| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 2701 |
EN300-1387104_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CCS5(=O)=O |
−9.8
± 0.2
|
| 2702 |
EN300-6792206_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](C5CCOCC5)O |
−9.8
± 0.3
|
| 2703 |
EN300-107435_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCCCS5(=O)=O |
−9.8
± 0.3
|
| 2704 |
MAK-UNK-c749d764-2_1
|
|
CC[C@@H]1CCC[C@@H]([C@@H]1O)CC(=O)Nc2cncc3c2cccc3 |
−9.8
± 0.5
|
| 2705 |
EN300-123416_1_1_1 |
|
CCCn1cc(nn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2706 |
EN300-2008102_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5CN6C[C@H](O5)CCC6=O |
−9.8
± 0.3
|
| 2707 |
EN300-55109_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@H]5CO |
−9.8
± 0.3
|
| 2708 |
EDG-MED-90036822-110_2
|
|
CC[N@@](C)CC(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(F)F |
−9.8
± 0.3
|
| 2709 |
EN300-175251_1_1_1 |
|
COCCCNC(=O)CCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.8
± 0.4
|
| 2710 |
ED_-GRI-5b13fbe2-69_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[C@@H]5[NH3+] |
−9.8
± 0.2
|
| 2711 |
EN300-307336_1_3_1 |
|
C[C@@]1(C[C@H](CN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O)CO |
−9.8
± 0.3
|
| 2712 |
EN300-1071940_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C[C@]5(CCCOC5)O |
−9.8
± 0.3
|
| 2713 |
EN300-1715993_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCn5ccnn5 |
−9.8
± 0.2
|
| 2714 |
EDJ-MED-ee07cf00-4_3
|
|
C[C@@H](C(=O)N[C@H](c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3)NC(=O)C4CCC4 |
−9.8
± 0.4
|
| 2715 |
EN300-1911992_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]([C@@H]5CCOC5)O |
−9.8
± 0.3
|
| 2716 |
EN300-245061_1_1_1 |
|
Cc1c(cn(n1)C)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.2
|
| 2717 |
EN300-315453_1_1_1 |
|
Cc1cncn1CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.2
|
| 2718 |
EN300-22884_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)N5CCNC(=O)C5 |
−9.8
± 0.3
|
| 2719 |
DAR-DIA-9e4459de-11_8
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@H]7CCC(=O)NC7=O)O |
−9.8
± 0.5
|
| 2720 |
EN300-94900_1_1_1 |
|
CS(=O)(=O)Cc1nc(on1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.4
|
| 2721 |
EN300-186943_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CN5CCOCC5=O |
−9.8
± 0.3
|
| 2722 |
EDG-MED-4c68219f-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)Nc5ccnn5C6C[NH2+]C6 |
−9.8
± 0.4
|
| 2723 |
EN300-7456948_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cc5cccnn5 |
−9.8
± 0.3
|
| 2724 |
EDG-MED-90036822-65_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5C[NH+](C5)CCF |
−9.8
± 0.3
|
| 2725 |
EN300-6953121_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H]5F |
−9.8
± 0.2
|
| 2726 |
EN300-28871_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCn5ccnn5 |
−9.8
± 0.3
|
| 2727 |
EN300-28871_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCn5ccnn5 |
−9.8
± 0.3
|
| 2728 |
EN300-7442332_3_1_1 |
|
Cc1c(n(cn1)OC)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2729 |
EN300-395954_1_1_1 |
|
C[C@@]12CN(CCN1C(=O)OC2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.8
± 0.3
|
| 2730 |
EN300-22879_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CCCC[C@@H]5C(=O)N |
−9.8
± 0.2
|
| 2731 |
EN300-107493_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCNC(=O)C5 |
−9.8
± 0.3
|
| 2732 |
ED_-GRI-5b13fbe2-27_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCn5cc(cn5)CN6CC[NH2+]CC6 |
−9.8
± 0.4
|
| 2733 |
ED_-GRI-5b13fbe2-55_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@]5(C[NH2+]C[C@H]5CO)F |
−9.8
± 0.3
|
| 2734 |
EN300-55072_1_1_1 |
|
C[C@@H](CO)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.8
± 0.3
|
| 2735 |
EN300-39439_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCCC(=O)N |
−9.8
± 0.3
|
| 2736 |
MAK-UNK-83e0a0b4-3_1
|
|
c1ccc2c(c1)cncc2N(CCNC3C[NH2+]C3)C(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−9.8
± 0.3
|
| 2737 |
EN300-6738887_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5[C@@H]6CC[C@H]5[C@@H](CC[C@@H]6O)O |
−9.8
± 0.3
|
| 2738 |
EN300-113234_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC(=O)OC5 |
−9.8
± 0.2
|
| 2739 |
EN300-182084_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CNC(=O)c5cscn5 |
−9.8
± 0.3
|
| 2740 |
EN300-23942_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5cccn5 |
−9.8
± 0.3
|
| 2741 |
EN300-69313_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@H](C5)O |
−9.8
± 0.2
|
| 2742 |
EN300-159953_2_1_1 |
|
CN([C@@H]1CC[N@@H+]2CCO[C@H]1C2)C(=O)CC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.8
± 0.3
|
| 2743 |
EN300-198515_3_1_1 |
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5cnc(n5)C#N |
−9.8
± 0.3
|
| 2744 |
EN300-7493922_3_1_1 |
|
Cn1cnc(n1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2745 |
EN300-122340_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CCSCC5)O |
−9.8
± 0.3
|
| 2746 |
EN300-125769_3_1_1 |
|
COCCCOCC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.8
± 0.3
|
| 2747 |
EN300-317085_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H]([C@@H](C5)F)O |
−9.8
± 0.2
|
| 2748 |
EN300-393148_3_1_1 |
|
C[N@]1[C@@H](CCS1(=O)=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2749 |
ALP-UNI-dbbfd3db-17_1
|
|
Cc1c(c(=O)n2c(n1)cc[nH]2)CC(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.8
± 0.3
|
| 2750 |
EN300-31148_1_1_1 |
|
CCC(=O)N[C@@H](C)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.8
± 0.3
|
| 2751 |
EN300-74089_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5(CCOCC5)C#N |
−9.8
± 0.2
|
| 2752 |
EN300-264184_1_1_1 |
|
CCn1c(c[nH]c1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.2
|
| 2753 |
EDG-MED-ba1ac7b9-22_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5Cc6c(nc[nH]6)C[C@@H]5C(=O)N |
−9.8
± 0.4
|
| 2754 |
EN300-98018_1_2_1 |
|
CC(=O)N1CC[C@](C1)(C)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2755 |
EN300-332002_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCc6n5c(=O)ccc6 |
−9.8
± 0.3
|
| 2756 |
EN300-378722_1_2_1 |
|
CN1CC[C@H](C1=O)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.2
|
| 2757 |
EN300-148515_2_1_1 |
|
Cn1c(nnn1)CN(C)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.2
|
| 2758 |
EN300-05754_3_2_1 |
|
C[C@H](C(=O)N1CCOCC1)OCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2759 |
EN300-6494859_1_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C[C@H](OC5)Cn6cccn6 |
−9.8
± 0.3
|
| 2760 |
EN300-7444533_1_3_1 |
|
C[C@@H]1C[C@H](C(=O)O1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.8
± 0.3
|
| 2761 |
EN300-321703_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCOC5COC5 |
−9.8
± 0.2
|
| 2762 |
EDG-MED-ba1ac7b9-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCC[C@@H]5c6c[nH]nc6 |
−9.8
± 0.3
|
| 2763 |
EN300-341337_1_3_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@]56CCO[C@H]5CCOC6 |
−9.7
± 0.3
|
| 2764 |
EN300-36111_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CN5CCCCC5=O |
−9.7
± 0.3
|
| 2765 |
VLA-UCB-05e51b3f-13_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CCC5CCCCC5 |
−9.7
± 0.4
|
| 2766 |
EN300-1911992_1_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]([C@H]5CCOC5)O |
−9.7
± 0.3
|
| 2767 |
EN300-85707_1_2_1 |
|
COC[C@H]1CN(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2768 |
EN300-23792_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(sc5)S(=O)(=O)N |
−9.7
± 0.2
|
| 2769 |
EN300-195590_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@H]5CCCNC(=O)C5 |
−9.7
± 0.3
|
| 2770 |
EN300-2617222_3_1_1 |
|
CNC(=O)c1cn(nn1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2771 |
EN300-22880_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)N5CCC[C@H](C5)C(=O)N |
−9.7
± 0.3
|
| 2772 |
EN300-33398_1_2_1 |
|
CC(C)N1C[C@H](CC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2773 |
EN300-174763_1_1_1 |
|
CCN(CC(=O)N)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.3
|
| 2774 |
EN300-316679_3_1_1 |
|
CCC[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.4
|
| 2775 |
MIC-UNK-cdc2493e-5_2
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)C4C[C@H]5CCCC[C@@H]5C4 |
−9.7
± 0.4
|
| 2776 |
EN300-14628_3_2_1 |
|
C[N@@](CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[C@H]5CCS(=O)(=O)C5 |
−9.7
± 0.5
|
| 2777 |
EN300-249804_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCOC(=O)N5 |
−9.7
± 0.3
|
| 2778 |
EN300-220536_1_1_1 |
|
CS(=O)(=O)C1(CCOCC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2779 |
EN300-74876_1_1_1 |
|
CC(=O)N1CC(C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2780 |
DAR-DIA-e7614d05-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC(F)(F)F |
−9.7
± 0.2
|
| 2781 |
EN300-217494_3_2_1 |
|
C[C@]([C@@H]1CCOC1)(C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.7
± 0.3
|
| 2782 |
EN300-201346_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5COC(=O)N5 |
−9.7
± 0.2
|
| 2783 |
EN300-38979_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5ccnc5 |
−9.7
± 0.3
|
| 2784 |
EN300-38979_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5ccnc5 |
−9.7
± 0.3
|
| 2785 |
EDG-MED-4c68219f-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5cn(nn5)CC[NH+]6CCOCC6 |
−9.7
± 0.4
|
| 2786 |
EN300-2924757_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc(cc5)CC(=O)N |
−9.7
± 0.3
|
| 2787 |
EN300-1724086_1_2_1 |
|
C[C@H]1C[C@@H](CN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−9.7
± 0.3
|
| 2788 |
EDG-MED-ba1ac7b9-14_7
|
|
C[N@@]1CCN(C[C@H]1C#N)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2789 |
EN300-6489696_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)(Cc6ccn[nH]6)O |
−9.7
± 0.3
|
| 2790 |
EN300-104746_2_2_1 |
|
CC[C@](C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.3
|
| 2791 |
EN300-127629_1_1_1 |
|
C[C@@]1(COCCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−9.7
± 0.3
|
| 2792 |
EN300-48760_1_1_1 |
|
CC(C)(C)NC(=O)CNC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2793 |
EDG-MED-ba1ac7b9-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCC[C@@H]5c6ccn[nH]6 |
−9.7
± 0.4
|
| 2794 |
EN300-1932780_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H](C(F)F)O |
−9.7
± 0.2
|
| 2795 |
EN300-199359_3_1_1 |
|
CC(C)[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.3
|
| 2796 |
EN300-19515_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCC(=O)N5 |
−9.7
± 0.2
|
| 2797 |
EN300-115421_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CNC(=O)c5c(cccn5)O |
−9.7
± 0.3
|
| 2798 |
EN300-100180_3_1_1 |
|
CC(=O)N1CC[C@@H](C1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.5
|
| 2799 |
DAR-DIA-0d514e7d-25_1_1
|
|
C[C@H]1COc2c(cc(cc2OC)Cl)[C@]1(C)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.1
|
| 2800 |
EN300-102901_1_1_1 |
|
CCC[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.7
± 0.2
|