Compounds

Showing 3801 through 3900 of 6426
Rank Compound SMILES ΔG / kcal M-1 pIC50
3801 EN300-113234_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC(=O)OC5 −9.0 ± 0.2 6.5 ± 0.2
3802 EN300-195756_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H]5CCC(=O)N5 −9.0 ± 0.2 6.5 ± 0.2
3803 KAD-UNI-8a629cb0-3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cc(sc5)S(=O)(=O)N −9.0 ± 0.3 6.5 ± 0.2
3804 EN300-94856_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC5CC(C5)O −9.0 ± 0.3 6.5 ± 0.2
3805 EN300-237224_2_1 molecule C[NH+]1CCC(CC1)OCC(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −9.0 ± 0.3 6.5 ± 0.2
3806 PET-UNK-dd44aeb6-1 molecule c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3F)Cl −9.0 ± 0.2 6.5 ± 0.2
3807 EN300-176877_3_1 molecule CN(C)C(=O)CCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −9.0 ± 0.3 6.5 ± 0.2
3808 BEN-BAS-c2bc0d80-4 molecule c1ccc2c(c1)cncc2NC(=O)C3CC=Nc4c3[nH]c(cc4=O)Cl −9.0 ± 0.3 6.5 ± 0.2
3809 EN300-1911992_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@@H]([C@@H]5CCOC5)O −9.0 ± 0.4 6.5 ± 0.3
3810 PET-UNK-dd44aeb6-2 molecule c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3Cl)Cl −9.0 ± 0.3 6.5 ± 0.2
3811 EDJ-MED-e4b030d8-2 molecule C[C@@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 −8.95 ± 0.05 6.52 ± 0.03
3812 EN300-7442332_1_1 molecule Cc1c(n(cn1)OC)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.2
3813 EN300-13489_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5CCN(CC5)C(=O)N −8.9 ± 0.3 6.5 ± 0.2
3814 EN300-247617_1_1 molecule Cc1cc(ncc1C(=O)N)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.2
3815 EN300-103144_4_1 molecule CSCC[C@@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O −8.9 ± 0.4 6.5 ± 0.3
3816 EN300-6745453_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5Cc6nncn6C5 −8.9 ± 0.3 6.5 ± 0.2
3817 EN300-260696_1_6 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5C[C@@H]([C@H]5n6cccn6)O −8.9 ± 0.3 6.5 ± 0.2
3818 EN300-174603_2_1 molecule CN(C(=O)CCOC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)OC −8.9 ± 0.3 6.5 ± 0.2
3819 DAR-DIA-6a508060-10 molecule CC1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.1 6.51 ± 0.07
3820 EN300-158274_1_1 molecule CC(=O)N1C[C@H](C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O −8.9 ± 0.3 6.5 ± 0.3
3821 EN300-31845_3_1 molecule COCCN1C[C@@H](CC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.4 6.5 ± 0.3
3822 EDG-MED-ba1ac7b9-10 molecule c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCCC5c6cc[nH]n6 −8.9 ± 0.4 6.5 ± 0.3
3823 EN300-173562_1_3 molecule C[C@@H]1C[C@H](CN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O −8.9 ± 0.2 6.5 ± 0.2
3824 MIC-UNK-d36ab305-4 molecule CN(C)c1ccc(cc1)C(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3825 EDJ-MED-e4b030d8-7 molecule COc1cc(cc2c1OCC[C@H]2C(=O)Nc3cncc4c3cccc4)Cl −8.9 ± 0.1 6.51 ± 0.08
3826 EN300-264301_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H]5CCC(=O)N5 −8.9 ± 0.3 6.5 ± 0.2
3827 EN300-23318_3_1 molecule C[C@@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)OCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.4 6.5 ± 0.3
3828 EN300-81038_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(C5)COC6 −8.9 ± 0.3 6.5 ± 0.2
3829 EN300-6489289_1_1 molecule Cc1nnc2n1[C@@H](CC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 −8.9 ± 0.2 6.5 ± 0.2
3830 EN300-39007_1_1 molecule CCN(CC(=O)NC)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3831 EN300-211482_2_1 molecule C[C@@H](C(=O)NC)OC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.2 6.5 ± 0.1
3832 DAR-DIA-0cde14eb-47 molecule c1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3)C4(CC4)Cl −8.9 ± 0.3 6.5 ± 0.3
3833 EN300-395719_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCO[C@H]6COC[C@H]6C5 −8.9 ± 0.3 6.5 ± 0.2
3834 EN300-249245_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)(C(F)F)O −8.9 ± 0.2 6.5 ± 0.2
3835 JOH-UNI-ee5ed7c8-9 molecule CN(c1c2ccccc2cnc1C#N)C(=O)Cc3cccc(c3)Cl −8.9 ± 0.3 6.5 ± 0.2
3836 EN300-44873_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC[N@@]5CCCS5(=O)=O −8.9 ± 0.4 6.5 ± 0.3
3837 EN300-1588613_3_4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CC[N@H+]6[C@H]5COCC6 −8.9 ± 0.5 6.5 ± 0.3
3838 EN300-24014_3_1 molecule CS(=O)(=O)[N@@]1CCCC[C@@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.4 6.5 ± 0.3
3839 EDJ-MED-d08626de-4 molecule CO[C@]1(CCOc2c1cc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.1 6.50 ± 0.09
3840 EN300-318305_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CC6(C5)CS(=O)(=O)C6 −8.9 ± 0.2 6.5 ± 0.2
3841 EN300-26603_1_1 molecule Cn1c2ccccc2n(c1=O)CC(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 −8.9 ± 0.3 6.5 ± 0.2
3842 MAT-POS-8a69d52e-1_4 molecule C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 −8.92 ± 0.10 6.50 ± 0.07
3843 EDG-MED-ba1ac7b9-7 molecule CC1N(CCO1)C(=O)CC2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.2
3844 EN300-65115_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)O −8.9 ± 0.2 6.5 ± 0.2
3845 EN300-6255179_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCn5cncn5 −8.9 ± 0.2 6.5 ± 0.1
3846 EN300-1724771_3_1 molecule CC(=O)N1CCN(CC1)C(=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.2
3847 EN300-1268016_1_15 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5C[C@H]6[C@H]5C[C@H](C6)C(=O)N −8.9 ± 0.3 6.5 ± 0.2
3848 ALP-UNI-3496895b-12 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ccn(n5)C6CCNC6=O −8.9 ± 0.3 6.5 ± 0.2
3849 EN300-373446_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)[C@H](CO)O −8.9 ± 0.6 6.5 ± 0.4
3850 EN300-152705_1_1 molecule C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N −8.9 ± 0.2 6.5 ± 0.2
3851 EN300-144970_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H](C5)CO −8.9 ± 0.2 6.5 ± 0.1
3852 EN300-1644723_2_5 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5[C@@H]6[C@H]5COCC6 −8.9 ± 0.3 6.5 ± 0.2
3853 EN300-1789253_2_1 molecule Cn1cc(nn1)c2cc(no2)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 −8.9 ± 0.3 6.5 ± 0.2
3854 EN300-80083_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCCCC(=O)N5 −8.9 ± 0.4 6.5 ± 0.3
3855 EN300-704025_2_1 molecule COC1(CS(=O)(=O)C1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.3 6.5 ± 0.2
3856 EN300-6763470_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](C(=O)N)C(F)(F)F −8.9 ± 0.2 6.5 ± 0.2
3857 EN300-66494_3_1 molecule CNC(=O)NCCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3858 EN300-297144_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@H](CCO)CO −8.9 ± 0.3 6.5 ± 0.2
3859 EN300-217107_4_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CC[C@@H]5C(=O)N −8.9 ± 0.4 6.5 ± 0.3
3860 EN300-6498351_3_1 molecule Cc1c(n(cn1)C)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.1
3861 EN300-7536177_3_1 molecule Cc1ncnn1CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.3 6.5 ± 0.3
3862 EN300-378373_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)COC5CC5 −8.9 ± 0.3 6.5 ± 0.2
3863 JOH-SUS-a69c159d-2_1 molecule c1ccc2c(c1)c(cnc2F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl −8.91 ± 0.06 6.49 ± 0.04
3864 EDG-MED-90036822-5 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](CF)N −8.9 ± 0.3 6.5 ± 0.2
3865 MAT-POS-fce787c2-11 molecule c1ccc2c(c1)cncc2NC(=O)C(CO)c3ccc(c(c3)Cl)Cl −8.9 ± 0.2 6.5 ± 0.2
3866 EN300-366974_1_1 molecule CN(CCS(=O)(=O)N)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3867 EN300-1600517_4_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@H](CO)F −8.9 ± 0.4 6.5 ± 0.3
3868 EN300-52589_1_1 molecule Cn1c(nc2c1c(=O)[nH]c(=O)n2C)CO[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 −8.9 ± 0.3 6.5 ± 0.2
3869 EN300-120586_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)NCC(F)F −8.9 ± 0.3 6.5 ± 0.2
3870 EN300-296237_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](CO)C(F)(F)F −8.9 ± 0.4 6.5 ± 0.3
3871 EN300-249804_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCOC(=O)N5 −8.9 ± 0.2 6.5 ± 0.2
3872 EN300-18074_4_1 molecule CC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3873 EN300-7435892_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5COC[C@@H]5C(=O)N −8.9 ± 0.3 6.5 ± 0.2
3874 EN300-734638_1_1 molecule COc1cc(=O)[nH]cc1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.4 6.5 ± 0.3
3875 EN300-307592_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5CC(C5)O −8.9 ± 0.2 6.5 ± 0.2
3876 EN300-01527_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NC[C@H]5CCCO5 −8.9 ± 0.3 6.5 ± 0.2
3877 EN300-1448603_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5CCS(=O)(=O)C5 −8.9 ± 0.3 6.5 ± 0.2
3878 MAT-POS-fce787c2-4 molecule c1ccc2c(c1)cncc2NC(=O)C(c3ccc(c(c3)Cl)Cl)O −8.9 ± 0.2 6.5 ± 0.2
3879 EN300-88417_1_1 molecule Cn1cncc1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.2
3880 RAL-THA-05e671eb-16 molecule c1ccc2c(c1)cncc2NC(=O)C3CCOc4c3cc(cc4Cl)Cl −8.90 ± 0.08 6.48 ± 0.06
3881 ED_-GRI-5b13fbe2-70 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[C@H]5N −8.9 ± 0.3 6.5 ± 0.2
3882 EN300-69070_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CC5)C(=O)N −8.9 ± 0.2 6.5 ± 0.2
3883 EN300-28106_2_2 molecule C[C@H](C(=O)N1CCN(CC1)C(=O)C)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.3 6.5 ± 0.2
3884 DAR-DIA-6a508060-10_2 molecule C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.1 6.48 ± 0.08
3885 EN300-7353672_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H]([C@@H](CC5)O)CO −8.9 ± 0.4 6.5 ± 0.3
3886 EN300-33553_1_1 molecule Cc1c(c(=O)[nH]cn1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.3 6.5 ± 0.2
3887 EN300-1724086_2_2 molecule C[C@H]1C[C@@H](CN(C1)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N −8.9 ± 0.2 6.5 ± 0.1
3888 EN300-28177_2_4 molecule C[C@H](C(=O)N1CCC[C@H](C1)C(=O)N)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.4 6.5 ± 0.3
3889 ED_-GRI-5b13fbe2-1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCNCc5cc(no5)C(=O)O −8.9 ± 0.5 6.5 ± 0.4
3890 DAR-DIA-23e5a6a0-4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4OC5CC6(CC6)CN5)Cl −8.9 ± 0.2 6.5 ± 0.2
3891 EDG-MED-4c68219f-11 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)NCCCC(=O)O −8.9 ± 0.3 6.5 ± 0.2
3892 RAL-THA-c11c1343-1 molecule CC(=O)N1CCC(c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.2 6.5 ± 0.1
3893 EN300-79022_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)c5cccnn5 −8.9 ± 0.3 6.5 ± 0.2
3894 EN300-269453_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCc6nnnn6C5 −8.9 ± 0.3 6.5 ± 0.2
3895 EN300-19700_4_1 molecule COC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.2 6.5 ± 0.1
3896 EN300-13000_1_1 molecule CN(CC(=O)OC)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.3 6.5 ± 0.2
3897 JAG-UCB-706446eb-4_1 molecule CCOC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 −8.9 ± 0.2 6.5 ± 0.2
3898 PET-UNK-8df914d1-1 molecule COc1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl −8.9 ± 0.3 6.5 ± 0.2
3899 KAD-UNI-8a629cb0-26 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC6(C5)CCO6 −8.9 ± 0.2 6.5 ± 0.2
3900 EN300-262745_2_1 molecule CCn1cc(nn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 −8.9 ± 0.2 6.5 ± 0.1
Last updated 2021-02-17T18:02:40.003401+00:00
Generated by fah-xchem version 0.1.0+78.gc30b862.dirty