0 B14R1.119 CC(C)(C)Sc1cccc(c1C=O)N 62a_100010232536_100000211941 [0,0,1,0,0,0|3,0,0]=4 1 B14R1.119 CC(C)(C)Sc1ccnc(c1C=O)Cl 62a_100000047006_100000211941 [0,0,1,0,0,0|3,0,0]=4 2 B14R1.119 CC(C)(C)Sc1ccnc(c1C=O)Cl 62a_100000211941_100000047006 [0,0,1,0,0,0|3,0,0]=4 3 B14R1.119 CC(C)(C)Sc1ccnc(c1C=O)F 62a_100000211941_100009828249 [0,0,1,0,0,0|3,0,0]=4 4 B14R1.119 CC(C)(C)Sc1ccnc(c1C=O)F 62a_100009828249_100000211941 [0,0,1,0,0,0|3,0,0]=4 5 B14R1.119 CC(C)(C)Sc1ccnc(c1C=O)N 62a_100009843235_100000211941 [0,0,1,0,0,0|2,0,0]=3 6 B14R1.119 CC(C)(C)Sc1nccc(c1C=O)N 62a_100000050385_100000211941 [0,0,1,0,0,0|2,0,0]=3 7 B14R1.119 CC(C)(C)Sc1nccc(c1C=O)N 62a_100000211941_100000050385 [0,0,1,0,0,0|2,0,0]=3 8 B14R1.119 CC(C)(C)Sc1nccc(c1C=O)O 62a_200010729673_100000211941 [0,0,1,0,0,0|3,0,0]=4 9 B14R1.119 CC(C)(C)Sc1ncnc(c1C#N)N 62a_100000211941_100000086035 [0,0,1,0,0,0|2,0,1]=4 10 B14R1.119 CC(C)(C)Sc1ncnc(c1C=O)N 62a_100000211941_100000765549 [0,0,1,0,0,0|1,0,0]=2 11 B14R1.119 CC(C)(C)Sc1ncnc(c1C=O)N 62a_100000765549_100000211941 [0,0,1,0,0,0|1,0,0]=2 12 B14R1.119 COc1c(ncnc1SC(C)(C)C)N 62a_100000211941_100011998528 [0,0,1,0,0,0|3,0,0]=4 13 B14R1.119 COc1c(ncnc1SC(C)(C)C)N 62a_100011998528_100000211941 [0,0,1,0,0,0|3,0,0]=4 14 B14R1.4451 CC(C)(C)OC(=O)c1cccnc1O 271570a_203496583355_100011933524 [0,0,1,0,0,0|3,0,0]=4 15 B14R1.4926 CC(=O)c1c(ccnc1C=C(C)C)N 271570a_100102525489_200010729368 [0,0,1,0,0,0|1,0,2]=4 16 B14R1.4926 CC(=O)c1c(ccnc1SC(C)C)N 62a_100000210206_200010729368 [0,0,1,0,0,0|2,0,0]=3 17 B14R1.4926 CC(=O)c1c(ccnc1SC(C)C)N 62a_200010729368_100000210206 [0,0,1,0,0,0|2,0,0]=3 18 B14R1.4926 CC(C)Sc1ncnc(c1C(C)C)N 62a_100000210206_200011913463 [0,0,1,0,0,0|2,0,1]=4 19 B14R1.4926 CC(C)Sc1ncnc(c1C(C)C)N 62a_200011913463_100000210206 [0,0,1,0,0,0|2,0,1]=4 20 B14R1.5958 CC(C)C[C@H](N)c1c(ncnc1N)N 271570a_100015190218_100010128106 [0,0,1,0,0,0|2,0,1]=4 21 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Br 1458a_100000701904_100000210624 [0,0,1,0,0,0|3,0,0]=4 22 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)C 1458a_100000758298_100000210624 [0,0,1,0,0,0|3,0,0]=4 23 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Cl 1458a_100000692601_100000210624 [0,0,1,0,0,0|3,0,0]=4 24 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)F 1458a_100000762013_100000210624 [0,0,1,0,0,0|3,0,0]=4 25 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)I 1458a_100000688020_100000210624 [0,0,1,0,0,0|3,0,0]=4 26 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)O 1458a_100011934116_100000210624 [0,0,1,0,0,0|3,0,0]=4 27 B14R1.5958 Cc1ccnc(c1[C@@H](N)CC(C)C)N 271570a_100015190218_100011998619 [0,0,1,0,0,0|2,0,1]=4 28 B14R1.5958 Cc1nccc(c1[C@@H](N)CC(C)C)N 271570a_100015190218_100010243816 [0,0,1,0,0,0|2,0,1]=4 29 B14R1.5958 Cc1ncnc(c1N(C)CC(C)C)C 27a_100000747067_100009820708 [0,0,1,0,0,0|3,0,0]=4 30 B14R1.5958 Cc1ncnc(c1[C@@H](N)CC(C)C)C 271570a_100015190218_100009820708 [0,0,1,0,0,0|2,0,1]=4 31 B14R1.5958 Cc1ncnc(c1[C@@H](N)CC(C)C)N 271570a_100015190218_100011996190 [0,0,1,0,0,0|1,0,1]=3 32 B14R1.6818 CC(C)(CCO)Nc1cc(ncn1)N 27a_100000763138_100000701291 [0,0,1,0,0,0|1,0,2]=4 33 B14R1.6818 COCC(C)(C)Nc1cc(ncn1)N 27a_100000752728_100000701291 [0,0,1,0,0,0|3,0,0]=4 34 B14R1.6818 CSCC(C)(C)Nc1cc(ncn1)N 27a_100000759623_100000701291 [0,0,1,0,0,0|3,0,0]=4 35 B14R2.8052 CC1(OC(=O)c2c1ccnc2O)C 271570a_203496583355_100000057204 [0,0,0,0,1,0|3,0,0]=4 36 B13R1.115 CC(=Cc1ncnc(c1C=O)N)C 271570a_100102525489_100000765549 [1,0,1,0,0,0|0,0,2]=4 37 B13R1.115 CC(C)Sc1ccnc(c1C=O)N 62a_100009843235_100000210206 [1,0,1,0,0,0|2,0,0]=4 38 B13R1.115 CC(C)Sc1nccc(c1C=O)N 62a_100000050385_100000210206 [1,0,1,0,0,0|2,0,0]=4 39 B13R1.115 CC(C)Sc1nccc(c1C=O)N 62a_100000210206_100000050385 [1,0,1,0,0,0|2,0,0]=4 40 B13R1.115 CC(C)Sc1ncnc(c1C=O)N 62a_100000210206_100000765549 [1,0,1,0,0,0|1,0,0]=3 41 B13R1.115 CC(C)Sc1ncnc(c1C=O)N 62a_100000765549_100000210206 [1,0,1,0,0,0|1,0,0]=3 42 B13R1.115 COc1c(ncnc1NC(C)C)N 27a_100138425928_100011998528 [1,0,1,0,0,0|2,0,0]=4 43 B13R1.115 COc1c(ncnc1SC(C)C)N 62a_100000210206_100011998528 [1,0,1,0,0,0|2,0,0]=4 44 B13R1.115 COc1c(ncnc1SC(C)C)N 62a_100011998528_100000210206 [1,0,1,0,0,0|2,0,0]=4 45 B13R1.151 CC(C)(C)Sc1ncnc(c1F)N 62a_100000126652_100000211941 [1,0,1,0,0,0|2,0,0]=4 46 B13R1.151 CC(C)(C)Sc1ncnc(c1F)N 62a_100000211941_100000126652 [1,0,1,0,0,0|2,0,0]=4 47 B13R1.151 CC(C)(C)Sc1ncnc(c1N)N 62a_100000211941_100000766367 [1,0,1,0,0,0|2,0,0]=4 48 B13R1.151 CC(C)(C)Sc1ncnc(c1N)N 62a_100000766367_100000211941 [1,0,1,0,0,0|2,0,0]=4 49 B13R1.151 CC(C)(C)Sc1ncnc(c1O)N 62a_100000211941_100000124137 [1,0,1,0,0,0|1,0,1]=4 50 B13R1.151 Cc1c(ncnc1SC(C)(C)C)N 62a_100000211941_100011913465 [1,0,1,0,0,0|1,0,1]=4 51 B13R1.151 Cc1c(ncnc1SC(C)(C)C)N 62a_100011913465_100000211941 [1,0,1,0,0,0|1,0,1]=4 52 B13R1.622 CC(C)(C)Sc1ccncc1C=O 62a_100000050567_100000211941 [1,0,1,0,0,0|2,0,0]=4 53 B13R1.622 CC(C)(C)Sc1ccncc1C=O 62a_100000211941_100000050567 [1,0,1,0,0,0|2,0,0]=4 54 B13R1.622 CC(C)(C)Sc1ncccc1C=O 62a_100000211941_100009816751 [1,0,1,0,0,0|2,0,0]=4 55 B13R1.622 CC(C)(C)Sc1ncccc1C=O 62a_100009816751_100000211941 [1,0,1,0,0,0|2,0,0]=4 56 B13R1.157 CC(C)(C)C=Cc1cccnc1N 271570a_100102527731_100000045569 [1,0,1,0,0,0|1,0,1]=4 57 B13R1.157 CC(C)(C)C=Cc1cnccc1N 271570a_100102527731_100000047001 [1,0,1,0,0,0|1,0,1]=4 58 B13R1.157 CC(C)(C)C=Cc1cncnc1Br 271570a_100102527731_200012461658 [1,0,1,0,0,0|1,0,1]=4 59 B13R1.157 CC(C)(C)C=Cc1cncnc1Cl 271570a_100102527731_100000758962 [1,0,1,0,0,0|1,0,1]=4 60 B13R1.157 CC(C)(C)C=Cc1cncnc1N 271570a_100102527731_100011996079 [1,0,1,0,0,0|0,0,1]=3 61 B13R1.157 CC(C)(C)C=Cc1cncnc1O 271570a_100102527731_100000751107 [1,0,1,0,0,0|1,0,1]=4 62 B13R1.157 CC(C)(C)COc1cccnc1N 34a_100000211975_100011219605 [1,0,1,0,0,0|2,0,0]=4 63 B13R1.157 CC(C)(C)COc1cnccc1N 34a_100000753702_100011219605 [1,0,1,0,0,0|2,0,0]=4 64 B13R1.157 CC(C)(C)CSc1cccnc1N 62a_100000045569_100011219605 [1,0,1,0,0,0|2,0,0]=4 65 B13R1.157 CC(C)(C)CSc1cccnc1N 62a_100011219605_100000045569 [1,0,1,0,0,0|2,0,0]=4 66 B13R1.157 CC(C)(C)CSc1cnccc1N 62a_100000047001_100011219605 [1,0,1,0,0,0|2,0,0]=4 67 B13R1.157 CC(C)(C)CSc1cnccc1N 62a_100011219605_100000047001 [1,0,1,0,0,0|2,0,0]=4 68 B13R1.157 CC(C)(C)CSc1cncnc1Br 62a_100011219605_200012461658 [1,0,1,0,0,0|2,0,0]=4 69 B13R1.157 CC(C)(C)CSc1cncnc1Br 62a_200012461658_100011219605 [1,0,1,0,0,0|2,0,0]=4 70 B13R1.157 CC(C)(C)CSc1cncnc1Cl 62a_100000758962_100011219605 [1,0,1,0,0,0|2,0,0]=4 71 B13R1.157 CC(C)(C)CSc1cncnc1Cl 62a_100011219605_100000758962 [1,0,1,0,0,0|2,0,0]=4 72 B13R1.157 CC(C)(C)CSc1cncnc1N 62a_100011219605_100011996079 [1,0,1,0,0,0|1,0,0]=3 73 B13R1.157 CC(C)(C)CSc1cncnc1N 62a_100011996079_100011219605 [1,0,1,0,0,0|1,0,0]=3 74 B13R1.157 CC(C)(C)CSc1cncnc1O 62a_100000751107_100011219605 [1,0,1,0,0,0|2,0,0]=4 75 B13R1.157 CC(C)(C)CSc1cncnc1O 62a_100011219605_100000751107 [1,0,1,0,0,0|2,0,0]=4 76 B13R1.157 CC(C)(F)CSc1cncnc1N 62a_100011996079_100011997219 [1,0,1,0,0,0|2,0,0]=4 77 B13R1.157 CC(C)(F)CSc1cncnc1N 62a_100011997219_100011996079 [1,0,1,0,0,0|2,0,0]=4 78 B13R1.157 CC(C)(O)C=Cc1cncnc1N 271570a_200016258132_100011996079 [1,0,1,0,0,0|1,0,1]=4 79 B13R1.157 CC(C)(O)COc1cncnc1N 7a_100000112926_100000764493 [1,0,1,0,0,0|2,0,0]=4 80 B13R1.157 CC(C)(O)CSc1cncnc1N 62a_100000764493_100011996079 [1,0,1,0,0,0|2,0,0]=4 81 B13R1.157 CC(C)(O)CSc1cncnc1N 62a_100011996079_100000764493 [1,0,1,0,0,0|2,0,0]=4 82 B13R1.157 C[N+](C)(C)CSc1cncnc1N 62a_100011996079_200000036245 [1,0,1,0,0,0|2,0,0]=4 83 B13R1.157 C[N+](C)(C)CSc1cncnc1N 62a_200000036245_100011996079 [1,0,1,0,0,0|2,0,0]=4 84 B13R1.157 C[Si](C)(C)COc1cncnc1N 7a_100000112926_100000233785 [1,0,1,0,0,0|1,1,0]=4 85 B13R1.157 C[Si](C)(C)CSc1cncnc1N 62a_100000037933_100011996079 [1,0,1,0,0,0|1,1,0]=4 86 B13R1.157 C[Si](C)(C)CSc1cncnc1N 62a_100011996079_100000037933 [1,0,1,0,0,0|1,1,0]=4 87 B13R1.157 Cc1ncncc1C=CC(C)(C)C 271570a_100102527731_100009819671 [1,0,1,0,0,0|1,0,1]=4 88 B13R1.157 Cc1ncncc1SCC(C)(C)C 62a_100009819671_100011219605 [1,0,1,0,0,0|2,0,0]=4 89 B13R1.157 Cc1ncncc1SCC(C)(C)C 62a_100011219605_100009819671 [1,0,1,0,0,0|2,0,0]=4 90 B13R1.201 CC(C)C[C@H](N)c1cncnc1N 271570a_100015190218_100011996079 [1,0,1,0,0,0|1,0,1]=4 91 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [1,0,1,0,0,0|2,0,0]=4 92 B13R1.201 Cc1ncncc1[C@@H](N)CC(C)C 271570a_100015190218_100009819671 [1,0,1,0,0,0|1,0,1]=4 93 B13R1.589 CC(=O)c1cccnc1NC(C)C 27a_100138425928_100009816689 [1,0,1,0,0,0|2,0,0]=4 94 B13R1.589 CC(=O)c1cccnc1SC(C)C 62a_100000210206_100000753718 [1,0,1,0,0,0|2,0,0]=4 95 B13R1.589 CC(=O)c1cccnc1SC(C)C 62a_100000753718_100000210206 [1,0,1,0,0,0|2,0,0]=4 96 B13R1.589 CC(=O)c1cnccc1NC(C)C 27a_100138425928_100160469449 [1,0,1,0,0,0|2,0,0]=4 97 B13R1.589 CC(=O)c1cnccc1SC(C)C 62a_100000210206_100160469449 [1,0,1,0,0,0|2,0,0]=4 98 B13R1.589 CC(=O)c1cnccc1SC(C)C 62a_100160469449_100000210206 [1,0,1,0,0,0|2,0,0]=4 99 B13R1.2897 CCSc1nccc(c1C(=O)C)N 62a_100000210202_200010729368 [1,0,1,0,0,0|2,0,0]=4 100 B13R1.2897 CCSc1nccc(c1C(=O)C)N 62a_200010729368_100000210202 [1,0,1,0,0,0|2,0,0]=4 101 B13R1.3787 CC(C)C=Cc1c(ncnc1N)N 271570a_100016257149_100010128106 [1,0,1,0,0,0|1,0,1]=4 102 B13R1.3787 CC(C)COc1c(ncnc1Cl)N 34a_100000124137_100000210624 [1,0,1,0,0,0|2,0,0]=4 103 B13R1.3787 CC(C)COc1c(ncnc1Cl)N 7a_100000124137_100000210760 [1,0,1,0,0,0|2,0,0]=4 104 B13R1.3787 CC(C)CSc1c(ncnc1Cl)N 62a_100000210624_100010371481 [1,0,1,0,0,0|2,0,0]=4 105 B13R1.3787 CC(C)CSc1c(ncnc1Cl)N 62a_100010371481_100000210760 [1,0,1,0,0,0|2,0,0]=4 106 B13R1.3787 CC(C)CSc1c(ncnc1N)N 62a_100000210624_100010128106 [1,0,1,0,0,0|2,0,0]=4 107 B13R1.3787 CC(C)CSc1c(ncnc1N)N 62a_100010128106_100000210760 [1,0,1,0,0,0|2,0,0]=4 108 B13R1.3787 Cc1ccnc(c1C=CC(C)C)N 271570a_100016257149_100011998619 [1,0,1,0,0,0|1,0,1]=4 109 B13R1.3787 Cc1ccnc(c1SCC(C)C)N 62a_100000210624_100011998619 [1,0,1,0,0,0|2,0,0]=4 110 B13R1.3787 Cc1ccnc(c1SCC(C)C)N 62a_100011998619_100000210760 [1,0,1,0,0,0|2,0,0]=4 111 B13R1.3787 Cc1nccc(c1C=CC(C)C)N 271570a_100016257149_100010243816 [1,0,1,0,0,0|1,0,1]=4 112 B13R1.3787 Cc1nccc(c1SCC(C)C)N 62a_100000210624_100010243816 [1,0,1,0,0,0|2,0,0]=4 113 B13R1.3787 Cc1nccc(c1SCC(C)C)N 62a_100010243816_100000210760 [1,0,1,0,0,0|2,0,0]=4 114 B13R1.3787 Cc1ncnc(c1C=CC(C)C)C 271570a_100016257149_100009820708 [1,0,1,0,0,0|1,0,1]=4 115 B13R1.3787 Cc1ncnc(c1C=CC(C)C)N 271570a_100016257149_100011996190 [1,0,1,0,0,0|0,0,1]=3 116 B13R1.3787 Cc1ncnc(c1C=CC(C)O)N 271570a_200011019289_100011996190 [1,0,1,0,0,0|1,0,1]=4 117 B13R1.3787 Cc1ncnc(c1NCC(C)C)C 27a_100000210953_100009820708 [1,0,1,0,0,0|2,0,0]=4 118 B13R1.3787 Cc1ncnc(c1OCC(C)C)C 34a_100009878406_100000210624 [1,0,1,0,0,0|2,0,0]=4 119 B13R1.3787 Cc1ncnc(c1OCC(C)C)C 7a_100009878406_100000210760 [1,0,1,0,0,0|2,0,0]=4 120 B13R1.3787 Cc1ncnc(c1SCC(C)C)C 62a_100000210624_100009820708 [1,0,1,0,0,0|2,0,0]=4 121 B13R1.3787 Cc1ncnc(c1SCC(C)C)C 62a_100009820708_100000210760 [1,0,1,0,0,0|2,0,0]=4 122 B13R1.3787 Cc1ncnc(c1SCC(C)C)Cl 62a_100000210624_100012356128 [1,0,1,0,0,0|2,0,0]=4 123 B13R1.3787 Cc1ncnc(c1SCC(C)C)Cl 62a_100012356128_100000210760 [1,0,1,0,0,0|2,0,0]=4 124 B13R1.3787 Cc1ncnc(c1SCC(C)C)N 62a_100000210624_100011996190 [1,0,1,0,0,0|1,0,0]=3 125 B13R1.3787 Cc1ncnc(c1SCC(C)C)N 62a_100011996190_100000210760 [1,0,1,0,0,0|1,0,0]=3 126 B13R1.3787 Cc1ncnc(c1SCC(C)O)N 62a_100011218427_100011996190 [1,0,1,0,0,0|2,0,0]=4 127 B13R1.3787 Cc1ncnc(c1SCC(C)O)N 62a_100011996190_100011218427 [1,0,1,0,0,0|2,0,0]=4 128 B13R1.3787 Cc1ncnc(c1SC[C@@H](C)O)N 62a_100009817552_100011996190 [1,0,1,0,0,0|2,0,0]=4 129 B13R1.3787 Cc1ncnc(c1SC[C@@H](C)O)N 62a_100011996190_100009817552 [1,0,1,0,0,0|2,0,0]=4 130 B13R1.4453 CCOC(=O)c1c(ncnc1O)C 271570a_203496583355_200010876006 [1,0,1,0,0,0|2,0,0]=4 131 B13R1.250 CC(C)(CO)Nc1cc(ncn1)N 27a_100000210608_100000701291 [1,0,1,0,0,0|1,0,1]=4 132 B13R1.250 CCC(C)(C)Nc1cc(ncn1)N 27a_100000211385_100000701291 [1,0,1,0,0,0|1,0,1]=4 133 B13R1.250 CCC(C)(C)Sc1cc(ncn1)N 62a_100000032637_100000701291 [1,0,1,0,0,0|1,0,1]=4 134 B13R1.250 CCC(C)(C)Sc1cc(ncn1)N 62a_100000701291_100000032637 [1,0,1,0,0,0|1,0,1]=4 135 B15R1.1584 CNc1ncnc(c1C=O)SC(C)(C)C 62a_100000211941_200012279091 [0,1,1,0,0,0|1,0,0]=3 136 B15R1.5016 C#CC(C)(C)Sc1ncnc(c1C=O)N 62a_100000038118_100000765549 [0,1,1,0,0,0|1,0,1]=4 137 B15R1.5016 C#CC(C)(C)Sc1ncnc(c1C=O)N 62a_100000765549_100000038118 [0,1,1,0,0,0|1,0,1]=4 138 B15R1.5016 CC(C)(C#N)Sc1ncnc(c1C=O)N 62a_100000765549_100011162410 [0,1,1,0,0,0|1,0,1]=4 139 B15R1.5016 CC(C)(C#N)Sc1ncnc(c1C=O)N 62a_100011162410_100000765549 [0,1,1,0,0,0|1,0,1]=4 140 B15R1.5016 CCC(C)(C)Sc1ccnc(c1C=O)N 62a_100009843235_100000032637 [0,1,1,0,0,0|2,0,0]=4 141 B15R1.5016 CCC(C)(C)Sc1nccc(c1C=O)N 62a_100000032637_100000050385 [0,1,1,0,0,0|2,0,0]=4 142 B15R1.5016 CCC(C)(C)Sc1nccc(c1C=O)N 62a_100000050385_100000032637 [0,1,1,0,0,0|2,0,0]=4 143 B15R1.5016 CCC(C)(C)Sc1ncnc(c1C=O)N 62a_100000032637_100000765549 [0,1,1,0,0,0|1,0,0]=3 144 B15R1.5016 CCC(C)(C)Sc1ncnc(c1C=O)N 62a_100000765549_100000032637 [0,1,1,0,0,0|1,0,0]=3 145 B15R1.8297 CC(=O)c1c(ccnc1SC(C)(C)C)N 62a_100000211941_200010729368 [0,1,1,0,0,0|2,0,0]=4 146 B15R1.8297 CC(=O)c1c(ccnc1SC(C)(C)C)N 62a_200010729368_100000211941 [0,1,1,0,0,0|2,0,0]=4 147 B15R1.4541 CNc1ncccc1C(=O)OC(C)(C)C 27a_100102657272_100011933524 [0,1,1,0,0,0|2,0,0]=4 148 B15R1.11746 COC(=O)c1c(ccnc1SC(C)C)N 62a_100000210206_100009985557 [0,1,1,0,0,0|2,0,0]=4 149 B15R1.11746 COC(=O)c1c(ncnc1C=C(C)C)N 271570a_100102525489_200021259019 [0,1,1,0,0,0|0,0,2]=4 150 B15R1.11746 COC(=O)c1c(ncnc1SC(C)C)N 62a_100000210206_200021259019 [0,1,1,0,0,0|1,0,0]=3 151 B15R1.11746 COC(=O)c1c(ncnc1SC(C)C)N 62a_200021259019_100000210206 [0,1,1,0,0,0|1,0,0]=3 152 B15R1.13377 CC(=O)c1c(ccnc1SC(C)CO)N 62a_100012180447_200010729368 [0,1,1,0,0,0|2,0,0]=4 153 B15R1.13377 CC(=O)c1c(ccnc1S[C@H](C)CO)N 62a_100016084084_200010729368 [0,1,1,0,0,0|2,0,0]=4 154 B15R1.13377 CC(=O)c1c(ccnc1S[C@H](C)CO)N 62a_200010729368_100016084084 [0,1,1,0,0,0|2,0,0]=4 155 B15R1.13377 CCC(C)Sc1nccc(c1C(=O)C)N 62a_100000758301_200010729368 [0,1,1,0,0,0|2,0,0]=4 156 B15R1.13377 CCC(C)Sc1nccc(c1C(=O)C)N 62a_200010729368_100000758301 [0,1,1,0,0,0|2,0,0]=4 157 B15R1.13377 COC(C)Sc1nccc(c1C(=O)C)N 62a_100009879195_200010729368 [0,1,1,0,0,0|2,0,0]=4 158 B15R1.13377 COC(C)Sc1nccc(c1C(=O)C)N 62a_200010729368_100009879195 [0,1,1,0,0,0|2,0,0]=4 159 B15R1.5730 CC(C)(CC(=O)N)Nc1cc(ncn1)F 27a_100000763158_200009880791 [0,1,1,0,0,0|2,0,0]=4 160 B15R1.5730 CC(C)(CC(=O)N)Nc1cc(ncn1)N 27a_100000763158_100000701291 [0,1,1,0,0,0|1,0,0]=3 161 B15R1.5730 CC(C)(CC(=O)N)Nc1cc(ncn1)O 27a_100000763158_100000765262 [0,1,1,0,0,0|2,0,0]=4 162 B15R1.5730 CC(C)(CC(=O)N)Nc1ncnc(n1)N 27a_100000763158_100000123831 [0,1,1,0,0,0|2,0,0]=4 163 B15R1.5730 Cc1cc(ncn1)NC(C)(C)CC(=O)N 27a_100000763158_100000744208 [0,1,1,0,0,0|2,0,0]=4 164 B15R2.20946 CNc1nccc2c1C(=O)OC2(C)C 27a_100102657272_100000057204 [0,1,0,0,1,0|2,0,0]=4 165 B15R2.13165 CC1(CC(=O)C=C(C1)c2cnco2)C 271570a_100010378321_100020591547 [0,0,1,1,0,0|2,0,0]=4 166 B15R2.13165 CC1(CC(=O)C=C(C1)c2cncs2)C 271570a_100010378321_100011934649 [0,0,1,1,0,0|2,0,0]=4 167 B15R2.29021 CC(C)(C)Sc1ncnc2c1cn[nH]2 62a_100000211941_100000735611 [0,0,1,1,0,0|2,0,0]=4 168 B15R2.11 CC(C)(C)Sc1c[nH]c2c1cncn2 62a_100000211941_100000072862 [0,0,1,1,0,0|2,0,0]=4 169 B15R2.11 CC(C)(C)Sc1c[nH]c2c1cncn2 62a_100009817560_100000211941 [0,0,1,1,0,0|2,0,0]=4 170 B15R2.11 CC(C)(C)Sc1n[nH]c2c1cncn2 62a_100000211941_100009875510 [0,0,1,1,0,0|2,0,0]=4 171 B15R2.11 CC(C)(C)Sc1n[nH]c2c1cncn2 62a_100009875510_100000211941 [0,0,1,1,0,0|2,0,0]=4 172 B15R2.48037 CC(=O)c1c(ccnc1SC2CC2)N 62a_200010729368_100000211595 [0,0,1,1,0,0|2,0,0]=4 173 B15R2.49945 Cc1c[nH]c2c1c(ncn2)NC(C)C 27a_100138425928_100000092391 [0,0,1,1,0,0|2,0,0]=4 174 B15R2.49945 Cc1c[nH]c2c1c(ncn2)SC(C)C 62a_100000210206_100000092391 [0,0,1,1,0,0|2,0,0]=4 175 B13R1.3789 CC(=C(C)c1c(ncnc1N)C)C 271570a_200000049429_100011996190 [0,0,1,0,1,0|1,0,1]=4 176 B15R1.4803 CC(C)(C)C=Cc1ccnc(c1C=O)N 271570a_100102527731_100009843235 [0,0,1,0,0,1|1,0,1]=4 177 B15R1.4803 CC(C)(C)C=Cc1ncnc(c1C=O)N 271570a_100102527731_100000765549 [0,0,1,0,0,1|0,0,1]=3 178 B15R1.4803 CC(C)(C)CNc1ccnc(c1C=O)F 27a_100000743828_100009877353 [0,0,1,0,0,1|2,0,0]=4 179 B15R1.4803 CC(C)(C)CNc1ncnc(c1C#N)N 27a_100000743828_100000086035 [0,0,1,0,0,1|1,0,1]=4 180 B15R1.4803 CC(C)(C)CSc1cccc(c1C=O)N 62a_100010232536_100011219605 [0,0,1,0,0,1|2,0,0]=4 181 B15R1.4803 CC(C)(C)CSc1ccnc(c1C=O)Cl 62a_100000047006_100011219605 [0,0,1,0,0,1|2,0,0]=4 182 B15R1.4803 CC(C)(C)CSc1ccnc(c1C=O)Cl 62a_100011219605_100000047006 [0,0,1,0,0,1|2,0,0]=4 183 B15R1.4803 CC(C)(C)CSc1ccnc(c1C=O)F 62a_100009828249_100011219605 [0,0,1,0,0,1|2,0,0]=4 184 B15R1.4803 CC(C)(C)CSc1ccnc(c1C=O)F 62a_100011219605_100009828249 [0,0,1,0,0,1|2,0,0]=4 185 B15R1.4803 CC(C)(C)CSc1ccnc(c1C=O)N 62a_100009843235_100011219605 [0,0,1,0,0,1|1,0,0]=3 186 B15R1.4803 CC(C)(C)CSc1nccc(c1C=O)N 62a_100000050385_100011219605 [0,0,1,0,0,1|1,0,0]=3 187 B15R1.4803 CC(C)(C)CSc1nccc(c1C=O)N 62a_100011219605_100000050385 [0,0,1,0,0,1|1,0,0]=3 188 B15R1.4803 CC(C)(C)CSc1nccc(c1C=O)O 62a_200010729673_100011219605 [0,0,1,0,0,1|2,0,0]=4 189 B15R1.4803 CC(C)(C)CSc1ncnc(c1C#N)N 62a_100011219605_100000086035 [0,0,1,0,0,1|1,0,1]=4 190 B15R1.4803 CC(C)(C)CSc1ncnc(c1C=O)N 62a_100000765549_100011219605 [0,0,1,0,0,1|0,0,0]=2 191 B15R1.4803 CC(C)(C)CSc1ncnc(c1C=O)N 62a_100011219605_100000765549 [0,0,1,0,0,1|0,0,0]=2 192 B15R1.4803 CC(C)(F)CSc1ccnc(c1C=O)N 62a_100009843235_100011997219 [0,0,1,0,0,1|2,0,0]=4 193 B15R1.4803 CC(C)(F)CSc1nccc(c1C=O)N 62a_100000050385_100011997219 [0,0,1,0,0,1|2,0,0]=4 194 B15R1.4803 CC(C)(F)CSc1nccc(c1C=O)N 62a_100011997219_100000050385 [0,0,1,0,0,1|2,0,0]=4 195 B15R1.4803 CC(C)(F)CSc1ncnc(c1C=O)N 62a_100000765549_100011997219 [0,0,1,0,0,1|1,0,0]=3 196 B15R1.4803 CC(C)(F)CSc1ncnc(c1C=O)N 62a_100011997219_100000765549 [0,0,1,0,0,1|1,0,0]=3 197 B15R1.4803 CC(C)(O)C=Cc1ncnc(c1C=O)N 271570a_200016258132_100000765549 [0,0,1,0,0,1|1,0,1]=4 198 B15R1.4803 CC(C)(O)CSc1ccnc(c1C=O)N 62a_100009843235_100000764493 [0,0,1,0,0,1|2,0,0]=4 199 B15R1.4803 CC(C)(O)CSc1nccc(c1C=O)N 62a_100000050385_100000764493 [0,0,1,0,0,1|2,0,0]=4 200 B15R1.4803 CC(C)(O)CSc1nccc(c1C=O)N 62a_100000764493_100000050385 [0,0,1,0,0,1|2,0,0]=4 201 B15R1.4803 CC(C)(O)CSc1ncnc(c1C=O)N 62a_100000764493_100000765549 [0,0,1,0,0,1|1,0,0]=3 202 B15R1.4803 CC(C)(O)CSc1ncnc(c1C=O)N 62a_100000765549_100000764493 [0,0,1,0,0,1|1,0,0]=3 203 B15R1.4803 COc1c(ncnc1NCC(C)(C)C)N 27a_100000743828_100011998528 [0,0,1,0,0,1|2,0,0]=4 204 B15R1.4803 COc1c(ncnc1SCC(C)(C)C)N 62a_100011219605_100011998528 [0,0,1,0,0,1|2,0,0]=4 205 B15R1.4803 COc1c(ncnc1SCC(C)(C)C)N 62a_100011998528_100011219605 [0,0,1,0,0,1|2,0,0]=4 206 B15R1.4803 C[N+](C)(C)CSc1ccnc(c1C=O)N 62a_100009843235_200000036245 [0,0,1,0,0,1|2,0,0]=4 207 B15R1.4803 C[N+](C)(C)CSc1nccc(c1C=O)N 62a_100000050385_200000036245 [0,0,1,0,0,1|2,0,0]=4 208 B15R1.4803 C[N+](C)(C)CSc1nccc(c1C=O)N 62a_200000036245_100000050385 [0,0,1,0,0,1|2,0,0]=4 209 B15R1.4803 C[N+](C)(C)CSc1ncnc(c1C=O)N 62a_100000765549_200000036245 [0,0,1,0,0,1|1,0,0]=3 210 B15R1.4803 C[N+](C)(C)CSc1ncnc(c1C=O)N 62a_200000036245_100000765549 [0,0,1,0,0,1|1,0,0]=3 211 B15R1.4803 C[Si](C)(C)C#Cc1ncnc(c1C=O)N 271570a_100010171944_100000765549 [0,0,1,0,0,1|0,1,1]=4 212 B15R1.4803 C[Si](C)(C)CSc1ccnc(c1C=O)N 62a_100009843235_100000037933 [0,0,1,0,0,1|1,1,0]=4 213 B15R1.4803 C[Si](C)(C)CSc1nccc(c1C=O)N 62a_100000037933_100000050385 [0,0,1,0,0,1|1,1,0]=4 214 B15R1.4803 C[Si](C)(C)CSc1nccc(c1C=O)N 62a_100000050385_100000037933 [0,0,1,0,0,1|1,1,0]=4 215 B15R1.4803 C[Si](C)(C)CSc1ncnc(c1C=O)N 62a_100000037933_100000765549 [0,0,1,0,0,1|0,1,0]=3 216 B15R1.4803 C[Si](C)(C)CSc1ncnc(c1C=O)N 62a_100000765549_100000037933 [0,0,1,0,0,1|0,1,0]=3 217 B15R1.5802 CC(C)(C)CC(=O)Cc1cccnc1Br 1458a_100000211214_100010140945 [0,0,1,0,0,1|2,0,0]=4 218 B15R1.5802 CC(C)(C)CC(=O)Cc1cccnc1Cl 1458a_100000211214_100000045678 [0,0,1,0,0,1|2,0,0]=4 219 B15R1.5802 CC(C)(C)CC(=O)Cc1cccnc1F 1458a_100000211214_100000099810 [0,0,1,0,0,1|2,0,0]=4 220 B15R1.5802 Cc1ccncc1CC(=O)CC(C)(C)C 1458a_100000211214_100000690890 [0,0,1,0,0,1|2,0,0]=4 221 B15R1.5802 Cc1ncccc1CC(=O)CC(C)(C)C 1458a_100000211214_100000732876 [0,0,1,0,0,1|2,0,0]=4 222 B15R1.8265 CC(=O)c1c(ccnc1C=CC(C)C)N 271570a_100016257149_200010729368 [0,0,1,0,0,1|1,0,1]=4 223 B15R1.8265 CC(=O)c1c(ccnc1SCC(C)C)N 62a_100000210624_200010729368 [0,0,1,0,0,1|1,0,0]=3 224 B15R1.8265 CC(=O)c1c(ccnc1SCC(C)C)N 62a_200010729368_100000210760 [0,0,1,0,0,1|1,0,0]=3 225 B15R1.8265 CC(=O)c1c(ccnc1SCC(C)O)N 62a_100011218427_200010729368 [0,0,1,0,0,1|2,0,0]=4 226 B15R1.8265 CC(=O)c1c(ccnc1SCC(C)O)N 62a_200010729368_100011218427 [0,0,1,0,0,1|2,0,0]=4 227 B15R1.8265 CC(=O)c1c(ccnc1SC[C@@H](C)O)N 62a_100009817552_200010729368 [0,0,1,0,0,1|2,0,0]=4 228 B15R1.8265 CC(=O)c1c(ccnc1SC[C@@H](C)O)N 62a_200010729368_100009817552 [0,0,1,0,0,1|2,0,0]=4 229 B15R1.8265 CC(C)CSc1ncnc(c1C(C)C)N 62a_100000210624_200011913463 [0,0,1,0,0,1|1,0,1]=4 230 B15R1.8265 CC(C)CSc1ncnc(c1C(C)C)N 62a_200011913463_100000210760 [0,0,1,0,0,1|1,0,1]=4 231 B15R1.8287 Cc1ncnc(c1SC(C)CC(C)C)N 62a_100000731052_100011996190 [0,0,1,0,0,1|1,0,1]=4 232 B15R1.8287 Cc1ncnc(c1SC(C)CC(C)C)N 62a_100011996190_100000731052 [0,0,1,0,0,1|1,0,1]=4 233 B15R1.9737 C=CC[Si](C)(C)CSc1cc(ncn1)N 62a_100000046978_100000701291 [0,0,1,0,0,1|1,1,0]=4 234 B15R1.9737 C=CC[Si](C)(C)CSc1cc(ncn1)N 62a_100000701291_100000046978 [0,0,1,0,0,1|1,1,0]=4 235 B15R1.9737 COCC(C)(C)CNc1cc(ncn1)N 27a_100000734190_100000701291 [0,0,1,0,0,1|2,0,0]=4