Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
6301 |
EN300-6479892_1_1_1 |
|
CN1C(=O)COC12CCN(CC2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.5
± 0.3
|
6302 |
LON-WEI-5e7d1b3e-39_1
|
|
C[C@@H](CCc1ccco1)NC(=O)Nc2cn(c(=O)c3c2cccc3)C |
−7.4
± 0.3
|
6303 |
VLA-UCB-34f3ed0c-19_1
|
|
c1ccc2c(c1)cncc2N(C(=O)c3ccco3)C(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−7.4
± 0.2
|
6304 |
EDJ-MED-92e193ae-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCNc4c3cc(cc4)Cl |
−7.4
± 0.2
|
6305 |
EN300-199359_2_1_1 |
|
CC(C)[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.4
± 0.2
|
6306 |
EN300-360157_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C[C@@]5(CCOC5)O |
−7.4
± 0.4
|
6307 |
EN300-207451_1_1_1 |
|
CN(C)S(=O)(=O)[C@@H]1CCCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.3
|
6308 |
EN300-10336_1_2_1 |
|
c1ccc(cc1)C[C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)NC(=O)N |
−7.4
± 0.3
|
6309 |
EN300-6735421_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC5(C[NH+](C5)C6CC6)CO |
−7.4
± 0.5
|
6310 |
NAU-LAT-2fed8305-1_1
|
|
CC(C)(c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3 |
−7.4
± 0.3
|
6311 |
EN300-264744_1_1_1 |
|
CC(C)([C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)F)O |
−7.4
± 0.2
|
6312 |
EN300-1702677_1_1_1 |
|
CN1CC2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)C(C1=O)(F)F |
−7.4
± 0.3
|
6313 |
MIC-UNK-5a93dd5f-9_6
|
|
CN(C)[C@H]1CC[N@@H+](C1)[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.4
|
6314 |
MAK-UNK-ffc90da7-2_5
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCC[C@@H]([C@H]3O)Cl |
−7.4
± 0.4
|
6315 |
MAT-POS-3b92565d-8_1
|
|
Cn1cc(c2ccccc2c1=O)NC(=O)Cc3cc(cc(c3)Cl)OC |
−7.4
± 0.3
|
6316 |
MIC-UNK-cdc2493e-14_4
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)[C@H]4CC[C@H](C4)[NH+]5CCCCC5 |
−7.4
± 0.5
|
6317 |
MAT-POS-e9e99895-10_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)C[NH3+] |
−7.4
± 0.4
|
6318 |
ALP-UNI-0676e700-24_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5[C@H](CC(=O)N5)C(F)(F)F |
−7.4
± 0.3
|
6319 |
EDJ-MED-d203f206-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@](C5)(CO)O |
−7.4
± 0.5
|
6320 |
EN300-172640_2_3_1 |
|
C[C@@H]1[C@H](NC(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.2
|
6321 |
DAR-DIA-0d514e7d-23_1
|
|
C[C@H]1COc2c(cc(cc2N3CCCC3)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.2
|
6322 |
JOH-UNI-ee5ed7c8-11_1
|
|
c1ccc2c(c1)cnc(c2NC(=O)Cc3cccc(c3)Cl)CC(F)(F)F |
−7.4
± 0.4
|
6323 |
EN300-7437779_2_1_1 |
|
Cn1c(=O)c(c[nH]1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.3
|
6324 |
EDJ-MED-d203f206-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H]6CS(=O)(=O)C[C@]6(C5)C#N |
−7.4
± 0.4
|
6325 |
EDG-MED-90036822-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC(=O)N(C5)CCC[NH3+] |
−7.4
± 0.4
|
6326 |
ALF-EVA-5b152d2f-5_1
|
|
c1cc2c(cc1C3CCC3)cncc2NC(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−7.42
± 0.08
|
6327 |
MAK-UNK-ffc90da7-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@H]3CCC[C@@H]([C@@H]3O)Cl |
−7.4
± 0.3
|
6328 |
EN300-111159_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c(cc(=O)[nH]n5)[O-] |
−7.4
± 0.3
|
6329 |
MAK-UNK-ffc90da7-9_2
|
|
C[C@H]1[C@@H](CCO1)SC[C@@H](C)c2ccc3c(c2)cncc3NC(=O)Cc4cccc(c4)Cl |
−7.4
± 0.3
|
6330 |
EN300-35592_2_1_1 |
|
Cn1cc(cc1C(=O)N)C(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.3
|
6331 |
JOH-UNI-a38a7bdd-5_2
|
|
c1ccc2c(c1)cncc2N(C(=O)Cc3cccc(c3)Cl)C(=O)[C@H]4C[C@@H]4F |
−7.4
± 0.3
|
6332 |
MAK-UNK-c749d764-5_8
|
|
c1ccc2c(c1)cncc2N(CO)C(=O)C[C@H]3CCC[C@H]([C@H]3O)C(F)F |
−7.4
± 0.3
|
6333 |
EN300-7352812_1_1_1 |
|
C[n+]1cc(c[nH]1)OC2(CC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.4
± 0.3
|
6334 |
EN300-6335413_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5C[C@H]5C(=O)NCCO |
−7.4
± 0.3
|
6335 |
BEN-BAS-5c03e89e-2_3
|
|
CC(C)([C@@H]1C=Nc2ccc(cc2[C@H]1C(=O)Nc3cncc4c3cccc4)Cl)O |
−7.4
± 0.2
|
6336 |
EDG-MED-ba1ac7b9-28_2
|
|
C[N@H+](CCO)C1CCN(CC1)C(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.6
|
6337 |
EN300-159633_2_2_1 |
|
C[C@](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C(F)(F)F)O |
−7.4
± 0.2
|
6338 |
EN300-190283_2_1_1 |
|
Cn1cncc1[C@@H](C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.4
± 0.4
|
6339 |
VLA-UNK-56836b69-5_1
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CC(=O)Nc5c4cc(c(c5)Cl)Cl)NC3=O |
−7.4
± 0.3
|
6340 |
PET-UNK-372a2f82-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)Cc4ccn[nH]4 |
−7.41
± 0.10
|
6341 |
EN300-761719_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@H](CO)O |
−7.4
± 0.4
|
6342 |
ALP-UNI-76695c4f-3_1
|
|
Cn1c(=O)c2c(cn1)CN(CC2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.4
± 0.3
|
6343 |
EDJ-MED-ee07cf00-9_2
|
|
c1ccc(cc1)c2nnn(n2)CC(=O)N[C@H](c3cccc(c3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.5
|
6344 |
EN300-1722017_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CC5)n6nccn6 |
−7.4
± 0.3
|
6345 |
MAK-UNK-c749d764-22_6
|
|
C[C@H](C[NH2+]C[C@@H]1CCCO1)[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.4
|
6346 |
EN300-180172_1_1_1 |
|
C[C@@](Cn1ccccc1=O)(C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.4
± 0.3
|
6347 |
EN300-66845_2_2_1 |
|
COC(=O)N1CCC[C@H]1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.4
|
6348 |
LEE-CAM-7ab9b158-3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)COCC(=O)Nc5[nH]ccn5 |
−7.4
± 0.4
|
6349 |
JAN-GHE-f375bf5b-1_1
|
|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C[C@@H]2CCNC2=O)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.4
|
6350 |
JOH-UNI-f51e3bbc-2_1
|
|
COc1c2ccccc2c(cn1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.4
± 0.1
|
6351 |
EN300-1067786_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCNC(=O)C56CC6 |
−7.4
± 0.4
|
6352 |
DAR-DIA-0d514e7d-32_15
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3[C@H]4C[C@H]4CO[C@H]5[C@@H]3C=C(C=C5)Cl |
−7.4
± 0.3
|
6353 |
DAR-DIA-0d514e7d-32_13
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3[C@@H]4C[C@H]4CO[C@H]5[C@@H]3C=C(C=C5)Cl |
−7.4
± 0.3
|
6354 |
EDJ-MED-40433386-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]c5S(=O)(=O)N |
−7.4
± 0.3
|
6355 |
ED_-GRI-5b13fbe2-6_1
|
|
C[NH+](C)CC(=O)NC[C@H](CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.4
± 0.5
|
6356 |
JOH-UNI-f51e3bbc-1_2
|
|
c1ccc2c(c1)c(c[nH]c2=O)NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−7.4
± 0.3
|
6357 |
ALP-UNI-3496895b-2_8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]6[C@H]5CCC[N@H+]6CCO |
−7.4
± 0.6
|
6358 |
ALP-UNI-0676e700-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5C[C@H]6CC[C@@H](C5)S6(=O)=O |
−7.4
± 0.3
|
6359 |
RAL-THA-8416115c-3_1
|
|
CCN1CC[C@@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.3
|
6360 |
RAL-THA-8416115c-4_1
|
|
CCCN1CC[C@@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.3
|
6361 |
EN300-08063_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)N5CCC(CC5)C(=O)N |
−7.4
± 0.3
|
6362 |
EN300-252961_2_4_1 |
|
COC[C@H]1C[C@H](CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.4
± 0.3
|
6363 |
MAK-UNK-c749d764-5_1
|
|
c1ccc2c(c1)cncc2N(CO)C(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−7.4
± 0.3
|
6364 |
ALP-UNI-dbbfd3db-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@@H](O5)C(=O)N6CCCC6 |
−7.4
± 0.3
|
6365 |
RAL-THA-2d450e86-20_1
|
|
Cc1c(cccc1Cl)CC(=O)Nc2cncc3c2cccc3 |
−7.4
± 0.3
|
6366 |
EN300-06654_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cn5cncn5 |
−7.4
± 0.3
|
6367 |
EN300-06654_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cn5cncn5 |
−7.4
± 0.3
|
6368 |
MAT-POS-e9e99895-11_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)COC |
−7.4
± 0.4
|
6369 |
EN300-08033_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H]5CCS(=O)(=O)C5 |
−7.4
± 0.3
|
6370 |
KAD-UNI-80f122c8-3_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]6CS(=O)(=O)C[C@@H]6C5 |
−7.4
± 0.3
|
6371 |
EDG-MED-90036822-68_1
|
|
C[N@@H+](CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C5CC5 |
−7.4
± 0.3
|
6372 |
EN300-132141_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCc6c(nc[nH]c6=O)C5 |
−7.4
± 0.3
|
6373 |
EN300-98648_4_2_1 |
|
CN1CC[C@H](C1=O)OCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.3
|
6374 |
EN300-98648_4_2_1 |
|
CN1CC[C@H](C1=O)OCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.3
|
6375 |
EN300-1440321_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5(CCC5)S(=O)(=O)N |
−7.4
± 0.4
|
6376 |
DAR-DIA-0d514e7d-32_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3[C@H]4C[C@@H]4CO[C@@H]5[C@@H]3C=C(C=C5)Cl |
−7.4
± 0.2
|
6377 |
MAT-POS-3b92565d-9_1
|
|
Cn1cc(c2ccccc2c1=O)NC(=O)Cc3cc(cc(c3)Cl)O[C@@H]4CC(=O)N4 |
−7.4
± 0.4
|
6378 |
EDG-MED-ba1ac7b9-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]5C(=O)N |
−7.4
± 0.4
|
6379 |
EN300-83691_2_1_1 |
|
Cc1c(n[nH]n1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.2
|
6380 |
MAT-POS-e9e99895-4_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)c4cc(n(n4)C)C#N |
−7.4
± 0.4
|
6381 |
EDJ-MED-ee07cf00-2_1
|
|
Cc1c(c(=O)n2c(n1)cc[nH]2)CC(=O)N[C@@H](c3cccc(c3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.4
|
6382 |
EN300-818706_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@@H]6C[C@H]5C(=O)N6 |
−7.4
± 0.3
|
6383 |
MIC-UNK-5a93dd5f-12_7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)[N@]4CC[C@H](C4)[NH+]5CCCCC5 |
−7.4
± 0.5
|
6384 |
EN300-7444533_2_3_1 |
|
C[C@@H]1C[C@H](C(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.4
± 0.2
|
6385 |
EDG-MED-ba1ac7b9-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]5CO |
−7.4
± 0.4
|
6386 |
MIC-UNK-cdc2493e-23_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(CCn3cnnc3)c4cccc(c4)Cl |
−7.4
± 0.4
|
6387 |
EN300-367351_1_1_1 |
|
Cn1c(cnn1)C2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)O |
−7.4
± 0.4
|
6388 |
MAK-UNK-c749d764-29_5
|
|
c1ccc2c(c1)cncc2N(C(=O)C[C@@H]3CCC[C@@H]([C@H]3O)C(F)F)C(=O)ON |
−7.4
± 0.4
|
6389 |
MAT-POS-2905de8c-2_1
|
|
C[NH2+][C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.4
± 0.3
|
6390 |
EN300-248888_4_2_1 |
|
C[C@](C=C)(C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.3
± 0.4
|
6391 |
MAT-POS-afd4d4fd-1_1
|
|
Cc1c(cccc1Cl)CC(=O)Nc2cncc3c2cccc3 |
−7.3
± 0.2
|
6392 |
JOH-UNI-ea72002d-1_2
|
|
c1ccc2c(c1)cncc2N(C(=O)[C@H]3CCOc4c3cc(cc4)Cl)N5C(=O)C=CC5=O |
−7.3
± 0.3
|
6393 |
ALP-UNI-0676e700-4_1
|
|
Cc1nc(on1)COCC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.3
± 0.2
|
6394 |
EN300-264744_3_1_1 |
|
CC(C)([C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)F)O |
−7.3
± 0.2
|
6395 |
EN300-118760_1_2_1 |
|
C[C@](C1CC1)(C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.3
± 0.2
|
6396 |
EN300-39033_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCNC(=O)c5ccncc5 |
−7.3
± 0.3
|
6397 |
EN300-52009_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CCC5)O |
−7.3
± 0.2
|
6398 |
ALF-EVA-ced740bd-1_1
|
|
COc1c(ccc2c1c(cnc2)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl)Cl |
−7.34
± 0.09
|
6399 |
EDG-MED-ba1ac7b9-22_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5Cc6c(nc[nH]6)C[C@H]5C(=O)N |
−7.3
± 0.5
|
6400 |
EN300-129455_2_1_1 |
|
CCNC(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.3
± 0.2
|