8.24
± 0.10
|
| 5493 |
EN300-1720418_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@@H]5CCON5 |
−8.2
± 0.3
|
| 5494 |
EN300-7550802_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6C[C@H]5CN6C(=O)N |
−8.2
± 0.3
|
| 5495 |
EN300-23129_2_1_1 |
|
CC(=O)NCCNC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.2
± 0.3
|
| 5496 |
EN300-254908_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CCOCC5)n6cnnn6 |
−8.2
± 0.4
|
| 5497 |
RAL-THA-2d450e86-12_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3)C#N |
−8.2
± 0.3
|
| 5498 |
MAK-UNK-c749d764-26_4
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@H]3CCCC[C@H]([C@@H]3O)Cl |
−8.2
± 0.3
|
| 5499 |
MIC-UNK-bcd487e9-10_1
|
|
Cn1cnc(n1)CN(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.2
± 0.5
|
| 5500 |
MIC-UNK-cdc2493e-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)[C@H]4CCc5ccccc5C4 |
−8.2
± 0.4
|