Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
701 |
EN300-6729572_1_5
|
|
C[C@@H]([C@@H]1C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−11.0
± 0.3
|
8.0
± 0.2
|
702 |
EN300-1270299_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(cn5)CO |
−11.0
± 0.2
|
8.0
± 0.2
|
703 |
EN300-141695_1_2
|
|
CN1CC[C@H](C1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
704 |
EN300-1726073_3_1
|
|
Cn1c(cnn1)C(C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)(F)F |
−11.0
± 0.4
|
8.0
± 0.3
|
705 |
EN300-124301_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCCn5ccnn5 |
−11.0
± 0.3
|
8.0
± 0.2
|
706 |
EN300-158292_1_2
|
|
CC(=O)N[C@H](C1CCOCC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
707 |
EN300-321459_1_1
|
|
CN(C1CC(C1)C(=O)N)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.2
|
708 |
EN300-204936_1_1
|
|
Cn1c(cnn1)C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.1
|
709 |
EN300-307008_3_2
|
|
CN1[C@H](CNC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
710 |
EN300-255795_1_1
|
|
CN1C[C@@H](NC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.2
|
711 |
EN300-1718194_1_1
|
|
CO[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)OC |
−11.0
± 0.3
|
8.0
± 0.2
|
712 |
EN300-23317_3_2
|
|
C[C@H](C(=O)NCCOC)OCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
713 |
EN300-1262640_1_1
|
|
CC(C)NC(=O)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
714 |
EN300-55072_3_1
|
|
C[C@@H](CO)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
715 |
EN300-132624_1_1
|
|
CCC(=O)CNC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
716 |
EN300-44993_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(cnc5)C(=O)N |
−11.0
± 0.2
|
8.0
± 0.2
|
717 |
EN300-1706036_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@H]5C(=O)NCCO5 |
−11.0
± 0.3
|
8.0
± 0.2
|
718 |
EN300-160277_1_1
|
|
COCCn1ccc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
719 |
EN300-258477_1_1
|
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)OC |
−11.0
± 0.3
|
8.0
± 0.2
|
720 |
EN300-249764_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H](C5CCC5)O |
−11.0
± 0.4
|
8.0
± 0.3
|
721 |
EN300-255422_1_1
|
|
Cc1cn(nc1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−11.0
± 0.2
|
8.0
± 0.2
|
722 |
EN300-1688983_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCS(=O)(=O)[N@@]6[C@H]5CCC6 |
−11.0
± 0.4
|
8.0
± 0.3
|
723 |
EN300-101796_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccnc(c5)OCCO |
−11.0
± 0.3
|
8.0
± 0.2
|
724 |
EN300-1703718_3_1
|
|
CC(=O)N1C[C@@H](C[C@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−11.0
± 0.4
|
8.0
± 0.3
|
725 |
EN300-263392_1_1
|
|
CS(=O)(=O)Cc1nc(co1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
726 |
EN300-27672_1_1
|
|
Cc1c(cn[nH]1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.2
|
727 |
EN300-99391_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CO[C@@H]5CCOC5 |
−11.0
± 0.3
|
8.0
± 0.2
|
728 |
EN300-222357_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCc5cn[nH]n5 |
−11.0
± 0.3
|
8.0
± 0.2
|
729 |
EN300-107267_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCO[C@H]5CCCNC5=O |
−11.0
± 0.3
|
8.0
± 0.2
|
730 |
EN300-92664_1_1
|
|
COCCn1c(ccn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
731 |
PET-UNK-7be94445-2
|
|
c1ccc2c(c1)cncc2N3CCN(C3=O)c4cccc(c4)Cl |
−11.0
± 0.3
|
8.0
± 0.3
|
732 |
EN300-69368_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CCOCC5)O |
−11.0
± 0.3
|
8.0
± 0.2
|
733 |
EN300-123589_1_1
|
|
CC(C)(C)S(=O)(=O)CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
734 |
EN300-366931_1_1
|
|
COc1cnnc(c1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−11.0
± 0.3
|
8.0
± 0.2
|
735 |
EN300-112500_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N(CC(=O)N)C5CC5 |
−11.0
± 0.3
|
8.0
± 0.2
|
736 |
EN300-1588613_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC[N@@H+]6[C@@H]5COCC6 |
−11.0
± 0.3
|
8.0
± 0.2
|
737 |
EN300-36111_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CN5CCCCC5=O |
−11.0
± 0.3
|
8.0
± 0.2
|
738 |
EN300-169955_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5[C@@H](CC(=O)N5)C(F)(F)F |
−11.0
± 0.3
|
8.0
± 0.2
|
739 |
EN300-129455_1_1
|
|
CCNC(=O)CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.3
|
8.0
± 0.2
|
740 |
ED_-GRI-5b13fbe2-44
|
|
Cc1c(nnn1CC(CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)(F)F)CN |
−11.0
± 0.3
|
8.0
± 0.2
|
741 |
EDJ-MED-d203f206-2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ncon5 |
−11.0
± 0.2
|
8.0
± 0.2
|
742 |
EN300-74029_1_1
|
|
C[C@@H]1CC(=O)NCCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
743 |
EN300-6505003_1_1
|
|
C[C@@H]1CC[C@@H](C(=O)N1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.4
|
8.0
± 0.3
|
744 |
EN300-35789_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cccnc5=O |
−11.0
± 0.3
|
8.0
± 0.2
|
745 |
EN300-151330_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn(nn5)c6cccnc6 |
−11.0
± 0.2
|
8.0
± 0.1
|
746 |
EN300-21303_1_1
|
|
CCOCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.2
|
8.0
± 0.1
|
747 |
EN300-42536_1_1
|
|
Cc1cc(nc(=O)[nH]1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.2
|
748 |
EN300-7430501_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCn6c(cnn6)C5 |
−11.0
± 0.2
|
8.0
± 0.1
|
749 |
EN300-33478_1_1
|
|
CCN1C[C@@H](CC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
750 |
EN300-14628_1_2
|
|
C[N@@H+](CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[C@H]5CCS(=O)(=O)C5 |
−11.0
± 0.4
|
8.0
± 0.3
|
751 |
EN300-246440_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CC5)n6cncn6 |
−11.0
± 0.3
|
8.0
± 0.2
|
752 |
EN300-6478433_3_1
|
|
CCn1c(nn(c1=O)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−11.0
± 0.4
|
8.0
± 0.3
|
753 |
EDJ-MED-d203f206-39
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@](C5)(C(=O)N)O |
−11.0
± 0.4
|
8.0
± 0.3
|
754 |
MAK-UNK-3875bbc8-2
|
|
CN(c1cncc2c1cccc2)C(=O)C3CCOc4c3cc(cc4)Cl |
−10.98
± 0.09
|
8.00
± 0.07
|
755 |
ED_-GRI-5b13fbe2-32
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5cn(nn5)C6CNC6 |
−11.0
± 0.3
|
8.0
± 0.2
|
756 |
ALP-UNI-dbbfd3db-3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CN5CCN(C5=O)C6CC6 |
−11.0
± 0.3
|
8.0
± 0.2
|
757 |
EN300-702756_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CS(=O)(=O)CC(=O)N5 |
−11.0
± 0.2
|
8.0
± 0.2
|
758 |
EN300-1600786_3_1
|
|
CN1C=C(NN1)CCOCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.3
|
8.0
± 0.2
|
759 |
EN300-366687_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCc6nncn6CC5 |
−11.0
± 0.2
|
8.0
± 0.2
|
760 |
EN300-262604_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5cnc(n5)C(=O)N |
−11.0
± 0.3
|
8.0
± 0.2
|
761 |
EN300-236175_1_1
|
|
Cn1cc(c(=O)cc1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−11.0
± 0.3
|
8.0
± 0.2
|
762 |
EN300-746311_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c[nH]c6c5c(=O)[nH]cn6 |
−11.0
± 0.2
|
8.0
± 0.2
|
763 |
EN300-10414_3_2
|
|
C[C@]1(CCS(=O)(=O)C1)NC(=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.4
|
8.0
± 0.3
|
764 |
EN300-216063_3_1
|
|
CN(C)C(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.0
± 0.1
|
7.99
± 0.10
|
765 |
EN300-247343_1_1
|
|
CC1(CC(C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−11.0
± 0.2
|
8.0
± 0.2
|
766 |
EN300-55744_1_2
|
|
CCCC[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−11.0
± 0.4
|
8.0
± 0.3
|
767 |
EN300-370967_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCN5CCOC5=O |
−11.0
± 0.2
|
8.0
± 0.1
|
768 |
EN300-316258_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)COCc5cc[nH]c(=O)c5 |
−11.0
± 0.2
|
8.0
± 0.2
|
769 |
EN300-96159_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5[nH]ncn5 |
−11.0
± 0.2
|
8.0
± 0.1
|
770 |
EN300-215465_1_1
|
|
CCn1ncc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.0
± 0.2
|
8.0
± 0.1
|
771 |
EN300-92447_1_1
|
|
CC1C[C@H](ON1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.2
|
8.0
± 0.2
|
772 |
EN300-6487407_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5[C@H](CC(=O)O5)O |
−10.9
± 0.3
|
8.0
± 0.2
|
773 |
EN300-6487680_3_1
|
|
Cc1nnn(n1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.3
|
8.0
± 0.2
|
774 |
EN300-697519_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCOC5 |
−10.9
± 0.3
|
8.0
± 0.2
|
775 |
EN300-249421_3_3
|
|
C[C@@H]([C@H]1CCC(=O)N1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.3
|
8.0
± 0.2
|
776 |
EN300-10414_1_2
|
|
C[C@]1(CCS(=O)(=O)C1)NC(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.4
|
8.0
± 0.3
|
777 |
EN300-132615_3_2
|
|
C[C@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)N |
−10.9
± 0.3
|
8.0
± 0.2
|
778 |
EN300-332002_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCc6n5c(=O)ccc6 |
−10.9
± 0.4
|
8.0
± 0.3
|
779 |
EN300-7463171_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCCS(=O)(=O)CCO |
−10.9
± 0.6
|
8.0
± 0.4
|
780 |
EN300-1212400_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C[C@@H]5CO)CO |
−10.9
± 0.3
|
8.0
± 0.2
|
781 |
EN300-2007627_1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H](C[C@H](C5)CO)CO |
−10.9
± 0.4
|
8.0
± 0.3
|
782 |
EN300-6499639_1_1
|
|
CC1=C[C@@H](N(N1)C)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.2
|
8.0
± 0.1
|
783 |
EN300-1600786_1_1
|
|
Cn1cc(nn1)CCO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.2
|
8.0
± 0.1
|
784 |
EN300-116092_3_1
|
|
CCS(=O)(=O)NCCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.9
± 0.4
|
8.0
± 0.3
|
785 |
EN300-6482296_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CO[C@@H]6[C@@H]5COC6 |
−10.9
± 0.3
|
8.0
± 0.2
|
786 |
EN300-185727_1_1
|
|
Cn1c2c(nn1)C[C@@H](CC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−10.9
± 0.3
|
8.0
± 0.2
|
787 |
EN300-51801_1_2
|
|
CCC[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−10.9
± 0.3
|
8.0
± 0.2
|
788 |
EN300-09334_1_1
|
|
CCCn1c(=O)ccc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.3
|
8.0
± 0.2
|
789 |
DAR-DIA-5ff57136-18
|
|
c1ccc2c(c1)cncc2N(C(=O)[C@@H]3CCOc4c3cc(cc4)Cl)N=C=S |
−10.9
± 0.1
|
8.0
± 0.1
|
790 |
EN300-185398_1_2
|
|
C[C@H](C(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(F)F)O |
−10.9
± 0.2
|
8.0
± 0.1
|
791 |
EN300-116234_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCCO5 |
−10.9
± 0.2
|
8.0
± 0.2
|
792 |
EN300-66764_1_3
|
|
COC(=O)[C@@H]1C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.2
|
8.0
± 0.2
|
793 |
EN300-134855_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](c5cccnc5)O |
−10.9
± 0.2
|
8.0
± 0.2
|
794 |
EN300-191495_3_1
|
|
CS(=O)(=O)C1(CC1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.4
|
8.0
± 0.3
|
795 |
EN300-6277108_1_2
|
|
CO[C@H]([C@@H]1CCCO1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.2
|
8.0
± 0.2
|
796 |
EN300-160080_3_1
|
|
CS(=O)(=O)c1nnc(s1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.3
|
8.0
± 0.2
|
797 |
EN300-85849_3_1
|
|
CC(C)(C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NS(=O)(=O)C |
−10.9
± 0.3
|
8.0
± 0.2
|
798 |
EN300-198240_3_1
|
|
Cn1cc(cn1)[C@@H](C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)OC |
−10.9
± 0.4
|
8.0
± 0.3
|
799 |
EN300-155362_3_1
|
|
C[C@@H]1CC(=O)N[C@@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−10.9
± 0.3
|
8.0
± 0.2
|
800 |
EN300-175186_3_1
|
|
C[C@@H](CO)OCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−10.9
± 0.3
|
8.0
± 0.2
|