Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
5101 |
NAU-LAT-2fed8305-7
|
|
c1ccc2c(c1)cncc2NC(=O)C3(COC3)c4cccc(c4)Cl |
−7.9
± 0.2
|
5.8
± 0.2
|
5102 |
EN300-113633_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5CCC(=O)NC5=O |
−7.9
± 0.3
|
5.8
± 0.2
|
5103 |
LAU-MED-88a3970a-8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4CCCCO)Cl |
−7.9
± 0.4
|
5.8
± 0.3
|
5104 |
EN300-153257_2_2
|
|
CC(C)[C@H](CO)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
5.8
± 0.2
|
5105 |
EN300-155764_1_1
|
|
C[C@@H]1C(=O)N(CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−7.9
± 0.3
|
5.8
± 0.2
|
5106 |
EN300-6760278_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@H]5C[C@@H]6[C@@H](O5)CCO6 |
−7.9
± 0.3
|
5.8
± 0.2
|
5107 |
EN300-314274_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cncc6c5CCNC6=O |
−7.9
± 0.3
|
5.8
± 0.2
|
5108 |
EN300-6736515_2_2
|
|
C[C@H]([C@@H]1COCCO1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.8
± 0.2
|
5109 |
DAR-DIA-0d514e7d-2
|
|
C[C@@H]1COc2c(cc(cc2OC)Cl)[C@@H]1C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
5.8
± 0.2
|
5110 |
EN300-52210_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)C[C@H](N6)O |
−7.9
± 0.4
|
5.8
± 0.3
|
5111 |
EN300-246501_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)C6CS(=O)(=O)C6 |
−7.9
± 0.3
|
5.8
± 0.2
|
5112 |
NAU-LAT-2fed8305-2
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CC3)c4cccc(c4)Cl |
−7.9
± 0.3
|
5.8
± 0.2
|
5113 |
EDG-MED-90036822-75
|
|
CN1C[C@@H](C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−7.9
± 0.4
|
5.8
± 0.3
|
5114 |
EN300-124063_2_1
|
|
Cn1c(ncn1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.8
± 0.2
|
5115 |
EN300-749499_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H](C5(CCOCC5)O)O |
−7.9
± 0.3
|
5.8
± 0.2
|
5116 |
EN300-332601_2_2
|
|
CC[C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−7.9
± 0.4
|
5.8
± 0.3
|
5117 |
PET-UNK-c9c1e0d8-4
|
|
c1ccc2c(c1)cncc2N3CCC(C3=O)c4cccc(c4)Cl |
−7.93
± 0.09
|
5.78
± 0.06
|
5118 |
MAT-POS-9ff17035-2
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)Oc4cccc(=O)[nH]4 |
−7.93
± 0.10
|
5.78
± 0.07
|
5119 |
EN300-6736890_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5COC[C@@H]5n6ccnc6 |
−7.9
± 0.3
|
5.8
± 0.2
|
5120 |
NAU-LAT-2fed8305-6
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(s3)Cl |
−7.9
± 0.3
|
5.8
± 0.2
|
5121 |
EN300-194442_1_1
|
|
C[C@@]1(CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−7.9
± 0.4
|
5.8
± 0.3
|
5122 |
EDG-MED-ba1ac7b9-33
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN(CC5)C6CCOC6 |
−7.9
± 0.3
|
5.8
± 0.2
|
5123 |
NAU-LAT-30527ac5-1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc4c3[nH]cc4)Cl |
−7.9
± 0.3
|
5.8
± 0.2
|
5124 |
KAD-UNI-80f122c8-1
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)NCC56CC(C5)(CO6)C(=O)N |
−7.9
± 0.3
|
5.8
± 0.2
|
5125 |
EN300-300217_4_3
|
|
C/C=C\[C@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.9
± 0.4
|
5.8
± 0.3
|
5126 |
RAL-THA-2d450e86-4
|
|
COc1ccc(cc1)CC(=O)Nc2cncc3c2cccc3 |
−7.9
± 0.3
|
5.8
± 0.2
|
5127 |
EN300-7444533_2_1
|
|
C[C@@H]1C[C@@H](C(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.8
± 0.2
|
5128 |
RAL-THA-05e671eb-2
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cc(c(c4)Cl)Cl |
−7.9
± 0.1
|
5.77
± 0.08
|
5129 |
EN300-1087187_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6CCC(=O)N[C@@H]6C5 |
−7.9
± 0.3
|
5.8
± 0.2
|
5130 |
RAL-THA-05e671eb-28
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3c(c(cc4)Cl)F |
−7.92
± 0.07
|
5.77
± 0.05
|
5131 |
EN300-316679_4_1
|
|
CCC[C@@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.9
± 0.3
|
5.8
± 0.2
|
5132 |
RAL-THA-8416115c-9
|
|
CN(C)C(=O)CN1CCC(c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.2
|
5.8
± 0.2
|
5133 |
EN300-749499_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H](C5(CCOCC5)O)O |
−7.9
± 0.4
|
5.8
± 0.3
|
5134 |
EN300-219020_4_1
|
|
Cn1ncc(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.2
|
5.8
± 0.2
|
5135 |
LEE-CAM-7ab9b158-3
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)COCC(=O)Nc5[nH]ccn5 |
−7.9
± 0.2
|
5.8
± 0.2
|
5136 |
EN300-185751_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cc5cncnc5 |
−7.9
± 0.2
|
5.8
± 0.2
|
5137 |
MIC-UNK-cdc2493e-10
|
|
CC(=O)NC1CCC(C1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
5.8
± 0.2
|
5138 |
ALP-UNI-3496895b-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN(CC5)CCC#N |
−7.9
± 0.3
|
5.8
± 0.2
|
5139 |
EN300-54891_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@@H]5CO |
−7.9
± 0.3
|
5.8
± 0.2
|
5140 |
EN300-2983332_2_2
|
|
CC(C)[C@H]1CNC(=O)CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.8
± 0.2
|
5141 |
KAD-UNI-8a629cb0-43
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@@H]5C[C@H]6[C@@H]5C[C@@H](C6)C(=O)N |
−7.9
± 0.4
|
5.8
± 0.3
|
5142 |
EN300-07752_2_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H](C[C@H]5C(=O)N)O |
−7.9
± 0.4
|
5.8
± 0.3
|
5143 |
EN300-1987964_2_1
|
|
CS(=O)(=O)CC1C=C(NO1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.2
|
5.8
± 0.2
|
5144 |
EN300-1387145_1_2
|
|
CS(=O)(=O)[C@H]1CCC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.7
|
5.8
± 0.5
|
5145 |
DAR-DIA-0d514e7d-21
|
|
C[C@H]1COc2c(cc(cc2N3CCNCC3)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.2
|
5.8
± 0.2
|
5146 |
EN300-121144_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cc5ccccc5C(=O)N |
−7.9
± 0.4
|
5.8
± 0.3
|
5147 |
NAU-LAT-0543f7f2-9
|
|
CC(=O)NCCOc1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3 |
−7.9
± 0.4
|
5.8
± 0.3
|
5148 |
ALP-POS-e0fe77e5-10
|
|
c1ccc2c(c1)cncc2N3CCCC4(C3=O)CCNc5c4cc(c(c5)Cl)Cl |
−7.9
± 0.3
|
5.8
± 0.2
|
5149 |
RAL-THA-8416115c-10
|
|
CNC(=O)CN1CCC(c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.2
|
5.8
± 0.2
|
5150 |
JOH-UNI-a38a7bdd-5
|
|
c1ccc2c(c1)cncc2N(C(=O)Cc3cccc(c3)Cl)C(=O)C4CC4F |
−7.9
± 0.3
|
5.8
± 0.2
|
5151 |
EN300-120920_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@@H]5CCC(=O)NC5=O |
−7.9
± 0.2
|
5.8
± 0.2
|
5152 |
EDJ-MED-e4b030d8-9
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3nc(cc4)Cl |
−7.9
± 0.2
|
5.8
± 0.2
|
5153 |
EN300-39504_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCCS(=O)(=O)N |
−7.9
± 0.5
|
5.7
± 0.4
|
5154 |
EN300-152337_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCC(=O)NCC5 |
−7.9
± 0.3
|
5.7
± 0.2
|
5155 |
EN300-6504498_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOC[C@H](C5)n6cncn6 |
−7.9
± 0.4
|
5.7
± 0.3
|
5156 |
EN300-209068_1_1
|
|
C[C@H](CN(C)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.9
± 0.2
|
5.7
± 0.1
|
5157 |
VLA-UCB-05e51b3f-11
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4OC5CC(=O)N5)Cl |
−7.9
± 0.3
|
5.7
± 0.2
|
5158 |
KAD-UNI-8a629cb0-33
|
|
CC[C@H](CN1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−7.9
± 0.5
|
5.7
± 0.4
|
5159 |
EN300-1073391_1_1
|
|
C[NH+]1CC(C1)N(C)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.7
± 0.2
|
5160 |
EN300-7355477_1_6
|
|
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 |
−7.9
± 0.3
|
5.7
± 0.2
|
5161 |
EN300-13668_1_1
|
|
CN(CC(=O)NC1CC1)C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.7
± 0.2
|
5162 |
EDJ-MED-12c115cc-1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3COc4c3cc(cc4)Cl |
−7.9
± 0.2
|
5.7
± 0.2
|
5163 |
NAU-LAT-2fed8305-3
|
|
c1ccc2c(c1)cncc2NC(=O)CN3CCC=C(C3)Cl |
−7.9
± 0.3
|
5.7
± 0.2
|
5164 |
EN300-11835_1_2
|
|
CC(C)C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−7.9
± 0.5
|
5.7
± 0.4
|
5165 |
RAL-THA-05e671eb-27
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3c(c(cc4)Cl)Cl |
−7.88
± 0.09
|
5.74
± 0.07
|
5166 |
EN300-1296824_3_1
|
|
C[C@@](CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(COC)O |
−7.9
± 0.4
|
5.7
± 0.3
|
5167 |
EN300-100689_3_1
|
|
CC(=O)N1CCO[C@@H](C1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
5.7
± 0.2
|
5168 |
MAK-UNK-ffc90da7-1
|
|
CC(CNCCCO)C(c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3 |
−7.9
± 0.2
|
5.7
± 0.2
|
5169 |
EN300-307658_2_1
|
|
C=C[C@H](CO)NC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
5.7
± 0.2
|
5170 |
EN300-67050_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCS(=O)(=O)CC5 |
−7.9
± 0.3
|
5.7
± 0.2
|
5171 |
JAG-UCB-706446eb-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5CCCOC5 |
−7.9
± 0.2
|
5.7
± 0.2
|
5172 |
EN300-42819_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCC(=O)NC5 |
−7.9
± 0.2
|
5.7
± 0.2
|
5173 |
EN300-07752_1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C[C@H]5C(=O)N)O |
−7.9
± 0.3
|
5.7
± 0.2
|
5174 |
EN300-82616_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCCNC5=O |
−7.9
± 0.3
|
5.7
± 0.2
|
5175 |
EN300-24653_1_1
|
|
CNC(=O)C1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.2
|
5.7
± 0.2
|
5176 |
EN300-157541_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCS(=O)(=O)C[C@@H]5CO |
−7.9
± 0.3
|
5.7
± 0.2
|
5177 |
EN300-300020_3_1
|
|
C[N@H+]1CCS(=O)(=O)C[C@@H]1CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.8
|
5.7
± 0.6
|
5178 |
EN300-1722713_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)CC(=O)NC6 |
−7.9
± 0.3
|
5.7
± 0.2
|
5179 |
EDG-MED-4c68219f-14
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)O[C@H]5C[C@H](NC5)CO |
−7.9
± 0.4
|
5.7
± 0.3
|
5180 |
MIC-UNK-cdc2493e-12
|
|
CN(C)C1CCC(C1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.4
|
5.7
± 0.3
|
5181 |
RAL-THA-05e671eb-6
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cc(cc4)C(F)(F)F |
−7.85
± 0.07
|
5.72
± 0.05
|
5182 |
EN300-220194_2_4
|
|
C[C@H]([C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)OC |
−7.9
± 0.3
|
5.7
± 0.2
|
5183 |
EN300-861925_4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCO[C@H](CO)F |
−7.9
± 0.4
|
5.7
± 0.3
|
5184 |
MAK-UNK-c749d764-5
|
|
c1ccc2c(c1)cncc2N(CO)C(=O)CC3CCCC(C3O)C(F)F |
−7.9
± 0.3
|
5.7
± 0.2
|
5185 |
RAL-THA-8416115c-6
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCN(c4c3cc(cc4)Cl)Cc5ccn[nH]5 |
−7.8
± 0.2
|
5.7
± 0.1
|
5186 |
EN300-7432022_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@]56CC[N@](C5)S(=O)(=O)C6 |
−7.8
± 0.3
|
5.7
± 0.2
|
5187 |
EN300-302290_2_1
|
|
CS(=O)(=O)N1CC(C1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.8
± 0.4
|
5.7
± 0.3
|
5188 |
EN300-6974806_2_1
|
|
C[C@H]([C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)O |
−7.8
± 0.2
|
5.7
± 0.1
|
5189 |
RAL-THA-05e671eb-24
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cccc4C#N |
−7.8
± 0.2
|
5.7
± 0.1
|
5190 |
EN300-248374_2_1
|
|
CCO[C@@H]1COC[C@H]1NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.8
± 0.3
|
5.7
± 0.2
|
5191 |
EN300-6486855_2_1
|
|
Cn1c(cnn1)CC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.8
± 0.3
|
5.7
± 0.2
|
5192 |
MAK-UNK-8be7dca9-9
|
|
c1cc2c(cc1C(=O)O)cncc2NC(=O)C3CCOc4c3cc(cc4)Cl |
−7.84
± 0.07
|
5.71
± 0.05
|
5193 |
MAK-UNK-c749d764-12
|
|
c1ccc2c(c1)cncc2NC(=O)CC3CCCC(C3O)Cl |
−7.8
± 0.1
|
5.71
± 0.10
|
5194 |
EN300-181558_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CC5(CCC(CC5)O)O |
−7.8
± 0.4
|
5.7
± 0.3
|
5195 |
VLA-UCB-05e51b3f-16
|
|
C=CC(=O)N(c1cncc2c1cccc2)C(=O)Cc3cccc(c3)Cl |
−7.8
± 0.5
|
5.7
± 0.3
|
5196 |
EN300-1932013_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H](CC(F)(F)F)O |
−7.8
± 0.4
|
5.7
± 0.3
|
5197 |
EN300-219496_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCC[N@@+]6(C5)[NH2+]S6(=O)=O |
−7.8
± 0.5
|
5.7
± 0.4
|
5198 |
BEN-DND-a7517465-6
|
|
COc1cccc2c1c(cnc2)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.84
± 0.08
|
5.71
± 0.06
|
5199 |
EN300-261596_2_1
|
|
C=CCn1cc(nn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.8
± 0.3
|
5.7
± 0.2
|
5200 |
EN300-160498_1_1
|
|
COc1c([nH]c(=O)[nH]c1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.8
± 0.3
|
5.7
± 0.2
|