Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
1201 |
EN300-310888_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCc5nnc6n5CCOCC6 |
−10.6
± 0.3
|
7.7
± 0.2
|
1202 |
EN300-1072972_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C[C@@H]5CCOC5=O |
−10.6
± 0.3
|
7.7
± 0.2
|
1203 |
ALP-UNI-dbbfd3db-16
|
|
Cn1c2c(cn1)c(=O)n(cn2)CC(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.6
± 0.3
|
7.7
± 0.2
|
1204 |
ED_-GRI-5b13fbe2-74
|
|
CN1CCOC(C1)c2nccc(n2)CO[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.6
± 0.3
|
7.7
± 0.2
|
1205 |
EN300-1253178_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)NC5CC5 |
−10.6
± 0.1
|
7.70
± 0.10
|
1206 |
ALP-UNI-dbbfd3db-5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)COc5ccc(cc5)C(=O)N |
−10.6
± 0.3
|
7.7
± 0.2
|
1207 |
FRA-DIA-13af2da5-1
|
|
CN(C)c1ccc(cc1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.6
± 0.3
|
7.7
± 0.2
|
1208 |
EN300-152913_1_1
|
|
CN(C)c1nc(on1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.6
± 0.3
|
7.7
± 0.2
|
1209 |
EN300-300217_1_3
|
|
C/C=C\[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−10.6
± 0.2
|
7.7
± 0.2
|
1210 |
EN300-31998_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn[nH]n5 |
−10.6
± 0.2
|
7.7
± 0.1
|
1211 |
ED_-GRI-5b13fbe2-34
|
|
CN(CCO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)CC(C(=O)N)(F)F |
−10.6
± 0.2
|
7.7
± 0.2
|
1212 |
EN300-195590_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C[C@@H]5CCCNC(=O)C5 |
−10.6
± 0.3
|
7.7
± 0.2
|
1213 |
EN300-66764_1_2
|
|
COC(=O)[C@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.6
± 0.2
|
7.7
± 0.2
|
1214 |
EN300-270422_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C[C@@H](C5)F)O |
−10.6
± 0.4
|
7.7
± 0.3
|
1215 |
EN300-45049_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCS(=O)(=O)N5 |
−10.6
± 0.3
|
7.7
± 0.2
|
1216 |
ED_-GRI-5b13fbe2-38
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCCN5CCn6c(c(cn6)CN)C5 |
−10.6
± 0.5
|
7.7
± 0.3
|
1217 |
EN300-45182_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCCN5CCOC5=O |
−10.6
± 0.3
|
7.7
± 0.2
|
1218 |
EN300-13489_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CCN(CC5)C(=O)N |
−10.6
± 0.3
|
7.7
± 0.2
|
1219 |
EN300-1699871_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5CCS(=O)(=O)N5 |
−10.6
± 0.3
|
7.7
± 0.2
|
1220 |
EN300-106540_1_1
|
|
C[C@@H](CC(=O)OC)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.6
± 0.2
|
7.7
± 0.2
|
1221 |
EN300-650518_1_1
|
|
CO[C@@H]1C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.6
± 0.2
|
7.7
± 0.2
|
1222 |
EN300-6497975_1_1
|
|
Cc1c(cnc(n1)CO)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.6
± 0.3
|
7.7
± 0.2
|
1223 |
EN300-96362_1_3
|
|
C[C@@H]([C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C5CC5)O |
−10.6
± 0.3
|
7.7
± 0.2
|
1224 |
EN300-12067_3_1
|
|
Cc1csc(=O)n1CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1225 |
EN300-146491_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCCC(=O)N5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1226 |
EN300-122849_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOC[C@@H]5c6ncon6 |
−10.5
± 0.4
|
7.7
± 0.3
|
1227 |
EN300-7540889_1_1
|
|
COc1ccc(nn1)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1228 |
EN300-259694_1_1
|
|
CCO[C@@]1(CCOC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1229 |
EN300-155823_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)(CC#N)O |
−10.5
± 0.2
|
7.7
± 0.2
|
1230 |
MAK-UNK-3875bbc8-1_1
|
|
Cc1ccc2c(c1)[C@@H](CCO2)C(=O)N(C)c3cncc4c3cccc4 |
−10.5
± 0.1
|
7.68
± 0.08
|
1231 |
EN300-67791_2_1
|
|
CC(C)[C@@H]1C(=O)NCCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.4
|
7.7
± 0.3
|
1232 |
EN300-116234_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCCO5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1233 |
EN300-1425677_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@]5(CCCO5)CO |
−10.5
± 0.3
|
7.7
± 0.2
|
1234 |
EN300-159634_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(=O)[nH]nc5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1235 |
EDJ-MED-fcba3f31-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@H]5CCNC5=O |
−10.5
± 0.2
|
7.7
± 0.1
|
1236 |
EN300-30397_3_2
|
|
C[C@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5cncn5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1237 |
MIC-UNK-9582b2c5-3
|
|
CC(=O)N1CCC2C(C1)CN(C(=O)N2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1238 |
EN300-107493_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCNC(=O)C5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1239 |
EN300-125140_4_1
|
|
COCC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.3
|
7.7
± 0.2
|
1240 |
EN300-265285_1_1
|
|
C[C@@H]1Cn2c(cc(n2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)C(=O)N1 |
−10.5
± 0.3
|
7.7
± 0.2
|
1241 |
EN300-64193_1_1
|
|
Cc1nnc(o1)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1242 |
VLA-UCB-50c39ae8-7
|
|
C=CC(=O)N(c1cncc2c1cccc2)C(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−10.5
± 0.2
|
7.7
± 0.1
|
1243 |
EN300-195756_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@H]5CCC(=O)N5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1244 |
EN300-31184_3_2
|
|
C[C@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C(C)C |
−10.5
± 0.3
|
7.7
± 0.2
|
1245 |
EN300-69162_3_1
|
|
C[C@@H](COC)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.3
|
7.7
± 0.2
|
1246 |
EN300-259847_1_1
|
|
CO[C@@H]1CCCCN(C1=O)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1247 |
EN300-343787_1_1
|
|
CN1[C@H](CCC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1248 |
EN300-1630093_2_2
|
|
CC(C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[C@]5(CCOC5)O |
−10.5
± 0.3
|
7.7
± 0.2
|
1249 |
EN300-7542429_1_2
|
|
C[C@H]1CN(C2(CC2)C(=O)N1)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.5
± 0.3
|
7.7
± 0.2
|
1250 |
EN300-295132_1_1
|
|
Cn1cncc(c1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1251 |
EN300-1968342_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H](CF)O |
−10.5
± 0.2
|
7.7
± 0.2
|
1252 |
EN300-244947_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCc5cn[nH]n5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1253 |
EN300-248526_3_2
|
|
c1ccc(cc1)[C@](COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)(C(=O)N)O |
−10.5
± 0.3
|
7.7
± 0.3
|
1254 |
EDJ-MED-e4b030d8-6
|
|
CCC[C@H]1COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−10.5
± 0.1
|
7.67
± 0.08
|
1255 |
EN300-02067_3_2
|
|
C[C@H](COC)NC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.3
|
7.7
± 0.2
|
1256 |
EN300-180875_1_1
|
|
CN(C)C(=O)C1(CC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1257 |
EN300-204239_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(=O)[nH]c(n5)C6CC6 |
−10.5
± 0.2
|
7.7
± 0.2
|
1258 |
ED_-GRI-5b13fbe2-64
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5cn(nn5)[C@H]6CC[C@H](C6)N |
−10.5
± 0.3
|
7.7
± 0.3
|
1259 |
ED_-GRI-5b13fbe2-57
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5ccn[nH]5 |
−10.5
± 0.2
|
7.7
± 0.1
|
1260 |
EN300-7447185_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CC6(C5)COC(=O)N6 |
−10.5
± 0.3
|
7.7
± 0.2
|
1261 |
EN300-1301381_3_2
|
|
COC[C@]1(CCCO1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1262 |
EN300-1253122_3_1
|
|
CCN(C)C(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.2
|
7.7
± 0.1
|
1263 |
EN300-156318_1_1
|
|
COc1cc[nH]c(=O)c1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1264 |
EN300-204935_1_1
|
|
Cn1ncc(n1)C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1265 |
JOH-SUS-a69c159d-6
|
|
c1ccc2c(c1)c(c(nc2F)F)NC(=O)C3CCOc4c3cc(cc4)Cl |
−10.52
± 0.06
|
7.66
± 0.05
|
1266 |
EDG-MED-5d232de5-8
|
|
c1ccc2c(c1)cncc2N3CC[C@H](C3=O)c4cccc(c4)Cl |
−10.5
± 0.3
|
7.7
± 0.2
|
1267 |
EN300-131572_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnn6c5cncc6 |
−10.5
± 0.2
|
7.7
± 0.2
|
1268 |
EN300-111006_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccncn5 |
−10.5
± 0.2
|
7.7
± 0.1
|
1269 |
MAK-UNK-8be7dca9-4_1
|
|
c1cc2cncc(c2cc1N3CC[NH2+]CC3)NC(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−10.52
± 0.09
|
7.66
± 0.07
|
1270 |
EN300-343787_3_1
|
|
CN1[C@H](CCC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1271 |
EN300-10397_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CNC(=O)N |
−10.5
± 0.3
|
7.7
± 0.2
|
1272 |
EN300-7461217_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5C[C@H]([C@@H](C5)F)O |
−10.5
± 0.3
|
7.7
± 0.2
|
1273 |
EN300-7459540_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@@H]5[C@@H](CO)O |
−10.5
± 0.4
|
7.7
± 0.3
|
1274 |
EN300-7459545_3_2
|
|
C[NH+](C)C[C@](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C(F)(F)F)O |
−10.5
± 0.5
|
7.7
± 0.4
|
1275 |
DAR-DIA-23e5a6a0-8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4CC5CC6(N5)COC6)Cl |
−10.5
± 0.3
|
7.7
± 0.2
|
1276 |
EN300-341337_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@]56CCO[C@@H]5CCOC6 |
−10.5
± 0.3
|
7.7
± 0.2
|
1277 |
EN300-263085_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CC5)n6cnnn6 |
−10.5
± 0.2
|
7.7
± 0.2
|
1278 |
EN300-371682_1_1
|
|
CN([C@@H]1COC[C@H]1O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.7
± 0.2
|
1279 |
EN300-6486855_1_1
|
|
Cn1c(cnn1)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.2
|
7.7
± 0.1
|
1280 |
EN300-82179_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC(=O)N |
−10.5
± 0.2
|
7.7
± 0.1
|
1281 |
EN300-23221_3_1
|
|
CC(C)NC(=O)CNC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.3
|
7.7
± 0.2
|
1282 |
EDG-MED-90036822-35
|
|
c1cc2c(c(cnc2)NC(=O)[C@]3(c4c(ccc(c4)Cl)OCC3)NC(=O)C(F)[C@H]5C[C@H](C5)N)cc1 |
−10.5
± 0.3
|
7.7
± 0.2
|
1283 |
EN300-263456_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(=O)n(n5)CCF |
−10.5
± 0.2
|
7.7
± 0.2
|
1284 |
EN300-1654606_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5C[C@@H]5F |
−10.5
± 0.2
|
7.7
± 0.1
|
1285 |
EN300-13252_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCCCCNC(=O)N |
−10.5
± 0.3
|
7.7
± 0.2
|
1286 |
EN300-248521_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]([C@@H](C5)O)CO |
−10.5
± 0.4
|
7.7
± 0.3
|
1287 |
EN300-21009_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCCO5 |
−10.5
± 0.2
|
7.7
± 0.2
|
1288 |
EN300-87536_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCCN5C(=O)N |
−10.5
± 0.3
|
7.7
± 0.2
|
1289 |
EN300-6494158_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[C@@H](CO5)CO |
−10.5
± 0.3
|
7.7
± 0.2
|
1290 |
EN300-149013_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c(n[nH]n5)Cl |
−10.5
± 0.2
|
7.6
± 0.2
|
1291 |
EN300-109535_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@H]5CC(=O)OC5 |
−10.5
± 0.3
|
7.6
± 0.2
|
1292 |
EDG-MED-90036822-104
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ncc(cn5)C6CCNC6 |
−10.5
± 0.3
|
7.6
± 0.2
|
1293 |
EN300-41828_1_1
|
|
CCOC(=O)CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.5
± 0.2
|
7.6
± 0.1
|
1294 |
EN300-73967_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CCS(=O)(=O)CC5)C#N |
−10.5
± 0.3
|
7.6
± 0.2
|
1295 |
EN300-155362_1_3
|
|
C[C@@H]1CC(=O)N[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.2
|
7.6
± 0.2
|
1296 |
EN300-60033_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)COC[C@@H]5CCCO5 |
−10.5
± 0.3
|
7.6
± 0.2
|
1297 |
EN300-6764836_1_7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C[C@@H]6[C@H]([C@H]([C@H]5O6)O)O |
−10.5
± 0.3
|
7.6
± 0.2
|
1298 |
EN300-254121_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H](c5cnc[nH]5)O |
−10.5
± 0.3
|
7.6
± 0.2
|
1299 |
EN300-1273362_2_1
|
|
C[C@@]1(CN(C1=O)C)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.3
|
7.6
± 0.2
|
1300 |
EN300-219020_3_1
|
|
Cn1ncc(n1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.5
± 0.2
|
7.6
± 0.1
|