Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
4001 |
EN300-147887_2
|
|
Cn1c(cnn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
6.9
± 0.1
|
4002 |
EN300-25986_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CCn5cccn5 |
−9.4
± 0.4
|
6.9
± 0.3
|
4003 |
EN300-314410_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C[C@H]5C(=O)N)O |
−9.4
± 0.2
|
6.9
± 0.2
|
4004 |
EN300-238405_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC5CC(=O)NC5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4005 |
EN300-370967_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCN5CCOC5=O |
−9.4
± 0.2
|
6.9
± 0.2
|
4006 |
EN300-114133_4
|
|
CCC(=O)N1CCC(C1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.6
|
6.9
± 0.4
|
4007 |
EN300-1179690_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC(C(=O)N)(F)F |
−9.4
± 0.3
|
6.9
± 0.2
|
4008 |
EN300-123400_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC(C5CCOC5)C(=O)N |
−9.4
± 0.2
|
6.9
± 0.1
|
4009 |
EN300-36845_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CNC(=O)C5CCCC5 |
−9.4
± 0.3
|
6.9
± 0.3
|
4010 |
EN300-262008_1
|
|
CON1CCC(CC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4011 |
EN300-104422_2
|
|
Cn1c(ncn1)CCNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4012 |
EN300-1706036_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC5C(=O)NCCO5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4013 |
EN300-1239522_2
|
|
CC(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)OC |
−9.4
± 0.2
|
6.9
± 0.1
|
4014 |
EN300-42683_1
|
|
CC(C)(CNC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N |
−9.4
± 0.3
|
6.9
± 0.2
|
4015 |
EN300-154700_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)(CO)CO |
−9.4
± 0.3
|
6.9
± 0.3
|
4016 |
EN300-51244_2
|
|
Cc1cc(n(n1)C)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4017 |
EN300-156995_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCCc5c[nH]nn5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4018 |
EN300-1238839_3
|
|
CS(=O)(=O)NCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.2
|
6.9
± 0.1
|
4019 |
EN300-199290_2
|
|
Cn1c(cnn1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
6.9
± 0.2
|
4020 |
EN300-124918_4
|
|
Cn1c(=O)[nH]c(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4021 |
EN300-172179_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CN5CCOC5=O |
−9.4
± 0.3
|
6.9
± 0.2
|
4022 |
EN300-189672_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)Cc5ccc(=O)[nH]c5 |
−9.4
± 0.4
|
6.9
± 0.3
|
4023 |
EN300-69876_1
|
|
Cn1cnnc1CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.9
± 0.2
|
4024 |
EN300-6498726_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](CO)CF |
−9.4
± 0.3
|
6.8
± 0.2
|
4025 |
EN300-217526_2
|
|
CCn1c(c(nn1)C)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.4
|
6.8
± 0.3
|
4026 |
EN300-264744_4
|
|
CC(C)(C(C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)F)O |
−9.4
± 0.3
|
6.8
± 0.2
|
4027 |
EN300-19016_2
|
|
COCCNC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
6.8
± 0.2
|
4028 |
EN300-7355979_2
|
|
Cn1cnc2c(c1=O)[nH]nc2C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|
6.8
± 0.2
|
4029 |
EN300-1704047_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5Cc6c(cn[nH]6)C5C(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4030 |
EN300-149975_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5(CCC5)CO |
−9.4
± 0.4
|
6.8
± 0.3
|
4031 |
EN300-07752_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(CC5C(=O)N)O |
−9.4
± 0.2
|
6.8
± 0.1
|
4032 |
EN300-42252_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn6cccnc6n5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4033 |
EN300-70323_1
|
|
Cc1nnc(n1C)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
6.8
± 0.1
|
4034 |
EN300-65383_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5cc[nH]c(=O)c5=O |
−9.4
± 0.3
|
6.8
± 0.2
|
4035 |
EN300-235010_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)C#N |
−9.4
± 0.3
|
6.8
± 0.2
|
4036 |
EN300-62449_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCNC(=O)C5CCC5 |
−9.4
± 0.4
|
6.8
± 0.3
|
4037 |
EN300-190026_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC(CO)C5CCCO5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4038 |
EN300-295372_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCn5ccnn5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4039 |
EN300-53395_2
|
|
CCS(=O)(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
6.8
± 0.3
|
4040 |
EN300-08033_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5CCS(=O)(=O)C5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4041 |
EN300-253462_2
|
|
CN(C)C(=O)[C@@H]1C[C@@H]1C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4042 |
EN300-1703852_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C[C@H]5COC(=O)N5 |
−9.4
± 0.4
|
6.8
± 0.3
|
4043 |
EN300-87334_1
|
|
Cn1c(ncn1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
6.8
± 0.2
|
4044 |
EN300-366233_1
|
|
CCN(C(C)C(=O)NC)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.2
|
6.8
± 0.2
|
4045 |
EN300-55355_1
|
|
CNC(=O)C1CCCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4046 |
EN300-62192_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5CC(=O)NC(=O)C5 |
−9.4
± 0.4
|
6.8
± 0.3
|
4047 |
EN300-321703_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCOC5COC5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4048 |
EN300-378836_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CN5CCCCS5(=O)=O |
−9.4
± 0.4
|
6.8
± 0.3
|
4049 |
EN300-69727_2
|
|
CC(C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)OC |
−9.4
± 0.4
|
6.8
± 0.3
|
4050 |
EN300-47046_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CCN(CC5)C(=O)C6CC6 |
−9.4
± 0.3
|
6.8
± 0.2
|
4051 |
EN300-307155_2
|
|
Cn1cnnc1C(CO)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4052 |
EN300-7355737_2
|
|
Cn1cc(c(n1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)N |
−9.4
± 0.4
|
6.8
± 0.3
|
4053 |
EN300-182579_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CN(C5)CC(F)F |
−9.4
± 0.3
|
6.8
± 0.2
|
4054 |
EN300-3044054_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5CCC(=O)N5C6CC6 |
−9.4
± 0.3
|
6.8
± 0.2
|
4055 |
EN300-30419_1
|
|
CS(=O)(=O)NCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
6.8
± 0.2
|
4056 |
EN300-178288_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC6CC6(C5)O |
−9.4
± 0.3
|
6.8
± 0.2
|
4057 |
EN300-182935_1
|
|
Cn1cnnc1C2CN(CCO2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.3
|
6.8
± 0.2
|
4058 |
EN300-39005_4
|
|
CN(CC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)OC |
−9.4
± 0.4
|
6.8
± 0.3
|
4059 |
EN300-53677_2
|
|
CS(=O)(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
6.8
± 0.2
|
4060 |
EN300-6738887_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C6CCC5C(CCC6O)O |
−9.4
± 0.2
|
6.8
± 0.2
|
4061 |
EN300-201164_2
|
|
CC(C)(C)C(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4062 |
EN300-108022_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCn5cnnn5 |
−9.4
± 0.2
|
6.8
± 0.2
|
4063 |
EN300-124652_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCCC5CC(=O)N |
−9.4
± 0.2
|
6.8
± 0.1
|
4064 |
EN300-110012_3
|
|
CCC(C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)N(C)C |
−9.4
± 0.3
|
6.8
± 0.2
|
4065 |
EN300-307198_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5(COC5)CO |
−9.4
± 0.3
|
6.8
± 0.2
|
4066 |
EN300-1253178_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NC5CC5 |
−9.4
± 0.2
|
6.8
± 0.1
|
4067 |
EN300-2924757_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(cc5)CC(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4068 |
EN300-746187_2
|
|
Cc1nc2n(n1)CC(CC2)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.4
± 0.2
|
6.8
± 0.2
|
4069 |
EN300-23019_1
|
|
CC(C)(C)NC(=O)CN(C)C(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
6.8
± 0.3
|
4070 |
EN300-1605043_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5(CC5)C(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4071 |
EN300-127629_2
|
|
CC1(COCCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−9.4
± 0.2
|
6.8
± 0.1
|
4072 |
EN300-7466449_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H]6C[C@@H](C5)[C@H]([C@H]6O)O |
−9.4
± 0.3
|
6.8
± 0.2
|
4073 |
EN300-204935_4
|
|
Cn1ncc(n1)C(=O)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4074 |
EN300-200426_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cc6n(n5)CCNC6=O |
−9.4
± 0.3
|
6.8
± 0.2
|
4075 |
EN300-189495_1
|
|
CC(=O)NCC(C)(C)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
6.8
± 0.2
|
4076 |
EN300-1071940_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CC5(CCCOC5)O |
−9.4
± 0.3
|
6.8
± 0.2
|
4077 |
EN300-36911_2
|
|
CNC(=O)NCC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.2
|
6.8
± 0.2
|
4078 |
EN300-7542483_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5COCCOC5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4079 |
EN300-182124_4
|
|
COC1(CC1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4080 |
EN300-219020_2
|
|
Cn1ncc(n1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.2
|
6.8
± 0.1
|
4081 |
EN300-82553_2
|
|
COc1ccc(nn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4082 |
EN300-54304_2
|
|
CCOCCOCC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.2
|
6.8
± 0.1
|
4083 |
EN300-10336_1
|
|
c1ccc(cc1)CC(C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)NC(=O)N |
−9.4
± 0.2
|
6.8
± 0.2
|
4084 |
EN300-1709315_2
|
|
CC1(CCCNS1(=O)=O)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4085 |
EN300-1699871_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC5CCS(=O)(=O)N5 |
−9.4
± 0.2
|
6.8
± 0.2
|
4086 |
EN300-244842_1
|
|
C[C@@H]1CN(C[C@H]1C(=O)N)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4087 |
EN300-1655797_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@H]([C@@H](C5)O)F |
−9.4
± 0.3
|
6.8
± 0.2
|
4088 |
EN300-04433_1
|
|
CSCCC(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4089 |
EN300-48760_2
|
|
CC(C)(C)NC(=O)CNC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.4
|
6.8
± 0.3
|
4090 |
EDJ-MED-e4b030d8-5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4C5COC5)Cl |
−9.4
± 0.2
|
6.8
± 0.1
|
4091 |
EN300-7444106_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5CCc6nnnn6C5 |
−9.4
± 0.2
|
6.8
± 0.2
|
4092 |
EN300-173562_2
|
|
CC1CC(CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.4
± 0.1
|
6.83
± 0.08
|
4093 |
EN300-14767_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5CCCN(C5)C(=O)N |
−9.4
± 0.4
|
6.8
± 0.3
|
4094 |
EN300-74450_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5[nH]ccn5 |
−9.4
± 0.2
|
6.8
± 0.2
|
4095 |
EN300-1689158_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc([nH]n5)C(=O)N |
−9.4
± 0.3
|
6.8
± 0.2
|
4096 |
EN300-396535_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5(CCC5)S(=O)(=O)N |
−9.4
± 0.4
|
6.8
± 0.3
|
4097 |
DAR-DIA-0d514e7d-29
|
|
C[C@@H]1COc2ccc(cc2[C@]1(C)C(=O)Nc3cncc4c3cccc4)Cl |
−9.4
± 0.2
|
6.8
± 0.1
|
4098 |
EN300-135078_1
|
|
CCN1CCN(CC1=O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.4
± 0.3
|
6.8
± 0.2
|
4099 |
EN300-50631_2
|
|
CN(C)S(=O)(=O)CCC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.4
± 0.3
|
6.8
± 0.2
|
4100 |
EN300-82104_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCCc5[nH]cnn5 |
−9.4
± 0.3
|
6.8
± 0.2
|