Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
4101 |
EN300-68794_3_1
|
|
CS(=O)(=O)CCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
4102 |
DAR-DIA-6a508060-11
|
|
c1ccc2c(c1)cncc2NC(=O)C3CC(C3)C4CC4Cl |
−8.8
± 0.1
|
6.39
± 0.09
|
4103 |
EN300-225560_1_1
|
|
CCn1c(cnn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
4104 |
EN300-251851_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCc5[nH]nnn5 |
−8.8
± 0.2
|
6.4
± 0.2
|
4105 |
EN300-77464_2_1
|
|
C[C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.2
|
6.4
± 0.2
|
4106 |
EN300-47606_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)NC[C@@H]5CCS(=O)(=O)C5 |
−8.8
± 0.4
|
6.4
± 0.3
|
4107 |
EN300-33478_1_2
|
|
CCN1C[C@H](CC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
4108 |
EN300-43090_2_1
|
|
Cc1nnc(o1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
4109 |
EN300-99983_2_1
|
|
CNC(=O)Cc1nc(on1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
4110 |
EN300-269453_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCc6nnnn6C5 |
−8.8
± 0.3
|
6.4
± 0.2
|
4111 |
EN300-178515_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCC(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
4112 |
EN300-16216_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC(=O)N |
−8.8
± 0.2
|
6.4
± 0.2
|
4113 |
EN300-7465104_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5CC(C5)(C6(CCC6)O)O |
−8.8
± 0.3
|
6.4
± 0.3
|
4114 |
VLA-UCB-34f3ed0c-13
|
|
c1ccc2c(c1)cncc2NC(=O)N(CCN3CCNCC3)c4cccc(c4)Cl |
−8.8
± 0.4
|
6.4
± 0.3
|
4115 |
EN300-46832_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NC[C@H]5CCOC5 |
−8.8
± 0.3
|
6.4
± 0.2
|
4116 |
EN300-1605566_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C[NH+]6CC[NH+]5CC6 |
−8.8
± 0.4
|
6.4
± 0.3
|
4117 |
EN300-722418_1_3
|
|
C[C@@H](CN(C[C@H](C)O)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.4
|
6.4
± 0.3
|
4118 |
EN300-246248_4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@H]5CCNC5=O |
−8.8
± 0.4
|
6.4
± 0.3
|
4119 |
MAT-POS-f9802937-7
|
|
COc1ccc2cncc(c2c1)NC(=O)C3CCOc4c3cc(cc4)Cl |
−8.75
± 0.06
|
6.38
± 0.04
|
4120 |
EN300-159953_1_1
|
|
CN([C@@H]1CC[N@@H+]2CCO[C@H]1C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.4
|
6.4
± 0.3
|
4121 |
EN300-7461217_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5C[C@H]([C@@H](C5)F)O |
−8.8
± 0.3
|
6.4
± 0.3
|
4122 |
MAT-POS-f9802937-8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCNc4c3cc(c(c4)Cl)Cl |
−8.8
± 0.2
|
6.4
± 0.2
|
4123 |
EDJ-MED-9e38fd34-1
|
|
CC1(c2cc(ccc2NC1=O)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.2
|
4124 |
ADA-UCB-dc2b944c-11
|
|
c1ccc2c(c1)c(cnc2Br)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.75
± 0.09
|
6.38
± 0.07
|
4125 |
EDG-MED-ba1ac7b9-31
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN(CC5)C6CCCOC6 |
−8.8
± 0.3
|
6.4
± 0.2
|
4126 |
LEE-CAM-7ab9b158-4
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)COCC5CN6CC(O5)CCC6=O |
−8.8
± 0.4
|
6.4
± 0.3
|
4127 |
MIC-UNK-644c43c7-4
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)CNC(C(F)(F)F)C(F)(F)F |
−8.8
± 0.4
|
6.4
± 0.3
|
4128 |
EN300-181938_4_2
|
|
C[C@](CC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C=C)O |
−8.8
± 0.3
|
6.4
± 0.2
|
4129 |
EN300-78727_1_1
|
|
Cc1nc(no1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.4
± 0.2
|
4130 |
EN300-188585_1_1
|
|
CC1(CCS(=O)(=O)CC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4131 |
EN300-39101_1_1
|
|
CCOC(=O)N(C)CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.4
± 0.2
|
4132 |
MIC-UNK-5a93dd5f-1
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3cccc(c3)Cl)N4CC5CCCC5C4 |
−8.7
± 0.3
|
6.4
± 0.2
|
4133 |
EN300-02015_4_1
|
|
COCCNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.4
± 0.3
|
4134 |
EDG-MED-90036822-30
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(CNC5COC5)(F)F |
−8.7
± 0.3
|
6.4
± 0.2
|
4135 |
EDG-MED-90036822-74
|
|
CN1CC(CC1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−8.7
± 0.1
|
6.37
± 0.10
|
4136 |
EN300-299532_2_2
|
|
CC(C)([C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)O |
−8.7
± 0.2
|
6.4
± 0.2
|
4137 |
EDG-MED-90036822-97
|
|
CN1CCC(CC1)[C@H](CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.3
|
6.4
± 0.2
|
4138 |
DAR-DIA-0d514e7d-20_1
|
|
C[C@H]1COc2c(cc(cc2N3CCOCC3)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.4
± 0.2
|
4139 |
EN300-7399047_1_1
|
|
CC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.4
± 0.2
|
4140 |
DAR-DIA-0d514e7d-27
|
|
C[C@@]1(c2cc(cc(c2OCC1(C)C)OC)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.2
|
6.4
± 0.2
|
4141 |
DAR-DIA-0cde14eb-58
|
|
CC(c1cccc(c1)C2(CC2)I)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.4
± 0.3
|
4142 |
EN300-244947_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCc5cn[nH]n5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4143 |
EN300-179091_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)COC(F)F |
−8.7
± 0.2
|
6.4
± 0.2
|
4144 |
EN300-23317_2_2
|
|
C[C@H](C(=O)NCCOC)OC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.4
± 0.3
|
4145 |
EN300-36851_1_2
|
|
C[C@H]1C[C@@H]1C(=O)NCCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4146 |
RAL-THA-05e671eb-17
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cc(cc4F)Cl |
−8.74
± 0.06
|
6.37
± 0.04
|
4147 |
EN300-180575_2_1
|
|
C[C@@H]1CCS(=O)(=O)CCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4148 |
EN300-36731_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5c(ccs5)n6cnnn6 |
−8.7
± 0.2
|
6.4
± 0.2
|
4149 |
EN300-218116_4_1
|
|
CC(CO)(CO)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.4
± 0.3
|
4150 |
EN300-73582_2_1
|
|
CCS(=O)(=O)NCCOC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.4
± 0.2
|
4151 |
EN300-244659_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C[C@H]5CO)F |
−8.7
± 0.3
|
6.4
± 0.2
|
4152 |
EN300-98038_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC5NC(=O)NN5 |
−8.7
± 0.2
|
6.4
± 0.1
|
4153 |
EN300-1709202_2_1
|
|
COC[C@@H](C1(CC1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.4
|
6.4
± 0.3
|
4154 |
EN300-360158_3_1
|
|
CC1(C[C@@](CO1)(CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O)C |
−8.7
± 0.4
|
6.4
± 0.3
|
4155 |
EN300-113234_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CC(=O)OC5 |
−8.7
± 0.2
|
6.4
± 0.1
|
4156 |
EN300-2011083_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCC(=O)OCC5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4157 |
EN300-6763991_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5nnc6n5CCOC6 |
−8.7
± 0.3
|
6.4
± 0.2
|
4158 |
EN300-106781_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCn5ccc(=O)[nH]c5=O |
−8.7
± 0.4
|
6.4
± 0.3
|
4159 |
EN300-317085_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H]([C@@H](C5)F)O |
−8.7
± 0.2
|
6.4
± 0.2
|
4160 |
EN300-6737762_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCCCNC5=O |
−8.7
± 0.3
|
6.4
± 0.2
|
4161 |
ALF-EVA-ced740bd-2
|
|
COc1cc2cncc(c2c(c1)Cl)NC(=O)C3CCOc4c3cc(cc4)Cl |
−8.7
± 0.2
|
6.4
± 0.2
|
4162 |
EN300-1264816_1_1
|
|
CN1CC[C@@H](C1=O)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4163 |
EN300-16772_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCCO |
−8.7
± 0.2
|
6.4
± 0.2
|
4164 |
EN300-31562_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5c[nH]nc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4165 |
EN300-260696_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5C[C@@H]([C@@H]5n6cccn6)O |
−8.7
± 0.2
|
6.4
± 0.2
|
4166 |
EN300-1601684_2_1
|
|
CC1([C@@H](OCCO1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−8.7
± 0.4
|
6.4
± 0.3
|
4167 |
EN300-156212_1_1
|
|
Cn1c(nnn1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.4
± 0.2
|
4168 |
EN300-7370063_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)CO |
−8.7
± 0.2
|
6.4
± 0.1
|
4169 |
EN300-6473273_1_1
|
|
Cn1c(ccn1)[C@@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.2
|
6.4
± 0.1
|
4170 |
EN300-1600363_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5C[C@H]5C#N |
−8.7
± 0.3
|
6.4
± 0.2
|
4171 |
EN300-212142_1_1
|
|
Cn1ncc(n1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.4
± 0.2
|
4172 |
EN300-39504_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCCS(=O)(=O)N |
−8.7
± 0.4
|
6.4
± 0.3
|
4173 |
KAD-UNI-8a629cb0-21
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN(CC5)CC(CO)(F)F |
−8.7
± 0.5
|
6.4
± 0.3
|
4174 |
DAR-DIA-0d514e7d-12
|
|
C[C@H]1COc2c(cc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)c5ccc(cc5F)F |
−8.7
± 0.2
|
6.3
± 0.1
|
4175 |
EN300-301690_2_2
|
|
CS(=O)(=O)[N@@]1CC[C@H](C1)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
4176 |
EN300-1664105_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)n6cc(nn6)CO |
−8.7
± 0.3
|
6.3
± 0.2
|
4177 |
EN300-384027_1_1
|
|
COC(=O)[C@@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.3
± 0.2
|
4178 |
EN300-96797_1_1
|
|
C[C@@H]1CN(CC(=O)N1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
6.3
± 0.2
|
4179 |
EN300-132523_3_1
|
|
C[N@@](CCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)C |
−8.7
± 0.4
|
6.3
± 0.3
|
4180 |
EN300-104891_1_1
|
|
CNC(=O)c1cccc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
4181 |
EN300-147628_1_1
|
|
CNC(=O)N1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
4182 |
EN300-25986_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCn5cccn5 |
−8.7
± 0.3
|
6.3
± 0.2
|
4183 |
EN300-7435482_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C6(C5)CCOCC6)O |
−8.7
± 0.3
|
6.3
± 0.2
|
4184 |
EN300-22880_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)N5CCC[C@@H](C5)C(=O)N |
−8.7
± 0.4
|
6.3
± 0.3
|
4185 |
EN300-7434398_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5(CC5)c6[nH]ncn6 |
−8.7
± 0.3
|
6.3
± 0.2
|
4186 |
ED_-GRI-5b13fbe2-58
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCn5cc(nn5)C6CCCN6 |
−8.7
± 0.3
|
6.3
± 0.2
|
4187 |
EN300-00903_2_1
|
|
Cc1ccnc2[n+]1NC(N2)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.7
± 0.3
|
6.3
± 0.2
|
4188 |
EDJ-MED-d203f206-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5CC56CC(C6)O |
−8.7
± 0.3
|
6.3
± 0.2
|
4189 |
EN300-1264911_2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@H](CF)O |
−8.7
± 0.3
|
6.3
± 0.2
|
4190 |
EN300-139268_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C(=O)NCC(F)(F)F |
−8.7
± 0.3
|
6.3
± 0.2
|
4191 |
EN300-208959_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CNC(=O)C[C@@H]5C(F)(F)F |
−8.7
± 0.3
|
6.3
± 0.2
|
4192 |
EN300-72272_1_4
|
|
C[C@H]([C@H](C)O)NC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.3
± 0.2
|
4193 |
EN300-124376_1_1
|
|
CN(C[C@@H](CO)O)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.3
± 0.3
|
4194 |
EN300-6238494_4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)[C@H]5COCCO5 |
−8.7
± 0.3
|
6.3
± 0.3
|
4195 |
EN300-35843_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5NC(=O)NN5 |
−8.7
± 0.2
|
6.3
± 0.1
|
4196 |
EN300-1681046_2_1
|
|
Cn1c2c(c(n1)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)COCC2 |
−8.7
± 0.3
|
6.3
± 0.2
|
4197 |
EN300-219802_2_1
|
|
Cn1cnc2c1c(cc(=O)[nH]2)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.7
± 0.3
|
6.3
± 0.2
|
4198 |
EN300-39476_1_1
|
|
Cc1c(cn(n1)CCO)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
4199 |
EN300-315737_1_1
|
|
CSCC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−8.7
± 0.3
|
6.3
± 0.2
|
4200 |
EN300-69708_1_1
|
|
Cc1c(c(=O)[n+]2c([nH]1)cc[nH]2)CC(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.7
± 0.3
|
6.3
± 0.2
|