Microstates

Showing 2601 through 2700 of 6099
Rank Microstate SMILES ΔG / kcal M-1
2601 EN300-196612_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC(=O)NCCF −7.0 ± 0.3
2602 EN300-7432415_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5C6(CCC6)OC(=O)N5 −7.0 ± 0.2
2603 EN300-682529_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@]5(CCOC5)CO −7.0 ± 0.3
2604 EN300-131690_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)c6ncon6 −7.0 ± 0.3
2605 EN300-1600887_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC[C@H]5COCCO5 −7.0 ± 0.3
2606 EN300-210084_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@H]5CCCC(=O)N5 −7.0 ± 0.4
2607 EN300-79606_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCCCNC(=O)N −7.0 ± 0.2
2608 EN300-182579_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5CN(C5)CC(F)F −7.0 ± 0.3
2609 EN300-108236_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)Cn5cc(nn5)CO −7.0 ± 0.3
2610 EN300-142130_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](CO)C(F)(F)F −7.0 ± 0.3
2611 EN300-246992_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@H]5CCC(=O)NC5 −7.0 ± 0.3
2612 EN300-104592_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CC[C@@H]5CCC(=O)N5 −7.0 ± 0.2
2613 EN300-210104_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCn5cnc(n5)C#N −7.0 ± 0.3
2614 EN300-817811_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cc(=O)[nH]cn5 −7.0 ± 0.3
2615 EN300-817811_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cc(=O)[nH]cn5 −7.0 ± 0.3
2616 EN300-175608_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H](CCF)CO −7.0 ± 0.3
2617 JAG-UCB-706446eb-1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCC(F)(F)F −7.0 ± 0.2
2618 EN300-179091_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)COC(F)F −7.0 ± 0.2
2619 EN300-395654_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C6(C5)COC6)CO −7.0 ± 0.2
2620 EN300-120920_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)O[C@@H]5CCC(=O)NC5=O −7.0 ± 0.2
2621 EN300-52645_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5cnn(c5)CCO −7.0 ± 0.2
2622 EN300-52645_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5cnn(c5)CCO −7.0 ± 0.2
2623 EN300-1428805_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5Cc6cncn6C(=O)N5 −7.0 ± 0.2
2624 EN300-169955_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5[C@H](CC(=O)N5)C(F)(F)F −7.0 ± 0.3
2625 EN300-100467_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cn5ccnn5 −7.0 ± 0.2
2626 EN300-366687_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCc6nncn6CC5 −7.0 ± 0.3
2627 EN300-7550655_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5nnc(s5)CO −7.0 ± 0.2
2628 EN300-1707980_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC(C5)c6[nH]ncn6 −7.0 ± 0.2
2629 EN300-7549247_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCc5nnc(s5)CO −7.0 ± 0.3
2630 EN300-227055_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@@H]5CC(=O)NC5=O −7.0 ± 0.3
2631 EN300-225920_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](c5ccccn5)C(=O)N −7.0 ± 0.3
2632 EN300-255990_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnn6c5ncc(c6)C#N −7.0 ± 0.2
2633 EN300-52210_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)CC(=O)N6 −7.0 ± 0.3
2634 EN300-52210_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)CC(=O)N6 −7.0 ± 0.3
2635 EN300-80241_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@H](C5)Cn6cncn6 −7.0 ± 0.3
2636 EN300-233678_1_3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]([C@@H](C5)CO)O −7.0 ± 0.3
2637 EN300-253571_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCc6nnnn6CC5 −7.0 ± 0.3
2638 EN300-19926_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CC#N −7.0 ± 0.2
2639 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 −7.0 ± 0.2
2640 EN300-26031_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5nnc6n5CCC6 −7.0 ± 0.2
2641 EN300-91609_2_3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCO[C@H]6[C@@H]5C6 −7.0 ± 0.2
2642 EN300-12440_4_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CC(=O)N(C5)C6CC6 −7.0 ± 0.3
2643 EN300-303519_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cnn6c5OCC6 −7.0 ± 0.2
2644 EN300-80855_1_4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@H]([C@H]5CCOC5)O −7.0 ± 0.4
2645 EN300-235010_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)C#N −7.0 ± 0.3
2646 EN300-386232_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H](C[C@H]5CCCO5)CO −7.0 ± 0.3
2647 EN300-1425608_2_3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H]([C@@H](C5)CO)CCO −7.0 ± 0.4
2648 EN300-261056_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn(cn5)c6ncccn6 −7.0 ± 0.2
2649 EN300-129384_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5CCCCNC5=O −7.0 ± 0.2
2650 EN300-129384_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5CCCCNC5=O −7.0 ± 0.2
2651 EN300-5340532_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnc(nc5)N6CCOCC6 −7.0 ± 0.3
2652 EN300-223198_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCCCS(=O)(=O)N −7.0 ± 0.4
2653 EN300-31998_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]n5 −7.0 ± 0.2
2654 EN300-260760_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5cc(=O)[nH][nH]5 −7.0 ± 0.2
2655 EN300-248521_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H]([C@H](C5)O)CO −7.0 ± 0.3
2656 EN300-241988_1_3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)[N@@H+]6CC[C@H](C6)O −7.0 ± 0.3
2657 EN300-122849_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCOC[C@@H]5c6ncon6 −7.0 ± 0.3
2658 EN300-98690_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c[nH+]c6n5cccn6 −7.0 ± 0.2
2659 EN300-69553_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCn5cncn5 −7.0 ± 0.3
2660 EN300-69553_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCCn5cncn5 −7.0 ± 0.3
2661 EN300-6491316_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc6cnnn6c5 −7.0 ± 0.3
2662 EN300-34636_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5cccc(=O)[nH]5 −7.0 ± 0.2
2663 EN300-105829_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@]5(CCOC5)CCO −7.0 ± 0.3
2664 EN300-307198_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5(COC5)CO −7.0 ± 0.4
2665 EN300-344753_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)C(=O)NCCO −7.0 ± 0.4
2666 EN300-344753_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)C(=O)NCCO −7.0 ± 0.4
2667 EN300-215607_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCCCn5cc(nn5)CO −7.0 ± 0.3
2668 EN300-191187_1_4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]([C@@H]5CCCO5)C(=O)N −7.0 ± 0.2
2669 EN300-7459540_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@@H]5[C@@H](CO)O −7.0 ± 0.3
2670 EN300-47606_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NC[C@@H]5CCS(=O)(=O)C5 −7.0 ± 0.3
2671 EN300-2969289_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@]5(CCCOC5)CO −7.0 ± 0.3
2672 EN300-1448674_3_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCn6c(ncn6)C5 −7.0 ± 0.3
2673 EN300-07752_2_4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H](C[C@@H]5C(=O)N)O −7.0 ± 0.3
2674 EN300-43972_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5[nH]ncn5 −7.0 ± 0.2
2675 EN300-43972_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCc5[nH]ncn5 −7.0 ± 0.2
2676 EN300-14767_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCCN(C5)C(=O)N −7.0 ± 0.3
2677 EN300-10334_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@]56CCC(=O)N5CCS6 −7.0 ± 0.3
2678 EN300-1268016_1_2 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 −7.0 ± 0.3
2679 EN300-370967_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCN5CCOC5=O −7.0 ± 0.3
2680 EN300-370967_4_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCN5CCOC5=O −7.0 ± 0.3
2681 EN300-30039_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(=O)[nH]c(=O)[nH]5 −7.0 ± 0.2
2682 EN300-249804_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCOC(=O)N5 −7.0 ± 0.2
2683 EN300-210907_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](C5CCS(=O)(=O)CC5)O −7.0 ± 0.4
2684 EN300-60033_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)COC[C@H]5CCCO5 −7.0 ± 0.3
2685 EN300-246501_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)C6CS(=O)(=O)C6 −7.0 ± 0.2
2686 EN300-373446_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@@H](C5)[C@H](CO)O −7.0 ± 0.4
2687 EN300-6472952_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)NC(=O)CO6 −7.0 ± 0.3
2688 EN300-6779469_2_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5[C@H]6[C@@H]5CS(=O)(=O)C6 −6.9 ± 0.3
2689 EN300-45049_3_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H]5CCS(=O)(=O)N5 −6.9 ± 0.2
2690 EN300-188316_1_3 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@H](CO)[C@H]5CCOC5 −6.9 ± 0.3
2691 EN300-251851_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCc5n[n-]nn5 −6.9 ± 0.3
2692 EN300-157158_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC/C=C\CO −6.9 ± 0.2
2693 JOH-UNI-f51e3bbc-4_1 molecule COc1c(c2ccccc2cn1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl −6.9 ± 0.1
2694 EN300-93574_1_4 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5CC[S@@](=O)C5 −6.9 ± 0.3
2695 EN300-6482296_2_8 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CO[C@@H]6[C@H]5COC6 −6.9 ± 0.3
2696 EN300-7500408_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@]5(CCCOC5)CO −6.9 ± 0.3
2697 EN300-31147_1_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCNC(=O)C5CC5 −6.9 ± 0.3
2698 EN300-6491682_1_2 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5CCc6c(n[nH]n6)C5 −6.9 ± 0.2
2699 EN300-10397_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CNC(=O)N −6.9 ± 0.2
2700 EN300-19507_2_1 molecule c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C(F)F −6.9 ± 0.2
Last updated 2020-12-09T19:38:12.118034+00:00
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