| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 6101 |
EDG-MED-ba1ac7b9-13_1
|
|
C[N@@H+]1C[C@@H]2C[C@H]1CN2C(=O)C[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.7
± 0.5
|
| 6102 |
EN300-6766359_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5[C@H]6C[C@H]6C(=O)N5 |
−7.7
± 0.3
|
| 6103 |
EN300-257790_1_1_1 |
|
CCC(=O)N1CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.7
± 0.3
|
| 6104 |
EDG-MED-4c68219f-12_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)[O-] |
−7.7
± 0.2
|
| 6105 |
EN300-321053_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H]5CCOC[C@@H]5O |
−7.7
± 0.3
|
| 6106 |
EN300-26031_2_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@H]5NN[C@H]6[N@@H+]5CCC6 |
−7.7
± 0.2
|
| 6107 |
EDG-MED-ba1ac7b9-5_1
|
|
CC[C@@H](CO)[NH+]1CCN(CC1)C(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.7
± 0.8
|
| 6108 |
MIC-UNK-cdc2493e-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(CCc3ccco3)c4cccc(c4)Cl |
−7.7
± 0.4
|
| 6109 |
EN300-101443_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(COC5)O |
−7.7
± 0.2
|
| 6110 |
MIC-UNK-cdc2493e-10_4
|
|
CC(=O)N[C@H]1CC[C@H](C1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.7
± 0.3
|
| 6111 |
EN300-6764836_2_1_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 |
−7.7
± 0.3
|
| 6112 |
EN300-217526_1_1_1 |
|
CCn1c(c(nn1)C)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.7
± 0.3
|
| 6113 |
EN300-7355477_1_8_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6C[C@H]([C@H](C[C@H]6C5)O)O |
−7.7
± 0.4
|
| 6114 |
EDJ-MED-ee07cf00-11_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)[C@@H]4CC[C@H](O4)C(=O)N5CCCC5 |
−7.7
± 0.5
|
| 6115 |
MAK-UNK-83e0a0b4-2_1
|
|
c1cc2c(cc1CN3CC[NH2+]CC3)cncc2N(CCNC4C[NH2+]C4)C(=O)[C@@H]5CCOc6c5cc(cc6)Cl |
−7.7
± 0.5
|
| 6116 |
EN300-1653482_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCn6c(nnn6)C5 |
−7.7
± 0.2
|
| 6117 |
EN300-249764_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H](C5CCC5)O |
−7.7
± 0.3
|
| 6118 |
EN300-6762327_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H](Cc5ccccn5)O |
−7.7
± 0.3
|
| 6119 |
MAK-UNK-c749d764-26_5
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCCC[C@@H]([C@H]3O)Cl |
−7.6
± 0.3
|
| 6120 |
EN300-385235_3_2_1 |
|
C[C@]1(CCS(=O)(=O)N1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.2
|
| 6121 |
MAT-POS-bbbbc21a-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3COc4c3cc(cc4)Cl |
−7.6
± 0.2
|
| 6122 |
LON-WEI-4d77710c-54_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)N3CCC(CC3)Cc4ccccc4 |
−7.6
± 0.4
|
| 6123 |
ALP-POS-5bb456a5-1_11
|
|
C[C@@H]1C[N@](CC[C@@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−7.6
± 0.4
|
| 6124 |
EDG-MED-ba1ac7b9-13_2
|
|
C[N@H+]1C[C@@H]2C[C@H]1CN2C(=O)C[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.6
± 0.5
|
| 6125 |
EN300-77778_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CCCS(=O)(=O)C5 |
−7.6
± 0.3
|
| 6126 |
VLA-UCB-1dbca3b4-6_2
|
|
c1ccc2c(c1)cncc2n3c(cc(c3O)c4cccc(c4)Cl)O |
−7.6
± 0.3
|
| 6127 |
KAD-UNI-8a629cb0-23_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5C[C@@H]6[C@@H]5C[C@H](C6)C(=O)N |
−7.6
± 0.3
|
| 6128 |
RAL-THA-2d450e86-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(cc3)Cl |
−7.6
± 0.3
|
| 6129 |
EN300-1251424_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)c5ccn(n5)CC#N |
−7.6
± 0.3
|
| 6130 |
MAT-POS-e9e99895-1_2
|
|
C[C@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)[NH3+] |
−7.6
± 0.3
|
| 6131 |
ADA-UCB-dc2b944c-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)F |
−7.64
± 0.06
|
| 6132 |
EDJ-MED-ee07cf00-1_1
|
|
Cn1c(=O)ccn(c1=O)CC(=O)N[C@@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.6
± 0.4
|
| 6133 |
DAR-DIA-0d514e7d-10_1
|
|
C[C@H]1COc2c(cc(cc2Nc3cnn(c3)C)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.2
|
| 6134 |
MAK-UNK-ffc90da7-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)Cl |
−7.6
± 0.4
|
| 6135 |
EN300-70323_1_1_1 |
|
Cc1nnc(n1C)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.3
|
| 6136 |
EN300-191771_2_1_1 |
|
CS(=O)(=O)C1(CCC1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.3
|
| 6137 |
RAL-THA-05e671eb-24_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cccc4C#N |
−7.6
± 0.1
|
| 6138 |
ALP-POS-2da19ca7-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](CC(=O)N)C5CCOCC5 |
−7.6
± 0.3
|
| 6139 |
EN300-245036_2_1_1 |
|
C[C@H]1[C@@H](CCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.6
± 0.3
|
| 6140 |
EDG-MED-90036822-59_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC[C@@H](CF)[NH3+] |
−7.6
± 0.6
|
| 6141 |
EN300-1587691_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCNC(=O)[C@H]5CCO |
−7.6
± 0.4
|
| 6142 |
EN300-705386_4_1_1 |
|
COC[C@@H]1C[C@H]1C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.4
|
| 6143 |
EN300-705386_4_1_1 |
|
COC[C@@H]1C[C@H]1C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.4
|
| 6144 |
EN300-142333_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C6(C5)CC6)O |
−7.6
± 0.3
|
| 6145 |
EDJ-MED-4c7486ba-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@@]5CC(F)(F)F |
−7.6
± 0.4
|
| 6146 |
EDG-MED-4c68219f-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CC(C5)[NH2+]C6COC6 |
−7.6
± 0.3
|
| 6147 |
KAD-UNI-8a629cb0-20_1
|
|
C[C@@H](C(=O)N1CCC(CC1)C(=O)N)O[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.4
|
| 6148 |
EN300-160080_2_1_2 |
|
CS(=O)(=O)[C@H]1NN[C@@H](S1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.5
|
| 6149 |
LAU-MED-88a3970a-14_1
|
|
COCCCc1cc(cc2c1OCC[C@@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−7.6
± 0.4
|
| 6150 |
EN300-16216_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC(=O)N |
−7.6
± 0.2
|
| 6151 |
EDG-MED-ba1ac7b9-8_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N(CC#N)C5CC5 |
−7.6
± 0.4
|
| 6152 |
ADA-UCB-dc2b944c-5_1
|
|
Cc1ccc2c(c1)[C@@H](CCO2)C(=O)Nc3cncc4c3cccc4 |
−7.62
± 0.06
|
| 6153 |
RAL-THA-05e671eb-13_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3ccc(c4)F |
−7.61
± 0.08
|
| 6154 |
EDG-MED-ba1ac7b9-25_8
|
|
C[C@H]1CN(CC[N@H+]1CCO)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.5
|
| 6155 |
EN300-7432898_1_1_1 |
|
CCOC1(CN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−7.6
± 0.4
|
| 6156 |
EN300-172640_2_2_1 |
|
C[C@H]1[C@@H](NC(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.3
|
| 6157 |
EN300-259251_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCn6c(c(cn6)CO)C5 |
−7.6
± 0.3
|
| 6158 |
EN300-09239_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cccc(c5)n6cnnn6 |
−7.6
± 0.4
|
| 6159 |
MIC-UNK-5a93dd5f-5_1
|
|
CC(=O)N[C@@H]1CC[N@@H+](C1)[C@@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.6
± 0.4
|
| 6160 |
EN300-132615_4_1_1 |
|
C[C@@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)N |
−7.6
± 0.4
|
| 6161 |
MAT-POS-fce787c2-9_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)[NH2+]C |
−7.6
± 0.4
|
| 6162 |
EN300-36931_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5(CCOCC5)C(=O)N |
−7.6
± 0.3
|
| 6163 |
ALP-POS-5bb456a5-1_3
|
|
C[C@@H]1C[N@](CC[C@@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−7.6
± 0.5
|
| 6164 |
ALP-POS-2da19ca7-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[NH+](CC5)[C@H]6CCOC6 |
−7.6
± 0.4
|
| 6165 |
ALP-UNI-76695c4f-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC56CC(C5)(CO6)C(=O)N |
−7.6
± 0.3
|
| 6166 |
ALP-UNI-b33a865d-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)Cc5cnc[nH]5 |
−7.6
± 0.3
|
| 6167 |
EN300-92031_3_1_4 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@H]5[NH2+][C@H](NO5)c6[nH]ncn6 |
−7.6
± 0.5
|
| 6168 |
EN300-92662_2_1_1 |
|
Cn1c(ccn1)CCC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.6
± 0.3
|
| 6169 |
ALP-UNI-0676e700-19_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CCS(=O)(=O)CC5)C#N |
−7.6
± 0.4
|
| 6170 |
CHO-MSK-a31cca77-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ncon5 |
−7.6
± 0.3
|
| 6171 |
KAD-UNI-8a629cb0-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cc5c(=O)[nH]cnc5[O-] |
−7.6
± 0.4
|
| 6172 |
ALP-UNI-3496895b-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5ccc(cc5)S(=O)(=O)N |
−7.6
± 0.3
|
| 6173 |
EN300-380827_1_1_1 |
|
Cn1c(cnn1)C2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)OC |
−7.6
± 0.3
|
| 6174 |
EN300-05512_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)N[C@@H]5CCS(=O)(=O)C5 |
−7.6
± 0.5
|
| 6175 |
RAL-THA-1d44ff04-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C(=O)N |
−7.6
± 0.3
|
| 6176 |
MAT-POS-f9802937-1_2
|
|
CN1c2ccc(cc2[C@](CC1=O)(C(=O)Nc3cncc4c3cccc4)OC)Cl |
−7.6
± 0.3
|
| 6177 |
EDG-MED-4c68219f-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5n[n-]nn5 |
−7.6
± 0.2
|
| 6178 |
EN300-77438_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H]5CCN(C5=O)C6CC6 |
−7.6
± 0.3
|
| 6179 |
EN300-77438_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H]5CCN(C5=O)C6CC6 |
−7.6
± 0.3
|
| 6180 |
ED_-GRI-5b13fbe2-23_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC[N@@H+]5CCn6c(c(cn6)C[NH3+])C5 |
−7.6
± 0.7
|
| 6181 |
EN300-217107_4_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H]5CC[C@H]5C(=O)N |
−7.6
± 0.4
|
| 6182 |
ED_-GRI-5b13fbe2-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H](C[NH3+])c5n[n-]nn5 |
−7.6
± 0.3
|
| 6183 |
EDG-MED-90036822-58_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC[C@H](CF)[NH3+] |
−7.6
± 0.4
|
| 6184 |
EN300-254121_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H](c5cnc[nH]5)O |
−7.6
± 0.4
|
| 6185 |
EN300-366931_2_1_1 |
|
COc1cnnc(c1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−7.6
± 0.3
|
| 6186 |
EN300-373791_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccnn5CC#N |
−7.6
± 0.2
|
| 6187 |
RAL-THA-8416115c-2_3
|
|
CN1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.6
± 0.2
|
| 6188 |
PET-UNK-b87f07d0-1_1
|
|
CC(=O)NCCCc1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3 |
−7.6
± 0.4
|
| 6189 |
DAR-DIA-e7614d05-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)OC(F)(F)F |
−7.6
± 0.3
|
| 6190 |
MIC-UNK-91acba05-6_4
|
|
CN1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.6
± 0.3
|
| 6191 |
LON-WEI-4d77710c-36_1
|
|
Cc1cc(c(cc1Cl)OC)NC(=O)Nc2cn(c(=O)c3c2cccc3)C |
−7.6
± 0.4
|
| 6192 |
EN300-233678_2_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@H]([C@H](C5)CO)O |
−7.6
± 0.3
|
| 6193 |
EDJ-MED-ee07cf00-1_2
|
|
Cn1c(=O)ccn(c1=O)CC(=O)N[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.6
± 0.6
|
| 6194 |
EN300-341011_2_1_1 |
|
Cn1c2c(nn1)CC[C@@H](C2)NC(=O)CC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.6
± 0.3
|
| 6195 |
JOH-SUS-a69c159d-5_2
|
|
c1cc2c(cc1F)c(cnc2F)NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−7.6
± 0.2
|
| 6196 |
FRA-DIA-b66f7109-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCNc4c3cc(cc4Cl)O[C@@H]5CC(=O)N5 |
−7.6
± 0.3
|
| 6197 |
FRA-DIA-0fa076fe-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3COc4c3cc(cc4Cl)O |
−7.6
± 0.2
|
| 6198 |
RAL-THA-05e671eb-30_1
|
|
COc1c(ccc2c1[C@@H](CCO2)C(=O)Nc3cncc4c3cccc4)Cl |
−7.6
± 0.1
|
| 6199 |
VLA-UNK-f702bf1c-5_2
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)N(C3=O)C[C@H]6CCC(=O)NC6 |
−7.6
± 0.3
|
| 6200 |
MAK-UNK-8be7dca9-4_2
|
|
c1cc2cncc(c2cc1N3CC[NH2+]CC3)NC(=O)[C@H]4CCOc5c4cc(cc5)Cl |
−7.6
± 0.3
|