| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 4001 |
EN300-62192_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C5CC(=O)NC(=O)C5 |
−9.1
± 0.3
|
| 4002 |
EN300-30458_3_1_1 |
|
CN1CC[C@@H](CC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4003 |
MAK-UNK-ffc90da7-6_2
|
|
C[C@H](C[NH2+]CCCO)c1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl |
−9.1
± 0.4
|
| 4004 |
EN300-1709745_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5cn(nn5)C6COC6 |
−9.1
± 0.2
|
| 4005 |
EN300-253187_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC[C@@H]5COCO5 |
−9.1
± 0.3
|
| 4006 |
EN300-52467_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCOCCO |
−9.1
± 0.3
|
| 4007 |
EN300-52467_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCOCCO |
−9.1
± 0.3
|
| 4008 |
EN300-52467_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCOCCO |
−9.1
± 0.3
|
| 4009 |
EN300-85760_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCO5 |
−9.1
± 0.2
|
| 4010 |
EN300-7457160_1_2_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[C@@H](ON5)CC6(COC6)O |
−9.1
± 0.4
|
| 4011 |
EN300-332601_1_1_1 |
|
CC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−9.1
± 0.2
|
| 4012 |
EN300-305294_1_7_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6C[C@H]([C@H]6C5)O |
−9.1
± 0.3
|
| 4013 |
FRA-DIA-13af2da5-2_1
|
|
CN(C)c1ccc(cc1)[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.2
|
| 4014 |
EN300-204935_2_1_1 |
|
Cn1ncc(n1)C(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4015 |
EN300-311920_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@]5(CCS(=O)(=O)C5)F |
−9.1
± 0.3
|
| 4016 |
EN300-103219_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CC(=O)N5 |
−9.1
± 0.3
|
| 4017 |
EN300-261859_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5C(=O)NSN5 |
−9.1
± 0.3
|
| 4018 |
EN300-60033_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)COC[C@H]5CCCO5 |
−9.1
± 0.3
|
| 4019 |
EDJ-MED-d203f206-28_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5CCN(CC5)c6[nH]ncn6 |
−9.1
± 0.3
|
| 4020 |
CHO-MSK-5891c1ff-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CCC[C@@H](C5)C(=O)N |
−9.1
± 0.3
|
| 4021 |
EN300-7434114_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)[C@@H](CCCO6)O |
−9.1
± 0.2
|
| 4022 |
EN300-6489289_3_2_2 |
|
C[C@H]1NN[C@@H]2[N@H+]1[C@H](CC2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.1
± 0.6
|
| 4023 |
MAT-POS-fce787c2-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](CO)c3ccc(c(c3)Cl)Cl |
−9.1
± 0.3
|
| 4024 |
EN300-7445396_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5Cc6c[nH]cc6S5(=O)=O |
−9.1
± 0.5
|
| 4025 |
EDJ-MED-d203f206-18_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5nccnn5 |
−9.1
± 0.3
|
| 4026 |
EN300-69162_4_1_1 |
|
C[C@@H](COC)C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.3
|
| 4027 |
EN300-219531_2_1_1 |
|
CCC[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.1
± 0.3
|
| 4028 |
DAR-DIA-9e4459de-11_1
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−9.1
± 0.5
|
| 4029 |
RAL-THA-1d44ff04-13_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C(=O)NO |
−9.1
± 0.3
|
| 4030 |
EDG-MED-971238d3-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO |
−9.1
± 0.1
|
| 4031 |
EN300-24804_1_1_1 |
|
COC(=O)CCCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.2
|
| 4032 |
EN300-60862_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@H](C5)C(=O)N |
−9.1
± 0.3
|
| 4033 |
EDJ-MED-ee07cf00-6_1
|
|
Cn1cc(cn1)C2=NO[C@@H](C2)C(=O)N[C@@H](c3cccc(c3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.5
|
| 4034 |
EN300-817777_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@H]6[C@@]5(C6)C(=O)N |
−9.1
± 0.3
|
| 4035 |
EN300-1264816_1_2_1 |
|
CN1CC[C@H](C1=O)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4036 |
EN300-1264816_1_2_1 |
|
CN1CC[C@H](C1=O)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4037 |
EN300-65115_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(C5)O |
−9.1
± 0.3
|
| 4038 |
EN300-99391_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CO[C@@H]5CCOC5 |
−9.1
± 0.3
|
| 4039 |
EN300-188217_1_1_1 |
|
CC(C)(CS(=O)(=O)C)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.3
|
| 4040 |
EN300-43090_1_1_1 |
|
Cc1nnc(o1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4041 |
EN300-1387145_3_4_1 |
|
CS(=O)(=O)[C@H]1CCC[C@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.4
|
| 4042 |
DAR-DIA-9e4459de-13_2
|
|
c1cc2c(c(c1)NCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−9.1
± 0.4
|
| 4043 |
JOH-UNI-ee5ed7c8-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](CC#N)c3cccc(c3)Cl |
−9.1
± 0.3
|
| 4044 |
MAK-UNK-8be7dca9-3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3c4cc(ccc4OC[C@@H]3C[NH3+])Cl |
−9.1
± 0.1
|
| 4045 |
EN300-220194_1_1_1 |
|
C[C@@H]([C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)OC |
−9.1
± 0.3
|
| 4046 |
KAD-UNI-8a629cb0-22_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cc6c([nH]c(=O)[nH]6)nc5 |
−9.1
± 0.3
|
| 4047 |
EN300-52009_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5(CCC5)O |
−9.1
± 0.3
|
| 4048 |
JOH-SUS-a69c159d-2_1
|
|
c1ccc2c(c1)c(cnc2F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.07
± 0.05
|
| 4049 |
EN300-75342_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5ccnc5 |
−9.1
± 0.2
|
| 4050 |
EN300-75342_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5ccnc5 |
−9.1
± 0.2
|
| 4051 |
EN300-7353672_1_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]([C@H](CC5)O)CO |
−9.1
± 0.4
|
| 4052 |
EN300-783124_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]([C@@H]5CCOC5)F |
−9.1
± 0.3
|
| 4053 |
VLA-UCB-05e51b3f-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4O[C@H]5CC(=O)N5)Cl)CCC6CCCCC6 |
−9.1
± 0.4
|
| 4054 |
EN300-1707870_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@](C5)(CCO)CO |
−9.1
± 0.4
|
| 4055 |
EN300-1072199_2_2_1 |
|
CO[C@]1(CCCOC1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4056 |
EDG-MED-90036822-92_1
|
|
C[N@](CCC#N)CC(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(F)F |
−9.1
± 0.3
|
| 4057 |
EN300-68889_3_1_1 |
|
CCNC(=O)CCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.3
|
| 4058 |
JOH-SUS-a69c159d-5_1
|
|
c1cc2c(cc1F)c(cnc2F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.06
± 0.06
|
| 4059 |
ALP-UNI-3735e77e-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCNc4c3cc(c(c4)Cl)Cl |
−9.1
± 0.3
|
| 4060 |
MAT-POS-1f3f1a6f-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3ccc(c(c3)Cl)Cl)[NH2+]CC4CC4 |
−9.1
± 0.4
|
| 4061 |
ED_-GRI-5b13fbe2-54_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCCn5c(c(nn5)C[NH3+])C(F)F |
−9.1
± 0.4
|
| 4062 |
EN300-84785_1_1_1 |
|
C[C@@H](CC(=O)N)NC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.3
|
| 4063 |
ALP-POS-696356e4-1_1_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.06
± 0.05
|
| 4064 |
EN300-7431629_1_1_1 |
|
Cc1nnc2n1CC[C@@]2(C)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.1
± 0.3
|
| 4065 |
EN300-7121836_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]c5F |
−9.1
± 0.2
|
| 4066 |
EN300-42819_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCC(=O)NC5 |
−9.1
± 0.2
|
| 4067 |
EN300-1707774_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)OC(=O)N |
−9.1
± 0.2
|
| 4068 |
EDG-MED-90036822-74_1
|
|
C[N@@H+]1C[C@@H](C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−9.1
± 0.2
|
| 4069 |
EN300-212266_3_1_1 |
|
CC(C)C(=O)N[C@@H](CO)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.4
|
| 4070 |
EN300-82616_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCCNC5=O |
−9.1
± 0.3
|
| 4071 |
EN300-31242_4_1_1 |
|
COCC(=O)NCCC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.3
|
| 4072 |
EN300-208959_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CNC(=O)C[C@@H]5C(F)(F)F |
−9.1
± 0.3
|
| 4073 |
EN300-1644703_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5(CC5)O |
−9.1
± 0.2
|
| 4074 |
EN300-7457160_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5C[C@H](ON5)CC6(COC6)O |
−9.1
± 0.4
|
| 4075 |
DAR-DIA-0d514e7d-16_1
|
|
C[C@H]1COc2c(cc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)c5ccccc5F |
−9.1
± 0.2
|
| 4076 |
EN300-314088_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H]([C@@H](C5)CO)CO |
−9.1
± 0.3
|
| 4077 |
MIC-UNK-d36ab305-4_2
|
|
CN(C)c1ccc(cc1)[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.1
± 0.4
|
| 4078 |
EN300-14752_1_1_1 |
|
CC(=O)N1CCC[C@@H](C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.2
|
| 4079 |
EN300-7444533_4_2_1 |
|
C[C@H]1C[C@@H](C(=O)O1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.1
± 0.3
|
| 4080 |
EN300-28177_2_1_1 |
|
C[C@@H](C(=O)N1CCC[C@@H](C1)C(=O)N)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.0
± 0.4
|
| 4081 |
ALP-UNI-dbbfd3db-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)Cl |
−9.0
± 0.3
|
| 4082 |
EN300-7444316_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H]([C@@H](C5)C(=O)N)C(=O)N |
−9.0
± 0.4
|
| 4083 |
EN300-10397_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CNC(=O)N |
−9.0
± 0.2
|
| 4084 |
EN300-55744_1_1_1 |
|
CCCC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.0
± 0.3
|
| 4085 |
EN300-314274_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cncc6c5CCNC6=O |
−9.0
± 0.3
|
| 4086 |
EN300-861925_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@@H](CO)F |
−9.0
± 0.2
|
| 4087 |
EN300-35789_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5cccnc5=O |
−9.0
± 0.3
|
| 4088 |
MAT-POS-f9802937-4_1
|
|
CN(C)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.2
|
| 4089 |
EN300-62074_1_1_1 |
|
CC(=O)N[C@@H](CCOC)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.3
|
| 4090 |
EN300-103187_1_1_1 |
|
CCOCCNC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.2
|
| 4091 |
EN300-14458_4_2_1 |
|
C[C@H](C(=O)N(C)C)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.3
|
| 4092 |
EN300-7375395_2_1_1 |
|
CC[C@@H](C(=O)N)NC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.3
|
| 4093 |
EN300-651177_1_1_1 |
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)Cn5cnnn5 |
−9.0
± 0.4
|
| 4094 |
EN300-6745081_1_2_1 |
|
C[C@]1(CCCCNC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.0
± 0.3
|
| 4095 |
EN300-39305_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CN5CCS(=O)(=O)CC5 |
−9.0
± 0.3
|
| 4096 |
EN300-175186_1_2_1 |
|
C[C@H](CO)O[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.0
± 0.3
|
| 4097 |
EN300-252683_1_1_1 |
|
CO[C@@H]1COC[C@@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.0
± 0.3
|
| 4098 |
ALP-POS-d3acb8cc-1_1_1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.05
± 0.09
|
| 4099 |
EN300-130644_1_1_1 |
|
CNC(=O)[C@@H]1CN(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.0
± 0.3
|
| 4100 |
EN300-102347_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC5(COC5)CO |
−9.0
± 0.2
|