| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 3801 |
EN300-91609_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H]6[C@@H]5C6 |
−9.2
± 0.3
|
| 3802 |
EN300-14767_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCCN(C5)C(=O)N |
−9.2
± 0.3
|
| 3803 |
EN300-254840_1_1_1 |
|
C[C@@H]([C@@H]1CN(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.4
|
| 3804 |
ED_-GRI-5b13fbe2-20_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[NH2+]C[C@@H](O5)CO |
−9.2
± 0.4
|
| 3805 |
MAK-UNK-8be7dca9-2_1
|
|
c1cc2c(cc1CC(=O)N)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.20
± 0.08
|
| 3806 |
EN300-2855057_3_1_1 |
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)N5CCOCC5 |
−9.2
± 0.5
|
| 3807 |
EN300-257405_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@](C5)(CC#N)O |
−9.2
± 0.3
|
| 3808 |
EN300-103187_4_1_1 |
|
CCOCCNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
| 3809 |
EN300-303908_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@]6(C[C@H]6C5)O |
−9.2
± 0.3
|
| 3810 |
EN300-1717166_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CC56CC(C6)O |
−9.2
± 0.3
|
| 3811 |
ED_-GRI-5b13fbe2-30_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC[NH2+]CCO |
−9.2
± 0.6
|
| 3812 |
DAR-DIA-23e5a6a0-1_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@@H]5CCC6([NH2+]5)CCC6)Cl |
−9.2
± 0.4
|
| 3813 |
EN300-98648_2_1_1 |
|
CN1CC[C@@H](C1=O)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.2
|
| 3814 |
EN300-98648_2_1_1 |
|
CN1CC[C@@H](C1=O)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.2
|
| 3815 |
EN300-6489145_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCNS(=O)(=O)CC5 |
−9.2
± 0.3
|
| 3816 |
EN300-7445396_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5Cc6c[nH]cc6S5(=O)=O |
−9.2
± 0.4
|
| 3817 |
EN300-76541_1_3_1 |
|
CC[C@@H](C)[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−9.2
± 0.5
|
| 3818 |
EN300-142333_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C6(C5)CC6)O |
−9.2
± 0.3
|
| 3819 |
EN300-1709295_1_1_1 |
|
Cc1cnc(cn1)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3820 |
EN300-302290_3_1_1 |
|
CS(=O)(=O)N1CC(C1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3821 |
ADA-UCB-dc2b944c-16_1_1
|
|
CC1(C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4)C |
−9.2
± 0.1
|
| 3822 |
EDJ-MED-d203f206-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5nnco5 |
−9.2
± 0.2
|
| 3823 |
BEN-DND-a7517465-3_1
|
|
c1cc2cncc(c2c(c1)Cl)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.2
± 0.2
|
| 3824 |
EN300-87536_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCCN5C(=O)N |
−9.2
± 0.3
|
| 3825 |
EN300-118760_2_2_1 |
|
C[C@](C1CC1)(C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.3
|
| 3826 |
EN300-14949_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(cc5)OCC(=O)N |
−9.2
± 0.3
|
| 3827 |
EN300-59487_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC(=O)NC5 |
−9.2
± 0.3
|
| 3828 |
ED_-GRI-5b13fbe2-46_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCN5CC[C@@H](CC5=O)C(=O)[O-] |
−9.2
± 0.5
|
| 3829 |
EN300-90142_3_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCC[C@H](C5)C(=O)N |
−9.2
± 0.3
|
| 3830 |
EN300-173006_4_1_1 |
|
C[C@@H](c1nnnn1C)OCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.4
|
| 3831 |
DAR-DIA-0d514e7d-33_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3c4cc(ccc4O[C@H]5[C@H]3C5)Cl |
−9.2
± 0.2
|
| 3832 |
EN300-175487_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)CO |
−9.2
± 0.4
|
| 3833 |
EN300-225165_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC5CC(=O)NC(=O)C5 |
−9.2
± 0.3
|
| 3834 |
EDG-MED-5d232de5-1_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.19
± 0.05
|
| 3835 |
ALP-UNI-dbbfd3db-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)C#N |
−9.2
± 0.4
|
| 3836 |
MAT-POS-de59a476-2_1
|
|
CO[C@@H](c1ccc(c(c1)Cl)Cl)C(=O)Nc2cncc3c2cccc3 |
−9.2
± 0.3
|
| 3837 |
EDJ-MED-ee07cf00-11_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)[C@H]4CC[C@@H](O4)C(=O)N5CCCC5 |
−9.2
± 0.4
|
| 3838 |
RAL-THA-c11c1343-1_2
|
|
CC(=O)N1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.2
|
| 3839 |
EN300-381149_1_1_1 |
|
Cn1c(ncn1)C2(CN(C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6)O |
−9.2
± 0.3
|
| 3840 |
MIC-UNK-9582b2c5-1_4
|
|
CC(=O)N1CC[C@H]2[C@H](C1)CN(C(=O)[C@@H]2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3841 |
EN300-49064_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5COC5 |
−9.2
± 0.2
|
| 3842 |
ADA-UCB-dc2b944c-16_1
|
|
CC1(C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4)C |
−9.19
± 0.10
|
| 3843 |
EN300-217107_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@@H]5C(=O)N |
−9.2
± 0.3
|
| 3844 |
EN300-222969_4_2_1 |
|
CN1C[C@H](OC1=O)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.5
|
| 3845 |
EN300-25986_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCn5cccn5 |
−9.2
± 0.3
|
| 3846 |
EN300-141224_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCn6c(ncn6)C5 |
−9.2
± 0.3
|
| 3847 |
EN300-7457160_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H]5C[C@@H](ON5)CC6(COC6)O |
−9.2
± 0.3
|
| 3848 |
MAT-POS-e9e99895-5_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)c4cc5n(n4)CCO5 |
−9.2
± 0.3
|
| 3849 |
DAR-DIA-9e4459de-13_7
|
|
c1cc2c(c(c1)NCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@H]7CCC(=O)NC7=O)O |
−9.2
± 0.3
|
| 3850 |
ALP-POS-d3acb8cc-1_1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.18
± 0.09
|
| 3851 |
EN300-65839_4_2_1 |
|
CC[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.4
|
| 3852 |
EN300-172020_1_2_1 |
|
Cn1cc(cn1)C[C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.3
|
| 3853 |
EN300-119126_4_1_1 |
|
Cc1[nH]nc(n1)CC(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.4
|
| 3854 |
EDG-MED-90036822-60_2
|
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5ccnc5 |
−9.2
± 0.2
|
| 3855 |
EN300-212814_1_1_1 |
|
C[C@@H]1CN(C[C@@H](O1)CCO)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3856 |
EDG-MED-90036822-36_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](n5ccnc5)F |
−9.2
± 0.2
|
| 3857 |
EN300-132963_3_2_1 |
|
CN1[C@H](CCC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3858 |
EN300-223964_3_1_1 |
|
CC[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[NH+](C)C |
−9.2
± 0.4
|
| 3859 |
EN300-246747_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5CC(=O)NC5 |
−9.2
± 0.2
|
| 3860 |
MAT-POS-fce787c2-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3ccc(c(c3)Cl)Cl)(F)F |
−9.2
± 0.3
|
| 3861 |
LAU-MED-88a3970a-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4CCCCO)Cl |
−9.2
± 0.2
|
| 3862 |
MAT-POS-1f3f1a6f-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3ccc(c(c3)Cl)Cl)[NH3+] |
−9.2
± 0.4
|
| 3863 |
ALP-UNI-3735e77e-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4Cl)Cl |
−9.17
± 0.09
|
| 3864 |
EN300-1212475_1_1_1 |
|
CC1(CC(=O)NC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.2
± 0.2
|
| 3865 |
EN300-6482296_3_5_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CO[C@@H]6[C@H]5COC6 |
−9.2
± 0.3
|
| 3866 |
EN300-1664603_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCc5ccn[nH]5 |
−9.2
± 0.2
|
| 3867 |
EDJ-MED-e4b030d8-3_1_1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.17
± 0.09
|
| 3868 |
BEN-BAS-5c03e89e-1_2
|
|
CC(C)([C@H]1COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)O |
−9.2
± 0.1
|
| 3869 |
EN300-67191_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCN5CCCC5=O |
−9.2
± 0.3
|
| 3870 |
EN300-19242_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CO |
−9.2
± 0.3
|
| 3871 |
EN300-6729572_1_2_1 |
|
C[C@H]([C@@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.2
± 0.2
|
| 3872 |
EN300-17381_4_2_1 |
|
C[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
| 3873 |
EN300-17381_4_2_1 |
|
C[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
| 3874 |
EN300-17381_4_2_1 |
|
C[C@H](C(=O)N)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
| 3875 |
BEN-DND-c852c98b-5_1_1
|
|
CS(=O)(=O)c1ccc2cncc(c2c1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.17
± 0.09
|
| 3876 |
EN300-201551_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@@]5CC(F)(F)F |
−9.2
± 0.3
|
| 3877 |
EN300-206592_1_1_1 |
|
CCC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)N |
−9.2
± 0.2
|
| 3878 |
MAT-POS-de59a476-5_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3ccc(c(c3)Cl)Cl)OCCO |
−9.2
± 0.4
|
| 3879 |
EN300-77092_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC5OCCO5 |
−9.2
± 0.4
|
| 3880 |
RAL-THA-8416115c-14_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)Cc5cn[nH]n5 |
−9.2
± 0.3
|
| 3881 |
EN300-6764893_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H](C5)OCCO |
−9.2
± 0.3
|
| 3882 |
EDJ-MED-9e38fd34-1_1
|
|
C[C@@]1(c2cc(ccc2NC1=O)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.2
± 0.3
|
| 3883 |
MAT-POS-f9802937-7_1
|
|
COc1ccc2cncc(c2c1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.16
± 0.06
|
| 3884 |
EN300-226964_3_1_1 |
|
Cc1ccn(n1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3885 |
MIC-UNK-9582b2c5-3_2
|
|
CC(=O)N1CC[C@H]2[C@@H](C1)CN(C(=O)N2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−9.2
± 0.4
|
| 3886 |
MIC-UNK-644c43c7-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)CCNC(C(F)(F)F)C(F)(F)F |
−9.2
± 0.5
|
| 3887 |
EN300-310022_1_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H](CN5c6ccncn6)O |
−9.2
± 0.3
|
| 3888 |
EN300-294602_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccsc5S(=O)(=O)N |
−9.2
± 0.3
|
| 3889 |
EN300-6498856_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC[C@@H]5C(=O)NC(=O)N5 |
−9.2
± 0.2
|
| 3890 |
EN300-637424_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn(nn5)[C@@H]6COC[C@H]6O |
−9.2
± 0.4
|
| 3891 |
EN300-1072199_2_1_1 |
|
CO[C@@]1(CCCOC1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.2
± 0.3
|
| 3892 |
EN300-260760_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5cc(=O)[nH][nH]5 |
−9.2
± 0.3
|
| 3893 |
EN300-2007620_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H](OCC5)CO |
−9.2
± 0.3
|
| 3894 |
EN300-1179673_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5cccc(c5)C(=O)N |
−9.2
± 0.3
|
| 3895 |
EN300-139167_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5COCCO5 |
−9.2
± 0.2
|
| 3896 |
EN300-139167_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5COCCO5 |
−9.2
± 0.2
|
| 3897 |
EN300-139167_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5COCCO5 |
−9.2
± 0.2
|
| 3898 |
EN300-6489289_3_2_3 |
|
C[C@@H]1NN[C@H]2[N@H+]1[C@H](CC2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.2
± 0.4
|
| 3899 |
KAD-UNI-80f122c8-3_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]6CS(=O)(=O)C[C@H]6C5 |
−9.2
± 0.3
|
| 3900 |
EN300-104088_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)OCCO |
−9.2
± 0.3
|