0 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 11a_100000715429_100000185807 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 1626a_100000715429_100000185807 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 240690a_100000715429_100000185807 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 527a_100000715429_100000185807 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.352 CC(NC(C)(C)C)c1ccccc1 2230a_100000715429_100000230085 [0,0,0,0,0,0|2,0,0]=2 5 B13R1.352 CC(NC(C)(C)C)c1cnccn1 2230a_100000715429_200000703233 [0,0,0,0,0,0|4,0,0]=4 6 B13R1.352 CC(OC(C)(C)C)c1ccccc1 34a_100015890283_100000211855 [0,0,0,0,0,0|2,0,0]=2 7 B13R1.352 CC(OC(C)(C)C)c1ccccc1 7a_100015890283_100000230085 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.352 CC(OC(C)(C)C)c1cnccn1 7a_100015890283_200000703233 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.352 CC(SC(C)(C)C)c1ccccc1 62a_100000211941_100000230085 [0,0,0,0,0,0|2,0,0]=2 10 B13R1.352 CC(SC(C)(C)C)c1ccccc1 62a_100000230085_100000211941 [0,0,0,0,0,0|2,0,0]=2 11 B13R1.352 CC(SC(C)(C)C)c1cnccn1 62a_100000211941_200000703233 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.352 CC(SC(C)(C)C)c1cnccn1 62a_200000703233_100000211941 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.352 CN(CC(C)(C)C)c1ccccc1 34a_100000210012_100011219605 [0,0,0,0,0,0|2,0,0]=2 14 B13R1.352 CN(CC(C)(C)C)c1cccnn1 27a_100000742839_100016991348 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.352 CN(CC(C)(C)C)c1ccncn1 27a_100000742839_100000703185 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.352 CN(CC(C)(C)C)c1cnccn1 27a_100000742839_100000211759 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.352 CN(CC(C)(C)C)c1ncccn1 27a_100000742839_100000211032 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.352 CN(CC(C)(C)F)c1ccccc1 34a_100000210012_100011997219 [0,0,0,0,0,0|3,0,0]=3 19 B13R1.352 CN(CC(C)(C)O)c1ccccc1 34a_100000210012_100000764493 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.352 CN(C[N+](C)(C)C)c1ccccc1 269982a_100000210012_200000036245 [0,0,0,0,0,0|1,0,0]=1 21 B13R1.352 CN(C[Si](C)(C)C)c1ccccc1 2230a_100000210012_100000037933 [0,0,0,0,0,0|2,0,0]=2 22 B13R1.352 CN(C[Si](C)(C)C)c1cccnn1 27a_200020589227_100016991348 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.352 CN(C[Si](C)(C)C)c1ccncn1 27a_200020589227_100000703185 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.352 CN(C[Si](C)(C)C)c1cnccn1 27a_200020589227_100000211759 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.352 CN(C[Si](C)(C)C)c1ncccn1 27a_200020589227_100000211032 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.352 C[C@@H](NS(=O)(=O)C)c1ccccc1 40a_100000751104_100000738038 [0,0,0,0,0,0|4,0,0]=4 27 B13R1.352 C[C@@H](OC(C)(C)C)c1ccccc1 34a_100000761318_100000210625 [0,0,0,0,0,0|2,0,0]=2 28 B13R1.352 C[Si](C)(C)CC(=O)c1ccccc1 1458a_100000185807_100000233785 [0,0,0,0,0,0|2,0,1]=3 29 B12R1.107 C=C(C)CN(C)c1ccccc1 2230a_100000210012_100000748629 [1,0,0,0,0,0|2,0,1]=4 30 B12R1.107 C=C(C)CN(C)c1ccccc1 269982a_100000210012_100000748629 [1,0,0,0,0,0|2,0,1]=4 31 B12R1.107 C=C(C)CN(C)c1ccccc1 34a_100000210012_100000748629 [1,0,0,0,0,0|2,0,1]=4 32 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000070787_100000756946 [1,0,0,0,0,0|2,0,0]=3 33 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000183687_200000210301 [1,0,0,0,0,0|2,0,0]=3 34 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,0,0,0,0,0|3,0,0]=4 35 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,0,0,0,0,0|3,0,0]=4 36 B12R1.107 CC(=O)CN(C)c1ccccc1 1458a_100000745425_200000210301 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,0,0,0,0,0|3,0,0]=4 38 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100015343762 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100015343762 [1,0,0,0,0,0|3,0,0]=4 40 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100015343762 [1,0,0,0,0,0|3,0,0]=4 41 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100103153847 [1,0,0,0,0,0|3,0,0]=4 42 B12R1.107 CC(C)CC(=O)c1ccccc1 1458a_100000185807_100000210624 [1,0,0,0,0,0|2,0,1]=4 43 B12R1.107 CC(C)CN(C)c1ccccc1 2230a_100000210012_100000210760 [1,0,0,0,0,0|2,0,0]=3 44 B12R1.107 CC(C)CN(C)c1ccccc1 269982a_100000210012_100000210624 [1,0,0,0,0,0|2,0,0]=3 45 B12R1.107 CC(C)CN(C)c1ccccc1 34a_100000210012_100000210624 [1,0,0,0,0,0|2,0,0]=3 46 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [1,0,0,0,0,0|2,0,0]=3 47 B12R1.107 CC(C)C[C@H](N)c1ccccn1 271570a_100015190218_100011216584 [1,0,0,0,0,0|3,0,0]=4 48 B12R1.107 CC(C)C[C@H](N)c1cccnc1 271570a_100015190218_100000752921 [1,0,0,0,0,0|3,0,0]=4 49 B12R1.107 CC(C)C[C@H](N)c1ccncc1 271570a_100015190218_100000035832 [1,0,0,0,0,0|3,0,0]=4 50 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [1,0,0,0,0,0|2,0,0]=3 51 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [1,0,0,0,0,0|2,0,0]=3 52 B12R1.107 CC(C)NC(C)c1ccccn1 2230a_100000181244_100000210206 [1,0,0,0,0,0|3,0,0]=4 53 B12R1.107 CC(C)NC(C)c1cccnc1 2230a_100000195435_100000210206 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.107 CC(C)NC(C)c1ccncc1 2230a_100000181269_100000210206 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [1,0,0,0,0,0|2,0,0]=3 56 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [1,0,0,0,0,0|2,0,0]=3 57 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [1,0,0,0,0,0|2,0,0]=3 58 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [1,0,0,0,0,0|2,0,0]=3 59 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000210206_100000230085 [1,0,0,0,0,0|2,0,0]=3 60 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000230085_100000210206 [1,0,0,0,0,0|2,0,0]=3 61 B12R1.107 CC(CC(=O)[13CH3])c1ccccc1 1458a_100000183687_200025704644 [1,0,0,0,0,0|2,0,0]=3 62 B12R1.107 CC(CN(C)C)c1ccccc1 2230a_100102631434_100000756946 [1,0,0,0,0,0|0,0,1]=2 63 B12R1.107 CC(CN(C)C)c1ccccc1 269982a_100102631434_100000756946 [1,0,0,0,0,0|0,0,1]=2 64 B12R1.107 CC(CN(C)C)c1ccccc1 270004a_100102631434_100000212034 [1,0,0,0,0,0|0,0,1]=2 65 B12R1.107 CC(O)CN(C)c1ccccc1 2230a_100000210012_100011218427 [1,0,0,0,0,0|3,0,0]=4 66 B12R1.107 CC(O)CN(C)c1ccccc1 269982a_100000210012_100011218427 [1,0,0,0,0,0|3,0,0]=4 67 B12R1.107 CC(O)CN(C)c1ccccc1 34a_100000210012_100011218427 [1,0,0,0,0,0|3,0,0]=4 68 B12R1.107 CN(C)CC(=O)c1ccccc1 269982a_100102631434_100000211460 [1,0,0,0,0,0|1,0,2]=4 69 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [1,0,0,0,0,0|1,0,1]=3 70 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [1,0,0,0,0,0|1,0,1]=3 71 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [1,0,0,0,0,0|1,0,1]=3 72 B12R1.107 CN(C)CS(=O)c1ccccc1 269982a_100102631434_100000031784 [1,0,0,0,0,0|2,0,1]=4 73 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [1,0,0,0,0,0|1,0,1]=3 74 B12R1.107 CN(CC(=O)[13CH3])c1ccccc1 1458a_100000745425_200025704644 [1,0,0,0,0,0|3,0,0]=4 75 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [1,0,0,0,0,0|1,0,1]=3 76 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [1,0,0,0,0,0|1,0,1]=3 77 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 2230a_100000210012_100009817552 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 269982a_100000210012_100009817552 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 34a_100000210012_100009817552 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.891 CC(C)(C)C=Cc1ccccc1 271570a_100102527731_100000210277 [1,0,0,0,0,0|1,0,2]=4 82 B12R1.891 CC(C)(C)CNc1ccccc1 34a_100000106764_100011219605 [1,0,0,0,0,0|2,0,0]=3 83 B12R1.891 CC(C)(C)COc1ccccc1 34a_100000210340_100011219605 [1,0,0,0,0,0|2,0,0]=3 84 B12R1.891 CC(C)(C)COc1cccnc1 34a_100000210849_100011219605 [1,0,0,0,0,0|3,0,0]=4 85 B12R1.891 CC(C)(C)COc1ccncc1 34a_100000212176_100011219605 [1,0,0,0,0,0|3,0,0]=4 86 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100000719477_100011219605 [1,0,0,0,0,0|2,0,0]=3 87 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100011219605_100000041952 [1,0,0,0,0,0|2,0,0]=3 88 B12R1.891 CC(C)(C)CSc1ccccn1 62a_100011216584_100011219605 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.891 CC(C)(C)CSc1ccccn1 62a_100011219605_100011216584 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.891 CC(C)(C)CSc1cccnc1 62a_100000210063_100011219605 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.891 CC(C)(C)CSc1cccnc1 62a_100011219605_100000210063 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.891 CC(C)(C)CSc1ccncc1 62a_100000728582_100011219605 [1,0,0,0,0,0|3,0,0]=4 93 B12R1.891 CC(C)(C)CSc1ccncc1 62a_100011219605_100000728582 [1,0,0,0,0,0|3,0,0]=4 94 B12R1.891 CC(C)(C)NCc1ccccc1 207a_100000715429_100015611070 [1,0,0,0,0,0|2,0,0]=3 95 B12R1.891 CC(C)(C)NCc1ccccc1 2230a_100000715429_100015291786 [1,0,0,0,0,0|2,0,0]=3 96 B12R1.891 CC(C)(C)NCc1ccccc1 34a_100015324214_100000210625 [1,0,0,0,0,0|2,0,0]=3 97 B12R1.891 CC(C)(C)NCc1ccccn1 207a_100000715429_100000209966 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.891 CC(C)(C)NCc1ccccn1 2230a_100000715429_100000721315 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.891 CC(C)(C)NCc1cccnc1 207a_100000715429_100000209961 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.891 CC(C)(C)NCc1cccnc1 2230a_100000715429_100000741622 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.891 CC(C)(C)NCc1ccncc1 207a_100000715429_100000186114 [1,0,0,0,0,0|3,0,0]=4 102 B12R1.891 CC(C)(C)NCc1ccncc1 2230a_100000715429_100015193705 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100000210790_100000210625 [1,0,0,0,0,0|2,0,0]=3 104 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100015890283_100015291786 [1,0,0,0,0,0|2,0,0]=3 105 B12R1.891 CC(C)(C)OCc1ccccc1 7a_100015890283_100000211182 [1,0,0,0,0,0|2,0,0]=3 106 B12R1.891 CC(C)(C)OCc1ccccn1 34a_100015890283_100000721315 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.891 CC(C)(C)OCc1ccccn1 7a_100015890283_100000721315 [1,0,0,0,0,0|3,0,0]=4 108 B12R1.891 CC(C)(C)OCc1cccnc1 34a_100015890283_100000733263 [1,0,0,0,0,0|3,0,0]=4 109 B12R1.891 CC(C)(C)OCc1cccnc1 7a_100015890283_100000741622 [1,0,0,0,0,0|3,0,0]=4 110 B12R1.891 CC(C)(C)OCc1ccncc1 7a_100015890283_100015193705 [1,0,0,0,0,0|3,0,0]=4 111 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211182_100000211941 [1,0,0,0,0,0|2,0,0]=3 112 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211941_100015291786 [1,0,0,0,0,0|2,0,0]=3 113 B12R1.891 CC(C)(C)SCc1ccccn1 62a_100000211941_100000721315 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.891 CC(C)(C)SCc1ccccn1 62a_100000721315_100000211941 [1,0,0,0,0,0|3,0,0]=4 115 B12R1.891 CC(C)(C)SCc1cccnc1 62a_100000211941_100000741622 [1,0,0,0,0,0|3,0,0]=4 116 B12R1.891 CC(C)(C)SCc1cccnc1 62a_100000741622_100000211941 [1,0,0,0,0,0|3,0,0]=4 117 B12R1.891 CC(C)(C)SCc1ccncc1 62a_100000211941_100015193705 [1,0,0,0,0,0|3,0,0]=4 118 B12R1.891 CC(C)(C)SCc1ccncc1 62a_100015193705_100000211941 [1,0,0,0,0,0|3,0,0]=4 119 B12R1.891 CC(C)(F)CNc1ccccc1 34a_100000106764_100011997219 [1,0,0,0,0,0|3,0,0]=4 120 B12R1.891 CC(C)(F)COc1ccccc1 34a_100000210340_100011997219 [1,0,0,0,0,0|3,0,0]=4 121 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100000719477_100011997219 [1,0,0,0,0,0|3,0,0]=4 122 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100011997219_100000041952 [1,0,0,0,0,0|3,0,0]=4 123 B12R1.891 CC(C)(O)CNc1ccccc1 34a_100000106764_100000764493 [1,0,0,0,0,0|3,0,0]=4 124 B12R1.891 CC(C)(O)COc1ccccc1 34a_100000210340_100000764493 [1,0,0,0,0,0|3,0,0]=4 125 B12R1.891 CC(C)(O)COc1ccccc1 7a_100000210340_100000764493 [1,0,0,0,0,0|3,0,0]=4 126 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000719477_100000764493 [1,0,0,0,0,0|3,0,0]=4 127 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000764493_100000041952 [1,0,0,0,0,0|3,0,0]=4 128 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_100000719477_200000036245 [1,0,0,0,0,0|1,0,0]=2 129 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_200000036245_100000041952 [1,0,0,0,0,0|1,0,0]=2 130 B12R1.891 C[N+](C)(C)CSc1ccccn1 62a_100011216584_200000036245 [1,0,0,0,0,0|2,0,0]=3 131 B12R1.891 C[N+](C)(C)CSc1ccccn1 62a_200000036245_100011216584 [1,0,0,0,0,0|2,0,0]=3 132 B12R1.891 C[N+](C)(C)CSc1cccnc1 62a_100000210063_200000036245 [1,0,0,0,0,0|2,0,0]=3 133 B12R1.891 C[N+](C)(C)CSc1cccnc1 62a_200000036245_100000210063 [1,0,0,0,0,0|2,0,0]=3 134 B12R1.891 C[N+](C)(C)CSc1cccnn1 62a_100016991348_200000036245 [1,0,0,0,0,0|3,0,0]=4 135 B12R1.891 C[N+](C)(C)CSc1cccnn1 62a_200000036245_100016991348 [1,0,0,0,0,0|3,0,0]=4 136 B12R1.891 C[N+](C)(C)CSc1ccncc1 62a_100000728582_200000036245 [1,0,0,0,0,0|2,0,0]=3 137 B12R1.891 C[N+](C)(C)CSc1ccncc1 62a_200000036245_100000728582 [1,0,0,0,0,0|2,0,0]=3 138 B12R1.891 C[N+](C)(C)CSc1ccncn1 62a_100000703185_200000036245 [1,0,0,0,0,0|3,0,0]=4 139 B12R1.891 C[N+](C)(C)CSc1ccncn1 62a_200000036245_100000703185 [1,0,0,0,0,0|3,0,0]=4 140 B12R1.891 C[N+](C)(C)CSc1ccnnc1 62a_100000732662_200000036245 [1,0,0,0,0,0|3,0,0]=4 141 B12R1.891 C[N+](C)(C)CSc1ccnnc1 62a_200000036245_100000732662 [1,0,0,0,0,0|3,0,0]=4 142 B12R1.891 C[N+](C)(C)CSc1cnccn1 62a_100000211759_200000036245 [1,0,0,0,0,0|3,0,0]=4 143 B12R1.891 C[N+](C)(C)CSc1cnccn1 62a_200000036245_100000211759 [1,0,0,0,0,0|3,0,0]=4 144 B12R1.891 C[N+](C)(C)CSc1cncnc1 62a_100011206942_200000036245 [1,0,0,0,0,0|3,0,0]=4 145 B12R1.891 C[N+](C)(C)CSc1cncnc1 62a_200000036245_100011206942 [1,0,0,0,0,0|3,0,0]=4 146 B12R1.891 C[N+](C)(C)CSc1ncccn1 62a_100000211032_200000036245 [1,0,0,0,0,0|3,0,0]=4 147 B12R1.891 C[N+](C)(C)CSc1ncccn1 62a_200000036245_100000211032 [1,0,0,0,0,0|3,0,0]=4 148 B12R1.891 C[Si](C)(C)C#Cc1ccccc1 271570a_100010171944_100000210277 [1,0,0,0,0,0|1,0,2]=4 149 B12R1.891 C[Si](C)(C)COc1ccccc1 7a_100000210340_100000233785 [1,0,0,0,0,0|2,0,0]=3 150 B12R1.891 C[Si](C)(C)COc1cccnc1 7a_100000210849_100000233785 [1,0,0,0,0,0|3,0,0]=4 151 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000037933_100000041952 [1,0,0,0,0,0|2,0,0]=3 152 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000719477_100000037933 [1,0,0,0,0,0|2,0,0]=3 153 B12R1.891 C[Si](C)(C)CSc1ccccn1 62a_100000037933_100011216584 [1,0,0,0,0,0|3,0,0]=4 154 B12R1.891 C[Si](C)(C)CSc1ccccn1 62a_100011216584_100000037933 [1,0,0,0,0,0|3,0,0]=4 155 B12R1.891 C[Si](C)(C)CSc1cccnc1 62a_100000037933_100000210063 [1,0,0,0,0,0|3,0,0]=4 156 B12R1.891 C[Si](C)(C)CSc1cccnc1 62a_100000210063_100000037933 [1,0,0,0,0,0|3,0,0]=4 157 B12R1.891 C[Si](C)(C)CSc1ccncc1 62a_100000037933_100000728582 [1,0,0,0,0,0|3,0,0]=4 158 B12R1.891 C[Si](C)(C)CSc1ccncc1 62a_100000728582_100000037933 [1,0,0,0,0,0|3,0,0]=4 159 B14R1.290 C#CC(C)(C)NC(C)c1ccccc1 34a_100000054563_100000211855 [0,1,0,0,0,0|2,0,1]=4 160 B14R1.290 C#CC(C)(C)OC(C)c1ccccc1 34a_100000189450_100000211855 [0,1,0,0,0,0|2,0,1]=4 161 B14R1.290 C#CC(C)(C)OC(C)c1ccccc1 7a_100000189450_100000230085 [0,1,0,0,0,0|2,0,1]=4 162 B14R1.290 C#CC(C)(C)O[C@H](C)c1ccccc1 34a_100000761318_100000038118 [0,1,0,0,0,0|2,0,1]=4 163 B14R1.290 C#CC(C)(C)SC(C)c1ccccc1 62a_100000038118_100000230085 [0,1,0,0,0,0|2,0,1]=4 164 B14R1.290 C#CC(C)(C)SC(C)c1ccccc1 62a_100000230085_100000038118 [0,1,0,0,0,0|2,0,1]=4 165 B14R1.290 C=CC(C)(C)OC(C)c1ccccc1 34a_100011215311_100000211855 [0,1,0,0,0,0|2,0,1]=4 166 B14R1.290 C=CC(C)(C)OC(C)c1ccccc1 7a_100011215311_100000230085 [0,1,0,0,0,0|2,0,1]=4 167 B14R1.290 C=C[Si](C)(C)CN(C)c1ccccc1 2230a_100000210012_100000038793 [0,1,0,0,0,0|2,0,1]=4 168 B14R1.290 CC(NC(C)(C)CO)c1ccccc1 2230a_100000210608_100000230085 [0,1,0,0,0,0|2,0,0]=3 169 B14R1.290 CC(OC(C)(C)C#N)c1ccccc1 34a_200015195151_100000211855 [0,1,0,0,0,0|2,0,1]=4 170 B14R1.290 CC(OC(C)(C)CCl)c1ccccc1 7a_100000764493_100000230085 [0,1,0,0,0,0|2,0,0]=3 171 B14R1.290 CC(SC(C)(C)C#N)c1ccccc1 62a_100000230085_100011162410 [0,1,0,0,0,0|2,0,1]=4 172 B14R1.290 CC(SC(C)(C)C#N)c1ccccc1 62a_100011162410_100000230085 [0,1,0,0,0,0|2,0,1]=4 173 B14R1.290 CCC(C)(C)NC(C)c1ccccc1 2230a_100000211385_100000230085 [0,1,0,0,0,0|2,0,0]=3 174 B14R1.290 CCC(C)(C)OC(C)c1ccccc1 7a_100000210230_100000230085 [0,1,0,0,0,0|2,0,0]=3 175 B14R1.290 CCC(C)(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210677 [0,1,0,0,0,0|2,0,0]=3 176 B14R1.290 CCC(C)(C)SC(C)c1ccccc1 62a_100000032637_100000230085 [0,1,0,0,0,0|2,0,0]=3 177 B14R1.290 CCC(C)(C)SC(C)c1ccccc1 62a_100000230085_100000032637 [0,1,0,0,0,0|2,0,0]=3 178 B14R1.290 CN(CC(C)(C)CO)c1ccccc1 34a_100000210012_100009813988 [0,1,0,0,0,0|2,0,0]=3 179 B14R1.290 COC(C)(C)CN(C)c1ccccc1 269982a_100000210012_100000701081 [0,1,0,0,0,0|2,0,0]=3 180 B14R1.290 COC(C)(C)CN(C)c1ccccc1 34a_100000210012_100000701081 [0,1,0,0,0,0|2,0,0]=3 181 B14R1.290 C[C@@H](OC(C)(C)C#N)c1ccccc1 34a_100000761318_100011162410 [0,1,0,0,0,0|2,0,1]=4 182 B14R1.290 C[C@@H](OC(C)(C)C#N)c1ccccc1 7a_100000761318_100011162410 [0,1,0,0,0,0|2,0,1]=4 183 B14R1.544 C#CC(OC(C)(C)C)c1ccccc1 34a_100011219616_100000210625 [0,1,0,0,0,0|2,0,1]=4 184 B14R1.544 C=CC(NC(C)(C)C)c1ccccc1 2230a_100000715429_200000085779 [0,1,0,0,0,0|2,0,1]=4 185 B14R1.544 C=CC(OC(C)(C)C)c1ccccc1 34a_100011215659_100000210625 [0,1,0,0,0,0|2,0,1]=4 186 B14R1.544 C=CC(SC(C)(C)C)c1ccccc1 62a_100000211941_200000085779 [0,1,0,0,0,0|2,0,1]=4 187 B14R1.544 C=CC(SC(C)(C)C)c1ccccc1 62a_200000085779_100000211941 [0,1,0,0,0,0|2,0,1]=4 188 B14R1.544 CC(C)(C)CC(N[13CH3])c1cccnc1 2230a_100011935037_200025704644 [0,1,0,0,0,0|2,0,0]=3 189 B14R1.544 CC(C)(C)N[C@H](CO)c1ccccc1 34a_100000751927_100000210625 [0,1,0,0,0,0|2,0,0]=3 190 B14R1.544 CC(C)(C)OC(CN)c1ccccc1 34a_100000210709_100000210625 [0,1,0,0,0,0|2,0,0]=3 191 B14R1.544 CC(C)(C)O[C@H](CCl)c1ccccc1 34a_100011933945_100000210625 [0,1,0,0,0,0|2,0,0]=3 192 B14R1.544 CCC(OC(C)(C)C)c1ccccc1 34a_100000698172_100000210625 [0,1,0,0,0,0|2,0,0]=3 193 B14R1.544 CCN(CC(C)(C)C)c1ccccc1 34a_100000210013_100011219605 [0,1,0,0,0,0|2,0,0]=3 194 B14R1.544 CCN(CC(C)(C)F)c1ccccc1 34a_100000210013_100011997219 [0,1,0,0,0,0|3,0,0]=4 195 B14R1.544 CCN(CC(C)(C)O)c1ccccc1 34a_100000210013_100000764493 [0,1,0,0,0,0|3,0,0]=4 196 B14R1.544 CCN(C[N+](C)(C)C)c1ccccc1 269982a_100000210013_200000036245 [0,1,0,0,0,0|1,0,0]=2 197 B14R1.544 CCN(C[Si](C)(C)C)c1ccccc1 2230a_100000210013_100000037933 [0,1,0,0,0,0|2,0,0]=3 198 B14R1.544 CNC(CC(C)(C)C)c1cccnc1 2230a_100011935037_200000210301 [0,1,0,0,0,0|2,0,0]=3 199 B14R1.683 CC(NC(C)(C)C)c1ccc(cc1)Br 2230a_100000715429_100000755118 [0,1,0,0,0,0|2,0,0]=3 200 B14R1.683 CC(NC(C)(C)C)c1ccc(cc1)Cl 2230a_100000715429_100000684792 [0,1,0,0,0,0|2,0,0]=3 201 B14R1.683 CC(NC(C)(C)C)c1ccc(cc1)F 2230a_100000715429_100000743420 [0,1,0,0,0,0|2,0,0]=3 202 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)Br 34a_100000745893_100000210625 [0,1,0,0,0,0|2,0,0]=3 203 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)Br 34a_100015890283_100000755118 [0,1,0,0,0,0|2,0,0]=3 204 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)Cl 7a_100015890283_100000684792 [0,1,0,0,0,0|2,0,0]=3 205 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)F 34a_100000181323_100000210625 [0,1,0,0,0,0|2,0,0]=3 206 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)F 34a_100015890283_100000743420 [0,1,0,0,0,0|2,0,0]=3 207 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)F 7a_100015890283_100000743420 [0,1,0,0,0,0|2,0,0]=3 208 B14R1.683 CC(OC(C)(C)C)c1ccc(cc1)N 34a_100011216399_100000210625 [0,1,0,0,0,0|2,0,0]=3 209 B14R1.683 CC(OC(C)(C)C)c1ccc(cn1)Br 34a_100012353650_100000210625 [0,1,0,0,0,0|3,0,0]=4 210 B14R1.683 CC(OC(C)(C)C)c1ccc(nc1)Br 34a_200010274204_100000210625 [0,1,0,0,0,0|3,0,0]=4 211 B14R1.683 CC(OC(C)(C)C)c1ccc(nc1)Cl 34a_200012017543_100000210625 [0,1,0,0,0,0|3,0,0]=4 212 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)Br 62a_100000211941_100000755118 [0,1,0,0,0,0|2,0,0]=3 213 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)Br 62a_100000755118_100000211941 [0,1,0,0,0,0|2,0,0]=3 214 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)Cl 62a_100000211941_100000684792 [0,1,0,0,0,0|2,0,0]=3 215 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)Cl 62a_100000684792_100000211941 [0,1,0,0,0,0|2,0,0]=3 216 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)F 62a_100000211941_100000743420 [0,1,0,0,0,0|2,0,0]=3 217 B14R1.683 CC(SC(C)(C)C)c1ccc(cc1)F 62a_100000743420_100000211941 [0,1,0,0,0,0|2,0,0]=3 218 B14R1.683 CN(CC(C)(C)C)c1ccc(cc1)Br 34a_100000219623_100011219605 [0,1,0,0,0,0|2,0,0]=3 219 B14R1.683 CN(CC(C)(C)C)c1ccc(cc1)Cl 34a_100020629279_100011219605 [0,1,0,0,0,0|2,0,0]=3 220 B14R1.683 CN(CC(C)(C)C)c1ccc(cc1)F 34a_100000219829_100011219605 [0,1,0,0,0,0|2,0,0]=3 221 B14R1.683 CN(CC(C)(C)C)c1ccc(cc1)I 34a_100000743151_100011219605 [0,1,0,0,0,0|2,0,0]=3 222 B14R1.683 CN(CC(C)(C)C)c1ccc(cc1)O 34a_100000182112_100011219605 [0,1,0,0,0,0|2,0,0]=3 223 B14R1.683 CN(CC(C)(C)C)c1ccc(cn1)Br 27a_100000742839_100000686858 [0,1,0,0,0,0|3,0,0]=4 224 B14R1.683 CN(CC(C)(C)F)c1ccc(cc1)Br 34a_100000219623_100011997219 [0,1,0,0,0,0|3,0,0]=4 225 B14R1.683 CN(CC(C)(C)F)c1ccc(cc1)Cl 34a_100020629279_100011997219 [0,1,0,0,0,0|3,0,0]=4 226 B14R1.683 CN(CC(C)(C)F)c1ccc(cc1)F 34a_100000219829_100011997219 [0,1,0,0,0,0|3,0,0]=4 227 B14R1.683 CN(CC(C)(C)F)c1ccc(cc1)I 34a_100000743151_100011997219 [0,1,0,0,0,0|3,0,0]=4 228 B14R1.683 CN(CC(C)(C)F)c1ccc(cc1)O 34a_100000182112_100011997219 [0,1,0,0,0,0|3,0,0]=4 229 B14R1.683 CN(CC(C)(C)O)c1ccc(cc1)Br 34a_100000219623_100000764493 [0,1,0,0,0,0|3,0,0]=4 230 B14R1.683 CN(CC(C)(C)O)c1ccc(cc1)Cl 34a_100020629279_100000764493 [0,1,0,0,0,0|3,0,0]=4 231 B14R1.683 CN(CC(C)(C)O)c1ccc(cc1)F 34a_100000219829_100000764493 [0,1,0,0,0,0|3,0,0]=4 232 B14R1.683 CN(CC(C)(C)O)c1ccc(cc1)I 34a_100000743151_100000764493 [0,1,0,0,0,0|3,0,0]=4 233 B14R1.683 CN(CC(C)(C)O)c1ccc(cc1)O 34a_100000182112_100000764493 [0,1,0,0,0,0|3,0,0]=4 234 B14R1.683 CN(C[N+](C)(C)C)c1ccc(cc1)Br 269982a_100000219623_200000036245 [0,1,0,0,0,0|1,0,0]=2 235 B14R1.683 CN(C[N+](C)(C)C)c1ccc(cc1)Cl 269982a_100020629279_200000036245 [0,1,0,0,0,0|1,0,0]=2 236 B14R1.683 CN(C[N+](C)(C)C)c1ccc(cc1)F 269982a_100000219829_200000036245 [0,1,0,0,0,0|1,0,0]=2 237 B14R1.683 CN(C[N+](C)(C)C)c1ccc(cc1)I 269982a_100000743151_200000036245 [0,1,0,0,0,0|1,0,0]=2 238 B14R1.683 CN(C[N+](C)(C)C)c1ccc(cc1)O 269982a_100000182112_200000036245 [0,1,0,0,0,0|1,0,0]=2 239 B14R1.683 CN(C[Si](C)(C)C)c1ccc(cc1)Br 2230a_100000219623_100000037933 [0,1,0,0,0,0|2,0,0]=3 240 B14R1.683 CN(C[Si](C)(C)C)c1ccc(cc1)Cl 2230a_100020629279_100000037933 [0,1,0,0,0,0|2,0,0]=3 241 B14R1.683 CN(C[Si](C)(C)C)c1ccc(cc1)F 2230a_100000219829_100000037933 [0,1,0,0,0,0|2,0,0]=3 242 B14R1.683 CN(C[Si](C)(C)C)c1ccc(cc1)I 2230a_100000743151_100000037933 [0,1,0,0,0,0|2,0,0]=3 243 B14R1.683 CN(C[Si](C)(C)C)c1ccc(cn1)Br 27a_200020589227_100000686858 [0,1,0,0,0,0|3,0,0]=4 244 B14R1.683 C[C@@H](NC(C)(C)C)c1ccc(cc1)Cl 34a_100015205461_100000210625 [0,1,0,0,0,0|2,0,0]=3 245 B14R1.683 C[C@H](NC(C)(C)C)c1ccc(cc1)F 34a_100025705893_100000210625 [0,1,0,0,0,0|2,0,0]=3 246 B14R1.683 C[C@H](OC(C)(C)C)c1ccc(cc1)Cl 34a_100011852131_100000210625 [0,1,0,0,0,0|2,0,0]=3 247 B14R1.683 C[Si](C)(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000233785 [0,1,0,0,0,0|2,0,1]=4 248 B14R1.683 C[Si](C)(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000233785 [0,1,0,0,0,0|2,0,1]=4 249 B14R1.683 C[Si](C)(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000233785 [0,1,0,0,0,0|2,0,1]=4 250 B14R1.683 C[Si](C)(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000233785 [0,1,0,0,0,0|2,0,1]=4 251 B14R1.683 C[Si](C)(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000233785 [0,1,0,0,0,0|2,0,1]=4 252 B14R1.683 Cc1ccc(cc1)C(=O)C[Si](C)(C)C 1458a_100000188618_100000233785 [0,1,0,0,0,0|2,0,1]=4 253 B14R1.683 Cc1ccc(cc1)C(C)NC(C)(C)C 2230a_100000715429_100011261388 [0,1,0,0,0,0|2,0,0]=3 254 B14R1.683 Cc1ccc(cc1)C(C)OC(C)(C)C 34a_100015890283_100011261388 [0,1,0,0,0,0|2,0,0]=3 255 B14R1.683 Cc1ccc(cc1)C(C)OC(C)(C)C 7a_100015890283_100011261388 [0,1,0,0,0,0|2,0,0]=3 256 B14R1.683 Cc1ccc(cc1)C(C)SC(C)(C)C 62a_100000211941_100011261388 [0,1,0,0,0,0|2,0,0]=3 257 B14R1.683 Cc1ccc(cc1)C(C)SC(C)(C)C 62a_100011261388_100000211941 [0,1,0,0,0,0|2,0,0]=3 258 B14R1.683 Cc1ccc(cc1)N(C)CC(C)(C)C 34a_100000219977_100011219605 [0,1,0,0,0,0|2,0,0]=3 259 B14R1.683 Cc1ccc(cc1)N(C)CC(C)(C)F 34a_100000219977_100011997219 [0,1,0,0,0,0|3,0,0]=4 260 B14R1.683 Cc1ccc(cc1)N(C)CC(C)(C)O 34a_100000219977_100000764493 [0,1,0,0,0,0|3,0,0]=4 261 B14R1.683 Cc1ccc(cc1)N(C)C[N+](C)(C)C 269982a_100000219977_200000036245 [0,1,0,0,0,0|1,0,0]=2 262 B14R1.683 Cc1ccc(cc1)N(C)C[Si](C)(C)C 2230a_100000219977_100000037933 [0,1,0,0,0,0|2,0,0]=3 263 B14R1.683 Cc1ccc(cc1)[C@@H](C)NC(C)(C)C 34a_100016988085_100000210625 [0,1,0,0,0,0|2,0,0]=3 264 B14R1.683 Cc1ccc(cc1)[C@@H](C)OC(C)(C)C 34a_100000690690_100000210625 [0,1,0,0,0,0|2,0,0]=3 265 B14R1.683 Cc1ccc(cn1)C(C)NC(C)(C)C 34a_100011815741_100000210625 [0,1,0,0,0,0|3,0,0]=4 266 B14R1.683 Cc1ccc(cn1)C(C)OC(C)(C)C 34a_200011815720_100000210625 [0,1,0,0,0,0|3,0,0]=4 267 B14R1.683 [2H]C(OC(C)(C)C)c1ccc(cc1)F 34a_217856618577_100000210625 [0,1,0,0,0,0|3,0,0]=4 268 B14R1.3335 CC(C)(C)NC(C)(C)c1ccccc1 2230a_100000715429_100000034625 [0,1,0,0,0,0|2,0,0]=3 269 B14R1.3335 CC(C)(C)OC(F)(F)c1ccccc1 7a_100015890283_100000036403 [0,1,0,0,0,0|3,0,0]=4 270 B14R1.3335 CC(C)(C)SC(C)(C)c1ccccc1 62a_100000034625_100000211941 [0,1,0,0,0,0|2,0,0]=3 271 B14R1.3335 CC(C)(C)SC(C)(C)c1ccccc1 62a_100000211941_100000034625 [0,1,0,0,0,0|2,0,0]=3 272 B14R1.3335 CC(C)(C)SC(F)(F)c1ccccc1 62a_100000211941_100000036403 [0,1,0,0,0,0|3,0,0]=4 273 B14R1.4451 CC(NC(C)(C)C)c1ccccc1Cl 2230a_100000715429_100000181259 [0,1,0,0,0,0|2,0,0]=3 274 B14R1.4451 CC(NC(C)(C)C)c1ccccc1Cl 34a_100000174978_100000210625 [0,1,0,0,0,0|2,0,0]=3 275 B14R1.4451 CC(NC(C)(C)C)c1ccccc1F 2230a_100000715429_200000741388 [0,1,0,0,0,0|2,0,0]=3 276 B14R1.4451 CC(NC(C)(C)C)c1ccccc1F 34a_100000181408_100000210625 [0,1,0,0,0,0|2,0,0]=3 277 B14R1.4451 CC(OC(C)(C)C)c1ccccc1Br 34a_100000702211_100000210625 [0,1,0,0,0,0|2,0,0]=3 278 B14R1.4451 CC(OC(C)(C)C)c1ccccc1Cl 34a_100000740796_100000210625 [0,1,0,0,0,0|2,0,0]=3 279 B14R1.4451 CC(OC(C)(C)C)c1ccccc1Cl 7a_100015890283_100000181259 [0,1,0,0,0,0|2,0,0]=3 280 B14R1.4451 CC(OC(C)(C)C)c1ccccc1F 34a_100000697922_100000210625 [0,1,0,0,0,0|2,0,0]=3 281 B14R1.4451 CC(OC(C)(C)C)c1ccccc1F 34a_100015890283_200000741388 [0,1,0,0,0,0|2,0,0]=3 282 B14R1.4451 CC(OC(C)(C)C)c1ccccc1F 7a_100015890283_200000741388 [0,1,0,0,0,0|2,0,0]=3 283 B14R1.4451 CC(OC(C)(C)C)c1cccnc1Cl 34a_100009865335_100000210625 [0,1,0,0,0,0|3,0,0]=4 284 B14R1.4451 CC(OC(C)(C)C)c1ccncc1F 34a_100012180158_100000210625 [0,1,0,0,0,0|3,0,0]=4 285 B14R1.4451 CC(SC(C)(C)C)c1ccccc1Cl 62a_100000181259_100000211941 [0,1,0,0,0,0|2,0,0]=3 286 B14R1.4451 CC(SC(C)(C)C)c1ccccc1Cl 62a_100000211941_100000181259 [0,1,0,0,0,0|2,0,0]=3 287 B14R1.4451 CC(SC(C)(C)C)c1ccccc1F 62a_100000211941_200000741388 [0,1,0,0,0,0|2,0,0]=3 288 B14R1.4451 CC(SC(C)(C)C)c1ccccc1F 62a_200000741388_100000211941 [0,1,0,0,0,0|2,0,0]=3 289 B14R1.4451 CN(CC(C)(C)C)c1ccccc1Br 34a_100020606079_100011219605 [0,1,0,0,0,0|2,0,0]=3 290 B14R1.4451 CN(CC(C)(C)C)c1ccccc1Cl 34a_100000219374_100011219605 [0,1,0,0,0,0|2,0,0]=3 291 B14R1.4451 CN(CC(C)(C)C)c1ccccc1F 34a_100000220357_100011219605 [0,1,0,0,0,0|2,0,0]=3 292 B14R1.4451 CN(CC(C)(C)C)c1ccncc1Br 27a_100000742839_100000726257 [0,1,0,0,0,0|3,0,0]=4 293 B14R1.4451 CN(CC(C)(C)C)c1ccncc1F 27a_100000742839_100000035921 [0,1,0,0,0,0|3,0,0]=4 294 B14R1.4451 CN(CC(C)(C)C)c1ncccc1Br 27a_100000742839_100000696092 [0,1,0,0,0,0|3,0,0]=4 295 B14R1.4451 CN(CC(C)(C)F)c1ccccc1Br 34a_100020606079_100011997219 [0,1,0,0,0,0|3,0,0]=4 296 B14R1.4451 CN(CC(C)(C)F)c1ccccc1Cl 34a_100000219374_100011997219 [0,1,0,0,0,0|3,0,0]=4 297 B14R1.4451 CN(CC(C)(C)F)c1ccccc1F 34a_100000220357_100011997219 [0,1,0,0,0,0|3,0,0]=4 298 B14R1.4451 CN(CC(C)(C)O)c1ccccc1Br 34a_100020606079_100000764493 [0,1,0,0,0,0|3,0,0]=4 299 B14R1.4451 CN(CC(C)(C)O)c1ccccc1Cl 34a_100000219374_100000764493 [0,1,0,0,0,0|3,0,0]=4 300 B14R1.4451 CN(CC(C)(C)O)c1ccccc1F 34a_100000220357_100000764493 [0,1,0,0,0,0|3,0,0]=4 301 B14R1.4451 CN(CC(C)(C)O)c1ccccc1F 38a_100000220357_100000691082 [0,1,0,0,0,0|3,0,0]=4 302 B14R1.4451 CN(C[N+](C)(C)C)c1ccccc1Br 269982a_100020606079_200000036245 [0,1,0,0,0,0|1,0,0]=2 303 B14R1.4451 CN(C[N+](C)(C)C)c1ccccc1Cl 269982a_100000219374_200000036245 [0,1,0,0,0,0|1,0,0]=2 304 B14R1.4451 CN(C[N+](C)(C)C)c1ccccc1F 269982a_100000220357_200000036245 [0,1,0,0,0,0|1,0,0]=2 305 B14R1.4451 CN(C[N+](C)(C)C)c1ccccc1O 269982a_100000033821_200000036245 [0,1,0,0,0,0|1,0,0]=2 306 B14R1.4451 CN(C[Si](C)(C)C)c1ccccc1Br 2230a_100020606079_100000037933 [0,1,0,0,0,0|2,0,0]=3 307 B14R1.4451 CN(C[Si](C)(C)C)c1ccccc1Cl 2230a_100000219374_100000037933 [0,1,0,0,0,0|2,0,0]=3 308 B14R1.4451 CN(C[Si](C)(C)C)c1ccccc1F 2230a_100000220357_100000037933 [0,1,0,0,0,0|2,0,0]=3 309 B14R1.4451 CN(C[Si](C)(C)C)c1ccncc1Br 27a_200020589227_100000726257 [0,1,0,0,0,0|3,0,0]=4 310 B14R1.4451 CN(C[Si](C)(C)C)c1ccncc1F 27a_200020589227_100000035921 [0,1,0,0,0,0|3,0,0]=4 311 B14R1.4451 CN(C[Si](C)(C)C)c1ncccc1Br 27a_200020589227_100000696092 [0,1,0,0,0,0|3,0,0]=4 312 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000233785 [0,1,0,0,0,0|2,0,1]=4 313 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000233785 [0,1,0,0,0,0|2,0,1]=4 314 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1F 1458a_100000188656_100000233785 [0,1,0,0,0,0|2,0,1]=4 315 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1I 1458a_100000187884_100000233785 [0,1,0,0,0,0|2,0,1]=4 316 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1O 1458a_100015234032_100000233785 [0,1,0,0,0,0|2,0,1]=4 317 B14R1.4451 C[Si](C)(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000233785 [0,1,0,0,0,0|2,0,1]=4 318 B14R1.4451 Cc1ccccc1C(=O)C[Si](C)(C)C 1458a_100000212026_100000233785 [0,1,0,0,0,0|2,0,1]=4 319 B14R1.4451 Cc1ccccc1C(C)NC(C)(C)C 34a_100000181355_100000210625 [0,1,0,0,0,0|2,0,0]=3 320 B14R1.4451 Cc1ccccc1C(C)OC(C)(C)C 34a_100000742021_100000210625 [0,1,0,0,0,0|2,0,0]=3 321 B14R1.4451 Cc1ccccc1N(C)CC(C)(C)C 34a_100000219699_100011219605 [0,1,0,0,0,0|2,0,0]=3 322 B14R1.4451 Cc1ccccc1N(C)CC(C)(C)F 34a_100000219699_100011997219 [0,1,0,0,0,0|3,0,0]=4 323 B14R1.4451 Cc1ccccc1N(C)CC(C)(C)O 34a_100000219699_100000764493 [0,1,0,0,0,0|3,0,0]=4 324 B14R1.4451 Cc1ccccc1N(C)C[N+](C)(C)C 269982a_100000219699_200000036245 [0,1,0,0,0,0|1,0,0]=2 325 B14R1.4451 Cc1ccccc1N(C)C[Si](C)(C)C 2230a_100000219699_100000037933 [0,1,0,0,0,0|2,0,0]=3 326 B14R1.4451 Cc1cnccc1N(C)CC(C)(C)C 27a_100000742839_100000765111 [0,1,0,0,0,0|3,0,0]=4 327 B14R1.4451 Cc1cnccc1N(C)C[Si](C)(C)C 27a_200020589227_100000765111 [0,1,0,0,0,0|3,0,0]=4 328 B14R1.5966 CC(NC(C)(C)C)c1cccc(c1)Cl 34a_100102723534_100000210625 [0,1,0,0,0,0|2,0,0]=3 329 B14R1.5966 CC(OC(C)(C)C)c1cccc(c1)Br 34a_100000246457_100000210625 [0,1,0,0,0,0|2,0,0]=3 330 B14R1.5966 CC(OC(C)(C)C)c1cccc(c1)F 34a_100000744526_100000210625 [0,1,0,0,0,0|2,0,0]=3 331 B14R1.5966 CC(OC(C)(C)C)c1cccc(c1)I 34a_100013085317_100000210625 [0,1,0,0,0,0|2,0,0]=3 332 B14R1.5966 CC(OC(C)(C)C)c1cccc(c1)N 34a_100011217120_100000210625 [0,1,0,0,0,0|2,0,0]=3 333 B14R1.5966 CC(OC(C)(C)C)c1cncc(c1)Br 34a_100012351597_100000210625 [0,1,0,0,0,0|3,0,0]=4 334 B14R1.5966 CN(CC(C)(C)C)c1cc(ccn1)F 27a_100000742839_100000764206 [0,1,0,0,0,0|3,0,0]=4 335 B14R1.5966 CN(CC(C)(C)C)c1cc[nH]c(=O)c1 27a_100000742839_100000061649 [0,1,0,0,0,0|3,0,0]=4 336 B14R1.5966 CN(CC(C)(C)C)c1cccc(c1)Br 34a_100000219648_100011219605 [0,1,0,0,0,0|2,0,0]=3 337 B14R1.5966 CN(CC(C)(C)C)c1cccc(c1)Cl 34a_100000220044_100011219605 [0,1,0,0,0,0|2,0,0]=3 338 B14R1.5966 CN(CC(C)(C)C)c1cccc(c1)F 34a_100020633736_100011219605 [0,1,0,0,0,0|2,0,0]=3 339 B14R1.5966 CN(CC(C)(C)C)c1cccc(c1)I 34a_100000221217_100011219605 [0,1,0,0,0,0|2,0,0]=3 340 B14R1.5966 CN(CC(C)(C)C)c1cccc(c1)O 34a_100000756613_100011219605 [0,1,0,0,0,0|2,0,0]=3 341 B14R1.5966 CN(CC(C)(C)C)c1cccc(n1)F 27a_100000742839_100009815982 [0,1,0,0,0,0|3,0,0]=4 342 B14R1.5966 CN(CC(C)(C)C)c1ccnc(c1)F 27a_100000742839_100009816116 [0,1,0,0,0,0|3,0,0]=4 343 B14R1.5966 CN(CC(C)(C)F)c1cccc(c1)Br 34a_100000219648_100011997219 [0,1,0,0,0,0|3,0,0]=4 344 B14R1.5966 CN(CC(C)(C)F)c1cccc(c1)Cl 34a_100000220044_100011997219 [0,1,0,0,0,0|3,0,0]=4 345 B14R1.5966 CN(CC(C)(C)F)c1cccc(c1)F 34a_100020633736_100011997219 [0,1,0,0,0,0|3,0,0]=4 346 B14R1.5966 CN(CC(C)(C)F)c1cccc(c1)I 34a_100000221217_100011997219 [0,1,0,0,0,0|3,0,0]=4 347 B14R1.5966 CN(CC(C)(C)F)c1cccc(c1)O 34a_100000756613_100011997219 [0,1,0,0,0,0|3,0,0]=4 348 B14R1.5966 CN(CC(C)(C)O)c1cccc(c1)Br 34a_100000219648_100000764493 [0,1,0,0,0,0|3,0,0]=4 349 B14R1.5966 CN(CC(C)(C)O)c1cccc(c1)Cl 34a_100000220044_100000764493 [0,1,0,0,0,0|3,0,0]=4 350 B14R1.5966 CN(CC(C)(C)O)c1cccc(c1)F 34a_100020633736_100000764493 [0,1,0,0,0,0|3,0,0]=4 351 B14R1.5966 CN(CC(C)(C)O)c1cccc(c1)I 34a_100000221217_100000764493 [0,1,0,0,0,0|3,0,0]=4 352 B14R1.5966 CN(CC(C)(C)O)c1cccc(c1)O 34a_100000756613_100000764493 [0,1,0,0,0,0|3,0,0]=4 353 B14R1.5966 CN(C[N+](C)(C)C)c1cccc(c1)Br 269982a_100000219648_200000036245 [0,1,0,0,0,0|1,0,0]=2 354 B14R1.5966 CN(C[N+](C)(C)C)c1cccc(c1)Cl 269982a_100000220044_200000036245 [0,1,0,0,0,0|1,0,0]=2 355 B14R1.5966 CN(C[N+](C)(C)C)c1cccc(c1)F 269982a_100020633736_200000036245 [0,1,0,0,0,0|1,0,0]=2 356 B14R1.5966 CN(C[N+](C)(C)C)c1cccc(c1)I 269982a_100000221217_200000036245 [0,1,0,0,0,0|1,0,0]=2 357 B14R1.5966 CN(C[N+](C)(C)C)c1cccc(c1)O 269982a_100000756613_200000036245 [0,1,0,0,0,0|1,0,0]=2 358 B14R1.5966 CN(C[Si](C)(C)C)c1cc(ccn1)F 27a_200020589227_100000764206 [0,1,0,0,0,0|3,0,0]=4 359 B14R1.5966 CN(C[Si](C)(C)C)c1cc[nH]c(=O)c1 27a_200020589227_100000061649 [0,1,0,0,0,0|3,0,0]=4 360 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(c1)Br 2230a_100000219648_100000037933 [0,1,0,0,0,0|2,0,0]=3 361 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(c1)Cl 2230a_100000220044_100000037933 [0,1,0,0,0,0|2,0,0]=3 362 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(c1)F 2230a_100020633736_100000037933 [0,1,0,0,0,0|2,0,0]=3 363 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(c1)I 2230a_100000221217_100000037933 [0,1,0,0,0,0|2,0,0]=3 364 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(c1)O 2230a_100000756613_100000037933 [0,1,0,0,0,0|2,0,0]=3 365 B14R1.5966 CN(C[Si](C)(C)C)c1cccc(n1)F 27a_200020589227_100009815982 [0,1,0,0,0,0|3,0,0]=4 366 B14R1.5966 CN(C[Si](C)(C)C)c1ccnc(c1)F 27a_200020589227_100009816116 [0,1,0,0,0,0|3,0,0]=4 367 B14R1.5966 C[C@@H](NC(C)(C)C)c1cccc(c1)F 34a_100015193778_100000210625 [0,1,0,0,0,0|2,0,0]=3 368 B14R1.5966 C[C@@H](OC(C)(C)C)c1cccc(c1)Cl 34a_100000747380_100000210625 [0,1,0,0,0,0|2,0,0]=3 369 B14R1.5966 C[C@H](NC(C)(C)C)c1cccc(n1)F 34a_100025709760_100000210625 [0,1,0,0,0,0|3,0,0]=4 370 B14R1.5966 C[Si](C)(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000233785 [0,1,0,0,0,0|2,0,1]=4 371 B14R1.5966 C[Si](C)(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000233785 [0,1,0,0,0,0|2,0,1]=4 372 B14R1.5966 C[Si](C)(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000233785 [0,1,0,0,0,0|2,0,1]=4 373 B14R1.5966 C[Si](C)(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000233785 [0,1,0,0,0,0|2,0,1]=4 374 B14R1.5966 C[Si](C)(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000233785 [0,1,0,0,0,0|2,0,1]=4 375 B14R1.5966 Cc1cc(ccn1)N(C)CC(C)(C)C 27a_100000742839_100000758586 [0,1,0,0,0,0|3,0,0]=4 376 B14R1.5966 Cc1cc(ccn1)N(C)C[Si](C)(C)C 27a_200020589227_100000758586 [0,1,0,0,0,0|3,0,0]=4 377 B14R1.5966 Cc1cccc(c1)C(=O)C[Si](C)(C)C 1458a_100000189346_100000233785 [0,1,0,0,0,0|2,0,1]=4 378 B14R1.5966 Cc1cccc(c1)C(C)OC(C)(C)C 34a_100000757818_100000210625 [0,1,0,0,0,0|2,0,0]=3 379 B14R1.5966 Cc1cccc(c1)N(C)CC(C)(C)C 34a_100000219674_100011219605 [0,1,0,0,0,0|2,0,0]=3 380 B14R1.5966 Cc1cccc(c1)N(C)CC(C)(C)F 34a_100000219674_100011997219 [0,1,0,0,0,0|3,0,0]=4 381 B14R1.5966 Cc1cccc(c1)N(C)CC(C)(C)O 34a_100000219674_100000764493 [0,1,0,0,0,0|3,0,0]=4 382 B14R1.5966 Cc1cccc(c1)N(C)C[N+](C)(C)C 269982a_100000219674_200000036245 [0,1,0,0,0,0|1,0,0]=2 383 B14R1.5966 Cc1cccc(c1)N(C)C[Si](C)(C)C 2230a_100000219674_100000037933 [0,1,0,0,0,0|2,0,0]=3 384 B14R1.5966 Cc1cccc(c1)[C@@H](C)NC(C)(C)C 34a_100000698126_100000210625 [0,1,0,0,0,0|2,0,0]=3 385 B14R1.5966 Cc1cccc(n1)C(C)OC(C)(C)C 34a_200011877368_100000210625 [0,1,0,0,0,0|3,0,0]=4 386 B14R1.10526 CC(C(=O)C(C)(C)C)c1ccccc1 1458a_106744555173_100000230085 [0,1,0,0,0,0|1,0,1]=3 387 B14R1.10526 CC(C(=O)C(C)(C)F)c1ccccc1 1458a_100000765255_100000230085 [0,1,0,0,0,0|2,0,1]=4 388 B14R1.10526 CC(C(=O)C(C)(C)O)c1ccccc1 1458a_100000242741_100000230085 [0,1,0,0,0,0|2,0,1]=4 389 B14R1.10526 CC(c1ccccc1)N(C)C(C)(C)C 269982a_100000195388_100000210625 [0,1,0,0,0,0|2,0,0]=3 390 B14R1.10526 CC(c1ccccc1)N(C)C(C)(C)C 269982a_100011215553_100000230085 [0,1,0,0,0,0|2,0,0]=3 391 B14R1.10526 CC(c1ccccn1)N(C)C(C)(C)C 269982a_100000231138_100000210625 [0,1,0,0,0,0|3,0,0]=4 392 B14R1.10526 CC(c1cccnc1)N(C)C(C)(C)C 269982a_100000232774_100000210625 [0,1,0,0,0,0|3,0,0]=4 393 B14R1.10526 CC(c1ccncc1)N(C)C(C)(C)C 269982a_100000231139_100000210625 [0,1,0,0,0,0|3,0,0]=4 394 B14R1.10526 CN(C(=O)C(C)(C)C)c1ccccc1 11a_100000210012_106744555173 [0,1,0,0,0,0|2,0,1]=4 395 B14R1.10526 CN(C(=O)C(C)(C)C)c1ccccc1 1626a_100000210012_106744555173 [0,1,0,0,0,0|2,0,1]=4 396 B14R1.10526 CN(C(=O)C(C)(C)C)c1ccccc1 22a_100000210012_106744555173 [0,1,0,0,0,0|2,0,1]=4 397 B12R0.410 C=CC=CC(=O)N(C)CC(C)(C)C 1626a_100000742839_100016291481 [0,0,1,0,0,0|3,0,0]=4 398 B12R0.410 C=CC=CC(=O)N(C)C[Si](C)(C)C 1626a_200020589227_100016291481 [0,0,1,0,0,0|3,0,0]=4 399 B14R2.9595 CC(NC1(CC1)C)c2ccccc2 2230a_100000757604_100000230085 [0,0,0,1,0,0|2,0,0]=3 400 B14R2.9595 CC(OC1(CC1)C)c2ccccc2 7a_100011725673_100000230085 [0,0,0,1,0,0|2,0,0]=3 401 B14R2.9595 CN(CC1(CO1)C)c2ccccc2 269982a_100000210012_100000760498 [0,0,0,1,0,0|3,0,0]=4 402 B14R2.9595 CN(CC1(CO1)C)c2ccccc2 34a_100000210012_100000760498 [0,0,0,1,0,0|3,0,0]=4 403 B14R2.45895 CC(C)(C)OC1Cc2c1cccc2 7a_100015890283_100009813401 [0,0,0,1,0,0|2,0,0]=3 404 B14R2.45895 CC(C)(C)SC1Cc2c1cccc2 62a_100000211941_100009813401 [0,0,0,1,0,0|2,0,0]=3 405 B14R2.45895 CC(C)(C)SC1Cc2c1cccc2 62a_100009813401_100000211941 [0,0,0,1,0,0|2,0,0]=3 406 B12R1.265 CC(OC(C)(C)C)c1ccsc1 34a_100011350980_100000210625 [0,0,0,0,1,0|3,0,0]=4 407 B12R1.265 C[C@H](OC(C)(C)C)c1ccco1 34a_100000755270_100000210625 [0,0,0,0,1,0|3,0,0]=4 408 B12R1.564 CN(c1ccccc1)C(C)(C)C 269982a_100000210012_100000210625 [0,0,0,0,1,0|2,0,0]=3 409 B12R1.564 CN(c1ccccc1)C(C)(C)C 34a_100000210012_100000210625 [0,0,0,0,1,0|2,0,0]=3 410 B14R1.433 CC(C)(C)CC(=O)Cc1ccccc1 1458a_100000211214_100015291786 [0,0,0,0,0,1|2,0,1]=4 411 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 11a_100000106764_100000211214 [0,0,0,0,0,1|2,0,1]=4 412 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000211214 [0,0,0,0,0,1|2,0,1]=4 413 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 22a_100000106764_100000211214 [0,0,0,0,0,1|2,0,1]=4 414 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 527a_100000106764_100000211214 [0,0,0,0,0,1|2,0,1]=4 415 B14R1.433 CC(C)(C)CN([13CH3])Cc1ccccc1 2230a_100000751856_200025704644 [0,0,0,0,0,1|2,0,0]=3 416 B14R1.433 CC(C)(C)CN([13CH3])Cc1ccccc1 269982a_100000751856_200025704644 [0,0,0,0,0,1|2,0,0]=3 417 B14R1.433 CC(C)(O)CN([13CH3])Cc1ccccc1 2230a_100000697163_200025704644 [0,0,0,0,0,1|3,0,0]=4 418 B14R1.433 CC(C)(O)CN([13CH3])Cc1ccccc1 269982a_100000697163_200025704644 [0,0,0,0,0,1|3,0,0]=4 419 B14R1.433 CC(Cc1ccccc1)OC(C)(C)C 34a_100000748627_100000210625 [0,0,0,0,0,1|2,0,0]=3 420 B14R1.433 CC(Cc1ccccc1)OC(C)(C)C 34a_100015890283_200011218536 [0,0,0,0,0,1|2,0,0]=3 421 B14R1.433 CC(Cc1ccccc1)OC(C)(C)C 7a_100015890283_200011218536 [0,0,0,0,0,1|2,0,0]=3 422 B14R1.433 CC(Cc1ccccc1)SC(C)(C)C 62a_100000211941_200011218536 [0,0,0,0,0,1|2,0,0]=3 423 B14R1.433 CC(Cc1ccccc1)SC(C)(C)C 62a_200011218536_100000211941 [0,0,0,0,0,1|2,0,0]=3 424 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 2230a_100000742839_100015291786 [0,0,0,0,0,1|2,0,0]=3 425 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 2230a_100000751856_200000210301 [0,0,0,0,0,1|2,0,0]=3 426 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 269982a_100000742839_100000211182 [0,0,0,0,0,1|2,0,0]=3 427 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 269982a_100000751856_200000210301 [0,0,0,0,0,1|2,0,0]=3 428 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 270004a_100000186898_100011204126 [0,0,0,0,0,1|2,0,0]=3 429 B14R1.433 CN(Cc1ccccc1)CC(C)(C)C 270004a_100000742839_100015611070 [0,0,0,0,0,1|2,0,0]=3 430 B14R1.433 CN(Cc1ccccc1)CC(C)(C)O 2230a_100000697163_200000210301 [0,0,0,0,0,1|3,0,0]=4 431 B14R1.433 CN(Cc1ccccc1)CC(C)(C)O 2230a_100000755907_100015291786 [0,0,0,0,0,1|3,0,0]=4 432 B14R1.433 CN(Cc1ccccc1)CC(C)(C)O 269982a_100000697163_200000210301 [0,0,0,0,0,1|3,0,0]=4 433 B14R1.433 CN(Cc1ccccc1)CC(C)(C)O 269982a_100000755907_100000211182 [0,0,0,0,0,1|3,0,0]=4 434 B14R1.433 CN(Cc1ccccc1)CC(C)(C)O 270004a_100000755907_100015611070 [0,0,0,0,0,1|3,0,0]=4 435 B14R1.433 CN(Cc1ccccc1)C[N+](C)(C)C 269982a_100000186898_200000036245 [0,0,0,0,0,1|1,0,0]=2 436 B14R1.433 CN(Cc1ccccc1)C[Si](C)(C)C 2230a_100000186898_100000037933 [0,0,0,0,0,1|2,0,0]=3 437 B14R1.433 CN(Cc1ccccc1)C[Si](C)(C)C 269982a_100000032861_200000210301 [0,0,0,0,0,1|2,0,0]=3 438 B14R1.433 CN(Cc1ccccc1)C[Si](C)(C)C 269982a_200020589227_100000211182 [0,0,0,0,0,1|2,0,0]=3 439 B14R1.433 CN(Cc1ccccn1)CC(C)(C)C 2230a_100000742839_100000721315 [0,0,0,0,0,1|3,0,0]=4 440 B14R1.433 CN(Cc1ccccn1)CC(C)(C)C 269982a_100000742839_100000721315 [0,0,0,0,0,1|3,0,0]=4 441 B14R1.433 CN(Cc1ccccn1)CC(C)(C)C 270004a_100000207498_100011204126 [0,0,0,0,0,1|3,0,0]=4 442 B14R1.433 CN(Cc1ccccn1)CC(C)(C)C 270004a_100000742839_100000209966 [0,0,0,0,0,1|3,0,0]=4 443 B14R1.433 CN(Cc1ccccn1)C[N+](C)(C)C 269982a_100000207498_200000036245 [0,0,0,0,0,1|2,0,0]=3 444 B14R1.433 CN(Cc1ccccn1)C[Si](C)(C)C 2230a_100000207498_100000037933 [0,0,0,0,0,1|3,0,0]=4 445 B14R1.433 CN(Cc1ccccn1)C[Si](C)(C)C 269982a_200020589227_100000721315 [0,0,0,0,0,1|3,0,0]=4 446 B14R1.433 CN(Cc1cccnc1)CC(C)(C)C 2230a_100000742839_100000741622 [0,0,0,0,0,1|3,0,0]=4 447 B14R1.433 CN(Cc1cccnc1)CC(C)(C)C 269982a_100000742839_100000733263 [0,0,0,0,0,1|3,0,0]=4 448 B14R1.433 CN(Cc1cccnc1)CC(C)(C)C 270004a_100000184577_100011204126 [0,0,0,0,0,1|3,0,0]=4 449 B14R1.433 CN(Cc1cccnc1)CC(C)(C)C 270004a_100000742839_100000209961 [0,0,0,0,0,1|3,0,0]=4 450 B14R1.433 CN(Cc1cccnc1)C[N+](C)(C)C 269982a_100000184577_200000036245 [0,0,0,0,0,1|2,0,0]=3 451 B14R1.433 CN(Cc1cccnc1)C[Si](C)(C)C 2230a_100000184577_100000037933 [0,0,0,0,0,1|3,0,0]=4 452 B14R1.433 CN(Cc1cccnc1)C[Si](C)(C)C 269982a_200020589227_100000733263 [0,0,0,0,0,1|3,0,0]=4 453 B14R1.433 CN(Cc1ccncc1)CC(C)(C)C 2230a_100000742839_100015193705 [0,0,0,0,0,1|3,0,0]=4 454 B14R1.433 CN(Cc1ccncc1)CC(C)(C)C 269982a_100000742839_100015193705 [0,0,0,0,0,1|3,0,0]=4 455 B14R1.433 CN(Cc1ccncc1)CC(C)(C)C 270004a_100000187231_100011204126 [0,0,0,0,0,1|3,0,0]=4 456 B14R1.433 CN(Cc1ccncc1)C[N+](C)(C)C 269982a_100000187231_200000036245 [0,0,0,0,0,1|2,0,0]=3 457 B14R1.433 CN(Cc1ccncc1)C[Si](C)(C)C 2230a_100000187231_100000037933 [0,0,0,0,0,1|3,0,0]=4 458 B14R1.433 CN(Cc1ccncc1)C[Si](C)(C)C 269982a_200020589227_100015193705 [0,0,0,0,0,1|3,0,0]=4 459 B14R1.433 CN(Cc1cnccn1)C[N+](C)(C)C 269982a_100011269079_200000036245 [0,0,0,0,0,1|3,0,0]=4 460 B14R1.433 CN(Cc1ncccn1)C[N+](C)(C)C 269982a_100025716638_200000036245 [0,0,0,0,0,1|3,0,0]=4 461 B14R1.433 C[C@@H](CC(C)(C)C)Nc1cccnn1 27a_106358413534_100016991348 [0,0,0,0,0,1|3,0,0]=4 462 B14R1.433 C[C@@H](CC(C)(C)C)Nc1ccncn1 27a_106358413534_100000703185 [0,0,0,0,0,1|3,0,0]=4 463 B14R1.433 C[C@@H](CC(C)(C)C)Nc1cnccn1 27a_106358413534_100000211759 [0,0,0,0,0,1|3,0,0]=4 464 B14R1.433 C[C@@H](CC(C)(C)C)Nc1ncccn1 27a_106358413534_100000211032 [0,0,0,0,0,1|3,0,0]=4 465 B14R1.433 C[N+](C)(C)CC(=O)Cc1ccccc1 1458a_100000033712_100015291786 [0,0,0,0,0,1|1,0,1]=3 466 B14R1.433 C[N+](C)(C)CC(=O)Cc1ccccn1 1458a_100000033712_100000721315 [0,0,0,0,0,1|2,0,1]=4 467 B14R1.433 C[N+](C)(C)CC(=O)Cc1cccnc1 1458a_100000033712_100000733263 [0,0,0,0,0,1|2,0,1]=4 468 B14R1.433 C[N+](C)(C)CC(=O)Cc1ccncc1 1458a_100000033712_100000705612 [0,0,0,0,0,1|2,0,1]=4 469 B14R1.433 C[N+](C)(C)CC(=O)Nc1ccccc1 11a_100000106764_100000033712 [0,0,0,0,0,1|1,0,1]=3 470 B14R1.433 C[N+](C)(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000033712 [0,0,0,0,0,1|1,0,1]=3 471 B14R1.433 C[N+](C)(C)CC(=O)Nc1ccccc1 22a_100000106764_100000033712 [0,0,0,0,0,1|1,0,1]=3 472 B14R1.433 C[N+](C)(C)CC(=O)Nc1ccccc1 527a_100000106764_100000033712 [0,0,0,0,0,1|1,0,1]=3 473 B14R1.433 C[Si](C)(C)CC(=O)Cc1ccccc1 1458a_100011218504_100015291786 [0,0,0,0,0,1|2,0,1]=4 474 B14R1.433 C[Si](C)(C)CC(=O)Nc1ccccc1 11a_100000106764_100011218504 [0,0,0,0,0,1|2,0,1]=4 475 B14R1.433 C[Si](C)(C)CC(=O)Nc1ccccc1 1626a_100000106764_100011218504 [0,0,0,0,0,1|2,0,1]=4 476 B14R1.433 C[Si](C)(C)CN([13CH3])Cc1ccccc1 269982a_100000032861_200025704644 [0,0,0,0,0,1|2,0,0]=3 477 B14R1.3098 CC(=NNC(C)(C)C)c1ccccc1 4a_100000725372_100000185851 [0,0,0,0,0,1|2,0,1]=4 478 B14R1.3098 CC(C)(C)CCC(=O)c1ccccc1 1458a_100000185807_100000755188 [0,0,0,0,0,1|2,0,1]=4 479 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 11a_100000743828_100000185807 [0,0,0,0,0,1|2,0,1]=4 480 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 1626a_100000743828_100000185807 [0,0,0,0,0,1|2,0,1]=4 481 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 240690a_100000743828_100000185807 [0,0,0,0,0,1|2,0,1]=4 482 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 527a_100000743828_100000185807 [0,0,0,0,0,1|2,0,1]=4 483 B14R1.3098 CC(C)(C)NCC(O)c1ccccc1 2230a_100000715429_100000185958 [0,0,0,0,0,1|2,0,0]=3 484 B14R1.3098 CC(C)(C)NC[C@@H](O)c1ccccc1 2230a_100000715429_100011933945 [0,0,0,0,0,1|2,0,0]=3 485 B14R1.3098 CC(C)(C)OCC(=O)c1ccccc1 7a_100015890283_100000211460 [0,0,0,0,0,1|2,0,1]=4 486 B14R1.3098 CC(C)(C)OCC(O)c1ccccc1 34a_100015890283_100000185958 [0,0,0,0,0,1|2,0,0]=3 487 B14R1.3098 CC(C)(C)OCC(O)c1ccccc1 7a_100015890283_100000185958 [0,0,0,0,0,1|2,0,0]=3 488 B14R1.3098 CC(C)(C)OC[C@@H](N)c1ccccc1 34a_100000751927_100000210625 [0,0,0,0,0,1|2,0,0]=3 489 B14R1.3098 CC(C)(C)OC[C@@H](N)c1ccncc1 34a_100138412524_100000210625 [0,0,0,0,0,1|3,0,0]=4 490 B14R1.3098 CC(C)(C)OC[C@@H](O)c1ccccc1 34a_100015890283_100011933945 [0,0,0,0,0,1|2,0,0]=3 491 B14R1.3098 CC(C)(C)OC[C@@H](O)c1ccccc1 7a_100015890283_100011933945 [0,0,0,0,0,1|2,0,0]=3 492 B14R1.3098 CC(C)(C)SCC(=O)c1ccccc1 62a_100000211460_100000211941 [0,0,0,0,0,1|2,0,1]=4 493 B14R1.3098 CC(C)(C)SCC(=O)c1ccccc1 62a_100000211941_100000211460 [0,0,0,0,0,1|2,0,1]=4 494 B14R1.3098 CC(C)(C)SCC(O)c1ccccc1 62a_100000185958_100000211941 [0,0,0,0,0,1|2,0,0]=3 495 B14R1.3098 CC(C)(C)SCC(O)c1ccccc1 62a_100000211941_100000185958 [0,0,0,0,0,1|2,0,0]=3 496 B14R1.3098 CC(C)(C)SCS(=O)c1ccccc1 62a_100000211941_100000031784 [0,0,0,0,0,1|3,0,0]=4 497 B14R1.3098 CC(C)(C)SC[C@@H](O)c1ccccc1 62a_100000211941_100011933945 [0,0,0,0,0,1|2,0,0]=3 498 B14R1.3098 CC(C)(C)SC[C@@H](O)c1ccccc1 62a_100011933945_100000211941 [0,0,0,0,0,1|2,0,0]=3 499 B14R1.3098 CC(CNC(C)(C)C)c1ccccc1 2230a_100000715429_100000756946 [0,0,0,0,0,1|1,0,0]=2 500 B14R1.3098 CC(CNC(C)(C)C)c1ccccc1 34a_100000701038_100000210625 [0,0,0,0,0,1|1,0,0]=2 501 B14R1.3098 CC(CNS(=O)(=O)C)c1ccccc1 40a_100000701038_100000738038 [0,0,0,0,0,1|3,0,0]=4 502 B14R1.3098 CC(COC(C)(C)C)c1ccccc1 34a_100011215166_100000210625 [0,0,0,0,0,1|1,0,0]=2 503 B14R1.3098 CC(COC(C)(C)C)c1ccccc1 34a_100015890283_100000756946 [0,0,0,0,0,1|1,0,0]=2 504 B14R1.3098 CC(COC(C)(C)C)c1ccccc1 7a_100015890283_100000756946 [0,0,0,0,0,1|1,0,0]=2 505 B14R1.3098 CC(CSC(C)(C)C)c1ccccc1 62a_100000211941_100000756946 [0,0,0,0,0,1|1,0,0]=2 506 B14R1.3098 CC(CSC(C)(C)C)c1ccccc1 62a_100000756946_100000211941 [0,0,0,0,0,1|1,0,0]=2 507 B14R1.3098 CC(NCC(C)(C)C)c1ccccc1 2230a_100000743828_100000230085 [0,0,0,0,0,1|1,0,0]=2 508 B14R1.3098 CC(NCC(C)(C)C)c1ccccc1 269862a_100000743828_100000185851 [0,0,0,0,0,1|1,0,0]=2 509 B14R1.3098 CC(NCC(C)(C)C)c1ccccn1 269862a_100000743828_100000210467 [0,0,0,0,0,1|2,0,0]=3 510 B14R1.3098 CC(NCC(C)(C)C)c1ccccn1 270004a_100000181244_100011204126 [0,0,0,0,0,1|2,0,0]=3 511 B14R1.3098 CC(NCC(C)(C)C)c1cccnc1 269862a_100000743828_100000210468 [0,0,0,0,0,1|2,0,0]=3 512 B14R1.3098 CC(NCC(C)(C)C)c1cccnc1 270004a_100000195435_100011204126 [0,0,0,0,0,1|2,0,0]=3 513 B14R1.3098 CC(NCC(C)(C)C)c1cccnn1 269862a_100000743828_100009866853 [0,0,0,0,0,1|3,0,0]=4 514 B14R1.3098 CC(NCC(C)(C)C)c1ccncc1 269862a_100000743828_100000185792 [0,0,0,0,0,1|2,0,0]=3 515 B14R1.3098 CC(NCC(C)(C)C)c1ccncc1 270004a_100000181269_100011204126 [0,0,0,0,0,1|2,0,0]=3 516 B14R1.3098 CC(NCC(C)(C)C)c1ccnnc1 269862a_100000743828_100012182992 [0,0,0,0,0,1|3,0,0]=4 517 B14R1.3098 CC(NCC(C)(C)C)c1cnccn1 2230a_100000743828_200000703233 [0,0,0,0,0,1|3,0,0]=4 518 B14R1.3098 CC(NCC(C)(C)C)c1cnccn1 269862a_100000743828_100000751083 [0,0,0,0,0,1|3,0,0]=4 519 B14R1.3098 CC(NCC(C)(C)C)c1cncnc1 269862a_100000743828_100000757475 [0,0,0,0,0,1|3,0,0]=4 520 B14R1.3098 CC(NCC(C)(C)C)c1ncccn1 270004a_100000743828_100011350828 [0,0,0,0,0,1|3,0,0]=4 521 B14R1.3098 CC(NCC(C)(C)C)c1ncccn1 270004a_100020641698_100011204126 [0,0,0,0,0,1|3,0,0]=4 522 B14R1.3098 CC(NCC(C)(C)F)c1ccccc1 2230a_100020643315_100000230085 [0,0,0,0,0,1|2,0,0]=3 523 B14R1.3098 CC(NCC(C)(C)F)c1ccccc1 269862a_100020643315_100000185851 [0,0,0,0,0,1|2,0,0]=3 524 B14R1.3098 CC(NCC(C)(C)F)c1ccccn1 269862a_100020643315_100000210467 [0,0,0,0,0,1|3,0,0]=4 525 B14R1.3098 CC(NCC(C)(C)F)c1cccnc1 269862a_100020643315_100000210468 [0,0,0,0,0,1|3,0,0]=4 526 B14R1.3098 CC(NCC(C)(C)F)c1ccncc1 269862a_100020643315_100000185792 [0,0,0,0,0,1|3,0,0]=4 527 B14R1.3098 CC(NCC(C)(C)O)c1ccccc1 2230a_100000751335_100000230085 [0,0,0,0,0,1|2,0,0]=3 528 B14R1.3098 CC(NCC(C)(C)O)c1ccccc1 269862a_100000751335_100000185851 [0,0,0,0,0,1|2,0,0]=3 529 B14R1.3098 CC(NCC(C)(C)O)c1ccccn1 269862a_100000751335_100000210467 [0,0,0,0,0,1|3,0,0]=4 530 B14R1.3098 CC(NCC(C)(C)O)c1cccnc1 269862a_100000751335_100000210468 [0,0,0,0,0,1|3,0,0]=4 531 B14R1.3098 CC(NCC(C)(C)O)c1ccncc1 269862a_100000751335_100000185792 [0,0,0,0,0,1|3,0,0]=4 532 B14R1.3098 CC(NCC(C)(F)F)c1ccccc1 269862a_100000731000_100000185851 [0,0,0,0,0,1|3,0,0]=4 533 B14R1.3098 CC(NC[Si](C)(C)C)c1ccccn1 2230a_100000181244_100000037933 [0,0,0,0,0,1|2,0,0]=3 534 B14R1.3098 CC(NC[Si](C)(C)C)c1cccnc1 2230a_100000195435_100000037933 [0,0,0,0,0,1|2,0,0]=3 535 B14R1.3098 CC(NC[Si](C)(C)C)c1ccncc1 2230a_100000181269_100000037933 [0,0,0,0,0,1|2,0,0]=3 536 B14R1.3098 CC(NC[Si](C)(C)C)c1ncccn1 2230a_100020641698_100000037933 [0,0,0,0,0,1|3,0,0]=4 537 B14R1.3098 CC(OCC(C)(C)F)c1ccccc1 34a_100000716592_100000211855 [0,0,0,0,0,1|2,0,0]=3 538 B14R1.3098 CC(OCC(C)(F)F)c1ccccc1 34a_100000068830_100000211855 [0,0,0,0,0,1|3,0,0]=4 539 B14R1.3098 CC(SCC(C)(C)C)c1ccccc1 62a_100000230085_100011219605 [0,0,0,0,0,1|1,0,0]=2 540 B14R1.3098 CC(SCC(C)(C)C)c1ccccc1 62a_100011219605_100000230085 [0,0,0,0,0,1|1,0,0]=2 541 B14R1.3098 CC(SCC(C)(C)C)c1cnccn1 62a_100011219605_200000703233 [0,0,0,0,0,1|3,0,0]=4 542 B14R1.3098 CC(SCC(C)(C)C)c1cnccn1 62a_200000703233_100011219605 [0,0,0,0,0,1|3,0,0]=4 543 B14R1.3098 CC(SCC(C)(C)F)c1ccccc1 62a_100000230085_100011997219 [0,0,0,0,0,1|2,0,0]=3 544 B14R1.3098 CC(SCC(C)(C)F)c1ccccc1 62a_100011997219_100000230085 [0,0,0,0,0,1|2,0,0]=3 545 B14R1.3098 CC(SCC(C)(C)O)c1ccccc1 62a_100000230085_100000764493 [0,0,0,0,0,1|2,0,0]=3 546 B14R1.3098 CC(SCC(C)(C)O)c1ccccc1 62a_100000764493_100000230085 [0,0,0,0,0,1|2,0,0]=3 547 B14R1.3098 CC(SC[N+](C)(C)C)c1ccccc1 62a_100000230085_200000036245 [0,0,0,0,0,1|0,0,0]=1 548 B14R1.3098 CC(SC[N+](C)(C)C)c1ccccc1 62a_200000036245_100000230085 [0,0,0,0,0,1|0,0,0]=1 549 B14R1.3098 CC(SC[N+](C)(C)C)c1cnccn1 62a_200000036245_200000703233 [0,0,0,0,0,1|2,0,0]=3 550 B14R1.3098 CC(SC[N+](C)(C)C)c1cnccn1 62a_200000703233_200000036245 [0,0,0,0,0,1|2,0,0]=3 551 B14R1.3098 CC(SC[Si](C)(C)C)c1ccccc1 62a_100000037933_100000230085 [0,0,0,0,0,1|1,0,0]=2 552 B14R1.3098 CC(SC[Si](C)(C)C)c1ccccc1 62a_100000230085_100000037933 [0,0,0,0,0,1|1,0,0]=2 553 B14R1.3098 CC(SC[Si](C)(C)C)c1cnccn1 62a_100000037933_200000703233 [0,0,0,0,0,1|3,0,0]=4 554 B14R1.3098 CC(SC[Si](C)(C)C)c1cnccn1 62a_200000703233_100000037933 [0,0,0,0,0,1|3,0,0]=4 555 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 2230a_100000210012_100000755188 [0,0,0,0,0,1|2,0,0]=3 556 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 269982a_100000210012_100000755188 [0,0,0,0,0,1|2,0,0]=3 557 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 34a_100000210012_100000755188 [0,0,0,0,0,1|2,0,0]=3 558 B14R1.3098 CN(CCC(C)(C)O)c1ccccc1 2230a_100000210012_100000702414 [0,0,0,0,0,1|3,0,0]=4 559 B14R1.3098 CN(CCC(C)(C)O)c1ccccc1 34a_100000210012_100000702414 [0,0,0,0,0,1|3,0,0]=4 560 B14R1.3098 CN(CC[N+](C)(C)C)c1ccccc1 269982a_100000210012_100000085578 [0,0,0,0,0,1|1,0,0]=2 561 B14R1.3098 CN(CC[N+](C)(C)C)c1ccccc1 34a_100000210012_100000085578 [0,0,0,0,0,1|1,0,0]=2 562 B14R1.3098 CN(CC[Si](C)(C)C)c1ccccc1 2230a_100000210012_200000733723 [0,0,0,0,0,1|2,0,0]=3 563 B14R1.3098 CN(CC[Si](C)(C)C)c1ccccc1 269982a_100000210012_200000733723 [0,0,0,0,0,1|2,0,0]=3 564 B14R1.3098 CN(CC[Si](C)(C)C)c1ccccc1 34a_100000210012_200000733723 [0,0,0,0,0,1|2,0,0]=3 565 B14R1.3098 C[C@@H](NCC(C)(C)C)c1ccccc1 270004a_100000751104_100011204126 [0,0,0,0,0,1|1,0,0]=2 566 B14R1.3098 C[C@@H](NCC(C)(C)C)c1cnccn1 270004a_100020589798_100011204126 [0,0,0,0,0,1|3,0,0]=4 567 B14R1.3098 C[C@@H](NC[Si](C)(C)C)c1ccccc1 2230a_100000751104_100000037933 [0,0,0,0,0,1|1,0,0]=2 568 B14R1.3098 C[C@@H](NC[Si](C)(C)C)c1cnccn1 2230a_100020589798_100000037933 [0,0,0,0,0,1|3,0,0]=4 569 B14R1.3098 C[C@@H](OCC(C)(C)C)c1ccccc1 34a_100000761318_100011219605 [0,0,0,0,0,1|1,0,0]=2 570 B14R1.3098 C[C@@H](OCC(C)(C)F)c1ccccc1 34a_100000761318_100011997219 [0,0,0,0,0,1|2,0,0]=3 571 B14R1.3098 C[C@@H](OCC(C)(C)O)c1ccccc1 34a_100000761318_100000764493 [0,0,0,0,0,1|2,0,0]=3 572 B14R1.3098 C[C@@H](OCC(C)(C)O)c1ccccc1 7a_100000761318_100000764493 [0,0,0,0,0,1|2,0,0]=3 573 B14R1.3098 C[C@@H](OC[Si](C)(C)C)c1ccccc1 7a_100000761318_100000233785 [0,0,0,0,0,1|1,0,0]=2 574 B14R1.3098 C[N+](C)(C)CCC(=O)c1ccccc1 1458a_100000185807_100000085578 [0,0,0,0,0,1|1,0,1]=3 575 B14R1.3098 C[Si](C)(C)CCC(=O)c1ccccc1 1458a_100000185807_200000733723 [0,0,0,0,0,1|2,0,1]=4 576 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 11a_102516607284_100000185807 [0,0,0,0,0,1|2,0,1]=4 577 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 1626a_102516607284_100000185807 [0,0,0,0,0,1|2,0,1]=4 578 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 240690a_102516607284_100000185807 [0,0,0,0,0,1|2,0,1]=4 579 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 527a_102516607284_100000185807 [0,0,0,0,0,1|2,0,1]=4 580 B11R0.68 C=CC=CC(=O)C(C)CC(C)C 1458a_100016291481_100000731052 [1,0,1,0,0,0|2,0,0]=4 581 B11R0.82 C=CC=CC(=O)CCC(C)(C)C 1458a_100016291481_100000755188 [1,0,1,0,0,0|2,0,0]=4 582 B11R0.82 C=CC=CC(=O)CC[N+](C)(C)C 1458a_100016291481_100000085578 [1,0,1,0,0,0|1,0,0]=3 583 B11R0.82 C=CC=CC(=O)CC[Si](C)(C)C 1458a_100016291481_200000733723 [1,0,1,0,0,0|2,0,0]=4 584 B11R1.16 CC(CN[13CH3])c1ccccc1 2230a_100000701038_200025704644 [2,0,0,0,0,0|0,0,1]=3 585 B11R1.16 CC(CN[13CH3])c1ccccc1 34a_100000701038_200025704644 [2,0,0,0,0,0|0,0,1]=3 586 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [2,0,0,0,0,0|1,0,0]=3 587 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [2,0,0,0,0,0|1,0,0]=3 588 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [2,0,0,0,0,0|1,0,0]=3 589 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [2,0,0,0,0,0|1,0,0]=3 590 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 591 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 592 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 593 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 594 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 595 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 596 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 597 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 598 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 599 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [2,0,0,0,0,0|2,0,0]=4 600 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [2,0,0,0,0,0|2,0,0]=4 601 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [2,0,0,0,0,0|2,0,0]=4 602 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [2,0,0,0,0,0|2,0,0]=4 603 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [2,0,0,0,0,0|2,0,0]=4 604 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [2,0,0,0,0,0|2,0,0]=4 605 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [2,0,0,0,0,0|2,0,0]=4 606 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [2,0,0,0,0,0|2,0,0]=4 607 B11R1.16 CNCC(C)c1ccccc1 2230a_100000701038_200000210301 [2,0,0,0,0,0|0,0,1]=3 608 B11R1.16 CNCC(C)c1ccccc1 2230a_106832991635_100000756946 [2,0,0,0,0,0|0,0,1]=3 609 B11R1.16 CNCC(C)c1ccccc1 270004a_106832991635_100000212034 [2,0,0,0,0,0|0,0,1]=3 610 B11R1.16 CNCC(C)c1ccccc1 34a_100000701038_200000210301 [2,0,0,0,0,0|0,0,1]=3 611 B11R1.16 CNCC(C)c1ccccc1 34a_100102657272_100000756946 [2,0,0,0,0,0|0,0,1]=3 612 B11R1.16 CNCC(C)c1ccccc1 7a_106832991635_100000756946 [2,0,0,0,0,0|0,0,1]=3 613 B11R1.16 CNCC(O)c1ccccc1 2230a_100000210709_200000210301 [2,0,0,0,0,0|1,0,1]=4 614 B11R1.16 CNCC(O)c1ccccc1 2230a_106832991635_100000185958 [2,0,0,0,0,0|1,0,1]=4 615 B11R1.16 CNCC(O)c1ccccc1 34a_100102657272_100000185958 [2,0,0,0,0,0|1,0,1]=4 616 B11R1.16 CNCC(O)c1ccccc1 7a_106832991635_100000185958 [2,0,0,0,0,0|1,0,1]=4 617 B11R1.16 CNC[C@@H](O)c1ccccc1 2230a_106832991635_100011933945 [2,0,0,0,0,0|1,0,1]=4 618 B11R1.16 CNC[C@@H](O)c1ccccc1 34a_100102657272_100011933945 [2,0,0,0,0,0|1,0,1]=4 619 B11R1.16 CNC[C@@H](O)c1ccccc1 7a_106832991635_100011933945 [2,0,0,0,0,0|1,0,1]=4 620 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [2,0,0,0,0,0|1,0,0]=3 621 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [2,0,0,0,0,0|1,0,0]=3 622 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [2,0,0,0,0,0|1,0,0]=3 623 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [2,0,0,0,0,0|2,0,0]=4 624 B11R1.16 COCN(C)c1ccccc1 2230a_100000210012_100000766300 [2,0,0,0,0,0|2,0,0]=4 625 B11R1.16 COCN(C)c1ccccc1 269982a_100000210012_100000766300 [2,0,0,0,0,0|2,0,0]=4 626 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [2,0,0,0,0,0|2,0,0]=4 627 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [2,0,0,0,0,0|2,0,0]=4 628 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [2,0,0,0,0,0|1,0,0]=3 629 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [2,0,0,0,0,0|1,0,0]=3 630 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [2,0,0,0,0,0|2,0,0]=4 631 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [2,0,0,0,0,0|2,0,0]=4 632 B11R1.16 CSCN(C)c1ccccc1 2230a_100000210012_100011218213 [2,0,0,0,0,0|2,0,0]=4 633 B11R1.16 CSCN(C)c1ccccc1 269982a_100000210012_100011218213 [2,0,0,0,0,0|2,0,0]=4 634 B11R1.16 CSCN(C)c1ccccc1 34a_100000210012_100011218213 [2,0,0,0,0,0|2,0,0]=4 635 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [2,0,0,0,0,0|2,0,0]=4 636 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [2,0,0,0,0,0|2,0,0]=4 637 B11R1.16 [13CH3]NCC(O)c1ccccc1 2230a_100000210709_200025704644 [2,0,0,0,0,0|1,0,1]=4 638 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [2,0,0,0,0,0|2,0,0]=4 639 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [2,0,0,0,0,0|2,0,0]=4 640 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [2,0,0,0,0,0|2,0,0]=4 641 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [2,0,0,0,0,0|2,0,0]=4 642 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [2,0,0,0,0,0|2,0,0]=4 643 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [2,0,0,0,0,0|2,0,0]=4 644 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [2,0,0,0,0,0|2,0,0]=4 645 B11R1.91 CC(C)CNc1ccccc1 34a_100000106764_100000210624 [2,0,0,0,0,0|2,0,0]=4 646 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [2,0,0,0,0,0|2,0,0]=4 647 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [2,0,0,0,0,0|2,0,0]=4 648 B11R1.91 CC(C)CSc1ccccc1 62a_100000210624_100000041952 [2,0,0,0,0,0|2,0,0]=4 649 B11R1.91 CC(C)CSc1ccccc1 62a_100000719477_100000210760 [2,0,0,0,0,0|2,0,0]=4 650 B11R1.91 CC(C)NCc1ccccc1 207a_100138425928_100015611070 [2,0,0,0,0,0|2,0,0]=4 651 B11R1.91 CC(C)NCc1ccccc1 2230a_100015324214_100000210206 [2,0,0,0,0,0|2,0,0]=4 652 B11R1.91 CC(C)NCc1ccccc1 2230a_100138425928_100015291786 [2,0,0,0,0,0|2,0,0]=4 653 B11R1.91 CC(C)NCc1ccccc1 34a_100015324214_100000210206 [2,0,0,0,0,0|2,0,0]=4 654 B11R1.91 CC(C)NCc1ccccc1 34a_100138425928_100015291786 [2,0,0,0,0,0|2,0,0]=4 655 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [2,0,0,0,0,0|2,0,0]=4 656 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [2,0,0,0,0,0|2,0,0]=4 657 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [2,0,0,0,0,0|2,0,0]=4 658 B11R1.91 CC(C)SCc1ccccc1 62a_100000210206_100015291786 [2,0,0,0,0,0|2,0,0]=4 659 B11R1.91 CC(C)SCc1ccccc1 62a_100000211182_100000210206 [2,0,0,0,0,0|2,0,0]=4 660 B11R1.91 CN(C)CCc1ccccc1 2230a_100000207497_200000210301 [2,0,0,0,0,0|0,0,1]=3 661 B11R1.91 CN(C)CCc1ccccc1 2230a_100102631434_100000765856 [2,0,0,0,0,0|0,0,1]=3 662 B11R1.91 CN(C)CCc1ccccc1 269982a_100000207497_200000210301 [2,0,0,0,0,0|0,0,1]=3 663 B11R1.91 CN(C)CCc1ccccc1 269982a_100102631434_100000765856 [2,0,0,0,0,0|0,0,1]=3 664 B11R1.91 CN(C)CCc1ccccn1 2230a_100000737206_200000210301 [2,0,0,0,0,0|1,0,1]=4 665 B11R1.91 CN(C)CCc1ccccn1 2230a_100102631434_100015183660 [2,0,0,0,0,0|1,0,1]=4 666 B11R1.91 CN(C)CCc1ccccn1 269982a_100000737206_200000210301 [2,0,0,0,0,0|1,0,1]=4 667 B11R1.91 CN(C)CCc1ccccn1 269982a_100102631434_100015183660 [2,0,0,0,0,0|1,0,1]=4 668 B11R1.91 CN(C)CCc1cccnc1 2230a_100000763209_200000210301 [2,0,0,0,0,0|1,0,1]=4 669 B11R1.91 CN(C)CCc1cccnc1 2230a_100102631434_200011713674 [2,0,0,0,0,0|1,0,1]=4 670 B11R1.91 CN(C)CCc1cccnc1 269982a_100000763209_200000210301 [2,0,0,0,0,0|1,0,1]=4 671 B11R1.91 CN(C)CCc1cccnc1 269982a_100102631434_200011713674 [2,0,0,0,0,0|1,0,1]=4 672 B11R1.91 CN(C)CCc1ccncc1 2230a_100000742850_200000210301 [2,0,0,0,0,0|1,0,1]=4 673 B11R1.91 CN(C)CCc1ccncc1 2230a_100102631434_100000723409 [2,0,0,0,0,0|1,0,1]=4 674 B11R1.91 CN(C)CCc1ccncc1 269982a_100000742850_200000210301 [2,0,0,0,0,0|1,0,1]=4 675 B11R1.91 CN(C)CCc1ccncc1 269982a_100102631434_100000723409 [2,0,0,0,0,0|1,0,1]=4 676 B11R1.91 CN(C)CSc1ccccc1 2230a_100102631434_100011218342 [2,0,0,0,0,0|1,0,1]=4 677 B11R1.91 CN(C)CSc1ccccc1 269982a_100102631434_100011218342 [2,0,0,0,0,0|1,0,1]=4 678 B11R1.91 CN([13CH3])CCc1ccccc1 2230a_100000207497_200025704644 [2,0,0,0,0,0|0,0,1]=3 679 B11R1.91 CN([13CH3])CCc1ccccc1 269982a_100000207497_200025704644 [2,0,0,0,0,0|0,0,1]=3 680 B11R1.91 CN([13CH3])CCc1ccccn1 2230a_100000737206_200025704644 [2,0,0,0,0,0|1,0,1]=4 681 B11R1.91 CN([13CH3])CCc1ccccn1 269982a_100000737206_200025704644 [2,0,0,0,0,0|1,0,1]=4 682 B11R1.91 CN([13CH3])CCc1cccnc1 2230a_100000763209_200025704644 [2,0,0,0,0,0|1,0,1]=4 683 B11R1.91 CN([13CH3])CCc1cccnc1 269982a_100000763209_200025704644 [2,0,0,0,0,0|1,0,1]=4 684 B11R1.91 CN([13CH3])CCc1ccncc1 2230a_100000742850_200025704644 [2,0,0,0,0,0|1,0,1]=4 685 B11R1.91 CN([13CH3])CCc1ccncc1 269982a_100000742850_200025704644 [2,0,0,0,0,0|1,0,1]=4 686 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [2,0,0,0,0,0|2,0,0]=4 687 B13R0.130 C=CC=CC(=O)CC(O)C[N+](C)(C)C 1458a_100016291481_100000032816 [0,1,1,0,0,0|1,0,1]=4 688 B13R0.130 C=CC=CC(=O)N[C@@H](C)CC(C)(C)C 1626a_106358413534_100016291481 [0,1,1,0,0,0|2,0,0]=4 689 B13R1.11 CC(CC(=O)CF)c1ccccc1 1458a_100000183687_100015361967 [1,1,0,0,0,0|2,0,0]=4 690 B13R1.11 CC(CC(=O)CO)c1ccccc1 1458a_100000210174_100000756946 [1,1,0,0,0,0|2,0,0]=4 691 B13R1.11 CC(CF)OC(C)c1ccccc1 34a_100016041109_100000211855 [1,1,0,0,0,0|2,0,0]=4 692 B13R1.11 CC(CF)OC(C)c1ccccc1 7a_100016041109_100000230085 [1,1,0,0,0,0|2,0,0]=4 693 B13R1.11 CC(CN)OC(C)c1ccccc1 34a_100000210904_100000211855 [1,1,0,0,0,0|2,0,0]=4 694 B13R1.11 CC(CO)N[C@H](C)c1ccccc1 2230a_100000751104_100012180447 [1,1,0,0,0,0|2,0,0]=4 695 B13R1.11 CC(CO)O[C@H](C)c1ccccc1 34a_100000761318_100012180447 [1,1,0,0,0,0|2,0,0]=4 696 B13R1.11 CC(CO)O[C@H](C)c1ccccc1 7a_100000761318_100012180447 [1,1,0,0,0,0|2,0,0]=4 697 B13R1.11 CC(CO)SC(C)c1ccccc1 62a_100012180447_100000230085 [1,1,0,0,0,0|2,0,0]=4 698 B13R1.11 CC(N[C@H](C)CF)c1ccccc1 269862a_100102880703_100000185851 [1,1,0,0,0,0|2,0,0]=4 699 B13R1.11 CC(N[C@H](C)CO)c1ccccc1 2230a_100000737577_100000230085 [1,1,0,0,0,0|2,0,0]=4 700 B13R1.11 CC(N[C@H](C)CO)c1ccccc1 269862a_100000737577_100000185851 [1,1,0,0,0,0|2,0,0]=4 701 B13R1.11 CC(S[C@H](C)CO)c1ccccc1 62a_100000230085_100016084084 [1,1,0,0,0,0|2,0,0]=4 702 B13R1.11 CC(S[C@H](C)CO)c1ccccc1 62a_100016084084_100000230085 [1,1,0,0,0,0|2,0,0]=4 703 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210202 [1,1,0,0,0,0|2,0,0]=4 704 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000210414_100000756946 [1,1,0,0,0,0|2,0,0]=4 705 B13R1.11 CCC(C)CN(C)c1ccccc1 2230a_100000210012_100000748023 [1,1,0,0,0,0|2,0,0]=4 706 B13R1.11 CCC(C)CN(C)c1ccccc1 269982a_100000210012_100000748023 [1,1,0,0,0,0|2,0,0]=4 707 B13R1.11 CCC(C)CN(C)c1ccccc1 34a_100000210012_100000748023 [1,1,0,0,0,0|2,0,0]=4 708 B13R1.11 CCC(C)NC(C)c1ccccc1 2230a_100000209981_100000230085 [1,1,0,0,0,0|2,0,0]=4 709 B13R1.11 CCC(C)NC(C)c1ccccc1 269862a_100000209981_100000185851 [1,1,0,0,0,0|2,0,0]=4 710 B13R1.11 CCC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000758301 [1,1,0,0,0,0|2,0,0]=4 711 B13R1.11 CCC(C)OC(C)c1ccccc1 7a_100000210228_100000230085 [1,1,0,0,0,0|2,0,0]=4 712 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 34a_100000761318_100011215416 [1,1,0,0,0,0|2,0,0]=4 713 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000758301 [1,1,0,0,0,0|2,0,0]=4 714 B13R1.11 CCC(C)SC(C)c1ccccc1 62a_100000230085_100000758301 [1,1,0,0,0,0|2,0,0]=4 715 B13R1.11 CCC(C)SC(C)c1ccccc1 62a_100000758301_100000230085 [1,1,0,0,0,0|2,0,0]=4 716 B13R1.11 CCN(C)CC(C)c1ccccc1 2230a_100000225621_100000756946 [1,1,0,0,0,0|0,0,1]=3 717 B13R1.11 CCN(C)CC(C)c1ccccc1 269982a_100000225621_100000756946 [1,1,0,0,0,0|0,0,1]=3 718 B13R1.11 CCN(C)CC(O)c1ccccc1 2230a_100000225621_100000185958 [1,1,0,0,0,0|1,0,1]=4 719 B13R1.11 CCN(C)CC(O)c1ccccc1 2230a_100000227976_100000210202 [1,1,0,0,0,0|1,0,1]=4 720 B13R1.11 CCN(C)CC(O)c1ccccc1 269982a_100000227976_100000204670 [1,1,0,0,0,0|1,0,1]=4 721 B13R1.11 CCN(C)C[C@@H](O)c1ccccc1 2230a_100000225621_100011933945 [1,1,0,0,0,0|1,0,1]=4 722 B13R1.11 CC[C@H](C)CN(C)c1ccccc1 2230a_100000210012_100009816398 [1,1,0,0,0,0|2,0,0]=4 723 B13R1.11 CC[C@H](C)CN(C)c1ccccc1 269982a_100000210012_100009816398 [1,1,0,0,0,0|2,0,0]=4 724 B13R1.11 CC[C@H](C)CN(C)c1ccccc1 34a_100000210012_100009816398 [1,1,0,0,0,0|2,0,0]=4 725 B13R1.11 CN(CF)CC(O)c1ccccc1 269982a_100000227976_100015361967 [1,1,0,0,0,0|1,0,1]=4 726 B13R1.11 CNC(=O)CC(C)c1ccccc1 11a_106832991635_100000183687 [1,1,0,0,0,0|2,0,0]=4 727 B13R1.11 CNC(=O)CC(C)c1ccccc1 1626a_100102657272_100000183687 [1,1,0,0,0,0|2,0,0]=4 728 B13R1.11 CNC(=O)CC(C)c1ccccc1 240690a_100102657272_100000183687 [1,1,0,0,0,0|2,0,0]=4 729 B13R1.11 CNC(=O)CC(C)c1ccccc1 527a_100102657272_100000183687 [1,1,0,0,0,0|2,0,0]=4 730 B13R1.11 COC(C)SC(C)c1ccccc1 62a_100000230085_100009879195 [1,1,0,0,0,0|2,0,0]=4 731 B13R1.11 COC(C)SC(C)c1ccccc1 62a_100009879195_100000230085 [1,1,0,0,0,0|2,0,0]=4 732 B13R1.11 C[C@@H](CO)CN(C)c1ccccc1 2230a_100000210012_100000059175 [1,1,0,0,0,0|2,0,0]=4 733 B13R1.11 C[C@@H](CO)CN(C)c1ccccc1 269982a_100000210012_100000059175 [1,1,0,0,0,0|2,0,0]=4 734 B13R1.11 C[C@@H](CO)CN(C)c1ccccc1 34a_100000210012_100000059175 [1,1,0,0,0,0|2,0,0]=4 735 B13R1.132 CC(=O)CC(C)c1ccc(cc1)C 1458a_100011240733_200000210301 [1,1,0,0,0,0|2,0,0]=4 736 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 2230a_100000219623_100000210760 [1,1,0,0,0,0|2,0,0]=4 737 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 2230a_200011231703_200000210301 [1,1,0,0,0,0|2,0,0]=4 738 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000210624 [1,1,0,0,0,0|2,0,0]=4 739 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 269982a_200011231703_200000210301 [1,1,0,0,0,0|2,0,0]=4 740 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 34a_100000219623_100000210624 [1,1,0,0,0,0|2,0,0]=4 741 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 34a_200011231703_200000210301 [1,1,0,0,0,0|2,0,0]=4 742 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210760 [1,1,0,0,0,0|2,0,0]=4 743 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210624 [1,1,0,0,0,0|2,0,0]=4 744 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000210624 [1,1,0,0,0,0|2,0,0]=4 745 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 2230a_100000219829_100000210760 [1,1,0,0,0,0|2,0,0]=4 746 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 2230a_100000713154_200000210301 [1,1,0,0,0,0|2,0,0]=4 747 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 269982a_100000219829_100000210624 [1,1,0,0,0,0|2,0,0]=4 748 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 269982a_100000713154_200000210301 [1,1,0,0,0,0|2,0,0]=4 749 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 34a_100000219829_100000210624 [1,1,0,0,0,0|2,0,0]=4 750 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 34a_100000713154_200000210301 [1,1,0,0,0,0|2,0,0]=4 751 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 2230a_100000743151_100000210760 [1,1,0,0,0,0|2,0,0]=4 752 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 269982a_100000743151_100000210624 [1,1,0,0,0,0|2,0,0]=4 753 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 34a_100000743151_100000210624 [1,1,0,0,0,0|2,0,0]=4 754 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 269982a_100000182112_100000210624 [1,1,0,0,0,0|2,0,0]=4 755 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 34a_100000182112_100000210624 [1,1,0,0,0,0|2,0,0]=4 756 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 2230a_200011231703_200025704644 [1,1,0,0,0,0|2,0,0]=4 757 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 269982a_200011231703_200025704644 [1,1,0,0,0,0|2,0,0]=4 758 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 34a_200011231703_200025704644 [1,1,0,0,0,0|2,0,0]=4 759 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 2230a_100000713154_200025704644 [1,1,0,0,0,0|2,0,0]=4 760 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 269982a_100000713154_200025704644 [1,1,0,0,0,0|2,0,0]=4 761 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 34a_100000713154_200025704644 [1,1,0,0,0,0|2,0,0]=4 762 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Br 271570a_100015190218_100000752885 [1,1,0,0,0,0|2,0,0]=4 763 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Cl 271570a_100015190218_100000755918 [1,1,0,0,0,0|2,0,0]=4 764 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)F 271570a_100015190218_100000211213 [1,1,0,0,0,0|2,0,0]=4 765 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)N 271570a_100015190218_100000185761 [1,1,0,0,0,0|2,0,0]=4 766 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)O 271570a_100015190218_100000185759 [1,1,0,0,0,0|2,0,0]=4 767 B13R1.132 CC(C)NC(C)c1ccc(cc1)Br 2230a_100138425928_100000755118 [1,1,0,0,0,0|2,0,0]=4 768 B13R1.132 CC(C)NC(C)c1ccc(cc1)Br 34a_100138425928_100000755118 [1,1,0,0,0,0|2,0,0]=4 769 B13R1.132 CC(C)NC(C)c1ccc(cc1)Cl 2230a_100138425928_100000684792 [1,1,0,0,0,0|2,0,0]=4 770 B13R1.132 CC(C)NC(C)c1ccc(cc1)F 2230a_100138425928_100000743420 [1,1,0,0,0,0|2,0,0]=4 771 B13R1.132 CC(C)NC(C)c1ccc(cc1)F 34a_100138425928_100000743420 [1,1,0,0,0,0|2,0,0]=4 772 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210206 [1,1,0,0,0,0|2,0,0]=4 773 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210206 [1,1,0,0,0,0|2,0,0]=4 774 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210206 [1,1,0,0,0,0|2,0,0]=4 775 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210206 [1,1,0,0,0,0|2,0,0]=4 776 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210206 [1,1,0,0,0,0|2,0,0]=4 777 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210206 [1,1,0,0,0,0|2,0,0]=4 778 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210206 [1,1,0,0,0,0|2,0,0]=4 779 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000212225_100000755118 [1,1,0,0,0,0|2,0,0]=4 780 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000745893_100000210206 [1,1,0,0,0,0|2,0,0]=4 781 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 7a_100000745893_100000210206 [1,1,0,0,0,0|2,0,0]=4 782 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000181323_100000210206 [1,1,0,0,0,0|2,0,0]=4 783 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000212225_100000743420 [1,1,0,0,0,0|2,0,0]=4 784 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 7a_100000181323_100000210206 [1,1,0,0,0,0|2,0,0]=4 785 B13R1.132 CC(C)OC(C)c1ccc(cc1)N 34a_100011216399_100000210206 [1,1,0,0,0,0|2,0,0]=4 786 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210206 [1,1,0,0,0,0|2,0,0]=4 787 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210206 [1,1,0,0,0,0|2,0,0]=4 788 B13R1.132 CC(C)SC(C)c1ccc(cc1)Br 62a_100000210206_100000755118 [1,1,0,0,0,0|2,0,0]=4 789 B13R1.132 CC(C)SC(C)c1ccc(cc1)Br 62a_100000755118_100000210206 [1,1,0,0,0,0|2,0,0]=4 790 B13R1.132 CC(C)SC(C)c1ccc(cc1)Cl 62a_100000210206_100000684792 [1,1,0,0,0,0|2,0,0]=4 791 B13R1.132 CC(C)SC(C)c1ccc(cc1)Cl 62a_100000684792_100000210206 [1,1,0,0,0,0|2,0,0]=4 792 B13R1.132 CC(C)SC(C)c1ccc(cc1)F 62a_100000210206_100000743420 [1,1,0,0,0,0|2,0,0]=4 793 B13R1.132 CC(C)SC(C)c1ccc(cc1)F 62a_100000743420_100000210206 [1,1,0,0,0,0|2,0,0]=4 794 B13R1.132 CN(C)CC(O)c1ccc(cc1)Cl 2230a_100102631434_200011996143 [1,1,0,0,0,0|1,0,1]=4 795 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 2230a_100016988945_200000210301 [1,1,0,0,0,0|1,0,1]=4 796 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 269982a_100016988945_200000210301 [1,1,0,0,0,0|1,0,1]=4 797 B13R1.132 CN(C)C[C@H](O)c1ccc(cc1)F 2230a_100102631434_100000720402 [1,1,0,0,0,0|1,0,1]=4 798 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 2230a_100016988945_200025704644 [1,1,0,0,0,0|1,0,1]=4 799 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 269982a_100016988945_200025704644 [1,1,0,0,0,0|1,0,1]=4 800 B13R1.132 Cc1ccc(cc1)C(C)CC(=O)[13CH3] 1458a_100011240733_200025704644 [1,1,0,0,0,0|2,0,0]=4 801 B13R1.132 Cc1ccc(cc1)C(C)NC(C)C 2230a_100138425928_100011261388 [1,1,0,0,0,0|2,0,0]=4 802 B13R1.132 Cc1ccc(cc1)C(C)NC(C)C 34a_100138425928_100011261388 [1,1,0,0,0,0|2,0,0]=4 803 B13R1.132 Cc1ccc(cc1)C(C)OC(C)C 34a_100000212225_100011261388 [1,1,0,0,0,0|2,0,0]=4 804 B13R1.132 Cc1ccc(cc1)C(C)SC(C)C 62a_100000210206_100011261388 [1,1,0,0,0,0|2,0,0]=4 805 B13R1.132 Cc1ccc(cc1)C(C)SC(C)C 62a_100011261388_100000210206 [1,1,0,0,0,0|2,0,0]=4 806 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 2230a_100000219977_100000210760 [1,1,0,0,0,0|2,0,0]=4 807 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 2230a_100015205861_200000210301 [1,1,0,0,0,0|2,0,0]=4 808 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 269982a_100000219977_100000210624 [1,1,0,0,0,0|2,0,0]=4 809 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 269982a_100015205861_200000210301 [1,1,0,0,0,0|2,0,0]=4 810 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 34a_100000219977_100000210624 [1,1,0,0,0,0|2,0,0]=4 811 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 34a_100015205861_200000210301 [1,1,0,0,0,0|2,0,0]=4 812 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 2230a_100015205861_200025704644 [1,1,0,0,0,0|2,0,0]=4 813 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 269982a_100015205861_200025704644 [1,1,0,0,0,0|2,0,0]=4 814 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 34a_100015205861_200025704644 [1,1,0,0,0,0|2,0,0]=4 815 B13R1.132 Cc1ccc(cc1)[C@@H](C)NC(C)C 2230a_100016988085_100000210206 [1,1,0,0,0,0|2,0,0]=4 816 B13R1.132 Cc1ccc(cc1)[C@@H](C)NC(C)C 34a_100016988085_100000210206 [1,1,0,0,0,0|2,0,0]=4 817 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 34a_100000690690_100000210206 [1,1,0,0,0,0|2,0,0]=4 818 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 7a_100000690690_100000210206 [1,1,0,0,0,0|2,0,0]=4 819 B13R1.132 Cc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000186775 [1,1,0,0,0,0|2,0,0]=4 820 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 2230a_100000219648_100000210760 [1,1,0,0,0,0|2,0,0]=4 821 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 269982a_100000219648_100000210624 [1,1,0,0,0,0|2,0,0]=4 822 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 34a_100000219648_100000210624 [1,1,0,0,0,0|2,0,0]=4 823 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 2230a_100000220044_100000210760 [1,1,0,0,0,0|2,0,0]=4 824 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 2230a_100015204621_200000210301 [1,1,0,0,0,0|2,0,0]=4 825 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000210624 [1,1,0,0,0,0|2,0,0]=4 826 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 269982a_100015204621_200000210301 [1,1,0,0,0,0|2,0,0]=4 827 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 34a_100000220044_100000210624 [1,1,0,0,0,0|2,0,0]=4 828 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 34a_100015204621_200000210301 [1,1,0,0,0,0|2,0,0]=4 829 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 7a_100015204621_200000210301 [1,1,0,0,0,0|2,0,0]=4 830 B13R1.147 CC(C)CN(C)c1cccc(c1)F 2230a_100020633736_100000210760 [1,1,0,0,0,0|2,0,0]=4 831 B13R1.147 CC(C)CN(C)c1cccc(c1)F 269982a_100020633736_100000210624 [1,1,0,0,0,0|2,0,0]=4 832 B13R1.147 CC(C)CN(C)c1cccc(c1)F 34a_100020633736_100000210624 [1,1,0,0,0,0|2,0,0]=4 833 B13R1.147 CC(C)CN(C)c1cccc(c1)I 2230a_100000221217_100000210760 [1,1,0,0,0,0|2,0,0]=4 834 B13R1.147 CC(C)CN(C)c1cccc(c1)I 269982a_100000221217_100000210624 [1,1,0,0,0,0|2,0,0]=4 835 B13R1.147 CC(C)CN(C)c1cccc(c1)I 34a_100000221217_100000210624 [1,1,0,0,0,0|2,0,0]=4 836 B13R1.147 CC(C)CN(C)c1cccc(c1)O 2230a_100000756613_100000210760 [1,1,0,0,0,0|2,0,0]=4 837 B13R1.147 CC(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000210624 [1,1,0,0,0,0|2,0,0]=4 838 B13R1.147 CC(C)CN(C)c1cccc(c1)O 34a_100000756613_100000210624 [1,1,0,0,0,0|2,0,0]=4 839 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 2230a_100015204621_200025704644 [1,1,0,0,0,0|2,0,0]=4 840 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 269982a_100015204621_200025704644 [1,1,0,0,0,0|2,0,0]=4 841 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 34a_100015204621_200025704644 [1,1,0,0,0,0|2,0,0]=4 842 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 7a_100015204621_200025704644 [1,1,0,0,0,0|2,0,0]=4 843 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Br 271570a_100015190218_100000691529 [1,1,0,0,0,0|2,0,0]=4 844 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Cl 271570a_100015190218_100000699651 [1,1,0,0,0,0|2,0,0]=4 845 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)F 271570a_100015190218_100000685547 [1,1,0,0,0,0|2,0,0]=4 846 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)N 271570a_100015190218_100000210019 [1,1,0,0,0,0|2,0,0]=4 847 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [1,1,0,0,0,0|2,0,0]=4 848 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)[S] 271570a_100015190218_114929384022 [1,1,0,0,0,0|2,0,0]=4 849 B13R1.147 CC(C)NC(C)c1cccc(c1)Br 2230a_100020642005_100000210206 [1,1,0,0,0,0|2,0,0]=4 850 B13R1.147 CC(C)NC(C)c1cccc(c1)Cl 2230a_100102723534_100000210206 [1,1,0,0,0,0|2,0,0]=4 851 B13R1.147 CC(C)NC(C)c1cccc(c1)Cl 34a_100102723534_100000210206 [1,1,0,0,0,0|2,0,0]=4 852 B13R1.147 CC(C)NC(C)c1cccc(c1)O 2230a_100000740644_100000210206 [1,1,0,0,0,0|2,0,0]=4 853 B13R1.147 CC(C)N[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210206 [1,1,0,0,0,0|2,0,0]=4 854 B13R1.147 CC(C)N[C@H](C)c1cccc(c1)F 34a_100015193778_100000210206 [1,1,0,0,0,0|2,0,0]=4 855 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 34a_100000246457_100000210206 [1,1,0,0,0,0|2,0,0]=4 856 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 7a_100000246457_100000210206 [1,1,0,0,0,0|2,0,0]=4 857 B13R1.147 CC(C)OC(C)c1cccc(c1)F 34a_100000744526_100000210206 [1,1,0,0,0,0|2,0,0]=4 858 B13R1.147 CC(C)OC(C)c1cccc(c1)F 7a_100000744526_100000210206 [1,1,0,0,0,0|2,0,0]=4 859 B13R1.147 CC(C)OC(C)c1cccc(c1)I 34a_100013085317_100000210206 [1,1,0,0,0,0|2,0,0]=4 860 B13R1.147 CC(C)OC(C)c1cccc(c1)I 7a_100013085317_100000210206 [1,1,0,0,0,0|2,0,0]=4 861 B13R1.147 CC(C)OC(C)c1cccc(c1)N 34a_100011217120_100000210206 [1,1,0,0,0,0|2,0,0]=4 862 B13R1.147 CC(C)OC(C)c1cccc(c1)N 7a_100011217120_100000210206 [1,1,0,0,0,0|2,0,0]=4 863 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210206 [1,1,0,0,0,0|2,0,0]=4 864 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210206 [1,1,0,0,0,0|2,0,0]=4 865 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 2230a_200000733937_200000210301 [1,1,0,0,0,0|1,0,1]=4 866 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 269982a_200000733937_200000210301 [1,1,0,0,0,0|1,0,1]=4 867 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_200000210301 [1,1,0,0,0,0|1,0,1]=4 868 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_200000210301 [1,1,0,0,0,0|1,0,1]=4 869 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 2230a_200000733937_200025704644 [1,1,0,0,0,0|1,0,1]=4 870 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 269982a_200000733937_200025704644 [1,1,0,0,0,0|1,0,1]=4 871 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 2230a_100009815823_200025704644 [1,1,0,0,0,0|1,0,1]=4 872 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 269982a_100009815823_200025704644 [1,1,0,0,0,0|1,0,1]=4 873 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 34a_100000757818_100000210206 [1,1,0,0,0,0|2,0,0]=4 874 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 7a_100000757818_100000210206 [1,1,0,0,0,0|2,0,0]=4 875 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 2230a_100000219674_100000210760 [1,1,0,0,0,0|2,0,0]=4 876 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 269982a_100000219674_100000210624 [1,1,0,0,0,0|2,0,0]=4 877 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 34a_100000219674_100000210624 [1,1,0,0,0,0|2,0,0]=4 878 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 2230a_100000698126_100000210206 [1,1,0,0,0,0|2,0,0]=4 879 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 34a_100000698126_100000210206 [1,1,0,0,0,0|2,0,0]=4 880 B13R1.147 Cc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100011215228 [1,1,0,0,0,0|2,0,0]=4 881 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 1458a_100000210198_100000230085 [1,1,0,0,0,0|1,0,1]=4 882 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210206 [1,1,0,0,0,0|1,0,1]=4 883 B13R1.152 CC(C)N(C)C(C)c1ccccc1 2230a_100000195388_100000210206 [1,1,0,0,0,0|2,0,0]=4 884 B13R1.152 CC(C)N(C)C(C)c1ccccc1 269982a_100000195388_100000210206 [1,1,0,0,0,0|2,0,0]=4 885 B13R1.152 CC(C)N(C)C(C)c1ccccc1 269982a_100000218734_200000210301 [1,1,0,0,0,0|2,0,0]=4 886 B13R1.152 CC(C)N(C)C(C)c1ccccc1 269982a_200000211004_100000230085 [1,1,0,0,0,0|2,0,0]=4 887 B13R1.152 CC(C)N([13CH3])C(C)c1ccccc1 269982a_100000218734_200025704644 [1,1,0,0,0,0|2,0,0]=4 888 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 11a_100102631434_100000751047 [1,1,0,0,0,0|0,0,2]=4 889 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 1626a_100102631434_100000751047 [1,1,0,0,0,0|0,0,2]=4 890 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 240690a_100102631434_100000751047 [1,1,0,0,0,0|0,0,2]=4 891 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 527a_100102631434_100000751047 [1,1,0,0,0,0|0,0,2]=4 892 B13R1.201 CC(=O)CC(C)c1ccccc1Br 1458a_100000743458_200000210301 [1,1,0,0,0,0|2,0,0]=4 893 B13R1.201 CC(=O)CC(C)c1ccccc1Cl 1458a_100012184337_200000210301 [1,1,0,0,0,0|2,0,0]=4 894 B13R1.201 CC(C)CN(C)c1ccccc1Br 2230a_100020606079_100000210760 [1,1,0,0,0,0|2,0,0]=4 895 B13R1.201 CC(C)CN(C)c1ccccc1Br 269982a_100020606079_100000210624 [1,1,0,0,0,0|2,0,0]=4 896 B13R1.201 CC(C)CN(C)c1ccccc1Br 34a_100020606079_100000210624 [1,1,0,0,0,0|2,0,0]=4 897 B13R1.201 CC(C)CN(C)c1ccccc1Cl 2230a_100000219374_100000210760 [1,1,0,0,0,0|2,0,0]=4 898 B13R1.201 CC(C)CN(C)c1ccccc1Cl 2230a_100011231759_200000210301 [1,1,0,0,0,0|2,0,0]=4 899 B13R1.201 CC(C)CN(C)c1ccccc1Cl 269982a_100000219374_100000210624 [1,1,0,0,0,0|2,0,0]=4 900 B13R1.201 CC(C)CN(C)c1ccccc1Cl 269982a_100011231759_200000210301 [1,1,0,0,0,0|2,0,0]=4 901 B13R1.201 CC(C)CN(C)c1ccccc1Cl 34a_100000219374_100000210624 [1,1,0,0,0,0|2,0,0]=4 902 B13R1.201 CC(C)CN(C)c1ccccc1Cl 34a_100011231759_200000210301 [1,1,0,0,0,0|2,0,0]=4 903 B13R1.201 CC(C)CN(C)c1ccccc1F 2230a_100000220357_100000210760 [1,1,0,0,0,0|2,0,0]=4 904 B13R1.201 CC(C)CN(C)c1ccccc1F 269982a_100000220357_100000210624 [1,1,0,0,0,0|2,0,0]=4 905 B13R1.201 CC(C)CN(C)c1ccccc1F 34a_100000220357_100000210624 [1,1,0,0,0,0|2,0,0]=4 906 B13R1.201 CC(C)CN(C)c1ccccc1F 38a_100000220357_100000210624 [1,1,0,0,0,0|2,0,0]=4 907 B13R1.201 CC(C)CN(C)c1ccccc1O 269982a_100000033821_100000210624 [1,1,0,0,0,0|2,0,0]=4 908 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 2230a_100011231759_200025704644 [1,1,0,0,0,0|2,0,0]=4 909 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 269982a_100011231759_200025704644 [1,1,0,0,0,0|2,0,0]=4 910 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 34a_100011231759_200025704644 [1,1,0,0,0,0|2,0,0]=4 911 B13R1.201 CC(C)C[C@H](N)c1ccccc1Br 271570a_100015190218_100000695589 [1,1,0,0,0,0|2,0,0]=4 912 B13R1.201 CC(C)C[C@H](N)c1ccccc1Cl 271570a_100015190218_100000764095 [1,1,0,0,0,0|2,0,0]=4 913 B13R1.201 CC(C)C[C@H](N)c1ccccc1F 271570a_100015190218_100011215700 [1,1,0,0,0,0|2,0,0]=4 914 B13R1.201 CC(C)C[C@H](N)c1ccccc1N 271570a_100015190218_100000210017 [1,1,0,0,0,0|2,0,0]=4 915 B13R1.201 CC(C)C[C@H](N)c1ccccc1O 271570a_100015190218_100000739446 [1,1,0,0,0,0|2,0,0]=4 916 B13R1.201 CC(C)NC(C)c1ccccc1Br 2230a_100000181357_100000210206 [1,1,0,0,0,0|2,0,0]=4 917 B13R1.201 CC(C)NC(C)c1ccccc1Cl 2230a_100000174978_100000210206 [1,1,0,0,0,0|2,0,0]=4 918 B13R1.201 CC(C)NC(C)c1ccccc1Cl 2230a_100138425928_100000181259 [1,1,0,0,0,0|2,0,0]=4 919 B13R1.201 CC(C)NC(C)c1ccccc1Cl 34a_100000174978_100000210206 [1,1,0,0,0,0|2,0,0]=4 920 B13R1.201 CC(C)NC(C)c1ccccc1F 2230a_100000181408_100000210206 [1,1,0,0,0,0|2,0,0]=4 921 B13R1.201 CC(C)NC(C)c1ccccc1F 2230a_100138425928_200000741388 [1,1,0,0,0,0|2,0,0]=4 922 B13R1.201 CC(C)NC(C)c1ccccc1F 34a_100000181408_100000210206 [1,1,0,0,0,0|2,0,0]=4 923 B13R1.201 CC(C)NC(C)c1ccccc1F 34a_100138425928_200000741388 [1,1,0,0,0,0|2,0,0]=4 924 B13R1.201 CC(C)N[C@H](C)c1ccccc1O 2230a_100025703389_100000210206 [1,1,0,0,0,0|2,0,0]=4 925 B13R1.201 CC(C)OC(C)c1ccccc1Br 34a_100000702211_100000210206 [1,1,0,0,0,0|2,0,0]=4 926 B13R1.201 CC(C)OC(C)c1ccccc1Br 7a_100000702211_100000210206 [1,1,0,0,0,0|2,0,0]=4 927 B13R1.201 CC(C)OC(C)c1ccccc1Cl 34a_100000740796_100000210206 [1,1,0,0,0,0|2,0,0]=4 928 B13R1.201 CC(C)OC(C)c1ccccc1Cl 7a_100000740796_100000210206 [1,1,0,0,0,0|2,0,0]=4 929 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000212225_200000741388 [1,1,0,0,0,0|2,0,0]=4 930 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000697922_100000210206 [1,1,0,0,0,0|2,0,0]=4 931 B13R1.201 CC(C)OC(C)c1ccccc1F 7a_100000697922_100000210206 [1,1,0,0,0,0|2,0,0]=4 932 B13R1.201 CC(C)OC(C)c1ccccc1N 7a_100011405641_100000210206 [1,1,0,0,0,0|2,0,0]=4 933 B13R1.201 CC(C)SC(C)c1ccccc1Cl 62a_100000181259_100000210206 [1,1,0,0,0,0|2,0,0]=4 934 B13R1.201 CC(C)SC(C)c1ccccc1Cl 62a_100000210206_100000181259 [1,1,0,0,0,0|2,0,0]=4 935 B13R1.201 CC(C)SC(C)c1ccccc1F 62a_100000210206_200000741388 [1,1,0,0,0,0|2,0,0]=4 936 B13R1.201 CC(C)SC(C)c1ccccc1F 62a_200000741388_100000210206 [1,1,0,0,0,0|2,0,0]=4 937 B13R1.201 CC(CC(=O)[13CH3])c1ccccc1Br 1458a_100000743458_200025704644 [1,1,0,0,0,0|2,0,0]=4 938 B13R1.201 CC(CC(=O)[13CH3])c1ccccc1Cl 1458a_100012184337_200025704644 [1,1,0,0,0,0|2,0,0]=4 939 B13R1.201 Cc1ccccc1C(C)NC(C)C 2230a_100000181355_100000210206 [1,1,0,0,0,0|2,0,0]=4 940 B13R1.201 Cc1ccccc1C(C)NC(C)C 34a_100000181355_100000210206 [1,1,0,0,0,0|2,0,0]=4 941 B13R1.201 Cc1ccccc1C(C)OC(C)C 34a_100000742021_100000210206 [1,1,0,0,0,0|2,0,0]=4 942 B13R1.201 Cc1ccccc1C(C)OC(C)C 7a_100000742021_100000210206 [1,1,0,0,0,0|2,0,0]=4 943 B13R1.201 Cc1ccccc1N(C)CC(C)C 2230a_100000219699_100000210760 [1,1,0,0,0,0|2,0,0]=4 944 B13R1.201 Cc1ccccc1N(C)CC(C)C 269982a_100000219699_100000210624 [1,1,0,0,0,0|2,0,0]=4 945 B13R1.201 Cc1ccccc1N(C)CC(C)C 34a_100000219699_100000210624 [1,1,0,0,0,0|2,0,0]=4 946 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000210755 [1,1,0,0,0,0|2,0,0]=4 947 B13R1.347 CC(=O)CC(C)(C)c1ccccc1 1458a_100011409233_200000210301 [1,1,0,0,0,0|2,0,0]=4 948 B13R1.347 CC(C)(CC(=O)[13CH3])c1ccccc1 1458a_100011409233_200025704644 [1,1,0,0,0,0|2,0,0]=4 949 B13R1.347 CC(C)NC(C)(C)c1ccccc1 2230a_100011218174_100000210206 [1,1,0,0,0,0|2,0,0]=4 950 B13R1.347 CC(C)NC(C)(C)c1ccccc1 2230a_100138425928_100000034625 [1,1,0,0,0,0|2,0,0]=4 951 B13R1.347 CC(C)OC(C)(C)c1ccccc1 7a_100000694644_100000210206 [1,1,0,0,0,0|2,0,0]=4 952 B13R1.347 CC(C)SC(C)(C)c1ccccc1 62a_100000034625_100000210206 [1,1,0,0,0,0|2,0,0]=4 953 B13R1.347 CC(C)SC(C)(C)c1ccccc1 62a_100000210206_100000034625 [1,1,0,0,0,0|2,0,0]=4 954 B13R1.347 CN(C)CC(C)(C)c1ccccc1 269982a_100102631434_100000703224 [1,1,0,0,0,0|0,0,1]=3 955 B13R1.347 CN(C)CC(C)(O)c1ccccc1 2230a_100011660921_200000210301 [1,1,0,0,0,0|0,0,1]=3 956 B13R1.347 CN(C)CC(C)(O)c1ccccc1 269982a_100011660921_200000210301 [1,1,0,0,0,0|0,0,1]=3 957 B13R1.347 CN(C)CC(F)(F)c1ccccc1 269982a_100102631434_100009875531 [1,1,0,0,0,0|1,0,1]=4 958 B13R1.347 CN(C)C[Si](C)(C)c1ccccc1 2230a_100102631434_100000038972 [1,1,0,0,0,0|0,1,1]=4 959 B13R1.347 CN(C)C[Si](C)(C)c1ccccc1 269982a_100102631434_100000038972 [1,1,0,0,0,0|0,1,1]=4 960 B13R1.347 CN([13CH3])CC(C)(O)c1ccccc1 2230a_100011660921_200025704644 [1,1,0,0,0,0|0,0,1]=3 961 B13R1.347 CN([13CH3])CC(C)(O)c1ccccc1 269982a_100011660921_200025704644 [1,1,0,0,0,0|0,0,1]=3 962 B13R1.713 CC(=O)CC(CO)c1ccccc1 1458a_106726389045_200000210301 [1,1,0,0,0,0|2,0,0]=4 963 B13R1.713 CC(C)CC(N[13CH3])c1ccccn1 2230a_100159271263_200025704644 [1,1,0,0,0,0|2,0,0]=4 964 B13R1.713 CC(C)CC(N[13CH3])c1cccnc1 2230a_200011351310_200025704644 [1,1,0,0,0,0|2,0,0]=4 965 B13R1.713 CC(C)C[C@H](N[13CH3])c1ccccc1 2230a_100016987908_200025704644 [1,1,0,0,0,0|1,0,0]=3 966 B13R1.713 CC(C)N[C@H](CO)c1ccccc1 2230a_100000751927_100000210206 [1,1,0,0,0,0|2,0,0]=4 967 B13R1.713 CC(C)N[C@H](CO)c1ccccc1 34a_100000751927_100000210206 [1,1,0,0,0,0|2,0,0]=4 968 B13R1.713 CC(C)OC(CBr)c1ccccc1 7a_100000185958_100000210206 [1,1,0,0,0,0|2,0,0]=4 969 B13R1.713 CC(C)OC(CN)c1ccccc1 34a_100000210709_100000210206 [1,1,0,0,0,0|2,0,0]=4 970 B13R1.713 CC(C)O[C@H](CCl)c1ccccc1 34a_100011933945_100000210206 [1,1,0,0,0,0|2,0,0]=4 971 B13R1.713 CC(C)O[C@H](CCl)c1ccccc1 7a_100011933945_100000210206 [1,1,0,0,0,0|2,0,0]=4 972 B13R1.713 CCC(CN(C)C)c1ccccc1 270004a_100102631434_100000753018 [1,1,0,0,0,0|0,0,1]=3 973 B13R1.713 CCC(NC(C)C)c1ccccc1 2230a_100000737752_100000210206 [1,1,0,0,0,0|2,0,0]=4 974 B13R1.713 CCC(OC(C)C)c1ccccc1 34a_100000698172_100000210206 [1,1,0,0,0,0|2,0,0]=4 975 B13R1.713 CCC(OC(C)C)c1ccccc1 7a_100000698172_100000210206 [1,1,0,0,0,0|2,0,0]=4 976 B13R1.713 CCN(CC(C)C)c1ccccc1 2230a_100000210013_100000210760 [1,1,0,0,0,0|2,0,0]=4 977 B13R1.713 CCN(CC(C)C)c1ccccc1 269982a_100000210013_100000210624 [1,1,0,0,0,0|2,0,0]=4 978 B13R1.713 CCN(CC(C)C)c1ccccc1 34a_100000210013_100000210624 [1,1,0,0,0,0|2,0,0]=4 979 B13R1.713 CNC(CC(C)C)c1ccccc1 269862a_106832991636_100000211545 [1,1,0,0,0,0|1,0,0]=3 980 B13R1.713 CNC(CC(C)C)c1ccccn1 2230a_100159271263_200000210301 [1,1,0,0,0,0|2,0,0]=4 981 B13R1.713 CNC(CC(C)C)c1ccccn1 269862a_106832991636_100000685706 [1,1,0,0,0,0|2,0,0]=4 982 B13R1.713 CNC(CC(C)C)c1cccnc1 2230a_200011351310_200000210301 [1,1,0,0,0,0|2,0,0]=4 983 B13R1.713 CNC(CC(C)C)c1cccnc1 269862a_106832991636_100011350585 [1,1,0,0,0,0|2,0,0]=4 984 B13R1.713 CN[C@@H](CC(C)C)c1ccccc1 2230a_100016987908_200000210301 [1,1,0,0,0,0|1,0,0]=3 985 B13R1.713 [13CH3]C(=O)CC(CO)c1ccccc1 1458a_106726389045_200025704644 [1,1,0,0,0,0|2,0,0]=4 986 B13R1.157 CC(C)(C)CNc1ccccc1Br 34a_100000210017_100011219605 [1,1,0,0,0,0|2,0,0]=4 987 B13R1.157 CC(C)(C)CNc1ccccc1Cl 34a_100000185783_100011219605 [1,1,0,0,0,0|2,0,0]=4 988 B13R1.157 CC(C)(C)CNc1ccccc1F 34a_100000210422_100011219605 [1,1,0,0,0,0|2,0,0]=4 989 B13R1.157 CC(C)(C)CNc1ccccc1I 34a_100000210053_100011219605 [1,1,0,0,0,0|2,0,0]=4 990 B13R1.157 CC(C)(C)CNc1ccccc1O 34a_100000185747_100011219605 [1,1,0,0,0,0|2,0,0]=4 991 B13R1.157 CC(C)(C)COc1ccccc1Br 34a_100000181306_100011219605 [1,1,0,0,0,0|2,0,0]=4 992 B13R1.157 CC(C)(C)COc1ccccc1Cl 34a_100000210172_100011219605 [1,1,0,0,0,0|2,0,0]=4 993 B13R1.157 CC(C)(C)COc1ccccc1F 34a_100000210171_100011219605 [1,1,0,0,0,0|2,0,0]=4 994 B13R1.157 CC(C)(C)COc1ccccc1I 34a_100000739446_100011219605 [1,1,0,0,0,0|2,0,0]=4 995 B13R1.157 CC(C)(C)COc1ccccc1N 34a_100000185747_100011219605 [1,1,0,0,0,0|2,0,0]=4 996 B13R1.157 CC(C)(C)CSc1ccccc1Br 62a_100000695589_100011219605 [1,1,0,0,0,0|2,0,0]=4 997 B13R1.157 CC(C)(C)CSc1ccccc1Br 62a_100011219605_100000695589 [1,1,0,0,0,0|2,0,0]=4 998 B13R1.157 CC(C)(C)CSc1ccccc1Cl 62a_100000764095_100011219605 [1,1,0,0,0,0|2,0,0]=4 999 B13R1.157 CC(C)(C)CSc1ccccc1Cl 62a_100011219605_100000764095 [1,1,0,0,0,0|2,0,0]=4 1000 B13R1.157 CC(C)(C)CSc1ccccc1F 62a_100011215700_100011219605 [1,1,0,0,0,0|2,0,0]=4 1001 B13R1.157 CC(C)(C)CSc1ccccc1F 62a_100011219605_100011215700 [1,1,0,0,0,0|2,0,0]=4 1002 B13R1.157 CC(C)(C)CSc1ccccc1N 62a_100000210017_100011219605 [1,1,0,0,0,0|2,0,0]=4 1003 B13R1.157 CC(C)(C)CSc1ccccc1N 62a_100011219605_100000210017 [1,1,0,0,0,0|2,0,0]=4 1004 B13R1.157 CC(C)(C)CSc1ccccc1O 62a_100000739446_100011219605 [1,1,0,0,0,0|2,0,0]=4 1005 B13R1.157 CC(C)(C)CSc1ccccc1O 62a_100011219605_100000739446 [1,1,0,0,0,0|2,0,0]=4 1006 B13R1.157 CC(C)(C)NCc1ccccc1Br 207a_100000715429_100000211189 [1,1,0,0,0,0|2,0,0]=4 1007 B13R1.157 CC(C)(C)NCc1ccccc1Br 2230a_100000715429_100000184730 [1,1,0,0,0,0|2,0,0]=4 1008 B13R1.157 CC(C)(C)NCc1ccccc1Br 34a_100000689332_100000210625 [1,1,0,0,0,0|2,0,0]=4 1009 B13R1.157 CC(C)(C)NCc1ccccc1Cl 207a_100000715429_100000210073 [1,1,0,0,0,0|2,0,0]=4 1010 B13R1.157 CC(C)(C)NCc1ccccc1Cl 2230a_100000715429_100000187162 [1,1,0,0,0,0|2,0,0]=4 1011 B13R1.157 CC(C)(C)NCc1ccccc1Cl 34a_100000174879_100000210625 [1,1,0,0,0,0|2,0,0]=4 1012 B13R1.157 CC(C)(C)NCc1ccccc1F 207a_100000715429_100000210811 [1,1,0,0,0,0|2,0,0]=4 1013 B13R1.157 CC(C)(C)NCc1ccccc1F 2230a_100000715429_100000211605 [1,1,0,0,0,0|2,0,0]=4 1014 B13R1.157 CC(C)(C)NCc1ccccc1F 34a_100000174869_100000210625 [1,1,0,0,0,0|2,0,0]=4 1015 B13R1.157 CC(C)(C)NCc1ccccc1I 207a_100000715429_100000010305 [1,1,0,0,0,0|2,0,0]=4 1016 B13R1.157 CC(C)(C)NCc1ccccc1I 2230a_100000715429_100011215278 [1,1,0,0,0,0|2,0,0]=4 1017 B13R1.157 CC(C)(C)NCc1ccccc1O 271570a_203496583355_100000740897 [1,1,0,0,0,0|2,0,0]=4 1018 B13R1.157 CC(C)(C)NCc1ccccc1O 34a_100000185550_100000210625 [1,1,0,0,0,0|2,0,0]=4 1019 B13R1.157 CC(C)(C)OCc1ccccc1Br 34a_100000756307_100000210625 [1,1,0,0,0,0|2,0,0]=4 1020 B13R1.157 CC(C)(C)OCc1ccccc1Br 34a_100015890283_100000184730 [1,1,0,0,0,0|2,0,0]=4 1021 B13R1.157 CC(C)(C)OCc1ccccc1Br 7a_100015890283_100000184730 [1,1,0,0,0,0|2,0,0]=4 1022 B13R1.157 CC(C)(C)OCc1ccccc1Cl 34a_100000210847_100000210625 [1,1,0,0,0,0|2,0,0]=4 1023 B13R1.157 CC(C)(C)OCc1ccccc1Cl 34a_100015890283_100000187162 [1,1,0,0,0,0|2,0,0]=4 1024 B13R1.157 CC(C)(C)OCc1ccccc1Cl 7a_100015890283_100000187162 [1,1,0,0,0,0|2,0,0]=4 1025 B13R1.157 CC(C)(C)OCc1ccccc1F 34a_100000211962_100000210625 [1,1,0,0,0,0|2,0,0]=4 1026 B13R1.157 CC(C)(C)OCc1ccccc1F 34a_100015890283_100000211605 [1,1,0,0,0,0|2,0,0]=4 1027 B13R1.157 CC(C)(C)OCc1ccccc1F 7a_100015890283_100000211605 [1,1,0,0,0,0|2,0,0]=4 1028 B13R1.157 CC(C)(C)OCc1ccccc1I 34a_100000187465_100000210625 [1,1,0,0,0,0|2,0,0]=4 1029 B13R1.157 CC(C)(C)OCc1ccccc1I 34a_100015890283_100011215278 [1,1,0,0,0,0|2,0,0]=4 1030 B13R1.157 CC(C)(C)OCc1ccccc1I 7a_100015890283_100011215278 [1,1,0,0,0,0|2,0,0]=4 1031 B13R1.157 CC(C)(C)OCc1ccccc1N 34a_100000212039_100000210625 [1,1,0,0,0,0|2,0,0]=4 1032 B13R1.157 CC(C)(C)SCc1ccccc1Br 62a_100000184730_100000211941 [1,1,0,0,0,0|2,0,0]=4 1033 B13R1.157 CC(C)(C)SCc1ccccc1Br 62a_100000211941_100000184730 [1,1,0,0,0,0|2,0,0]=4 1034 B13R1.157 CC(C)(C)SCc1ccccc1Cl 62a_100000187162_100000211941 [1,1,0,0,0,0|2,0,0]=4 1035 B13R1.157 CC(C)(C)SCc1ccccc1Cl 62a_100000211941_100000187162 [1,1,0,0,0,0|2,0,0]=4 1036 B13R1.157 CC(C)(C)SCc1ccccc1F 62a_100000211605_100000211941 [1,1,0,0,0,0|2,0,0]=4 1037 B13R1.157 CC(C)(C)SCc1ccccc1F 62a_100000211941_100000211605 [1,1,0,0,0,0|2,0,0]=4 1038 B13R1.157 CC(C)(C)SCc1ccccc1I 62a_100000211941_100011216222 [1,1,0,0,0,0|2,0,0]=4 1039 B13R1.157 CC(C)(C)SCc1ccccc1I 62a_100011216222_100000211941 [1,1,0,0,0,0|2,0,0]=4 1040 B13R1.157 C[N+](C)(C)CSc1c[nH]ccc1=O 62a_100009998708_200000036245 [1,1,0,0,0,0|2,0,0]=4 1041 B13R1.157 C[N+](C)(C)CSc1c[nH]ccc1=O 62a_200000036245_100009998708 [1,1,0,0,0,0|2,0,0]=4 1042 B13R1.157 C[N+](C)(C)CSc1c[nH]ccc1=S 62a_200000036245_200012280681 [1,1,0,0,0,0|2,0,0]=4 1043 B13R1.157 C[N+](C)(C)CSc1c[nH]ccc1=S 62a_200012280681_200000036245 [1,1,0,0,0,0|2,0,0]=4 1044 B13R1.157 C[N+](C)(C)CSc1cccc[n+]1[O-] 62a_200000036245_200000042595 [1,1,0,0,0,0|2,0,0]=4 1045 B13R1.157 C[N+](C)(C)CSc1ccccc1Br 62a_100000695589_200000036245 [1,1,0,0,0,0|1,0,0]=3 1046 B13R1.157 C[N+](C)(C)CSc1ccccc1Br 62a_200000036245_100000695589 [1,1,0,0,0,0|1,0,0]=3 1047 B13R1.157 C[N+](C)(C)CSc1ccccc1Cl 62a_100000764095_200000036245 [1,1,0,0,0,0|1,0,0]=3 1048 B13R1.157 C[N+](C)(C)CSc1ccccc1Cl 62a_200000036245_100000764095 [1,1,0,0,0,0|1,0,0]=3 1049 B13R1.157 C[N+](C)(C)CSc1ccccc1F 62a_100011215700_200000036245 [1,1,0,0,0,0|1,0,0]=3 1050 B13R1.157 C[N+](C)(C)CSc1ccccc1F 62a_200000036245_100011215700 [1,1,0,0,0,0|1,0,0]=3 1051 B13R1.157 C[N+](C)(C)CSc1ccccc1N 62a_100000210017_200000036245 [1,1,0,0,0,0|1,0,0]=3 1052 B13R1.157 C[N+](C)(C)CSc1ccccc1N 62a_200000036245_100000210017 [1,1,0,0,0,0|1,0,0]=3 1053 B13R1.157 C[N+](C)(C)CSc1ccccc1O 62a_100000739446_200000036245 [1,1,0,0,0,0|1,0,0]=3 1054 B13R1.157 C[N+](C)(C)CSc1ccccc1O 62a_200000036245_100000739446 [1,1,0,0,0,0|1,0,0]=3 1055 B13R1.157 C[N+](C)(C)CSc1cccnc1Br 62a_100010202626_200000036245 [1,1,0,0,0,0|2,0,0]=4 1056 B13R1.157 C[N+](C)(C)CSc1cccnc1Br 62a_200000036245_100010202626 [1,1,0,0,0,0|2,0,0]=4 1057 B13R1.157 C[N+](C)(C)CSc1cccnc1Cl 62a_100000036424_200000036245 [1,1,0,0,0,0|2,0,0]=4 1058 B13R1.157 C[N+](C)(C)CSc1cccnc1Cl 62a_200000036245_100000036424 [1,1,0,0,0,0|2,0,0]=4 1059 B13R1.157 C[N+](C)(C)CSc1cccnc1F 62a_100009816115_200000036245 [1,1,0,0,0,0|2,0,0]=4 1060 B13R1.157 C[N+](C)(C)CSc1cccnc1F 62a_200000036245_100009816115 [1,1,0,0,0,0|2,0,0]=4 1061 B13R1.157 C[N+](C)(C)CSc1cccnc1N 62a_100000045569_200000036245 [1,1,0,0,0,0|2,0,0]=4 1062 B13R1.157 C[N+](C)(C)CSc1cccnc1N 62a_200000036245_100000045569 [1,1,0,0,0,0|2,0,0]=4 1063 B13R1.157 C[N+](C)(C)CSc1cccnc1O 62a_100000760158_200000036245 [1,1,0,0,0,0|2,0,0]=4 1064 B13R1.157 C[N+](C)(C)CSc1cccnc1O 62a_200000036245_100000760158 [1,1,0,0,0,0|2,0,0]=4 1065 B13R1.157 C[N+](C)(C)CSc1ccncc1Br 62a_100000726257_200000036245 [1,1,0,0,0,0|2,0,0]=4 1066 B13R1.157 C[N+](C)(C)CSc1ccncc1Br 62a_200000036245_100000726257 [1,1,0,0,0,0|2,0,0]=4 1067 B13R1.157 C[N+](C)(C)CSc1ccncc1Cl 62a_100000708259_200000036245 [1,1,0,0,0,0|2,0,0]=4 1068 B13R1.157 C[N+](C)(C)CSc1ccncc1Cl 62a_200000036245_100000708259 [1,1,0,0,0,0|2,0,0]=4 1069 B13R1.157 C[N+](C)(C)CSc1ccncc1F 62a_100000047030_200000036245 [1,1,0,0,0,0|2,0,0]=4 1070 B13R1.157 C[N+](C)(C)CSc1ccncc1F 62a_200000036245_100000047030 [1,1,0,0,0,0|2,0,0]=4 1071 B13R1.157 C[N+](C)(C)CSc1ccncc1N 62a_100000756074_200000036245 [1,1,0,0,0,0|2,0,0]=4 1072 B13R1.157 C[N+](C)(C)CSc1ccncc1N 62a_200000036245_100000756074 [1,1,0,0,0,0|2,0,0]=4 1073 B13R1.157 C[N+](C)(C)CSc1ccncc1O 62a_100009817591_200000036245 [1,1,0,0,0,0|2,0,0]=4 1074 B13R1.157 C[N+](C)(C)CSc1ccncc1O 62a_200000036245_100009817591 [1,1,0,0,0,0|2,0,0]=4 1075 B13R1.157 C[N+](C)(C)CSc1cnccc1Br 62a_100010138639_200000036245 [1,1,0,0,0,0|2,0,0]=4 1076 B13R1.157 C[N+](C)(C)CSc1cnccc1Br 62a_200000036245_100010138639 [1,1,0,0,0,0|2,0,0]=4 1077 B13R1.157 C[N+](C)(C)CSc1cnccc1Cl 62a_100009995489_200000036245 [1,1,0,0,0,0|2,0,0]=4 1078 B13R1.157 C[N+](C)(C)CSc1cnccc1Cl 62a_200000036245_100009995489 [1,1,0,0,0,0|2,0,0]=4 1079 B13R1.157 C[N+](C)(C)CSc1cnccc1F 62a_100009820683_200000036245 [1,1,0,0,0,0|2,0,0]=4 1080 B13R1.157 C[N+](C)(C)CSc1cnccc1F 62a_200000036245_100009820683 [1,1,0,0,0,0|2,0,0]=4 1081 B13R1.157 C[N+](C)(C)CSc1cnccc1N 62a_100000047001_200000036245 [1,1,0,0,0,0|2,0,0]=4 1082 B13R1.157 C[N+](C)(C)CSc1cnccc1N 62a_200000036245_100000047001 [1,1,0,0,0,0|2,0,0]=4 1083 B13R1.157 C[N+](C)(C)CSc1ncccc1Br 62a_100000696092_200000036245 [1,1,0,0,0,0|2,0,0]=4 1084 B13R1.157 C[N+](C)(C)CSc1ncccc1Br 62a_200000036245_100000696092 [1,1,0,0,0,0|2,0,0]=4 1085 B13R1.157 C[N+](C)(C)CSc1ncccc1Cl 62a_100011356963_200000036245 [1,1,0,0,0,0|2,0,0]=4 1086 B13R1.157 C[N+](C)(C)CSc1ncccc1Cl 62a_200000036245_100011356963 [1,1,0,0,0,0|2,0,0]=4 1087 B13R1.157 C[N+](C)(C)CSc1ncccc1F 62a_100000685392_200000036245 [1,1,0,0,0,0|2,0,0]=4 1088 B13R1.157 C[N+](C)(C)CSc1ncccc1F 62a_200000036245_100000685392 [1,1,0,0,0,0|2,0,0]=4 1089 B13R1.157 C[N+](C)(C)CSc1ncccc1N 62a_100000688686_200000036245 [1,1,0,0,0,0|2,0,0]=4 1090 B13R1.157 C[N+](C)(C)CSc1ncccc1N 62a_200000036245_100000688686 [1,1,0,0,0,0|2,0,0]=4 1091 B13R1.157 C[N+](C)(C)CSc1ncccc1O 62a_100000034122_200000036245 [1,1,0,0,0,0|2,0,0]=4 1092 B13R1.157 C[N+](C)(C)CSc1ncccc1O 62a_200000036245_100000034122 [1,1,0,0,0,0|2,0,0]=4 1093 B13R1.157 C[Si](C)(C)COc1ccccc1Br 7a_100000181306_100000233785 [1,1,0,0,0,0|2,0,0]=4 1094 B13R1.157 C[Si](C)(C)COc1ccccc1Cl 7a_100000210172_100000233785 [1,1,0,0,0,0|2,0,0]=4 1095 B13R1.157 C[Si](C)(C)COc1ccccc1F 7a_100000210171_100000233785 [1,1,0,0,0,0|2,0,0]=4 1096 B13R1.157 C[Si](C)(C)COc1ccccc1I 7a_100000739446_100000233785 [1,1,0,0,0,0|2,0,0]=4 1097 B13R1.157 C[Si](C)(C)COc1ccccc1N 7a_100000185747_100000233785 [1,1,0,0,0,0|2,0,0]=4 1098 B13R1.157 C[Si](C)(C)CSc1ccccc1Br 62a_100000037933_100000695589 [1,1,0,0,0,0|2,0,0]=4 1099 B13R1.157 C[Si](C)(C)CSc1ccccc1Br 62a_100000695589_100000037933 [1,1,0,0,0,0|2,0,0]=4 1100 B13R1.157 C[Si](C)(C)CSc1ccccc1Cl 62a_100000037933_100000764095 [1,1,0,0,0,0|2,0,0]=4 1101 B13R1.157 C[Si](C)(C)CSc1ccccc1Cl 62a_100000764095_100000037933 [1,1,0,0,0,0|2,0,0]=4 1102 B13R1.157 C[Si](C)(C)CSc1ccccc1F 62a_100000037933_100011215700 [1,1,0,0,0,0|2,0,0]=4 1103 B13R1.157 C[Si](C)(C)CSc1ccccc1F 62a_100011215700_100000037933 [1,1,0,0,0,0|2,0,0]=4 1104 B13R1.157 C[Si](C)(C)CSc1ccccc1N 62a_100000037933_100000210017 [1,1,0,0,0,0|2,0,0]=4 1105 B13R1.157 C[Si](C)(C)CSc1ccccc1N 62a_100000210017_100000037933 [1,1,0,0,0,0|2,0,0]=4 1106 B13R1.157 C[Si](C)(C)CSc1ccccc1O 62a_100000037933_100000739446 [1,1,0,0,0,0|2,0,0]=4 1107 B13R1.157 C[Si](C)(C)CSc1ccccc1O 62a_100000739446_100000037933 [1,1,0,0,0,0|2,0,0]=4 1108 B13R1.157 C[n+]1ccccc1SC[N+](C)(C)C 62a_200000036245_100000212160 [1,1,0,0,0,0|2,0,0]=4 1109 B13R1.157 Cc1ccccc1CNC(C)(C)C 207a_100000715429_100000211143 [1,1,0,0,0,0|2,0,0]=4 1110 B13R1.157 Cc1ccccc1CNC(C)(C)C 2230a_100000715429_100000211839 [1,1,0,0,0,0|2,0,0]=4 1111 B13R1.157 Cc1ccccc1CNC(C)(C)C 34a_100000174972_100000210625 [1,1,0,0,0,0|2,0,0]=4 1112 B13R1.157 Cc1ccccc1COC(C)(C)C 34a_100000698903_100000210625 [1,1,0,0,0,0|2,0,0]=4 1113 B13R1.157 Cc1ccccc1COC(C)(C)C 34a_100015890283_100000211839 [1,1,0,0,0,0|2,0,0]=4 1114 B13R1.157 Cc1ccccc1COC(C)(C)C 7a_100015890283_100000211839 [1,1,0,0,0,0|2,0,0]=4 1115 B13R1.157 Cc1ccccc1CSC(C)(C)C 62a_100000211839_100000211941 [1,1,0,0,0,0|2,0,0]=4 1116 B13R1.157 Cc1ccccc1CSC(C)(C)C 62a_100000211941_100000211839 [1,1,0,0,0,0|2,0,0]=4 1117 B13R1.157 Cc1ccccc1NCC(C)(C)C 34a_100015192222_100011219605 [1,1,0,0,0,0|2,0,0]=4 1118 B13R1.157 Cc1ccccc1OCC(C)(C)C 34a_100000210338_100011219605 [1,1,0,0,0,0|2,0,0]=4 1119 B13R1.157 Cc1ccccc1OC[Si](C)(C)C 7a_100000210338_100000233785 [1,1,0,0,0,0|2,0,0]=4 1120 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100000210755_100011219605 [1,1,0,0,0,0|2,0,0]=4 1121 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100011219605_100000210755 [1,1,0,0,0,0|2,0,0]=4 1122 B13R1.157 Cc1ccccc1SC[N+](C)(C)C 62a_100000210755_200000036245 [1,1,0,0,0,0|1,0,0]=3 1123 B13R1.157 Cc1ccccc1SC[N+](C)(C)C 62a_200000036245_100000210755 [1,1,0,0,0,0|1,0,0]=3 1124 B13R1.157 Cc1ccccc1SC[Si](C)(C)C 62a_100000037933_100000210755 [1,1,0,0,0,0|2,0,0]=4 1125 B13R1.157 Cc1ccccc1SC[Si](C)(C)C 62a_100000210755_100000037933 [1,1,0,0,0,0|2,0,0]=4 1126 B13R1.157 Cc1cccnc1SC[N+](C)(C)C 62a_100000751373_200000036245 [1,1,0,0,0,0|2,0,0]=4 1127 B13R1.157 Cc1cccnc1SC[N+](C)(C)C 62a_200000036245_100000751373 [1,1,0,0,0,0|2,0,0]=4 1128 B13R1.157 Cc1ccncc1SC[N+](C)(C)C 62a_100000761580_200000036245 [1,1,0,0,0,0|2,0,0]=4 1129 B13R1.157 Cc1ccncc1SC[N+](C)(C)C 62a_200000036245_100000761580 [1,1,0,0,0,0|2,0,0]=4 1130 B13R1.157 Cc1cnccc1SC[N+](C)(C)C 62a_100000765111_200000036245 [1,1,0,0,0,0|2,0,0]=4 1131 B13R1.157 Cc1cnccc1SC[N+](C)(C)C 62a_200000036245_100000765111 [1,1,0,0,0,0|2,0,0]=4 1132 B13R1.157 Cc1ncccc1SC[N+](C)(C)C 62a_100000751574_200000036245 [1,1,0,0,0,0|2,0,0]=4 1133 B13R1.157 Cc1ncccc1SC[N+](C)(C)C 62a_200000036245_100000751574 [1,1,0,0,0,0|2,0,0]=4 1134 B13R1.254 CC(C)(CCc1ccccc1)O[13CH3] 7a_100000750528_200025704644 [1,1,0,0,0,0|1,0,0]=3 1135 B13R1.254 CC(C)(CCl)OCc1ccccc1 7a_100000764493_100000211182 [1,1,0,0,0,0|2,0,0]=4 1136 B13R1.254 CC(C)(CO)CNc1ccccc1 34a_100000106764_100009813988 [1,1,0,0,0,0|2,0,0]=4 1137 B13R1.254 CC(C)(CO)COc1ccccc1 34a_100000210340_100009813988 [1,1,0,0,0,0|2,0,0]=4 1138 B13R1.254 CC(C)(CO)COc1ccccc1 7a_100000210340_100009813988 [1,1,0,0,0,0|2,0,0]=4 1139 B13R1.254 CC(C)(CO)CSc1ccccc1 62a_100000719477_100009813988 [1,1,0,0,0,0|2,0,0]=4 1140 B13R1.254 CC(C)(CO)CSc1ccccc1 62a_100009813988_100000041952 [1,1,0,0,0,0|2,0,0]=4 1141 B13R1.254 CC(C)(CO)NCc1ccccc1 207a_100000210608_100015611070 [1,1,0,0,0,0|2,0,0]=4 1142 B13R1.254 CC(C)(CO)NCc1ccccc1 2230a_100000210608_100015291786 [1,1,0,0,0,0|2,0,0]=4 1143 B13R1.254 CC(C)(CO)NCc1ccccc1 270004a_100000210608_100015611070 [1,1,0,0,0,0|2,0,0]=4 1144 B13R1.254 CCC(C)(C)NCc1ccccc1 207a_100000211385_100015611070 [1,1,0,0,0,0|2,0,0]=4 1145 B13R1.254 CCC(C)(C)NCc1ccccc1 2230a_100000211385_100015291786 [1,1,0,0,0,0|2,0,0]=4 1146 B13R1.254 CCC(C)(C)NCc1ccccc1 270004a_100000211385_100015611070 [1,1,0,0,0,0|2,0,0]=4 1147 B13R1.254 CCC(C)(C)OCc1ccccc1 7a_100000210230_100000211182 [1,1,0,0,0,0|2,0,0]=4 1148 B13R1.254 CCC(C)(C)OCc1ccccc1 7a_100000210790_100000210677 [1,1,0,0,0,0|2,0,0]=4 1149 B13R1.254 CCC(C)(C)SCc1ccccc1 62a_100000032637_100015291786 [1,1,0,0,0,0|2,0,0]=4 1150 B13R1.254 CCC(C)(C)SCc1ccccc1 62a_100000211182_100000032637 [1,1,0,0,0,0|2,0,0]=4 1151 B13R1.254 COC(C)(C)CCc1ccccc1 7a_100000750528_200000210301 [1,1,0,0,0,0|1,0,0]=3 1152 B13R1.254 COC(C)(C)CNc1ccccc1 34a_100000106764_100000701081 [1,1,0,0,0,0|2,0,0]=4 1153 B13R1.254 COC(C)(C)COc1ccccc1 34a_100000210340_100000701081 [1,1,0,0,0,0|2,0,0]=4 1154 B13R1.254 COC(C)(C)CSc1ccccc1 62a_100000701081_100000041952 [1,1,0,0,0,0|2,0,0]=4 1155 B13R1.254 COC(C)(C)CSc1ccccc1 62a_100000719477_100000701081 [1,1,0,0,0,0|2,0,0]=4 1156 B13R1.353 CC(C)(C)C(=O)Cc1ccccc1 1458a_106744555173_100015291786 [1,1,0,0,0,0|1,0,1]=4 1157 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccc1 2230a_100000180882_200025704644 [1,1,0,0,0,0|2,0,0]=4 1158 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccc1 269982a_100000180882_200025704644 [1,1,0,0,0,0|2,0,0]=4 1159 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 2230a_100000180882_200000210301 [1,1,0,0,0,0|2,0,0]=4 1160 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100000180882_200000210301 [1,1,0,0,0,0|2,0,0]=4 1161 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100000186898_100000210625 [1,1,0,0,0,0|2,0,0]=4 1162 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100011215553_100000211182 [1,1,0,0,0,0|2,0,0]=4 1163 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 270004a_100011215553_100015611070 [1,1,0,0,0,0|2,0,0]=4 1164 B13R1.512 CC(C)(C)CNc1ccc(cc1)Br 34a_100000210018_100011219605 [1,1,0,0,0,0|2,0,0]=4 1165 B13R1.512 CC(C)(C)CNc1ccc(cc1)Cl 34a_100000210052_100011219605 [1,1,0,0,0,0|2,0,0]=4 1166 B13R1.512 CC(C)(C)CNc1ccc(cc1)F 34a_100000185862_100011219605 [1,1,0,0,0,0|2,0,0]=4 1167 B13R1.512 CC(C)(C)CNc1ccc(cc1)I 34a_100000185761_100011219605 [1,1,0,0,0,0|2,0,0]=4 1168 B13R1.512 CC(C)(C)CNc1ccc(cc1)O 34a_100000185829_100011219605 [1,1,0,0,0,0|2,0,0]=4 1169 B13R1.512 CC(C)(C)COc1ccc(cc1)Br 34a_100000185759_100011219605 [1,1,0,0,0,0|2,0,0]=4 1170 B13R1.512 CC(C)(C)COc1ccc(cc1)Cl 34a_100000210216_100011219605 [1,1,0,0,0,0|2,0,0]=4 1171 B13R1.512 CC(C)(C)COc1ccc(cc1)F 34a_100000210339_100011219605 [1,1,0,0,0,0|2,0,0]=4 1172 B13R1.512 CC(C)(C)COc1ccc(cc1)I 34a_100000212066_100011219605 [1,1,0,0,0,0|2,0,0]=4 1173 B13R1.512 CC(C)(C)COc1ccc(cc1)N 34a_100000185829_100011219605 [1,1,0,0,0,0|2,0,0]=4 1174 B13R1.512 CC(C)(C)COc1ccc(cc1)O 271570a_203496583355_200010229346 [1,1,0,0,0,0|2,0,0]=4 1175 B13R1.512 CC(C)(C)CSc1ccc(cc1)Br 62a_100000752885_100011219605 [1,1,0,0,0,0|2,0,0]=4 1176 B13R1.512 CC(C)(C)CSc1ccc(cc1)Br 62a_100011219605_100000752885 [1,1,0,0,0,0|2,0,0]=4 1177 B13R1.512 CC(C)(C)CSc1ccc(cc1)Cl 62a_100000755918_100011219605 [1,1,0,0,0,0|2,0,0]=4 1178 B13R1.512 CC(C)(C)CSc1ccc(cc1)Cl 62a_100011219605_100000755918 [1,1,0,0,0,0|2,0,0]=4 1179 B13R1.512 CC(C)(C)CSc1ccc(cc1)F 62a_100000211213_100011219605 [1,1,0,0,0,0|2,0,0]=4 1180 B13R1.512 CC(C)(C)CSc1ccc(cc1)F 62a_100011219605_100000211213 [1,1,0,0,0,0|2,0,0]=4 1181 B13R1.512 CC(C)(C)CSc1ccc(cc1)N 62a_100000185761_100011219605 [1,1,0,0,0,0|2,0,0]=4 1182 B13R1.512 CC(C)(C)CSc1ccc(cc1)N 62a_100011219605_100000185761 [1,1,0,0,0,0|2,0,0]=4 1183 B13R1.512 CC(C)(C)CSc1ccc(cc1)O 62a_100011219605_100000185759 [1,1,0,0,0,0|2,0,0]=4 1184 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 207a_100000715429_100000186029 [1,1,0,0,0,0|2,0,0]=4 1185 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 2230a_100000715429_100011217064 [1,1,0,0,0,0|2,0,0]=4 1186 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 34a_100000174875_100000210625 [1,1,0,0,0,0|2,0,0]=4 1187 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 207a_100000715429_100000189385 [1,1,0,0,0,0|2,0,0]=4 1188 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 2230a_100000715429_100000694040 [1,1,0,0,0,0|2,0,0]=4 1189 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210625 [1,1,0,0,0,0|2,0,0]=4 1190 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 207a_100000715429_100000210084 [1,1,0,0,0,0|2,0,0]=4 1191 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 2230a_100000715429_100000198546 [1,1,0,0,0,0|2,0,0]=4 1192 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 34a_100000174882_100000210625 [1,1,0,0,0,0|2,0,0]=4 1193 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 207a_100000715429_100000188517 [1,1,0,0,0,0|2,0,0]=4 1194 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 2230a_100000715429_100000189116 [1,1,0,0,0,0|2,0,0]=4 1195 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 34a_100016989417_100000210625 [1,1,0,0,0,0|2,0,0]=4 1196 B13R1.512 CC(C)(C)NCc1ccc(cc1)O 271570a_203496583355_100000189139 [1,1,0,0,0,0|2,0,0]=4 1197 B13R1.512 CC(C)(C)NCc1ccc(cc1)O 34a_100000185549_100000210625 [1,1,0,0,0,0|2,0,0]=4 1198 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 34a_100000695286_100000210625 [1,1,0,0,0,0|2,0,0]=4 1199 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 34a_100015890283_100000189115 [1,1,0,0,0,0|2,0,0]=4 1200 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 7a_100015890283_100011217064 [1,1,0,0,0,0|2,0,0]=4 1201 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210625 [1,1,0,0,0,0|2,0,0]=4 1202 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 34a_100015890283_100000694040 [1,1,0,0,0,0|2,0,0]=4 1203 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 7a_100015890283_100000187161 [1,1,0,0,0,0|2,0,0]=4 1204 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 34a_100000210977_100000210625 [1,1,0,0,0,0|2,0,0]=4 1205 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 34a_100015890283_100000198546 [1,1,0,0,0,0|2,0,0]=4 1206 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 7a_100015890283_100000198546 [1,1,0,0,0,0|2,0,0]=4 1207 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 34a_100000690907_100000210625 [1,1,0,0,0,0|2,0,0]=4 1208 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 34a_100015890283_100000189116 [1,1,0,0,0,0|2,0,0]=4 1209 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 7a_100015890283_100000189116 [1,1,0,0,0,0|2,0,0]=4 1210 B13R1.512 CC(C)(C)OCc1ccc(cc1)N 34a_100011215238_100000210625 [1,1,0,0,0,0|2,0,0]=4 1211 B13R1.512 CC(C)(C)OCc1ccc(cc1)O 271570a_203496583355_100011493771 [1,1,0,0,0,0|2,0,0]=4 1212 B13R1.512 CC(C)(C)SCc1ccc(cc1)Br 62a_100000189115_100000211941 [1,1,0,0,0,0|2,0,0]=4 1213 B13R1.512 CC(C)(C)SCc1ccc(cc1)Br 62a_100000211941_100000189115 [1,1,0,0,0,0|2,0,0]=4 1214 B13R1.512 CC(C)(C)SCc1ccc(cc1)Cl 62a_100000187161_100000211941 [1,1,0,0,0,0|2,0,0]=4 1215 B13R1.512 CC(C)(C)SCc1ccc(cc1)Cl 62a_100000211941_100000187161 [1,1,0,0,0,0|2,0,0]=4 1216 B13R1.512 CC(C)(C)SCc1ccc(cc1)F 62a_100000198546_100000211941 [1,1,0,0,0,0|2,0,0]=4 1217 B13R1.512 CC(C)(C)SCc1ccc(cc1)F 62a_100000211941_100000187164 [1,1,0,0,0,0|2,0,0]=4 1218 B13R1.512 CC(C)(C)SCc1ccc(cc1)I 62a_100000189116_100000211941 [1,1,0,0,0,0|2,0,0]=4 1219 B13R1.512 CC(C)(C)SCc1ccc(cc1)I 62a_100000211941_100000189116 [1,1,0,0,0,0|2,0,0]=4 1220 B13R1.512 C[N+](C)(C)CSc1cc[n+](cc1)[O-] 62a_200000036245_100000039755 [1,1,0,0,0,0|2,0,0]=4 1221 B13R1.512 C[N+](C)(C)CSc1ccc(=O)[nH]c1 62a_100000212171_200000036245 [1,1,0,0,0,0|2,0,0]=4 1222 B13R1.512 C[N+](C)(C)CSc1ccc(=O)[nH]c1 62a_200000036245_100000212171 [1,1,0,0,0,0|2,0,0]=4 1223 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Br 62a_100000752885_200000036245 [1,1,0,0,0,0|1,0,0]=3 1224 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Br 62a_200000036245_100000752885 [1,1,0,0,0,0|1,0,0]=3 1225 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Cl 62a_100000755918_200000036245 [1,1,0,0,0,0|1,0,0]=3 1226 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Cl 62a_200000036245_100000755918 [1,1,0,0,0,0|1,0,0]=3 1227 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)F 62a_100000211213_200000036245 [1,1,0,0,0,0|1,0,0]=3 1228 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)F 62a_200000036245_100000211213 [1,1,0,0,0,0|1,0,0]=3 1229 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)N 62a_100000185761_200000036245 [1,1,0,0,0,0|1,0,0]=3 1230 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)N 62a_200000036245_100000185761 [1,1,0,0,0,0|1,0,0]=3 1231 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)O 62a_200000036245_100000185759 [1,1,0,0,0,0|1,0,0]=3 1232 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)Br 62a_100000686858_200000036245 [1,1,0,0,0,0|2,0,0]=4 1233 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)Br 62a_200000036245_100000686858 [1,1,0,0,0,0|2,0,0]=4 1234 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)Cl 62a_100011356976_200000036245 [1,1,0,0,0,0|2,0,0]=4 1235 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)Cl 62a_200000036245_100011356976 [1,1,0,0,0,0|2,0,0]=4 1236 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)F 62a_100000744514_200000036245 [1,1,0,0,0,0|2,0,0]=4 1237 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)F 62a_200000036245_100000744514 [1,1,0,0,0,0|2,0,0]=4 1238 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)N 62a_100000737798_200000036245 [1,1,0,0,0,0|2,0,0]=4 1239 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)N 62a_200000036245_100000737798 [1,1,0,0,0,0|2,0,0]=4 1240 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)O 62a_100000685995_200000036245 [1,1,0,0,0,0|2,0,0]=4 1241 B13R1.512 C[N+](C)(C)CSc1ccc(cn1)O 62a_200000036245_100000744096 [1,1,0,0,0,0|2,0,0]=4 1242 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)Br 62a_100009814638_200000036245 [1,1,0,0,0,0|2,0,0]=4 1243 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)Br 62a_200000036245_100009814638 [1,1,0,0,0,0|2,0,0]=4 1244 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)Cl 62a_100000034144_200000036245 [1,1,0,0,0,0|2,0,0]=4 1245 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)Cl 62a_200000036245_100000034144 [1,1,0,0,0,0|2,0,0]=4 1246 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)F 62a_100000042367_200000036245 [1,1,0,0,0,0|2,0,0]=4 1247 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)F 62a_200000036245_100000042367 [1,1,0,0,0,0|2,0,0]=4 1248 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)N 62a_100000187370_200000036245 [1,1,0,0,0,0|2,0,0]=4 1249 B13R1.512 C[N+](C)(C)CSc1ccc(nc1)N 62a_200000036245_100000187370 [1,1,0,0,0,0|2,0,0]=4 1250 B13R1.512 C[Si](C)(C)CNc1ccc(cc1)Br 2230a_100000210018_100000037933 [1,1,0,0,0,0|2,0,0]=4 1251 B13R1.512 C[Si](C)(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000037933 [1,1,0,0,0,0|2,0,0]=4 1252 B13R1.512 C[Si](C)(C)COc1ccc(cc1)Br 7a_100000185759_100000233785 [1,1,0,0,0,0|2,0,0]=4 1253 B13R1.512 C[Si](C)(C)COc1ccc(cc1)Cl 7a_100000210216_100000233785 [1,1,0,0,0,0|2,0,0]=4 1254 B13R1.512 C[Si](C)(C)COc1ccc(cc1)I 7a_100000212066_100000233785 [1,1,0,0,0,0|2,0,0]=4 1255 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Br 62a_100000037933_100000752885 [1,1,0,0,0,0|2,0,0]=4 1256 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Br 62a_100000752885_100000037933 [1,1,0,0,0,0|2,0,0]=4 1257 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Cl 62a_100000037933_100000755918 [1,1,0,0,0,0|2,0,0]=4 1258 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Cl 62a_100000755918_100000037933 [1,1,0,0,0,0|2,0,0]=4 1259 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)F 62a_100000037933_100000211213 [1,1,0,0,0,0|2,0,0]=4 1260 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)F 62a_100000211213_100000037933 [1,1,0,0,0,0|2,0,0]=4 1261 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)N 62a_100000037933_100000185761 [1,1,0,0,0,0|2,0,0]=4 1262 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)N 62a_100000185761_100000037933 [1,1,0,0,0,0|2,0,0]=4 1263 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)O 62a_100000037933_100000185759 [1,1,0,0,0,0|2,0,0]=4 1264 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 207a_100000715429_100000211033 [1,1,0,0,0,0|2,0,0]=4 1265 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 2230a_100000715429_100000210814 [1,1,0,0,0,0|2,0,0]=4 1266 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 34a_100000174908_100000210625 [1,1,0,0,0,0|2,0,0]=4 1267 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 34a_100011215236_100000210625 [1,1,0,0,0,0|2,0,0]=4 1268 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 34a_100015890283_100000210814 [1,1,0,0,0,0|2,0,0]=4 1269 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 7a_100015890283_100000210814 [1,1,0,0,0,0|2,0,0]=4 1270 B13R1.512 Cc1ccc(cc1)CSC(C)(C)C 62a_100000210814_100000211941 [1,1,0,0,0,0|2,0,0]=4 1271 B13R1.512 Cc1ccc(cc1)CSC(C)(C)C 62a_100000211941_100000210814 [1,1,0,0,0,0|2,0,0]=4 1272 B13R1.512 Cc1ccc(cc1)NCC(C)(C)C 34a_100000124888_100011219605 [1,1,0,0,0,0|2,0,0]=4 1273 B13R1.512 Cc1ccc(cc1)OCC(C)(C)C 34a_100000210336_100011219605 [1,1,0,0,0,0|2,0,0]=4 1274 B13R1.512 Cc1ccc(cc1)OC[Si](C)(C)C 7a_100000210336_100000233785 [1,1,0,0,0,0|2,0,0]=4 1275 B13R1.512 Cc1ccc(cc1)SCC(C)(C)C 62a_100000186775_100011219605 [1,1,0,0,0,0|2,0,0]=4 1276 B13R1.512 Cc1ccc(cc1)SCC(C)(C)C 62a_100011219605_100000186775 [1,1,0,0,0,0|2,0,0]=4 1277 B13R1.512 Cc1ccc(cc1)SC[N+](C)(C)C 62a_100000186775_200000036245 [1,1,0,0,0,0|1,0,0]=3 1278 B13R1.512 Cc1ccc(cc1)SC[N+](C)(C)C 62a_200000036245_100000186775 [1,1,0,0,0,0|1,0,0]=3 1279 B13R1.512 Cc1ccc(cc1)SC[Si](C)(C)C 62a_100000037933_100000186775 [1,1,0,0,0,0|2,0,0]=4 1280 B13R1.512 Cc1ccc(cc1)SC[Si](C)(C)C 62a_100000186775_100000037933 [1,1,0,0,0,0|2,0,0]=4 1281 B13R1.512 Cc1ccc(cn1)SC[N+](C)(C)C 62a_100000751577_200000036245 [1,1,0,0,0,0|2,0,0]=4 1282 B13R1.512 Cc1ccc(cn1)SC[N+](C)(C)C 62a_200000036245_100000751577 [1,1,0,0,0,0|2,0,0]=4 1283 B13R1.512 Cc1ccc(nc1)SC[N+](C)(C)C 62a_100011192072_200000036245 [1,1,0,0,0,0|2,0,0]=4 1284 B13R1.512 Cc1ccc(nc1)SC[N+](C)(C)C 62a_200000036245_100000754016 [1,1,0,0,0,0|2,0,0]=4 1285 B13R1.838 CC(C)(C)CNc1cccc(c1)Br 34a_100000210019_100011219605 [1,1,0,0,0,0|2,0,0]=4 1286 B13R1.838 CC(C)(C)CNc1cccc(c1)Cl 34a_100000185859_100011219605 [1,1,0,0,0,0|2,0,0]=4 1287 B13R1.838 CC(C)(C)CNc1cccc(c1)F 34a_100000210047_100011219605 [1,1,0,0,0,0|2,0,0]=4 1288 B13R1.838 CC(C)(C)CNc1cccc(c1)I 34a_100000211102_100011219605 [1,1,0,0,0,0|2,0,0]=4 1289 B13R1.838 CC(C)(C)CNc1cccc(c1)O 34a_100000210217_100011219605 [1,1,0,0,0,0|2,0,0]=4 1290 B13R1.838 CC(C)(C)COc1cccc(c1)Br 34a_100000210342_100011219605 [1,1,0,0,0,0|2,0,0]=4 1291 B13R1.838 CC(C)(C)COc1cccc(c1)Cl 34a_100000210295_100011219605 [1,1,0,0,0,0|2,0,0]=4 1292 B13R1.838 CC(C)(C)COc1cccc(c1)F 34a_100000210426_100011219605 [1,1,0,0,0,0|2,0,0]=4 1293 B13R1.838 CC(C)(C)COc1cccc(c1)I 34a_100000211634_100011219605 [1,1,0,0,0,0|2,0,0]=4 1294 B13R1.838 CC(C)(C)COc1cccc(c1)N 34a_100000210217_100011219605 [1,1,0,0,0,0|2,0,0]=4 1295 B13R1.838 CC(C)(C)COc1cccc(c1)O 271570a_203496583355_200010229345 [1,1,0,0,0,0|2,0,0]=4 1296 B13R1.838 CC(C)(C)CSc1cccc(c1)Br 62a_100000691529_100011219605 [1,1,0,0,0,0|2,0,0]=4 1297 B13R1.838 CC(C)(C)CSc1cccc(c1)Br 62a_100011219605_100000691529 [1,1,0,0,0,0|2,0,0]=4 1298 B13R1.838 CC(C)(C)CSc1cccc(c1)Cl 62a_100000699651_100011219605 [1,1,0,0,0,0|2,0,0]=4 1299 B13R1.838 CC(C)(C)CSc1cccc(c1)Cl 62a_100011219605_100000699651 [1,1,0,0,0,0|2,0,0]=4 1300 B13R1.838 CC(C)(C)CSc1cccc(c1)F 62a_100000685547_100011219605 [1,1,0,0,0,0|2,0,0]=4 1301 B13R1.838 CC(C)(C)CSc1cccc(c1)F 62a_100011219605_100000685547 [1,1,0,0,0,0|2,0,0]=4 1302 B13R1.838 CC(C)(C)CSc1cccc(c1)N 62a_100000210019_100011219605 [1,1,0,0,0,0|2,0,0]=4 1303 B13R1.838 CC(C)(C)CSc1cccc(c1)N 62a_100011219605_100000210019 [1,1,0,0,0,0|2,0,0]=4 1304 B13R1.838 CC(C)(C)CSc1cccc(c1)O 62a_100011219605_100000211634 [1,1,0,0,0,0|2,0,0]=4 1305 B13R1.838 CC(C)(C)CSc1cccc(c1)[S] 62a_100011219605_114929384022 [1,1,0,0,0,0|2,0,0]=4 1306 B13R1.838 CC(C)(C)CSc1cccc(c1)[S] 62a_114929384022_100011219605 [1,1,0,0,0,0|2,0,0]=4 1307 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 207a_100000715429_100000210085 [1,1,0,0,0,0|2,0,0]=4 1308 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 2230a_100000715429_100000698116 [1,1,0,0,0,0|2,0,0]=4 1309 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 34a_100000174977_100000210625 [1,1,0,0,0,0|2,0,0]=4 1310 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 207a_100000715429_100000210801 [1,1,0,0,0,0|2,0,0]=4 1311 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 2230a_100000715429_100000181238 [1,1,0,0,0,0|2,0,0]=4 1312 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 34a_100000174878_100000210625 [1,1,0,0,0,0|2,0,0]=4 1313 B13R1.838 CC(C)(C)NCc1cccc(c1)F 207a_100000715429_100000210812 [1,1,0,0,0,0|2,0,0]=4 1314 B13R1.838 CC(C)(C)NCc1cccc(c1)F 2230a_100000715429_100000230114 [1,1,0,0,0,0|2,0,0]=4 1315 B13R1.838 CC(C)(C)NCc1cccc(c1)F 34a_100000174948_100000210625 [1,1,0,0,0,0|2,0,0]=4 1316 B13R1.838 CC(C)(C)NCc1cccc(c1)I 207a_100000715429_100000014684 [1,1,0,0,0,0|2,0,0]=4 1317 B13R1.838 CC(C)(C)NCc1cccc(c1)I 2230a_100000715429_100011218688 [1,1,0,0,0,0|2,0,0]=4 1318 B13R1.838 CC(C)(C)NCc1cccc(c1)I 34a_100000106179_100000210625 [1,1,0,0,0,0|2,0,0]=4 1319 B13R1.838 CC(C)(C)NCc1cccc(c1)O 207a_100000715429_100000188321 [1,1,0,0,0,0|2,0,0]=4 1320 B13R1.838 CC(C)(C)NCc1cccc(c1)O 2230a_100000715429_100011660834 [1,1,0,0,0,0|2,0,0]=4 1321 B13R1.838 CC(C)(C)NCc1cccc(c1)O 34a_100000743036_100000210625 [1,1,0,0,0,0|2,0,0]=4 1322 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 34a_100000687537_100000210625 [1,1,0,0,0,0|2,0,0]=4 1323 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 34a_100015890283_100000698116 [1,1,0,0,0,0|2,0,0]=4 1324 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 7a_100015890283_100000211773 [1,1,0,0,0,0|2,0,0]=4 1325 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 34a_100000241301_100000210625 [1,1,0,0,0,0|2,0,0]=4 1326 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 34a_100015890283_100000187163 [1,1,0,0,0,0|2,0,0]=4 1327 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 7a_100015890283_100000187163 [1,1,0,0,0,0|2,0,0]=4 1328 B13R1.838 CC(C)(C)OCc1cccc(c1)F 34a_100000210976_100000210625 [1,1,0,0,0,0|2,0,0]=4 1329 B13R1.838 CC(C)(C)OCc1cccc(c1)F 34a_100015890283_100000187166 [1,1,0,0,0,0|2,0,0]=4 1330 B13R1.838 CC(C)(C)OCc1cccc(c1)F 7a_100015890283_100000230114 [1,1,0,0,0,0|2,0,0]=4 1331 B13R1.838 CC(C)(C)OCc1cccc(c1)I 34a_100011215336_100000210625 [1,1,0,0,0,0|2,0,0]=4 1332 B13R1.838 CC(C)(C)OCc1cccc(c1)I 34a_100015890283_100011218688 [1,1,0,0,0,0|2,0,0]=4 1333 B13R1.838 CC(C)(C)OCc1cccc(c1)I 7a_100015890283_100011218688 [1,1,0,0,0,0|2,0,0]=4 1334 B13R1.838 CC(C)(C)OCc1cccc(c1)N 34a_100000211919_100000210625 [1,1,0,0,0,0|2,0,0]=4 1335 B13R1.838 CC(C)(C)OCc1cccc(c1)O 34a_100015890283_100011660834 [1,1,0,0,0,0|2,0,0]=4 1336 B13R1.838 CC(C)(C)OCc1cccc(c1)O 7a_100015890283_100000084143 [1,1,0,0,0,0|2,0,0]=4 1337 B13R1.838 CC(C)(C)SCc1cccc(c1)Br 62a_100000211773_100000211941 [1,1,0,0,0,0|2,0,0]=4 1338 B13R1.838 CC(C)(C)SCc1cccc(c1)Br 62a_100000211941_100000211773 [1,1,0,0,0,0|2,0,0]=4 1339 B13R1.838 CC(C)(C)SCc1cccc(c1)Cl 62a_100000187163_100000211941 [1,1,0,0,0,0|2,0,0]=4 1340 B13R1.838 CC(C)(C)SCc1cccc(c1)Cl 62a_100000211941_100000187163 [1,1,0,0,0,0|2,0,0]=4 1341 B13R1.838 CC(C)(C)SCc1cccc(c1)F 62a_100000211941_100000230114 [1,1,0,0,0,0|2,0,0]=4 1342 B13R1.838 CC(C)(C)SCc1cccc(c1)F 62a_100000230114_100000211941 [1,1,0,0,0,0|2,0,0]=4 1343 B13R1.838 CC(C)(C)SCc1cccc(c1)I 62a_100000211941_100011218688 [1,1,0,0,0,0|2,0,0]=4 1344 B13R1.838 CC(C)(C)SCc1cccc(c1)I 62a_100011218688_100000211941 [1,1,0,0,0,0|2,0,0]=4 1345 B13R1.838 CC(C)(C)SCc1cccc(c1)O 62a_100000211941_100011660834 [1,1,0,0,0,0|2,0,0]=4 1346 B13R1.838 CC(C)(C)SCc1cccc(c1)O 62a_100011660834_100000211941 [1,1,0,0,0,0|2,0,0]=4 1347 B13R1.838 C[N+](C)(C)CSc1cc(=O)cc[nH]1 62a_100009817434_200000036245 [1,1,0,0,0,0|2,0,0]=4 1348 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)Cl 62a_100010167805_200000036245 [1,1,0,0,0,0|2,0,0]=4 1349 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)Cl 62a_200000036245_100010167805 [1,1,0,0,0,0|2,0,0]=4 1350 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)F 62a_100000764206_200000036245 [1,1,0,0,0,0|2,0,0]=4 1351 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)F 62a_200000036245_100000764206 [1,1,0,0,0,0|2,0,0]=4 1352 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)N 62a_100009814236_200000036245 [1,1,0,0,0,0|2,0,0]=4 1353 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)N 62a_200000036245_100009814236 [1,1,0,0,0,0|2,0,0]=4 1354 B13R1.838 C[N+](C)(C)CSc1cc(ccn1)O 62a_200000036245_100000762945 [1,1,0,0,0,0|2,0,0]=4 1355 B13R1.838 C[N+](C)(C)CSc1cc[nH]c(=O)c1 62a_100009816521_200000036245 [1,1,0,0,0,0|2,0,0]=4 1356 B13R1.838 C[N+](C)(C)CSc1cc[nH]c(=O)c1 62a_200000036245_100009816521 [1,1,0,0,0,0|2,0,0]=4 1357 B13R1.838 C[N+](C)(C)CSc1ccc[n+](c1)[O-] 62a_200000036245_100009815978 [1,1,0,0,0,0|2,0,0]=4 1358 B13R1.838 C[N+](C)(C)CSc1cccc(=O)[nH]1 62a_200000036245_100000752884 [1,1,0,0,0,0|2,0,0]=4 1359 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Br 62a_100000691529_200000036245 [1,1,0,0,0,0|1,0,0]=3 1360 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Br 62a_200000036245_100000691529 [1,1,0,0,0,0|1,0,0]=3 1361 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Cl 62a_100000699651_200000036245 [1,1,0,0,0,0|1,0,0]=3 1362 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Cl 62a_200000036245_100000699651 [1,1,0,0,0,0|1,0,0]=3 1363 B13R1.838 C[N+](C)(C)CSc1cccc(c1)F 62a_100000685547_200000036245 [1,1,0,0,0,0|1,0,0]=3 1364 B13R1.838 C[N+](C)(C)CSc1cccc(c1)F 62a_200000036245_100000685547 [1,1,0,0,0,0|1,0,0]=3 1365 B13R1.838 C[N+](C)(C)CSc1cccc(c1)N 62a_100000210019_200000036245 [1,1,0,0,0,0|1,0,0]=3 1366 B13R1.838 C[N+](C)(C)CSc1cccc(c1)N 62a_200000036245_100000210019 [1,1,0,0,0,0|1,0,0]=3 1367 B13R1.838 C[N+](C)(C)CSc1cccc(c1)O 62a_200000036245_100000211634 [1,1,0,0,0,0|1,0,0]=3 1368 B13R1.838 C[N+](C)(C)CSc1cccc(c1)[S] 62a_114929384022_200000036245 [1,1,0,0,0,0|1,0,0]=3 1369 B13R1.838 C[N+](C)(C)CSc1cccc(c1)[S] 62a_200000036245_114929384022 [1,1,0,0,0,0|1,0,0]=3 1370 B13R1.838 C[N+](C)(C)CSc1cccc(n1)Br 62a_100000684672_200000036245 [1,1,0,0,0,0|2,0,0]=4 1371 B13R1.838 C[N+](C)(C)CSc1cccc(n1)Br 62a_200000036245_100000684672 [1,1,0,0,0,0|2,0,0]=4 1372 B13R1.838 C[N+](C)(C)CSc1cccc(n1)Cl 62a_100000051397_200000036245 [1,1,0,0,0,0|2,0,0]=4 1373 B13R1.838 C[N+](C)(C)CSc1cccc(n1)Cl 62a_200000036245_100000051397 [1,1,0,0,0,0|2,0,0]=4 1374 B13R1.838 C[N+](C)(C)CSc1cccc(n1)F 62a_100009815982_200000036245 [1,1,0,0,0,0|2,0,0]=4 1375 B13R1.838 C[N+](C)(C)CSc1cccc(n1)F 62a_200000036245_100009815982 [1,1,0,0,0,0|2,0,0]=4 1376 B13R1.838 C[N+](C)(C)CSc1cccc(n1)N 62a_100000740741_200000036245 [1,1,0,0,0,0|2,0,0]=4 1377 B13R1.838 C[N+](C)(C)CSc1cccc(n1)N 62a_200000036245_100000740741 [1,1,0,0,0,0|2,0,0]=4 1378 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)Br 62a_100009814637_200000036245 [1,1,0,0,0,0|2,0,0]=4 1379 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)Br 62a_200000036245_100009814637 [1,1,0,0,0,0|2,0,0]=4 1380 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)Cl 62a_100000035001_200000036245 [1,1,0,0,0,0|2,0,0]=4 1381 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)Cl 62a_200000036245_100000035001 [1,1,0,0,0,0|2,0,0]=4 1382 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)F 62a_100009816116_200000036245 [1,1,0,0,0,0|2,0,0]=4 1383 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)F 62a_200000036245_100009816116 [1,1,0,0,0,0|2,0,0]=4 1384 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)N 62a_100000049665_200000036245 [1,1,0,0,0,0|2,0,0]=4 1385 B13R1.838 C[N+](C)(C)CSc1ccnc(c1)N 62a_200000036245_100000049665 [1,1,0,0,0,0|2,0,0]=4 1386 B13R1.838 C[N+](C)(C)CSc1cncc(c1)Br 62a_100000728054_200000036245 [1,1,0,0,0,0|2,0,0]=4 1387 B13R1.838 C[N+](C)(C)CSc1cncc(c1)Br 62a_200000036245_100000728054 [1,1,0,0,0,0|2,0,0]=4 1388 B13R1.838 C[N+](C)(C)CSc1cncc(c1)Cl 62a_100000049639_200000036245 [1,1,0,0,0,0|2,0,0]=4 1389 B13R1.838 C[N+](C)(C)CSc1cncc(c1)Cl 62a_200000036245_100000049639 [1,1,0,0,0,0|2,0,0]=4 1390 B13R1.838 C[N+](C)(C)CSc1cncc(c1)F 62a_100000744099_200000036245 [1,1,0,0,0,0|2,0,0]=4 1391 B13R1.838 C[N+](C)(C)CSc1cncc(c1)F 62a_200000036245_100000744099 [1,1,0,0,0,0|2,0,0]=4 1392 B13R1.838 C[N+](C)(C)CSc1cncc(c1)N 62a_100000687067_200000036245 [1,1,0,0,0,0|2,0,0]=4 1393 B13R1.838 C[N+](C)(C)CSc1cncc(c1)N 62a_200000036245_100000687067 [1,1,0,0,0,0|2,0,0]=4 1394 B13R1.838 C[N+](C)(C)CSc1cncc(c1)O 62a_100000754920_200000036245 [1,1,0,0,0,0|2,0,0]=4 1395 B13R1.838 C[N+](C)(C)CSc1cncc(c1)O 62a_200000036245_100000754920 [1,1,0,0,0,0|2,0,0]=4 1396 B13R1.838 C[Si](C)(C)COc1cccc(c1)Br 7a_100000210342_100000233785 [1,1,0,0,0,0|2,0,0]=4 1397 B13R1.838 C[Si](C)(C)COc1cccc(c1)Cl 7a_100000210295_100000233785 [1,1,0,0,0,0|2,0,0]=4 1398 B13R1.838 C[Si](C)(C)COc1cccc(c1)F 7a_100000210426_100000233785 [1,1,0,0,0,0|2,0,0]=4 1399 B13R1.838 C[Si](C)(C)COc1cccc(c1)I 7a_100000211634_100000233785 [1,1,0,0,0,0|2,0,0]=4 1400 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Br 62a_100000037933_100000691529 [1,1,0,0,0,0|2,0,0]=4 1401 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Br 62a_100000691529_100000037933 [1,1,0,0,0,0|2,0,0]=4 1402 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Cl 62a_100000037933_100000699651 [1,1,0,0,0,0|2,0,0]=4 1403 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Cl 62a_100000699651_100000037933 [1,1,0,0,0,0|2,0,0]=4 1404 B13R1.838 C[Si](C)(C)CSc1cccc(c1)F 62a_100000037933_100000685547 [1,1,0,0,0,0|2,0,0]=4 1405 B13R1.838 C[Si](C)(C)CSc1cccc(c1)F 62a_100000685547_100000037933 [1,1,0,0,0,0|2,0,0]=4 1406 B13R1.838 C[Si](C)(C)CSc1cccc(c1)N 62a_100000037933_100000210019 [1,1,0,0,0,0|2,0,0]=4 1407 B13R1.838 C[Si](C)(C)CSc1cccc(c1)N 62a_100000210019_100000037933 [1,1,0,0,0,0|2,0,0]=4 1408 B13R1.838 C[Si](C)(C)CSc1cccc(c1)O 62a_100000037933_100000211634 [1,1,0,0,0,0|2,0,0]=4 1409 B13R1.838 C[Si](C)(C)CSc1cccc(c1)[S] 62a_100000037933_114929384022 [1,1,0,0,0,0|2,0,0]=4 1410 B13R1.838 C[Si](C)(C)CSc1cccc(c1)[S] 62a_114929384022_100000037933 [1,1,0,0,0,0|2,0,0]=4 1411 B13R1.838 C[n+]1cccc(c1)SC[N+](C)(C)C 62a_100009996589_200000036245 [1,1,0,0,0,0|2,0,0]=4 1412 B13R1.838 C[n+]1cccc(c1)SC[N+](C)(C)C 62a_200000036245_100009996589 [1,1,0,0,0,0|2,0,0]=4 1413 B13R1.838 Cc1cc(ccn1)SC[N+](C)(C)C 62a_100000758586_200000036245 [1,1,0,0,0,0|2,0,0]=4 1414 B13R1.838 Cc1cc(ccn1)SC[N+](C)(C)C 62a_200000036245_100000758586 [1,1,0,0,0,0|2,0,0]=4 1415 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 207a_100000715429_100000211157 [1,1,0,0,0,0|2,0,0]=4 1416 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 2230a_100000715429_100000211840 [1,1,0,0,0,0|2,0,0]=4 1417 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 34a_100000185548_100000210625 [1,1,0,0,0,0|2,0,0]=4 1418 B13R1.838 Cc1cccc(c1)COC(C)(C)C 34a_100011217746_100000210625 [1,1,0,0,0,0|2,0,0]=4 1419 B13R1.838 Cc1cccc(c1)COC(C)(C)C 34a_100015890283_100000211840 [1,1,0,0,0,0|2,0,0]=4 1420 B13R1.838 Cc1cccc(c1)COC(C)(C)C 7a_100015890283_100000211840 [1,1,0,0,0,0|2,0,0]=4 1421 B13R1.838 Cc1cccc(c1)CSC(C)(C)C 62a_100000211840_100000211941 [1,1,0,0,0,0|2,0,0]=4 1422 B13R1.838 Cc1cccc(c1)CSC(C)(C)C 62a_100000211941_100000211840 [1,1,0,0,0,0|2,0,0]=4 1423 B13R1.838 Cc1cccc(c1)NCC(C)(C)C 34a_100000188690_100011219605 [1,1,0,0,0,0|2,0,0]=4 1424 B13R1.838 Cc1cccc(c1)NC[Si](C)(C)C 2230a_100000188690_100000037933 [1,1,0,0,0,0|2,0,0]=4 1425 B13R1.838 Cc1cccc(c1)OCC(C)(C)C 34a_100000210337_100011219605 [1,1,0,0,0,0|2,0,0]=4 1426 B13R1.838 Cc1cccc(c1)OC[Si](C)(C)C 7a_100000210337_100000233785 [1,1,0,0,0,0|2,0,0]=4 1427 B13R1.838 Cc1cccc(c1)SCC(C)(C)C 62a_100011215228_100011219605 [1,1,0,0,0,0|2,0,0]=4 1428 B13R1.838 Cc1cccc(c1)SCC(C)(C)C 62a_100011219605_100011215228 [1,1,0,0,0,0|2,0,0]=4 1429 B13R1.838 Cc1cccc(c1)SC[N+](C)(C)C 62a_100011215228_200000036245 [1,1,0,0,0,0|1,0,0]=3 1430 B13R1.838 Cc1cccc(c1)SC[N+](C)(C)C 62a_200000036245_100011215228 [1,1,0,0,0,0|1,0,0]=3 1431 B13R1.838 Cc1cccc(c1)SC[Si](C)(C)C 62a_100000037933_100011215228 [1,1,0,0,0,0|2,0,0]=4 1432 B13R1.838 Cc1cccc(c1)SC[Si](C)(C)C 62a_100011215228_100000037933 [1,1,0,0,0,0|2,0,0]=4 1433 B13R1.838 Cc1cccc(n1)SC[N+](C)(C)C 62a_100000742759_200000036245 [1,1,0,0,0,0|2,0,0]=4 1434 B13R1.838 Cc1cccc(n1)SC[N+](C)(C)C 62a_200000036245_100000742759 [1,1,0,0,0,0|2,0,0]=4 1435 B13R1.838 Cc1ccnc(c1)SC[N+](C)(C)C 62a_100000750283_200000036245 [1,1,0,0,0,0|2,0,0]=4 1436 B13R1.838 Cc1ccnc(c1)SC[N+](C)(C)C 62a_200000036245_100000750283 [1,1,0,0,0,0|2,0,0]=4 1437 B13R1.838 Cc1cncc(c1)SC[N+](C)(C)C 62a_100000760492_200000036245 [1,1,0,0,0,0|2,0,0]=4 1438 B13R1.838 Cc1cncc(c1)SC[N+](C)(C)C 62a_200000036245_100000760492 [1,1,0,0,0,0|2,0,0]=4 1439 B13R1.263 CCC(C)(C)N(C)c1ccccc1 269982a_100000210012_100000032637 [0,1,0,0,1,0|2,0,0]=4 1440 B13R1.276 CN(c1ccccc1Br)C(C)(C)C 269982a_100020606079_100000210625 [0,1,0,0,1,0|2,0,0]=4 1441 B13R1.276 CN(c1ccccc1Br)C(C)(C)C 34a_100020606079_100000210625 [0,1,0,0,1,0|2,0,0]=4 1442 B13R1.276 CN(c1ccccc1Cl)C(C)(C)C 269982a_100000219374_100000210625 [0,1,0,0,1,0|2,0,0]=4 1443 B13R1.276 CN(c1ccccc1Cl)C(C)(C)C 34a_100000219374_100000210625 [0,1,0,0,1,0|2,0,0]=4 1444 B13R1.276 CN(c1ccccc1F)C(C)(C)C 269982a_100000220357_100000210625 [0,1,0,0,1,0|2,0,0]=4 1445 B13R1.276 CN(c1ccccc1F)C(C)(C)C 34a_100000220357_100000210625 [0,1,0,0,1,0|2,0,0]=4 1446 B13R1.276 CN(c1ccccc1O)C(C)(C)C 269982a_100000033821_100000210625 [0,1,0,0,1,0|2,0,0]=4 1447 B13R1.276 Cc1ccccc1N(C)C(C)(C)C 269982a_100000219699_100000210625 [0,1,0,0,1,0|2,0,0]=4 1448 B13R1.276 Cc1ccccc1N(C)C(C)(C)C 34a_100000219699_100000210625 [0,1,0,0,1,0|2,0,0]=4 1449 B13R1.525 CN(c1ccc(cc1)Br)C(C)(C)C 269982a_100000219623_100000210625 [0,1,0,0,1,0|2,0,0]=4 1450 B13R1.525 CN(c1ccc(cc1)Br)C(C)(C)C 34a_100000219623_100000210625 [0,1,0,0,1,0|2,0,0]=4 1451 B13R1.525 CN(c1ccc(cc1)Cl)C(C)(C)C 269982a_100020629279_100000210625 [0,1,0,0,1,0|2,0,0]=4 1452 B13R1.525 CN(c1ccc(cc1)Cl)C(C)(C)C 34a_100020629279_100000210625 [0,1,0,0,1,0|2,0,0]=4 1453 B13R1.525 CN(c1ccc(cc1)F)C(C)(C)C 269982a_100000219829_100000210625 [0,1,0,0,1,0|2,0,0]=4 1454 B13R1.525 CN(c1ccc(cc1)F)C(C)(C)C 34a_100000219829_100000210625 [0,1,0,0,1,0|2,0,0]=4 1455 B13R1.525 CN(c1ccc(cc1)I)C(C)(C)C 269982a_100000743151_100000210625 [0,1,0,0,1,0|2,0,0]=4 1456 B13R1.525 CN(c1ccc(cc1)I)C(C)(C)C 34a_100000743151_100000210625 [0,1,0,0,1,0|2,0,0]=4 1457 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 269982a_100000182112_100000210625 [0,1,0,0,1,0|2,0,0]=4 1458 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 34a_100000182112_100000210625 [0,1,0,0,1,0|2,0,0]=4 1459 B13R1.525 Cc1ccc(cc1)N(C)C(C)(C)C 269982a_100000219977_100000210625 [0,1,0,0,1,0|2,0,0]=4 1460 B13R1.525 Cc1ccc(cc1)N(C)C(C)(C)C 34a_100000219977_100000210625 [0,1,0,0,1,0|2,0,0]=4 1461 B13R1.719 CC(C)(C)C(N[13CH3])c1ccccc1 2230a_100000738585_200025704644 [0,1,0,0,1,0|1,0,0]=3 1462 B13R1.719 CCN(c1ccccc1)C(C)(C)C 269982a_100000210013_100000210625 [0,1,0,0,1,0|2,0,0]=4 1463 B13R1.719 CCN(c1ccccc1)C(C)(C)C 34a_100000210013_100000210625 [0,1,0,0,1,0|2,0,0]=4 1464 B13R1.719 CNC(c1ccccc1)C(C)(C)C 2230a_100000738585_200000210301 [0,1,0,0,1,0|1,0,0]=3 1465 B13R1.719 CNC(c1ccccc1)C(C)(C)O 269862a_106832991636_100011217161 [0,1,0,0,1,0|2,0,0]=4 1466 B13R1.3492 CN(c1cccc(c1)Br)C(C)(C)C 269982a_100000219648_100000210625 [0,1,0,0,1,0|2,0,0]=4 1467 B13R1.3492 CN(c1cccc(c1)Br)C(C)(C)C 34a_100000219648_100000210625 [0,1,0,0,1,0|2,0,0]=4 1468 B13R1.3492 CN(c1cccc(c1)Cl)C(C)(C)C 269982a_100000220044_100000210625 [0,1,0,0,1,0|2,0,0]=4 1469 B13R1.3492 CN(c1cccc(c1)Cl)C(C)(C)C 34a_100000220044_100000210625 [0,1,0,0,1,0|2,0,0]=4 1470 B13R1.3492 CN(c1cccc(c1)F)C(C)(C)C 269982a_100020633736_100000210625 [0,1,0,0,1,0|2,0,0]=4 1471 B13R1.3492 CN(c1cccc(c1)F)C(C)(C)C 34a_100020633736_100000210625 [0,1,0,0,1,0|2,0,0]=4 1472 B13R1.3492 CN(c1cccc(c1)I)C(C)(C)C 269982a_100000221217_100000210625 [0,1,0,0,1,0|2,0,0]=4 1473 B13R1.3492 CN(c1cccc(c1)I)C(C)(C)C 34a_100000221217_100000210625 [0,1,0,0,1,0|2,0,0]=4 1474 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 269982a_100000756613_100000210625 [0,1,0,0,1,0|2,0,0]=4 1475 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 34a_100000756613_100000210625 [0,1,0,0,1,0|2,0,0]=4 1476 B13R1.3492 Cc1cccc(c1)N(C)C(C)(C)C 269982a_100000219674_100000210625 [0,1,0,0,1,0|2,0,0]=4 1477 B13R1.3492 Cc1cccc(c1)N(C)C(C)(C)C 34a_100000219674_100000210625 [0,1,0,0,1,0|2,0,0]=4 1478 B15R1.339 CC(Cc1ccccc1)OC(C)(C)CCl 7a_100000764493_200011218536 [0,1,0,0,0,1|2,0,0]=4 1479 B15R1.339 CCC(C)(C)OC(C)Cc1ccccc1 7a_100000210230_200011218536 [0,1,0,0,0,1|2,0,0]=4 1480 B15R1.339 CCC(C)(C)OC(C)Cc1ccccc1 7a_100000748627_100000210677 [0,1,0,0,0,1|2,0,0]=4 1481 B15R1.339 CCC(C)(C)SC(C)Cc1ccccc1 62a_100000032637_200011218536 [0,1,0,0,0,1|2,0,0]=4 1482 B15R1.339 CCC(C)(C)SC(C)Cc1ccccc1 62a_200011218536_100000032637 [0,1,0,0,0,1|2,0,0]=4 1483 B15R1.339 CN(Cc1ccccc1)CC(C)(C)CO 2230a_100000732702_100015291786 [0,1,0,0,0,1|2,0,0]=4 1484 B15R1.339 CN(Cc1ccccc1)CC(C)(C)CO 269982a_100000732702_100000211182 [0,1,0,0,0,1|2,0,0]=4 1485 B15R1.339 CN(Cc1ccccc1)CC(C)(C)CO 270004a_100000732702_100015611070 [0,1,0,0,0,1|2,0,0]=4 1486 B15R1.339 COC(C)(C)CN(C)Cc1ccccc1 269982a_100000186898_100000701081 [0,1,0,0,0,1|2,0,0]=4 1487 B15R1.339 CSC(C)(C)CN(C)Cc1ccccc1 270004a_100000186898_100009845794 [0,1,0,0,0,1|2,0,0]=4 1488 B15R1.649 CC(C)(C)CN(CF)Cc1ccccc1 269982a_100000751856_100015361967 [0,1,0,0,0,1|2,0,0]=4 1489 B15R1.649 CC(C)(C)OC(CN)Cc1ccccc1 34a_100000752270_100000210625 [0,1,0,0,0,1|2,0,0]=4 1490 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 2230a_100000732750_100015291786 [0,1,0,0,0,1|2,0,0]=4 1491 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 2230a_100000751856_100000210202 [0,1,0,0,0,1|2,0,0]=4 1492 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 269982a_100000732750_100000211182 [0,1,0,0,0,1|2,0,0]=4 1493 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 269982a_100000751856_100000204670 [0,1,0,0,0,1|2,0,0]=4 1494 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 270004a_100000186914_100011204126 [0,1,0,0,0,1|2,0,0]=4 1495 B15R1.649 CCN(Cc1ccccc1)CC(C)(C)C 270004a_100000732750_100015611070 [0,1,0,0,0,1|2,0,0]=4 1496 B15R1.649 CCN(Cc1ccccc1)C[N+](C)(C)C 269982a_100000186914_200000036245 [0,1,0,0,0,1|1,0,0]=3 1497 B15R1.649 CCN(Cc1ccccc1)C[Si](C)(C)C 2230a_100000186914_100000037933 [0,1,0,0,0,1|2,0,0]=4 1498 B15R1.649 CCN(Cc1ccccc1)C[Si](C)(C)C 269982a_100000032861_100000204670 [0,1,0,0,0,1|2,0,0]=4 1499 B15R1.649 CCN(Cc1ccccn1)C[N+](C)(C)C 269982a_100000201164_200000036245 [0,1,0,0,0,1|2,0,0]=4 1500 B15R1.649 CCN(Cc1cccnc1)C[N+](C)(C)C 269982a_100000186920_200000036245 [0,1,0,0,0,1|2,0,0]=4 1501 B15R1.649 CCN(Cc1ccncc1)C[N+](C)(C)C 269982a_100000186919_200000036245 [0,1,0,0,0,1|2,0,0]=4 1502 B15R1.649 C[Si](C)(C)CN(CF)Cc1ccccc1 269982a_100000032861_100015361967 [0,1,0,0,0,1|2,0,0]=4 1503 B15R1.913 CC(Cc1ccc(cc1)F)OC(C)(C)C 34a_100011351027_100000210625 [0,1,0,0,0,1|2,0,0]=4 1504 B15R1.913 CC(Cc1ccc(cc1)O)NC(C)(C)C 34a_100102634573_100000210625 [0,1,0,0,0,1|2,0,0]=4 1505 B15R1.913 CN(Cc1ccc(cc1)Br)CC(C)(C)C 2230a_100000742839_100011217064 [0,1,0,0,0,1|2,0,0]=4 1506 B15R1.913 CN(Cc1ccc(cc1)Br)CC(C)(C)C 269982a_100000742839_100011217064 [0,1,0,0,0,1|2,0,0]=4 1507 B15R1.913 CN(Cc1ccc(cc1)Br)CC(C)(C)C 26a_100000742839_100000185759 [0,1,0,0,0,1|2,0,0]=4 1508 B15R1.913 CN(Cc1ccc(cc1)Br)CC(C)(C)C 270004a_100000180866_100011204126 [0,1,0,0,0,1|2,0,0]=4 1509 B15R1.913 CN(Cc1ccc(cc1)Br)CC(C)(C)C 270004a_100000742839_100000186029 [0,1,0,0,0,1|2,0,0]=4 1510 B15R1.913 CN(Cc1ccc(cc1)Br)C[N+](C)(C)C 269982a_100000180866_200000036245 [0,1,0,0,0,1|1,0,0]=3 1511 B15R1.913 CN(Cc1ccc(cc1)Br)C[Si](C)(C)C 2230a_100000180866_100000037933 [0,1,0,0,0,1|2,0,0]=4 1512 B15R1.913 CN(Cc1ccc(cc1)Br)C[Si](C)(C)C 269982a_200020589227_100011217064 [0,1,0,0,0,1|2,0,0]=4 1513 B15R1.913 CN(Cc1ccc(cc1)Br)C[Si](C)(C)C 26a_200020589227_100000185759 [0,1,0,0,0,1|2,0,0]=4 1514 B15R1.913 CN(Cc1ccc(cc1)Cl)CC(C)(C)C 2230a_100000742839_100000694040 [0,1,0,0,0,1|2,0,0]=4 1515 B15R1.913 CN(Cc1ccc(cc1)Cl)CC(C)(C)C 269982a_100000742839_100000187161 [0,1,0,0,0,1|2,0,0]=4 1516 B15R1.913 CN(Cc1ccc(cc1)Cl)CC(C)(C)C 270004a_100000184517_100011204126 [0,1,0,0,0,1|2,0,0]=4 1517 B15R1.913 CN(Cc1ccc(cc1)Cl)CC(C)(C)C 270004a_100000742839_100000189385 [0,1,0,0,0,1|2,0,0]=4 1518 B15R1.913 CN(Cc1ccc(cc1)Cl)CC(C)(C)C 34a_100000184517_100011219605 [0,1,0,0,0,1|2,0,0]=4 1519 B15R1.913 CN(Cc1ccc(cc1)Cl)C[N+](C)(C)C 269982a_100000184517_200000036245 [0,1,0,0,0,1|1,0,0]=3 1520 B15R1.913 CN(Cc1ccc(cc1)Cl)C[Si](C)(C)C 2230a_100000184517_100000037933 [0,1,0,0,0,1|2,0,0]=4 1521 B15R1.913 CN(Cc1ccc(cc1)Cl)C[Si](C)(C)C 269982a_200020589227_100000187161 [0,1,0,0,0,1|2,0,0]=4 1522 B15R1.913 CN(Cc1ccc(cc1)F)CC(C)(C)C 2230a_100000742839_100000198546 [0,1,0,0,0,1|2,0,0]=4 1523 B15R1.913 CN(Cc1ccc(cc1)F)CC(C)(C)C 269982a_100000742839_100000198546 [0,1,0,0,0,1|2,0,0]=4 1524 B15R1.913 CN(Cc1ccc(cc1)F)CC(C)(C)C 270004a_100000184576_100011204126 [0,1,0,0,0,1|2,0,0]=4 1525 B15R1.913 CN(Cc1ccc(cc1)F)CC(C)(C)C 270004a_100000742839_100000210084 [0,1,0,0,0,1|2,0,0]=4 1526 B15R1.913 CN(Cc1ccc(cc1)F)CC(C)(C)C 34a_100000184576_100011219605 [0,1,0,0,0,1|2,0,0]=4 1527 B15R1.913 CN(Cc1ccc(cc1)F)C[N+](C)(C)C 269982a_100000184576_200000036245 [0,1,0,0,0,1|1,0,0]=3 1528 B15R1.913 CN(Cc1ccc(cc1)F)C[Si](C)(C)C 2230a_100000184576_100000037933 [0,1,0,0,0,1|2,0,0]=4 1529 B15R1.913 CN(Cc1ccc(cc1)F)C[Si](C)(C)C 269982a_200020589227_100000198546 [0,1,0,0,0,1|2,0,0]=4 1530 B15R1.913 CN(Cc1ccc(cc1)I)CC(C)(C)C 2230a_100000742839_100000189116 [0,1,0,0,0,1|2,0,0]=4 1531 B15R1.913 CN(Cc1ccc(cc1)I)CC(C)(C)C 269982a_100000742839_100000189116 [0,1,0,0,0,1|2,0,0]=4 1532 B15R1.913 CN(Cc1ccc(cc1)I)C[Si](C)(C)C 269982a_200020589227_100000189116 [0,1,0,0,0,1|2,0,0]=4 1533 B15R1.913 CN(Cc1ccc(cc1)O)CC(C)(C)C 270004a_100000207500_100011204126 [0,1,0,0,0,1|2,0,0]=4 1534 B15R1.913 CN(Cc1ccc(cc1)O)C[N+](C)(C)C 269982a_100000207500_200000036245 [0,1,0,0,0,1|1,0,0]=3 1535 B15R1.913 CN(Cc1ccc(cc1)O)C[Si](C)(C)C 2230a_100000207500_100000037933 [0,1,0,0,0,1|2,0,0]=4 1536 B15R1.913 CN(Cc1ccc(nc1)Cl)C[N+](C)(C)C 269982a_100000026953_200000036245 [0,1,0,0,0,1|2,0,0]=4 1537 B15R1.913 C[C@@H](CC(C)(C)C)Nc1ccc(cn1)Br 27a_106358413534_100000686858 [0,1,0,0,0,1|2,0,0]=4 1538 B15R1.913 C[N+](C)(C)CC(=O)Cc1ccc(cc1)Br 1458a_100000033712_100000189115 [0,1,0,0,0,1|1,0,1]=4 1539 B15R1.913 C[N+](C)(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000033712_100000694040 [0,1,0,0,0,1|1,0,1]=4 1540 B15R1.913 C[N+](C)(C)CC(=O)Cc1ccc(cc1)F 1458a_100000033712_100000198546 [0,1,0,0,0,1|1,0,1]=4 1541 B15R1.913 C[N+](C)(C)CC(=O)Cc1ccc(cc1)I 1458a_100000033712_100000189116 [0,1,0,0,0,1|1,0,1]=4 1542 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000033712 [0,1,0,0,0,1|1,0,1]=4 1543 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000033712 [0,1,0,0,0,1|1,0,1]=4 1544 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000033712 [0,1,0,0,0,1|1,0,1]=4 1545 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000033712 [0,1,0,0,0,1|1,0,1]=4 1546 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000033712 [0,1,0,0,0,1|1,0,1]=4 1547 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000033712 [0,1,0,0,0,1|1,0,1]=4 1548 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000033712 [0,1,0,0,0,1|1,0,1]=4 1549 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000033712 [0,1,0,0,0,1|1,0,1]=4 1550 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)F 11a_100000185862_100000033712 [0,1,0,0,0,1|1,0,1]=4 1551 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000033712 [0,1,0,0,0,1|1,0,1]=4 1552 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000033712 [0,1,0,0,0,1|1,0,1]=4 1553 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)F 527a_100000185862_100000033712 [0,1,0,0,0,1|1,0,1]=4 1554 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)I 11a_100000185761_100000033712 [0,1,0,0,0,1|1,0,1]=4 1555 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000033712 [0,1,0,0,0,1|1,0,1]=4 1556 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000033712 [0,1,0,0,0,1|1,0,1]=4 1557 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)I 527a_100000185761_100000033712 [0,1,0,0,0,1|1,0,1]=4 1558 B15R1.913 C[N+](C)(C)CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000033712 [0,1,0,0,0,1|1,0,1]=4 1559 B15R1.913 Cc1ccc(cc1)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000210814 [0,1,0,0,0,1|1,0,1]=4 1560 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 2230a_100000742839_100000210814 [0,1,0,0,0,1|2,0,0]=4 1561 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 269982a_100000742839_100000210814 [0,1,0,0,0,1|2,0,0]=4 1562 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 26a_100000742839_200020625495 [0,1,0,0,0,1|2,0,0]=4 1563 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 270004a_100000742839_100000211033 [0,1,0,0,0,1|2,0,0]=4 1564 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 270004a_100000744650_100011204126 [0,1,0,0,0,1|2,0,0]=4 1565 B15R1.913 Cc1ccc(cc1)CN(C)CC(C)(C)C 34a_100000744650_100011219605 [0,1,0,0,0,1|2,0,0]=4 1566 B15R1.913 Cc1ccc(cc1)CN(C)C[N+](C)(C)C 269982a_100000744650_200000036245 [0,1,0,0,0,1|1,0,0]=3 1567 B15R1.913 Cc1ccc(cc1)CN(C)C[Si](C)(C)C 2230a_100000744650_100000037933 [0,1,0,0,0,1|2,0,0]=4 1568 B15R1.913 Cc1ccc(cc1)CN(C)C[Si](C)(C)C 269982a_200020589227_100000210814 [0,1,0,0,0,1|2,0,0]=4 1569 B15R1.913 Cc1ccc(cc1)CN(C)C[Si](C)(C)C 26a_200020589227_200020625495 [0,1,0,0,0,1|2,0,0]=4 1570 B15R1.913 Cc1ccc(cc1)NC(=O)C[N+](C)(C)C 11a_100000124888_100000033712 [0,1,0,0,0,1|1,0,1]=4 1571 B15R1.913 Cc1ccc(cc1)NC(=O)C[N+](C)(C)C 1626a_100000124888_100000033712 [0,1,0,0,0,1|1,0,1]=4 1572 B15R1.913 Cc1ccc(cc1)NC(=O)C[N+](C)(C)C 22a_100000124888_100000033712 [0,1,0,0,0,1|1,0,1]=4 1573 B15R1.913 Cc1ccc(cc1)NC(=O)C[N+](C)(C)C 527a_100000124888_100000033712 [0,1,0,0,0,1|1,0,1]=4 1574 B15R1.913 Cc1ccc(cn1)CN(C)C[N+](C)(C)C 269982a_106623407658_200000036245 [0,1,0,0,0,1|2,0,0]=4 1575 B15R1.913 Cc1ccc(nc1)CN(C)C[N+](C)(C)C 269982a_200000717808_200000036245 [0,1,0,0,0,1|2,0,0]=4 1576 B15R1.3977 CC(C(=O)C[N+](C)(C)C)c1ccccc1 1458a_100000033712_100000230085 [0,1,0,0,0,1|1,0,1]=4 1577 B15R1.3977 CC(NC(C)(C)C)C(=O)c1ccccc1 2230a_100000715429_100000239700 [0,1,0,0,0,1|2,0,0]=4 1578 B15R1.3977 CC(OC(C)(C)C)C(=O)c1ccccc1 7a_100015890283_100000239700 [0,1,0,0,0,1|2,0,0]=4 1579 B15R1.3977 CC(SC(C)(C)C)C(=O)c1ccccc1 62a_100000211941_100000239700 [0,1,0,0,0,1|2,0,0]=4 1580 B15R1.3977 CC(SC(C)(C)C)C(=O)c1ccccc1 62a_100000239700_100000211941 [0,1,0,0,0,1|2,0,0]=4 1581 B15R1.3977 CC(c1ccccc1)N(C)CC(C)(C)C 2230a_100000742839_100000230085 [0,1,0,0,0,1|2,0,0]=4 1582 B15R1.3977 CC(c1ccccc1)N(C)CC(C)(C)C 269982a_100000742839_100000230085 [0,1,0,0,0,1|2,0,0]=4 1583 B15R1.3977 CC(c1ccccc1)N(C)CC(C)(C)C 270004a_100000195388_100011204126 [0,1,0,0,0,1|2,0,0]=4 1584 B15R1.3977 CC(c1ccccc1)N(C)C[N+](C)(C)C 269982a_100000195388_200000036245 [0,1,0,0,0,1|1,0,0]=3 1585 B15R1.3977 CC(c1ccccc1)N(C)C[Si](C)(C)C 2230a_100000195388_100000037933 [0,1,0,0,0,1|2,0,0]=4 1586 B15R1.3977 CC(c1ccccc1)N(C)C[Si](C)(C)C 269982a_200020589227_100000230085 [0,1,0,0,0,1|2,0,0]=4 1587 B15R1.3977 CC(c1ccccn1)N(C)C[N+](C)(C)C 269982a_100000231138_200000036245 [0,1,0,0,0,1|2,0,0]=4 1588 B15R1.3977 CC(c1cccnc1)N(C)C[N+](C)(C)C 269982a_100000232774_200000036245 [0,1,0,0,0,1|2,0,0]=4 1589 B15R1.3977 CC(c1ccncc1)N(C)C[N+](C)(C)C 269982a_100000231139_200000036245 [0,1,0,0,0,1|2,0,0]=4 1590 B15R1.3977 CN(C(=O)C[N+](C)(C)C)c1ccccc1 11a_100000210012_100000033712 [0,1,0,0,0,1|1,0,1]=4 1591 B15R1.3977 CN(C(=O)C[N+](C)(C)C)c1ccccc1 1626a_100000210012_100000033712 [0,1,0,0,0,1|1,0,1]=4 1592 B15R1.3977 CN(C(=O)C[N+](C)(C)C)c1ccccc1 22a_100000210012_100000033712 [0,1,0,0,0,1|1,0,1]=4 1593 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 11a_100000742839_100000185807 [0,1,0,0,0,1|2,0,0]=4 1594 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 1626a_100000742839_100000185807 [0,1,0,0,0,1|2,0,0]=4 1595 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 240690a_100000742839_100000185807 [0,1,0,0,0,1|2,0,0]=4 1596 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 527a_100000742839_100000185807 [0,1,0,0,0,1|2,0,0]=4 1597 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 11a_200020589227_100000185807 [0,1,0,0,0,1|2,0,0]=4 1598 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 1626a_200020589227_100000185807 [0,1,0,0,0,1|2,0,0]=4 1599 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 240690a_200020589227_100000185807 [0,1,0,0,0,1|2,0,0]=4 1600 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 527a_200020589227_100000185807 [0,1,0,0,0,1|2,0,0]=4 1601 B15R1.3977 C[C@H](OC(C)(C)C)[C@@H](N)c1ccccc1 34a_100134616770_100000210625 [0,1,0,0,0,1|2,0,0]=4 1602 B15R1.5802 CN(Cc1ccccc1Br)CC(C)(C)C 2230a_100000742839_100000184730 [0,1,0,0,0,1|2,0,0]=4 1603 B15R1.5802 CN(Cc1ccccc1Br)CC(C)(C)C 269982a_100000742839_100000184730 [0,1,0,0,0,1|2,0,0]=4 1604 B15R1.5802 CN(Cc1ccccc1Br)CC(C)(C)C 26a_100000742839_100000181306 [0,1,0,0,0,1|2,0,0]=4 1605 B15R1.5802 CN(Cc1ccccc1Br)CC(C)(C)C 270004a_100000184654_100011204126 [0,1,0,0,0,1|2,0,0]=4 1606 B15R1.5802 CN(Cc1ccccc1Br)CC(C)(C)C 270004a_100000742839_100000211189 [0,1,0,0,0,1|2,0,0]=4 1607 B15R1.5802 CN(Cc1ccccc1Br)C[N+](C)(C)C 269982a_100000184654_200000036245 [0,1,0,0,0,1|1,0,0]=3 1608 B15R1.5802 CN(Cc1ccccc1Br)C[Si](C)(C)C 2230a_100000184654_100000037933 [0,1,0,0,0,1|2,0,0]=4 1609 B15R1.5802 CN(Cc1ccccc1Br)C[Si](C)(C)C 269982a_200020589227_100000184730 [0,1,0,0,0,1|2,0,0]=4 1610 B15R1.5802 CN(Cc1ccccc1Br)C[Si](C)(C)C 26a_200020589227_100000181306 [0,1,0,0,0,1|2,0,0]=4 1611 B15R1.5802 CN(Cc1ccccc1Cl)CC(C)(C)C 2230a_100000742839_100000187162 [0,1,0,0,0,1|2,0,0]=4 1612 B15R1.5802 CN(Cc1ccccc1Cl)CC(C)(C)C 269982a_100000742839_100000187162 [0,1,0,0,0,1|2,0,0]=4 1613 B15R1.5802 CN(Cc1ccccc1Cl)CC(C)(C)C 26a_100000742839_100000210172 [0,1,0,0,0,1|2,0,0]=4 1614 B15R1.5802 CN(Cc1ccccc1Cl)CC(C)(C)C 270004a_100000184507_100011204126 [0,1,0,0,0,1|2,0,0]=4 1615 B15R1.5802 CN(Cc1ccccc1Cl)CC(C)(C)C 270004a_100000742839_100000210073 [0,1,0,0,0,1|2,0,0]=4 1616 B15R1.5802 CN(Cc1ccccc1Cl)C[N+](C)(C)C 269982a_100000184507_200000036245 [0,1,0,0,0,1|1,0,0]=3 1617 B15R1.5802 CN(Cc1ccccc1Cl)C[Si](C)(C)C 2230a_100000184507_100000037933 [0,1,0,0,0,1|2,0,0]=4 1618 B15R1.5802 CN(Cc1ccccc1Cl)C[Si](C)(C)C 269982a_200020589227_100000187162 [0,1,0,0,0,1|2,0,0]=4 1619 B15R1.5802 CN(Cc1ccccc1Cl)C[Si](C)(C)C 26a_200020589227_100000210172 [0,1,0,0,0,1|2,0,0]=4 1620 B15R1.5802 CN(Cc1ccccc1F)CC(C)(C)C 2230a_100000742839_100000211605 [0,1,0,0,0,1|2,0,0]=4 1621 B15R1.5802 CN(Cc1ccccc1F)CC(C)(C)C 269982a_100000742839_100000211605 [0,1,0,0,0,1|2,0,0]=4 1622 B15R1.5802 CN(Cc1ccccc1F)CC(C)(C)C 270004a_100000742528_100011204126 [0,1,0,0,0,1|2,0,0]=4 1623 B15R1.5802 CN(Cc1ccccc1F)CC(C)(C)C 270004a_100000742839_100000210811 [0,1,0,0,0,1|2,0,0]=4 1624 B15R1.5802 CN(Cc1ccccc1F)CC(C)(C)C 34a_100000742528_100011219605 [0,1,0,0,0,1|2,0,0]=4 1625 B15R1.5802 CN(Cc1ccccc1F)C[N+](C)(C)C 269982a_100000742528_200000036245 [0,1,0,0,0,1|1,0,0]=3 1626 B15R1.5802 CN(Cc1ccccc1F)C[Si](C)(C)C 2230a_100000742528_100000037933 [0,1,0,0,0,1|2,0,0]=4 1627 B15R1.5802 CN(Cc1ccccc1F)C[Si](C)(C)C 269982a_200020589227_100000211605 [0,1,0,0,0,1|2,0,0]=4 1628 B15R1.5802 CN(Cc1ccccc1I)CC(C)(C)C 2230a_100000742839_100011215278 [0,1,0,0,0,1|2,0,0]=4 1629 B15R1.5802 CN(Cc1ccccc1I)CC(C)(C)C 269982a_100000742839_100011215278 [0,1,0,0,0,1|2,0,0]=4 1630 B15R1.5802 CN(Cc1ccccc1I)CC(C)(C)C 270004a_100000742839_100000010305 [0,1,0,0,0,1|2,0,0]=4 1631 B15R1.5802 CN(Cc1ccccc1I)C[Si](C)(C)C 269982a_200020589227_100011215278 [0,1,0,0,0,1|2,0,0]=4 1632 B15R1.5802 CN(Cc1ccccc1O)CC(C)(C)C 270004a_100015189988_100011204126 [0,1,0,0,0,1|2,0,0]=4 1633 B15R1.5802 CN(Cc1ccccc1O)C[N+](C)(C)C 269982a_100015189988_200000036245 [0,1,0,0,0,1|1,0,0]=3 1634 B15R1.5802 CN(Cc1ccccc1O)C[Si](C)(C)C 2230a_100015189988_100000037933 [0,1,0,0,0,1|2,0,0]=4 1635 B15R1.5802 CN(Cc1cccnc1Cl)C[N+](C)(C)C 269982a_103496529121_200000036245 [0,1,0,0,0,1|2,0,0]=4 1636 B15R1.5802 C[C@@H](CC(C)(C)C)Nc1ccncc1Br 27a_106358413534_100000726257 [0,1,0,0,0,1|2,0,0]=4 1637 B15R1.5802 C[C@@H](CC(C)(C)C)Nc1ccncc1F 27a_106358413534_100000035921 [0,1,0,0,0,1|2,0,0]=4 1638 B15R1.5802 C[C@@H](CC(C)(C)C)Nc1ncccc1Br 27a_106358413534_100000696092 [0,1,0,0,0,1|2,0,0]=4 1639 B15R1.5802 C[N+](C)(C)CC(=O)Cc1ccccc1Br 1458a_100000033712_100000184730 [0,1,0,0,0,1|1,0,1]=4 1640 B15R1.5802 C[N+](C)(C)CC(=O)Cc1ccccc1Cl 1458a_100000033712_100000187162 [0,1,0,0,0,1|1,0,1]=4 1641 B15R1.5802 C[N+](C)(C)CC(=O)Cc1ccccc1F 1458a_100000033712_100000187165 [0,1,0,0,0,1|1,0,1]=4 1642 B15R1.5802 C[N+](C)(C)CC(=O)Cc1ccccc1I 1458a_100000033712_100011216222 [0,1,0,0,0,1|1,0,1]=4 1643 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Br 11a_100000210017_100000033712 [0,1,0,0,0,1|1,0,1]=4 1644 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Br 1626a_100000210017_100000033712 [0,1,0,0,0,1|1,0,1]=4 1645 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Cl 11a_100000185783_100000033712 [0,1,0,0,0,1|1,0,1]=4 1646 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000033712 [0,1,0,0,0,1|1,0,1]=4 1647 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Cl 22a_100000185783_100000033712 [0,1,0,0,0,1|1,0,1]=4 1648 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1Cl 527a_100000185783_100000033712 [0,1,0,0,0,1|1,0,1]=4 1649 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1F 11a_100000210422_100000033712 [0,1,0,0,0,1|1,0,1]=4 1650 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1F 1626a_100000210422_100000033712 [0,1,0,0,0,1|1,0,1]=4 1651 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1F 22a_100000210422_100000033712 [0,1,0,0,0,1|1,0,1]=4 1652 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1F 527a_100000210422_100000033712 [0,1,0,0,0,1|1,0,1]=4 1653 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1I 11a_100000210053_100000033712 [0,1,0,0,0,1|1,0,1]=4 1654 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1I 1626a_100000210053_100000033712 [0,1,0,0,0,1|1,0,1]=4 1655 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000033712 [0,1,0,0,0,1|1,0,1]=4 1656 B15R1.5802 C[N+](C)(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000033712 [0,1,0,0,0,1|1,0,1]=4 1657 B15R1.5802 Cc1ccccc1CC(=O)C[N+](C)(C)C 1458a_100000033712_100000211839 [0,1,0,0,0,1|1,0,1]=4 1658 B15R1.5802 Cc1ccccc1CN(C)CC(C)(C)C 2230a_100000742839_100000211839 [0,1,0,0,0,1|2,0,0]=4 1659 B15R1.5802 Cc1ccccc1CN(C)CC(C)(C)C 269982a_100000742839_100000211839 [0,1,0,0,0,1|2,0,0]=4 1660 B15R1.5802 Cc1ccccc1CN(C)CC(C)(C)C 270004a_100000184421_100011204126 [0,1,0,0,0,1|2,0,0]=4 1661 B15R1.5802 Cc1ccccc1CN(C)CC(C)(C)C 270004a_100000742839_100000211143 [0,1,0,0,0,1|2,0,0]=4 1662 B15R1.5802 Cc1ccccc1CN(C)C[N+](C)(C)C 269982a_100000184421_200000036245 [0,1,0,0,0,1|1,0,0]=3 1663 B15R1.5802 Cc1ccccc1CN(C)C[Si](C)(C)C 2230a_100000184421_100000037933 [0,1,0,0,0,1|2,0,0]=4 1664 B15R1.5802 Cc1ccccc1CN(C)C[Si](C)(C)C 269982a_200020589227_100000211839 [0,1,0,0,0,1|2,0,0]=4 1665 B15R1.5802 Cc1ccccc1NC(=O)C[N+](C)(C)C 11a_100015192222_100000033712 [0,1,0,0,0,1|1,0,1]=4 1666 B15R1.5802 Cc1ccccc1NC(=O)C[N+](C)(C)C 1626a_100015192222_100000033712 [0,1,0,0,0,1|1,0,1]=4 1667 B15R1.5802 Cc1ccccc1NC(=O)C[N+](C)(C)C 22a_100015192222_100000033712 [0,1,0,0,0,1|1,0,1]=4 1668 B15R1.5802 Cc1ccccc1NC(=O)C[N+](C)(C)C 527a_100015192222_100000033712 [0,1,0,0,0,1|1,0,1]=4 1669 B15R1.5802 Cc1cnccc1CN(C)C[N+](C)(C)C 269982a_100015187836_200000036245 [0,1,0,0,0,1|2,0,0]=4 1670 B15R1.5802 Cc1cnccc1N[C@@H](C)CC(C)(C)C 27a_106358413534_100000765111 [0,1,0,0,0,1|2,0,0]=4 1671 B15R1.5802 Cc1ncccc1CN(C)C[N+](C)(C)C 269982a_200011875998_200000036245 [0,1,0,0,0,1|2,0,0]=4 1672 B15R1.8303 CN(Cc1cc(ccn1)Cl)C[N+](C)(C)C 269982a_100102954512_200000036245 [0,1,0,0,0,1|2,0,0]=4 1673 B15R1.8303 CN(Cc1cccc(c1)Br)CC(C)(C)C 2230a_100000742839_100000698116 [0,1,0,0,0,1|2,0,0]=4 1674 B15R1.8303 CN(Cc1cccc(c1)Br)CC(C)(C)C 269982a_100000742839_100000211773 [0,1,0,0,0,1|2,0,0]=4 1675 B15R1.8303 CN(Cc1cccc(c1)Br)CC(C)(C)C 26a_100000742839_100000210342 [0,1,0,0,0,1|2,0,0]=4 1676 B15R1.8303 CN(Cc1cccc(c1)Br)CC(C)(C)C 270004a_100000187585_100011204126 [0,1,0,0,0,1|2,0,0]=4 1677 B15R1.8303 CN(Cc1cccc(c1)Br)CC(C)(C)C 270004a_100000742839_100000210085 [0,1,0,0,0,1|2,0,0]=4 1678 B15R1.8303 CN(Cc1cccc(c1)Br)C[N+](C)(C)C 269982a_100000187585_200000036245 [0,1,0,0,0,1|1,0,0]=3 1679 B15R1.8303 CN(Cc1cccc(c1)Br)C[Si](C)(C)C 2230a_100000187585_100000037933 [0,1,0,0,0,1|2,0,0]=4 1680 B15R1.8303 CN(Cc1cccc(c1)Br)C[Si](C)(C)C 269982a_200020589227_100000211773 [0,1,0,0,0,1|2,0,0]=4 1681 B15R1.8303 CN(Cc1cccc(c1)Br)C[Si](C)(C)C 26a_200020589227_100000210342 [0,1,0,0,0,1|2,0,0]=4 1682 B15R1.8303 CN(Cc1cccc(c1)Cl)CC(C)(C)C 2230a_100000742839_100000181238 [0,1,0,0,0,1|2,0,0]=4 1683 B15R1.8303 CN(Cc1cccc(c1)Cl)CC(C)(C)C 269982a_100000742839_100000181238 [0,1,0,0,0,1|2,0,0]=4 1684 B15R1.8303 CN(Cc1cccc(c1)Cl)CC(C)(C)C 270004a_100000742839_100000210801 [0,1,0,0,0,1|2,0,0]=4 1685 B15R1.8303 CN(Cc1cccc(c1)Cl)CC(C)(C)C 270004a_100020629429_100011204126 [0,1,0,0,0,1|2,0,0]=4 1686 B15R1.8303 CN(Cc1cccc(c1)Cl)C[N+](C)(C)C 269982a_100020629429_200000036245 [0,1,0,0,0,1|1,0,0]=3 1687 B15R1.8303 CN(Cc1cccc(c1)Cl)C[Si](C)(C)C 2230a_100020629429_100000037933 [0,1,0,0,0,1|2,0,0]=4 1688 B15R1.8303 CN(Cc1cccc(c1)Cl)C[Si](C)(C)C 269982a_200020589227_100000181238 [0,1,0,0,0,1|2,0,0]=4 1689 B15R1.8303 CN(Cc1cccc(c1)F)CC(C)(C)C 2230a_100000742839_100000230114 [0,1,0,0,0,1|2,0,0]=4 1690 B15R1.8303 CN(Cc1cccc(c1)F)CC(C)(C)C 269982a_100000742839_100000230114 [0,1,0,0,0,1|2,0,0]=4 1691 B15R1.8303 CN(Cc1cccc(c1)F)CC(C)(C)C 270004a_100000184398_100011204126 [0,1,0,0,0,1|2,0,0]=4 1692 B15R1.8303 CN(Cc1cccc(c1)F)CC(C)(C)C 270004a_100000742839_100000210812 [0,1,0,0,0,1|2,0,0]=4 1693 B15R1.8303 CN(Cc1cccc(c1)F)CC(C)(C)C 34a_100000184398_100011219605 [0,1,0,0,0,1|2,0,0]=4 1694 B15R1.8303 CN(Cc1cccc(c1)F)C[N+](C)(C)C 269982a_100000184398_200000036245 [0,1,0,0,0,1|1,0,0]=3 1695 B15R1.8303 CN(Cc1cccc(c1)F)C[Si](C)(C)C 2230a_100000184398_100000037933 [0,1,0,0,0,1|2,0,0]=4 1696 B15R1.8303 CN(Cc1cccc(c1)F)C[Si](C)(C)C 269982a_200020589227_100000230114 [0,1,0,0,0,1|2,0,0]=4 1697 B15R1.8303 CN(Cc1cccc(c1)I)CC(C)(C)C 2230a_100000742839_100011218688 [0,1,0,0,0,1|2,0,0]=4 1698 B15R1.8303 CN(Cc1cccc(c1)I)CC(C)(C)C 269982a_100000742839_100011218688 [0,1,0,0,0,1|2,0,0]=4 1699 B15R1.8303 CN(Cc1cccc(c1)I)CC(C)(C)C 270004a_100000742839_100000014684 [0,1,0,0,0,1|2,0,0]=4 1700 B15R1.8303 CN(Cc1cccc(c1)I)C[Si](C)(C)C 269982a_200020589227_100011218688 [0,1,0,0,0,1|2,0,0]=4 1701 B15R1.8303 CN(Cc1cccc(c1)O)CC(C)(C)C 2230a_100000742839_100011660834 [0,1,0,0,0,1|2,0,0]=4 1702 B15R1.8303 CN(Cc1cccc(c1)O)CC(C)(C)C 269982a_100000742839_100000084143 [0,1,0,0,0,1|2,0,0]=4 1703 B15R1.8303 CN(Cc1cccc(c1)O)CC(C)(C)C 270004a_100000207540_100011204126 [0,1,0,0,0,1|2,0,0]=4 1704 B15R1.8303 CN(Cc1cccc(c1)O)CC(C)(C)C 270004a_100000742839_100000188321 [0,1,0,0,0,1|2,0,0]=4 1705 B15R1.8303 CN(Cc1cccc(c1)O)C[N+](C)(C)C 269982a_100000207540_200000036245 [0,1,0,0,0,1|1,0,0]=3 1706 B15R1.8303 CN(Cc1cccc(c1)O)C[Si](C)(C)C 2230a_100000207540_100000037933 [0,1,0,0,0,1|2,0,0]=4 1707 B15R1.8303 CN(Cc1cccc(c1)O)C[Si](C)(C)C 269982a_200020589227_100000084143 [0,1,0,0,0,1|2,0,0]=4 1708 B15R1.8303 CN(Cc1cccc(n1)Br)C[N+](C)(C)C 269982a_106354212997_200000036245 [0,1,0,0,0,1|2,0,0]=4 1709 B15R1.8303 CN(Cc1cncc(c1)Br)C[N+](C)(C)C 269982a_103549770560_200000036245 [0,1,0,0,0,1|2,0,0]=4 1710 B15R1.8303 C[C@@H](CC(C)(C)C)Nc1cc(ccn1)F 27a_106358413534_100000764206 [0,1,0,0,0,1|2,0,0]=4 1711 B15R1.8303 C[C@@H](CC(C)(C)C)Nc1cc[nH]c(=O)c1 27a_106358413534_100000061649 [0,1,0,0,0,1|2,0,0]=4 1712 B15R1.8303 C[C@@H](CC(C)(C)C)Nc1cccc(n1)F 27a_106358413534_100009815982 [0,1,0,0,0,1|2,0,0]=4 1713 B15R1.8303 C[C@@H](CC(C)(C)C)Nc1ccnc(c1)F 27a_106358413534_100009816116 [0,1,0,0,0,1|2,0,0]=4 1714 B15R1.8303 C[N+](C)(C)CC(=O)Cc1cccc(c1)Br 1458a_100000033712_100000211773 [0,1,0,0,0,1|1,0,1]=4 1715 B15R1.8303 C[N+](C)(C)CC(=O)Cc1cccc(c1)Cl 1458a_100000033712_100000181238 [0,1,0,0,0,1|1,0,1]=4 1716 B15R1.8303 C[N+](C)(C)CC(=O)Cc1cccc(c1)F 1458a_100000033712_100000230114 [0,1,0,0,0,1|1,0,1]=4 1717 B15R1.8303 C[N+](C)(C)CC(=O)Cc1cccc(c1)I 1458a_100000033712_100011218688 [0,1,0,0,0,1|1,0,1]=4 1718 B15R1.8303 C[N+](C)(C)CC(=O)Cc1cccc(c1)O 1458a_100000033712_100011660834 [0,1,0,0,0,1|1,0,1]=4 1719 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000033712 [0,1,0,0,0,1|1,0,1]=4 1720 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000033712 [0,1,0,0,0,1|1,0,1]=4 1721 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000033712 [0,1,0,0,0,1|1,0,1]=4 1722 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Br 527a_100000210019_100000033712 [0,1,0,0,0,1|1,0,1]=4 1723 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000033712 [0,1,0,0,0,1|1,0,1]=4 1724 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000033712 [0,1,0,0,0,1|1,0,1]=4 1725 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000033712 [0,1,0,0,0,1|1,0,1]=4 1726 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)F 11a_100000210047_100000033712 [0,1,0,0,0,1|1,0,1]=4 1727 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000033712 [0,1,0,0,0,1|1,0,1]=4 1728 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)F 22a_100000210047_100000033712 [0,1,0,0,0,1|1,0,1]=4 1729 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)F 527a_100000210047_100000033712 [0,1,0,0,0,1|1,0,1]=4 1730 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)I 11a_100000211102_100000033712 [0,1,0,0,0,1|1,0,1]=4 1731 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000033712 [0,1,0,0,0,1|1,0,1]=4 1732 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)I 22a_100000211102_100000033712 [0,1,0,0,0,1|1,0,1]=4 1733 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)I 527a_100000211102_100000033712 [0,1,0,0,0,1|1,0,1]=4 1734 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000033712 [0,1,0,0,0,1|1,0,1]=4 1735 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)O 22a_100000210217_100000033712 [0,1,0,0,0,1|1,0,1]=4 1736 B15R1.8303 C[N+](C)(C)CC(=O)Nc1cccc(c1)O 527a_100000210217_100000033712 [0,1,0,0,0,1|1,0,1]=4 1737 B15R1.8303 Cc1cc(ccn1)N[C@@H](C)CC(C)(C)C 27a_106358413534_100000758586 [0,1,0,0,0,1|2,0,0]=4 1738 B15R1.8303 Cc1cccc(c1)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000211840 [0,1,0,0,0,1|1,0,1]=4 1739 B15R1.8303 Cc1cccc(c1)CN(C)CC(C)(C)C 2230a_100000742839_100000211840 [0,1,0,0,0,1|2,0,0]=4 1740 B15R1.8303 Cc1cccc(c1)CN(C)CC(C)(C)C 269982a_100000742839_100000211840 [0,1,0,0,0,1|2,0,0]=4 1741 B15R1.8303 Cc1cccc(c1)CN(C)CC(C)(C)C 270004a_100000742839_100000211157 [0,1,0,0,0,1|2,0,0]=4 1742 B15R1.8303 Cc1cccc(c1)CN(C)CC(C)(C)C 270004a_102495364743_100011204126 [0,1,0,0,0,1|2,0,0]=4 1743 B15R1.8303 Cc1cccc(c1)CN(C)CC(C)(C)C 34a_102495364743_100011219605 [0,1,0,0,0,1|2,0,0]=4 1744 B15R1.8303 Cc1cccc(c1)CN(C)C[N+](C)(C)C 269982a_102495364743_200000036245 [0,1,0,0,0,1|1,0,0]=3 1745 B15R1.8303 Cc1cccc(c1)CN(C)C[Si](C)(C)C 2230a_102495364743_100000037933 [0,1,0,0,0,1|2,0,0]=4 1746 B15R1.8303 Cc1cccc(c1)CN(C)C[Si](C)(C)C 269982a_200020589227_100000211840 [0,1,0,0,0,1|2,0,0]=4 1747 B15R1.8303 Cc1cccc(c1)NC(=O)C[N+](C)(C)C 11a_100000188690_100000033712 [0,1,0,0,0,1|1,0,1]=4 1748 B15R1.8303 Cc1cccc(c1)NC(=O)C[N+](C)(C)C 1626a_100000188690_100000033712 [0,1,0,0,0,1|1,0,1]=4 1749 B15R1.8303 Cc1cccc(c1)NC(=O)C[N+](C)(C)C 22a_100000188690_100000033712 [0,1,0,0,0,1|1,0,1]=4 1750 B15R1.8303 Cc1cccc(c1)NC(=O)C[N+](C)(C)C 527a_100000188690_100000033712 [0,1,0,0,0,1|1,0,1]=4 1751 B15R1.8303 Cc1cccc(n1)CN(C)C[N+](C)(C)C 269982a_100000687132_200000036245 [0,1,0,0,0,1|2,0,0]=4 1752 B15R1.8303 Cc1ccnc(c1)CN(C)C[N+](C)(C)C 269982a_106354213154_200000036245 [0,1,0,0,0,1|2,0,0]=4 1753 B15R1.9101 CC(Cc1ccccc1)C(=O)C(C)(C)C 1458a_106744555173_200011218536 [0,1,0,0,0,1|1,0,1]=4 1754 B15R1.9101 CC(Cc1ccccc1)N(C)C(C)(C)C 269982a_100011215553_200011218536 [0,1,0,0,0,1|2,0,0]=4 1755 B15R1.9101 CC(N(C)Cc1ccccc1)C(C)(C)C 2230a_100000745498_100015291786 [0,1,0,0,0,1|2,0,0]=4 1756 B15R1.9101 CC(N(C)Cc1ccccc1)C(C)(C)C 269982a_100000745498_100000211182 [0,1,0,0,0,1|2,0,0]=4 1757 B15R1.9101 CC(N(C)Cc1ccccc1)C(C)(C)C 270004a_100000745498_100015611070 [0,1,0,0,0,1|2,0,0]=4 1758 B15R1.9101 CC(Oc1ccccc1)C(=O)C(C)(C)C 7a_100000210340_100009893019 [0,1,0,0,0,1|1,0,1]=4 1759 B15R1.9101 CC(Sc1ccccc1)C(=O)C(C)(C)C 62a_100000719477_100009893019 [0,1,0,0,0,1|1,0,1]=4 1760 B15R1.9101 CC(Sc1ccccc1)C(=O)C(C)(C)C 62a_100009893019_100000041952 [0,1,0,0,0,1|1,0,1]=4 1761 B15R1.311 C#CC(C)(C)NCC(C)c1ccccc1 270004a_100000054563_100000212034 [0,1,0,0,0,1|1,0,1]=4 1762 B15R1.311 C#CC(C)(C)NCC(C)c1ccccc1 34a_100000054563_100000756946 [0,1,0,0,0,1|1,0,1]=4 1763 B15R1.311 C#CC(C)(C)NCC(C)c1ccccc1 34a_100000701038_100000038118 [0,1,0,0,0,1|1,0,1]=4 1764 B15R1.311 C#CC(C)(C)OCC(C)c1ccccc1 34a_100000189450_100000756946 [0,1,0,0,0,1|1,0,1]=4 1765 B15R1.311 C#CC(C)(C)OCC(C)c1ccccc1 34a_100011215166_100000038118 [0,1,0,0,0,1|1,0,1]=4 1766 B15R1.311 C#CC(C)(C)OCC(C)c1ccccc1 7a_100000189450_100000756946 [0,1,0,0,0,1|1,0,1]=4 1767 B15R1.311 C#CC(C)(C)SCC(C)c1ccccc1 62a_100000038118_100000756946 [0,1,0,0,0,1|1,0,1]=4 1768 B15R1.311 C#CC(C)(C)SCC(C)c1ccccc1 62a_100000756946_100000038118 [0,1,0,0,0,1|1,0,1]=4 1769 B15R1.311 C=CC(C)(C)OCC(C)c1ccccc1 34a_100011215311_100000756946 [0,1,0,0,0,1|1,0,1]=4 1770 B15R1.311 C=CC(C)(C)OCC(C)c1ccccc1 7a_100011215311_100000756946 [0,1,0,0,0,1|1,0,1]=4 1771 B15R1.311 C=C[Si](C)(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000038793 [0,1,0,0,0,1|1,0,1]=4 1772 B15R1.311 C=C[Si](C)(C)CSC(C)c1ccccc1 62a_100000038793_100000230085 [0,1,0,0,0,1|1,0,1]=4 1773 B15R1.311 C=C[Si](C)(C)CSC(C)c1ccccc1 62a_100000230085_100000038793 [0,1,0,0,0,1|1,0,1]=4 1774 B15R1.311 CC(C)(CCl)OCC(O)c1ccccc1 7a_100000764493_100000185958 [0,1,0,0,0,1|2,0,0]=4 1775 B15R1.311 CC(C)(CCl)OC[C@@H](O)c1ccccc1 7a_100000764493_100011933945 [0,1,0,0,0,1|2,0,0]=4 1776 B15R1.311 CC(C)(CO)NCC(O)c1ccccc1 2230a_100000210608_100000185958 [0,1,0,0,0,1|2,0,0]=4 1777 B15R1.311 CC(C)(CO)NC[C@@H](O)c1ccccc1 2230a_100000210608_100011933945 [0,1,0,0,0,1|2,0,0]=4 1778 B15R1.311 CC(CNC(C)(C)C#N)c1ccccc1 34a_100000701038_100011162410 [0,1,0,0,0,1|1,0,1]=4 1779 B15R1.311 CC(CNC(C)(C)CO)c1ccccc1 2230a_100000210608_100000756946 [0,1,0,0,0,1|1,0,0]=3 1780 B15R1.311 CC(CNC(C)(C)CO)c1ccccc1 270004a_100000210608_100000212034 [0,1,0,0,0,1|1,0,0]=3 1781 B15R1.311 CC(COC(C)(C)C#N)c1ccccc1 34a_100011215166_100011162410 [0,1,0,0,0,1|1,0,1]=4 1782 B15R1.311 CC(COC(C)(C)C#N)c1ccccc1 34a_200015195151_100000756946 [0,1,0,0,0,1|1,0,1]=4 1783 B15R1.311 CC(COC(C)(C)C#N)c1ccccc1 7a_100011215166_100011162410 [0,1,0,0,0,1|1,0,1]=4 1784 B15R1.311 CC(COC(C)(C)CCl)c1ccccc1 7a_100000764493_100000756946 [0,1,0,0,0,1|1,0,0]=3 1785 B15R1.311 CC(CSC(C)(C)C#N)c1ccccc1 62a_100000756946_100011162410 [0,1,0,0,0,1|1,0,1]=4 1786 B15R1.311 CC(CSC(C)(C)C#N)c1ccccc1 62a_100011162410_100000756946 [0,1,0,0,0,1|1,0,1]=4 1787 B15R1.311 CC(NCC(C)(C)CO)c1ccccc1 2230a_100020635058_100000230085 [0,1,0,0,0,1|1,0,0]=3 1788 B15R1.311 CC(NCC(C)(C)CO)c1ccccc1 269862a_100020635058_100000185851 [0,1,0,0,0,1|1,0,0]=3 1789 B15R1.311 CC(NCC(C)(C)CO)c1ccccn1 269862a_100020635058_100000210467 [0,1,0,0,0,1|2,0,0]=4 1790 B15R1.311 CC(NCC(C)(C)CO)c1cccnc1 269862a_100020635058_100000210468 [0,1,0,0,0,1|2,0,0]=4 1791 B15R1.311 CC(NCC(C)(C)CO)c1ccncc1 269862a_100020635058_100000185792 [0,1,0,0,0,1|2,0,0]=4 1792 B15R1.311 CC(OCC(C)(C)CCl)c1ccccc1 7a_100011217199_100000230085 [0,1,0,0,0,1|1,0,0]=3 1793 B15R1.311 CC(SCC(C)(C)CO)c1ccccc1 62a_100000230085_100009813988 [0,1,0,0,0,1|1,0,0]=3 1794 B15R1.311 CC(SCC(C)(C)CO)c1ccccc1 62a_100009813988_100000230085 [0,1,0,0,0,1|1,0,0]=3 1795 B15R1.311 CCC(C)(C)COC(C)c1ccccc1 7a_100000765029_100000230085 [0,1,0,0,0,1|1,0,0]=3 1796 B15R1.311 CCC(C)(C)NCC(C)c1ccccc1 2230a_100000211385_100000756946 [0,1,0,0,0,1|1,0,0]=3 1797 B15R1.311 CCC(C)(C)NCC(C)c1ccccc1 270004a_100000211385_100000212034 [0,1,0,0,0,1|1,0,0]=3 1798 B15R1.311 CCC(C)(C)NCC(O)c1ccccc1 2230a_100000211385_100000185958 [0,1,0,0,0,1|2,0,0]=4 1799 B15R1.311 CCC(C)(C)NC[C@@H](O)c1ccccc1 2230a_100000211385_100011933945 [0,1,0,0,0,1|2,0,0]=4 1800 B15R1.311 CCC(C)(C)OCC(C)c1ccccc1 7a_100000210230_100000756946 [0,1,0,0,0,1|1,0,0]=3 1801 B15R1.311 CCC(C)(C)OCC(C)c1ccccc1 7a_100011215166_100000210677 [0,1,0,0,0,1|1,0,0]=3 1802 B15R1.311 CCC(C)(C)OCC(O)c1ccccc1 7a_100000210230_100000185958 [0,1,0,0,0,1|2,0,0]=4 1803 B15R1.311 CCC(C)(C)OC[C@@H](O)c1ccccc1 7a_100000210230_100011933945 [0,1,0,0,0,1|2,0,0]=4 1804 B15R1.311 CCC(C)(C)SCC(C)c1ccccc1 62a_100000032637_100000756946 [0,1,0,0,0,1|1,0,0]=3 1805 B15R1.311 CCC(C)(C)SCC(C)c1ccccc1 62a_100000756946_100000032637 [0,1,0,0,0,1|1,0,0]=3 1806 B15R1.311 CCC(C)(C)SCC(O)c1ccccc1 62a_100000032637_100000185958 [0,1,0,0,0,1|2,0,0]=4 1807 B15R1.311 CCC(C)(C)SCC(O)c1ccccc1 62a_100000185958_100000032637 [0,1,0,0,0,1|2,0,0]=4 1808 B15R1.311 CCC(C)(C)SC[C@@H](O)c1ccccc1 62a_100000032637_100011933945 [0,1,0,0,0,1|2,0,0]=4 1809 B15R1.311 CCC(C)(C)SC[C@@H](O)c1ccccc1 62a_100011933945_100000032637 [0,1,0,0,0,1|2,0,0]=4 1810 B15R1.311 COC(C)(C)CNC(C)c1ccccc1 2230a_100000763424_100000230085 [0,1,0,0,0,1|1,0,0]=3 1811 B15R1.311 COC(C)(C)CNC(C)c1ccccc1 269862a_100000763424_100000185851 [0,1,0,0,0,1|1,0,0]=3 1812 B15R1.311 COC(C)(C)CNC(C)c1ccccn1 269862a_100000763424_100000210467 [0,1,0,0,0,1|2,0,0]=4 1813 B15R1.311 COC(C)(C)CNC(C)c1cccnc1 269862a_100000763424_100000210468 [0,1,0,0,0,1|2,0,0]=4 1814 B15R1.311 COC(C)(C)CNC(C)c1ccncc1 269862a_100000763424_100000185792 [0,1,0,0,0,1|2,0,0]=4 1815 B15R1.311 COC(C)(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000701081 [0,1,0,0,0,1|1,0,0]=3 1816 B15R1.311 COC(C)(C)CSC(C)c1ccccc1 62a_100000230085_100000701081 [0,1,0,0,0,1|1,0,0]=3 1817 B15R1.311 COC(C)(C)CSC(C)c1ccccc1 62a_100000701081_100000230085 [0,1,0,0,0,1|1,0,0]=3 1818 B15R1.311 CSC(C)(C)CNC(C)c1ccccn1 270004a_100000181244_100009845794 [0,1,0,0,0,1|2,0,0]=4 1819 B15R1.311 CSC(C)(C)CNC(C)c1cccnc1 270004a_100000195435_100009845794 [0,1,0,0,0,1|2,0,0]=4 1820 B15R1.311 CSC(C)(C)CNC(C)c1ccncc1 270004a_100000181269_100009845794 [0,1,0,0,0,1|2,0,0]=4 1821 B15R1.311 CSC(C)(C)CN[C@H](C)c1ccccc1 270004a_100000751104_100009845794 [0,1,0,0,0,1|1,0,0]=3 1822 B15R1.311 C[C@@H](OCC(C)(C)CO)c1ccccc1 34a_100000761318_100009813988 [0,1,0,0,0,1|1,0,0]=3 1823 B15R1.311 C[C@@H](OCC(C)(C)CO)c1ccccc1 7a_100000761318_100009813988 [0,1,0,0,0,1|1,0,0]=3 1824 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)Br 34a_100020626992_100000210625 [0,1,0,0,0,1|2,0,0]=4 1825 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)Cl 2230a_100000715429_200011996143 [0,1,0,0,0,1|2,0,0]=4 1826 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)Cl 34a_100000736658_100000210625 [0,1,0,0,0,1|2,0,0]=4 1827 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)O 34a_100000067596_100000210625 [0,1,0,0,0,1|2,0,0]=4 1828 B15R1.892 CC(C)(C)NC[C@H](O)c1ccc(cc1)F 2230a_100000715429_100000720402 [0,1,0,0,0,1|2,0,0]=4 1829 B15R1.892 CC(C)(C)OCC(N)c1ccc(cc1)Br 34a_100000734186_100000210625 [0,1,0,0,0,1|2,0,0]=4 1830 B15R1.892 CC(C)(C)OCC(N)c1ccc(cc1)F 34a_100000705410_100000210625 [0,1,0,0,0,1|2,0,0]=4 1831 B15R1.892 CC(C)(C)OCC(O)c1ccc(cc1)Cl 34a_100015890283_200011996143 [0,1,0,0,0,1|2,0,0]=4 1832 B15R1.892 CC(C)(C)OCC(O)c1ccc(cc1)Cl 7a_100015890283_200011996143 [0,1,0,0,0,1|2,0,0]=4 1833 B15R1.892 CC(C)(C)OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_100000210625 [0,1,0,0,0,1|2,0,0]=4 1834 B15R1.892 CC(C)(C)OC[C@H](O)c1ccc(cc1)F 34a_100015890283_100000720402 [0,1,0,0,0,1|2,0,0]=4 1835 B15R1.892 CC(C)(C)OC[C@H](O)c1ccc(cc1)F 7a_100015890283_100000720402 [0,1,0,0,0,1|2,0,0]=4 1836 B15R1.892 CC(C)(C)SCC(O)c1ccc(cc1)Cl 62a_100000211941_200011996143 [0,1,0,0,0,1|2,0,0]=4 1837 B15R1.892 CC(C)(C)SCC(O)c1ccc(cc1)Cl 62a_200011996143_100000211941 [0,1,0,0,0,1|2,0,0]=4 1838 B15R1.892 CC(C)(C)SC[C@H](O)c1ccc(cc1)F 62a_100000211941_100000720402 [0,1,0,0,0,1|2,0,0]=4 1839 B15R1.892 CC(C)(C)SC[C@H](O)c1ccc(cc1)F 62a_100000720402_100000211941 [0,1,0,0,0,1|2,0,0]=4 1840 B15R1.892 CC(CNC(C)(C)C)c1ccc(cc1)O 34a_200015188644_100000210625 [0,1,0,0,0,1|1,0,0]=3 1841 B15R1.892 CC(NCC(C)(C)C)c1cc[n+](cc1)[O-] 269862a_100000743828_100000076990 [0,1,0,0,0,1|2,0,0]=4 1842 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)Br 2230a_100000743828_100000755118 [0,1,0,0,0,1|1,0,0]=3 1843 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)Br 269862a_100000743828_100000185794 [0,1,0,0,0,1|1,0,0]=3 1844 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)Cl 2230a_100000743828_100000684792 [0,1,0,0,0,1|1,0,0]=3 1845 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)Cl 269862a_100000743828_100000185797 [0,1,0,0,0,1|1,0,0]=3 1846 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)F 2230a_100000743828_100000743420 [0,1,0,0,0,1|1,0,0]=3 1847 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)F 269862a_100000743828_100000185800 [0,1,0,0,0,1|1,0,0]=3 1848 B15R1.892 CC(NCC(C)(C)C)c1ccc(cc1)I 269862a_100000743828_100000185465 [0,1,0,0,0,1|1,0,0]=3 1849 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)Br 269862a_100000743828_100000686046 [0,1,0,0,0,1|2,0,0]=4 1850 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)Br 270004a_100000723930_100011204126 [0,1,0,0,0,1|2,0,0]=4 1851 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)Br 270004a_100000743828_100000686046 [0,1,0,0,0,1|2,0,0]=4 1852 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)Cl 269862a_100000743828_100000692432 [0,1,0,0,0,1|2,0,0]=4 1853 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)Cl 270004a_100000743828_100000692432 [0,1,0,0,0,1|2,0,0]=4 1854 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)F 269862a_100000743828_100102946652 [0,1,0,0,0,1|2,0,0]=4 1855 B15R1.892 CC(NCC(C)(C)C)c1ccc(cn1)F 270004a_100000743828_100102946652 [0,1,0,0,0,1|2,0,0]=4 1856 B15R1.892 CC(NCC(C)(C)C)c1ccc(nc1)Br 269862a_100000743828_100000684857 [0,1,0,0,0,1|2,0,0]=4 1857 B15R1.892 CC(NCC(C)(C)C)c1ccc(nc1)Cl 269862a_100000743828_100000690552 [0,1,0,0,0,1|2,0,0]=4 1858 B15R1.892 CC(NCC(C)(C)C)c1ccc(nc1)F 269862a_100000743828_100000085738 [0,1,0,0,0,1|2,0,0]=4 1859 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)Br 2230a_100020643315_100000755118 [0,1,0,0,0,1|2,0,0]=4 1860 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)Br 269862a_100020643315_100000185794 [0,1,0,0,0,1|2,0,0]=4 1861 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)Cl 2230a_100020643315_100000684792 [0,1,0,0,0,1|2,0,0]=4 1862 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)Cl 269862a_100020643315_100000185797 [0,1,0,0,0,1|2,0,0]=4 1863 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)F 2230a_100020643315_100000743420 [0,1,0,0,0,1|2,0,0]=4 1864 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)F 269862a_100020643315_100000185800 [0,1,0,0,0,1|2,0,0]=4 1865 B15R1.892 CC(NCC(C)(C)F)c1ccc(cc1)I 269862a_100020643315_100000185465 [0,1,0,0,0,1|2,0,0]=4 1866 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Br 2230a_100000751335_100000755118 [0,1,0,0,0,1|2,0,0]=4 1867 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Br 269862a_100000751335_100000185794 [0,1,0,0,0,1|2,0,0]=4 1868 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Cl 2230a_100000751335_100000684792 [0,1,0,0,0,1|2,0,0]=4 1869 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Cl 269862a_100000751335_100000185797 [0,1,0,0,0,1|2,0,0]=4 1870 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)F 2230a_100000751335_100000743420 [0,1,0,0,0,1|2,0,0]=4 1871 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)F 269862a_100000751335_100000185800 [0,1,0,0,0,1|2,0,0]=4 1872 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)I 269862a_100000751335_100000185465 [0,1,0,0,0,1|2,0,0]=4 1873 B15R1.892 CC(NC[Si](C)(C)C)c1ccc(cn1)Br 2230a_100000723930_100000037933 [0,1,0,0,0,1|2,0,0]=4 1874 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)Br 34a_100000745893_100011219605 [0,1,0,0,0,1|1,0,0]=3 1875 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)F 34a_100000181323_100011219605 [0,1,0,0,0,1|1,0,0]=3 1876 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)N 34a_100011216399_100011219605 [0,1,0,0,0,1|1,0,0]=3 1877 B15R1.892 CC(OCC(C)(C)C)c1ccc(cn1)Br 34a_100012353650_100011219605 [0,1,0,0,0,1|2,0,0]=4 1878 B15R1.892 CC(OCC(C)(C)C)c1ccc(nc1)Br 34a_200010274204_100011219605 [0,1,0,0,0,1|2,0,0]=4 1879 B15R1.892 CC(OCC(C)(C)C)c1ccc(nc1)Cl 34a_200012017543_100011219605 [0,1,0,0,0,1|2,0,0]=4 1880 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)Br 34a_100000716592_100000755118 [0,1,0,0,0,1|2,0,0]=4 1881 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)Br 34a_100000745893_100011997219 [0,1,0,0,0,1|2,0,0]=4 1882 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)F 34a_100000181323_100011997219 [0,1,0,0,0,1|2,0,0]=4 1883 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)F 34a_100000716592_100000743420 [0,1,0,0,0,1|2,0,0]=4 1884 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)N 34a_100011216399_100011997219 [0,1,0,0,0,1|2,0,0]=4 1885 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)Br 34a_100000745893_100000764493 [0,1,0,0,0,1|2,0,0]=4 1886 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)Br 7a_100000745893_100000764493 [0,1,0,0,0,1|2,0,0]=4 1887 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)F 34a_100000181323_100000764493 [0,1,0,0,0,1|2,0,0]=4 1888 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)F 7a_100000181323_100000764493 [0,1,0,0,0,1|2,0,0]=4 1889 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)N 34a_100011216399_100000764493 [0,1,0,0,0,1|2,0,0]=4 1890 B15R1.892 CC(OC[Si](C)(C)C)c1ccc(cc1)Br 7a_100000745893_100000233785 [0,1,0,0,0,1|1,0,0]=3 1891 B15R1.892 CC(OC[Si](C)(C)C)c1ccc(cc1)F 7a_100000181323_100000233785 [0,1,0,0,0,1|1,0,0]=3 1892 B15R1.892 CC(OC[Si](C)(C)C)c1ccc(cn1)Br 7a_100012353650_100000233785 [0,1,0,0,0,1|2,0,0]=4 1893 B15R1.892 CC(OC[Si](C)(C)C)c1ccc(nc1)Br 7a_200010274204_100000233785 [0,1,0,0,0,1|2,0,0]=4 1894 B15R1.892 CC(OC[Si](C)(C)C)c1ccc(nc1)Cl 7a_200012017543_100000233785 [0,1,0,0,0,1|2,0,0]=4 1895 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)Br 62a_100000755118_100011219605 [0,1,0,0,0,1|1,0,0]=3 1896 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)Br 62a_100011219605_100000755118 [0,1,0,0,0,1|1,0,0]=3 1897 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)Cl 62a_100000684792_100011219605 [0,1,0,0,0,1|1,0,0]=3 1898 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)Cl 62a_100011219605_100000684792 [0,1,0,0,0,1|1,0,0]=3 1899 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)F 62a_100000743420_100011219605 [0,1,0,0,0,1|1,0,0]=3 1900 B15R1.892 CC(SCC(C)(C)C)c1ccc(cc1)F 62a_100011219605_100000743420 [0,1,0,0,0,1|1,0,0]=3 1901 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)Br 62a_100000755118_100011997219 [0,1,0,0,0,1|2,0,0]=4 1902 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)Br 62a_100011997219_100000755118 [0,1,0,0,0,1|2,0,0]=4 1903 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)Cl 62a_100000684792_100011997219 [0,1,0,0,0,1|2,0,0]=4 1904 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)Cl 62a_100011997219_100000684792 [0,1,0,0,0,1|2,0,0]=4 1905 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)F 62a_100000743420_100011997219 [0,1,0,0,0,1|2,0,0]=4 1906 B15R1.892 CC(SCC(C)(C)F)c1ccc(cc1)F 62a_100011997219_100000743420 [0,1,0,0,0,1|2,0,0]=4 1907 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)Br 62a_100000755118_100000764493 [0,1,0,0,0,1|2,0,0]=4 1908 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)Br 62a_100000764493_100000755118 [0,1,0,0,0,1|2,0,0]=4 1909 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)Cl 62a_100000684792_100000764493 [0,1,0,0,0,1|2,0,0]=4 1910 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)Cl 62a_100000764493_100000684792 [0,1,0,0,0,1|2,0,0]=4 1911 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)F 62a_100000743420_100000764493 [0,1,0,0,0,1|2,0,0]=4 1912 B15R1.892 CC(SCC(C)(C)O)c1ccc(cc1)F 62a_100000764493_100000743420 [0,1,0,0,0,1|2,0,0]=4 1913 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)Br 62a_100000755118_200000036245 [0,1,0,0,0,1|0,0,0]=2 1914 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)Br 62a_200000036245_100000755118 [0,1,0,0,0,1|0,0,0]=2 1915 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)Cl 62a_100000684792_200000036245 [0,1,0,0,0,1|0,0,0]=2 1916 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)Cl 62a_200000036245_100000684792 [0,1,0,0,0,1|0,0,0]=2 1917 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)F 62a_100000743420_200000036245 [0,1,0,0,0,1|0,0,0]=2 1918 B15R1.892 CC(SC[N+](C)(C)C)c1ccc(cc1)F 62a_200000036245_100000743420 [0,1,0,0,0,1|0,0,0]=2 1919 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)Br 62a_100000037933_100000755118 [0,1,0,0,0,1|1,0,0]=3 1920 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)Br 62a_100000755118_100000037933 [0,1,0,0,0,1|1,0,0]=3 1921 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)Cl 62a_100000037933_100000684792 [0,1,0,0,0,1|1,0,0]=3 1922 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)Cl 62a_100000684792_100000037933 [0,1,0,0,0,1|1,0,0]=3 1923 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)F 62a_100000037933_100000743420 [0,1,0,0,0,1|1,0,0]=3 1924 B15R1.892 CC(SC[Si](C)(C)C)c1ccc(cc1)F 62a_100000743420_100000037933 [0,1,0,0,0,1|1,0,0]=3 1925 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Br 2230a_100000219623_100000755188 [0,1,0,0,0,1|2,0,0]=4 1926 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Br 269982a_100000219623_100000755188 [0,1,0,0,0,1|2,0,0]=4 1927 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Br 34a_100000219623_100000755188 [0,1,0,0,0,1|2,0,0]=4 1928 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Cl 2230a_100020629279_100000755188 [0,1,0,0,0,1|2,0,0]=4 1929 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Cl 269982a_100020629279_100000755188 [0,1,0,0,0,1|2,0,0]=4 1930 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)Cl 34a_100020629279_100000755188 [0,1,0,0,0,1|2,0,0]=4 1931 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)F 2230a_100000219829_100000755188 [0,1,0,0,0,1|2,0,0]=4 1932 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)F 269982a_100000219829_100000755188 [0,1,0,0,0,1|2,0,0]=4 1933 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)F 34a_100000219829_100000755188 [0,1,0,0,0,1|2,0,0]=4 1934 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)I 2230a_100000743151_100000755188 [0,1,0,0,0,1|2,0,0]=4 1935 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)I 269982a_100000743151_100000755188 [0,1,0,0,0,1|2,0,0]=4 1936 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)I 34a_100000743151_100000755188 [0,1,0,0,0,1|2,0,0]=4 1937 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)O 269982a_100000182112_100000755188 [0,1,0,0,0,1|2,0,0]=4 1938 B15R1.892 CN(CCC(C)(C)C)c1ccc(cc1)O 34a_100000182112_100000755188 [0,1,0,0,0,1|2,0,0]=4 1939 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)Br 269982a_100000219623_100000085578 [0,1,0,0,0,1|1,0,0]=3 1940 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)Br 34a_100000219623_100000085578 [0,1,0,0,0,1|1,0,0]=3 1941 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)Cl 269982a_100020629279_100000085578 [0,1,0,0,0,1|1,0,0]=3 1942 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)Cl 34a_100020629279_100000085578 [0,1,0,0,0,1|1,0,0]=3 1943 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)F 269982a_100000219829_100000085578 [0,1,0,0,0,1|1,0,0]=3 1944 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)F 34a_100000219829_100000085578 [0,1,0,0,0,1|1,0,0]=3 1945 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)I 269982a_100000743151_100000085578 [0,1,0,0,0,1|1,0,0]=3 1946 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)I 34a_100000743151_100000085578 [0,1,0,0,0,1|1,0,0]=3 1947 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)O 269982a_100000182112_100000085578 [0,1,0,0,0,1|1,0,0]=3 1948 B15R1.892 CN(CC[N+](C)(C)C)c1ccc(cc1)O 34a_100000182112_100000085578 [0,1,0,0,0,1|1,0,0]=3 1949 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Br 2230a_100000219623_200000733723 [0,1,0,0,0,1|2,0,0]=4 1950 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Br 269982a_100000219623_200000733723 [0,1,0,0,0,1|2,0,0]=4 1951 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Br 34a_100000219623_200000733723 [0,1,0,0,0,1|2,0,0]=4 1952 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Cl 2230a_100020629279_200000733723 [0,1,0,0,0,1|2,0,0]=4 1953 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Cl 269982a_100020629279_200000733723 [0,1,0,0,0,1|2,0,0]=4 1954 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)Cl 34a_100020629279_200000733723 [0,1,0,0,0,1|2,0,0]=4 1955 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)F 2230a_100000219829_200000733723 [0,1,0,0,0,1|2,0,0]=4 1956 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)F 269982a_100000219829_200000733723 [0,1,0,0,0,1|2,0,0]=4 1957 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)F 34a_100000219829_200000733723 [0,1,0,0,0,1|2,0,0]=4 1958 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)I 2230a_100000743151_200000733723 [0,1,0,0,0,1|2,0,0]=4 1959 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)I 269982a_100000743151_200000733723 [0,1,0,0,0,1|2,0,0]=4 1960 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)I 34a_100000743151_200000733723 [0,1,0,0,0,1|2,0,0]=4 1961 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)O 269982a_100000182112_200000733723 [0,1,0,0,0,1|2,0,0]=4 1962 B15R1.892 CN(CC[Si](C)(C)C)c1ccc(cc1)O 34a_100000182112_200000733723 [0,1,0,0,0,1|2,0,0]=4 1963 B15R1.892 C[C@@H](NCC(C)(C)C)c1ccc(cc1)Br 270004a_100000720352_100011204126 [0,1,0,0,0,1|1,0,0]=3 1964 B15R1.892 C[C@@H](NCC(C)(C)C)c1ccc(cc1)Cl 270004a_100015205461_100011204126 [0,1,0,0,0,1|1,0,0]=3 1965 B15R1.892 C[C@@H](NCC(C)(C)C)c1ccc(cc1)Cl 34a_100015205461_100011219605 [0,1,0,0,0,1|1,0,0]=3 1966 B15R1.892 C[C@@H](NCC(C)(C)F)c1ccc(cc1)Cl 34a_100015205461_100011997219 [0,1,0,0,0,1|2,0,0]=4 1967 B15R1.892 C[C@@H](NCC(C)(C)O)c1ccc(cc1)Cl 34a_100015205461_100000764493 [0,1,0,0,0,1|2,0,0]=4 1968 B15R1.892 C[C@@H](NC[Si](C)(C)C)c1ccc(cc1)Br 2230a_100000720352_100000037933 [0,1,0,0,0,1|1,0,0]=3 1969 B15R1.892 C[C@@H](NC[Si](C)(C)C)c1ccc(cc1)Cl 2230a_100015205461_100000037933 [0,1,0,0,0,1|1,0,0]=3 1970 B15R1.892 C[C@H](NCC(C)(C)C)c1ccc(cc1)F 270004a_100025705893_100011204126 [0,1,0,0,0,1|1,0,0]=3 1971 B15R1.892 C[C@H](NCC(C)(C)C)c1ccc(cc1)F 34a_100025705893_100011219605 [0,1,0,0,0,1|1,0,0]=3 1972 B15R1.892 C[C@H](NCC(C)(C)C)c1ccc(cc1)I 270004a_100000753911_100011204126 [0,1,0,0,0,1|1,0,0]=3 1973 B15R1.892 C[C@H](NCC(C)(C)C)c1ccc(cc1)O 270004a_100161106496_100011204126 [0,1,0,0,0,1|1,0,0]=3 1974 B15R1.892 C[C@H](NCC(C)(C)C)c1ccc(nc1)Br 270004a_100015387476_100011204126 [0,1,0,0,0,1|2,0,0]=4 1975 B15R1.892 C[C@H](NCC(C)(C)F)c1ccc(cc1)F 34a_100025705893_100011997219 [0,1,0,0,0,1|2,0,0]=4 1976 B15R1.892 C[C@H](NCC(C)(C)O)c1ccc(cc1)F 34a_100025705893_100000764493 [0,1,0,0,0,1|2,0,0]=4 1977 B15R1.892 C[C@H](NC[Si](C)(C)C)c1ccc(cc1)F 2230a_100025705893_100000037933 [0,1,0,0,0,1|1,0,0]=3 1978 B15R1.892 C[C@H](NC[Si](C)(C)C)c1ccc(cc1)I 2230a_100000753911_100000037933 [0,1,0,0,0,1|1,0,0]=3 1979 B15R1.892 C[C@H](NC[Si](C)(C)C)c1ccc(cc1)O 2230a_100161106496_100000037933 [0,1,0,0,0,1|1,0,0]=3 1980 B15R1.892 C[C@H](NC[Si](C)(C)C)c1ccc(nc1)Br 2230a_100015387476_100000037933 [0,1,0,0,0,1|2,0,0]=4 1981 B15R1.892 C[C@H](OCC(C)(C)C)c1ccc(cc1)Cl 34a_100011852131_100011219605 [0,1,0,0,0,1|1,0,0]=3 1982 B15R1.892 C[C@H](OCC(C)(C)F)c1ccc(cc1)Cl 34a_100011852131_100011997219 [0,1,0,0,0,1|2,0,0]=4 1983 B15R1.892 C[C@H](OCC(C)(C)O)c1ccc(cc1)Cl 34a_100011852131_100000764493 [0,1,0,0,0,1|2,0,0]=4 1984 B15R1.892 C[C@H](OCC(C)(C)O)c1ccc(cc1)Cl 7a_100011852131_100000764493 [0,1,0,0,0,1|2,0,0]=4 1985 B15R1.892 C[C@H](OC[Si](C)(C)C)c1ccc(cc1)Cl 7a_100011852131_100000233785 [0,1,0,0,0,1|1,0,0]=3 1986 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000085578 [0,1,0,0,0,1|1,0,1]=4 1987 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000085578 [0,1,0,0,0,1|1,0,1]=4 1988 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000085578 [0,1,0,0,0,1|1,0,1]=4 1989 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000085578 [0,1,0,0,0,1|1,0,1]=4 1990 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000085578 [0,1,0,0,0,1|1,0,1]=4 1991 B15R1.892 Cc1ccc(cc1)C(=O)CC[N+](C)(C)C 1458a_100000188618_100000085578 [0,1,0,0,0,1|1,0,1]=4 1992 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)C 2230a_100000743828_100011261388 [0,1,0,0,0,1|1,0,0]=3 1993 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)C 269862a_100000743828_100000185793 [0,1,0,0,0,1|1,0,0]=3 1994 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)F 2230a_100020643315_100011261388 [0,1,0,0,0,1|2,0,0]=4 1995 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)F 269862a_100020643315_100000185793 [0,1,0,0,0,1|2,0,0]=4 1996 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)O 2230a_100000751335_100011261388 [0,1,0,0,0,1|2,0,0]=4 1997 B15R1.892 Cc1ccc(cc1)C(C)NCC(C)(C)O 269862a_100000751335_100000185793 [0,1,0,0,0,1|2,0,0]=4 1998 B15R1.892 Cc1ccc(cc1)C(C)OCC(C)(C)F 34a_100000716592_100011261388 [0,1,0,0,0,1|2,0,0]=4 1999 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)C 62a_100011219605_100011261388 [0,1,0,0,0,1|1,0,0]=3 2000 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)C 62a_100011261388_100011219605 [0,1,0,0,0,1|1,0,0]=3 2001 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)F 62a_100011261388_100011997219 [0,1,0,0,0,1|2,0,0]=4 2002 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)F 62a_100011997219_100011261388 [0,1,0,0,0,1|2,0,0]=4 2003 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)O 62a_100000764493_100011261388 [0,1,0,0,0,1|2,0,0]=4 2004 B15R1.892 Cc1ccc(cc1)C(C)SCC(C)(C)O 62a_100011261388_100000764493 [0,1,0,0,0,1|2,0,0]=4 2005 B15R1.892 Cc1ccc(cc1)C(C)SC[N+](C)(C)C 62a_100011261388_200000036245 [0,1,0,0,0,1|0,0,0]=2 2006 B15R1.892 Cc1ccc(cc1)C(C)SC[N+](C)(C)C 62a_200000036245_100011261388 [0,1,0,0,0,1|0,0,0]=2 2007 B15R1.892 Cc1ccc(cc1)C(C)SC[Si](C)(C)C 62a_100000037933_100011261388 [0,1,0,0,0,1|1,0,0]=3 2008 B15R1.892 Cc1ccc(cc1)C(C)SC[Si](C)(C)C 62a_100011261388_100000037933 [0,1,0,0,0,1|1,0,0]=3 2009 B15R1.892 Cc1ccc(cc1)C(O)CNC(C)(C)C 34a_200020610344_100000210625 [0,1,0,0,0,1|2,0,0]=4 2010 B15R1.892 Cc1ccc(cc1)N(C)CCC(C)(C)C 2230a_100000219977_100000755188 [0,1,0,0,0,1|2,0,0]=4 2011 B15R1.892 Cc1ccc(cc1)N(C)CCC(C)(C)C 269982a_100000219977_100000755188 [0,1,0,0,0,1|2,0,0]=4 2012 B15R1.892 Cc1ccc(cc1)N(C)CCC(C)(C)C 34a_100000219977_100000755188 [0,1,0,0,0,1|2,0,0]=4 2013 B15R1.892 Cc1ccc(cc1)N(C)CC[N+](C)(C)C 269982a_100000219977_100000085578 [0,1,0,0,0,1|1,0,0]=3 2014 B15R1.892 Cc1ccc(cc1)N(C)CC[N+](C)(C)C 34a_100000219977_100000085578 [0,1,0,0,0,1|1,0,0]=3 2015 B15R1.892 Cc1ccc(cc1)N(C)CC[Si](C)(C)C 2230a_100000219977_200000733723 [0,1,0,0,0,1|2,0,0]=4 2016 B15R1.892 Cc1ccc(cc1)N(C)CC[Si](C)(C)C 269982a_100000219977_200000733723 [0,1,0,0,0,1|2,0,0]=4 2017 B15R1.892 Cc1ccc(cc1)N(C)CC[Si](C)(C)C 34a_100000219977_200000733723 [0,1,0,0,0,1|2,0,0]=4 2018 B15R1.892 Cc1ccc(cc1)[C@@H](C)NCC(C)(C)C 270004a_100016988085_100011204126 [0,1,0,0,0,1|1,0,0]=3 2019 B15R1.892 Cc1ccc(cc1)[C@@H](C)NCC(C)(C)C 34a_100016988085_100011219605 [0,1,0,0,0,1|1,0,0]=3 2020 B15R1.892 Cc1ccc(cc1)[C@@H](C)NCC(C)(C)F 34a_100016988085_100011997219 [0,1,0,0,0,1|2,0,0]=4 2021 B15R1.892 Cc1ccc(cc1)[C@@H](C)NCC(C)(C)O 34a_100016988085_100000764493 [0,1,0,0,0,1|2,0,0]=4 2022 B15R1.892 Cc1ccc(cc1)[C@@H](C)NC[Si](C)(C)C 2230a_100016988085_100000037933 [0,1,0,0,0,1|1,0,0]=3 2023 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)C 34a_100000690690_100011219605 [0,1,0,0,0,1|1,0,0]=3 2024 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)F 34a_100000690690_100011997219 [0,1,0,0,0,1|2,0,0]=4 2025 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)O 34a_100000690690_100000764493 [0,1,0,0,0,1|2,0,0]=4 2026 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)O 7a_100000690690_100000764493 [0,1,0,0,0,1|2,0,0]=4 2027 B15R1.892 Cc1ccc(cc1)[C@@H](C)OC[Si](C)(C)C 7a_100000690690_100000233785 [0,1,0,0,0,1|1,0,0]=3 2028 B15R1.892 Cc1ccc(cc1)[C@@H](N)COC(C)(C)C 34a_100009818840_100000210625 [0,1,0,0,0,1|2,0,0]=4 2029 B15R1.892 Cc1ccc(cn1)C(C)NCC(C)(C)C 269862a_100000743828_100011280547 [0,1,0,0,0,1|2,0,0]=4 2030 B15R1.892 Cc1ccc(cn1)C(C)NCC(C)(C)C 270004a_100011815741_100011204126 [0,1,0,0,0,1|2,0,0]=4 2031 B15R1.892 Cc1ccc(cn1)C(C)NCC(C)(C)C 34a_100011815741_100011219605 [0,1,0,0,0,1|2,0,0]=4 2032 B15R1.892 Cc1ccc(cn1)C(C)NC[Si](C)(C)C 2230a_100011815741_100000037933 [0,1,0,0,0,1|2,0,0]=4 2033 B15R1.892 Cc1ccc(cn1)C(C)OCC(C)(C)C 34a_200011815720_100011219605 [0,1,0,0,0,1|2,0,0]=4 2034 B15R1.892 Cc1ccc(cn1)C(C)OC[Si](C)(C)C 7a_200011815720_100000233785 [0,1,0,0,0,1|2,0,0]=4 2035 B15R1.892 Cc1ccc(nc1)C(C)NCC(C)(C)C 269862a_100000743828_100000084104 [0,1,0,0,0,1|2,0,0]=4 2036 B15R1.892 Cc1ccc(nc1)C(C)NCC(C)(C)C 270004a_100000743828_100000084104 [0,1,0,0,0,1|2,0,0]=4 2037 B15R1.892 [2H]C(OCC(C)(C)C)c1ccc(cc1)F 34a_217856618577_100011219605 [0,1,0,0,0,1|2,0,0]=4 2038 B15R1.892 [2H]C(OC[Si](C)(C)C)c1ccc(cc1)F 7a_217856618577_100000233785 [0,1,0,0,0,1|2,0,0]=4 2039 B15R1.5334 C#CC(OCC(C)(C)C)c1ccccc1 34a_100011219616_100011219605 [0,1,0,0,0,1|1,0,1]=4 2040 B15R1.5334 C#CC(OC[Si](C)(C)C)c1ccccc1 7a_100011219616_100000233785 [0,1,0,0,0,1|1,0,1]=4 2041 B15R1.5334 C=CC(NCC(C)(C)C)c1ccccc1 2230a_100000743828_200000085779 [0,1,0,0,0,1|1,0,1]=4 2042 B15R1.5334 C=CC(OCC(C)(C)C)c1ccccc1 34a_100011215659_100011219605 [0,1,0,0,0,1|1,0,1]=4 2043 B15R1.5334 C=CC(OC[Si](C)(C)C)c1ccccc1 7a_100011215659_100000233785 [0,1,0,0,0,1|1,0,1]=4 2044 B15R1.5334 C=CC(SCC(C)(C)C)c1ccccc1 62a_100011219605_200000085779 [0,1,0,0,0,1|1,0,1]=4 2045 B15R1.5334 C=CC(SCC(C)(C)C)c1ccccc1 62a_200000085779_100011219605 [0,1,0,0,0,1|1,0,1]=4 2046 B15R1.5334 C=CC(SC[N+](C)(C)C)c1ccccc1 62a_200000036245_200000085779 [0,1,0,0,0,1|0,0,1]=3 2047 B15R1.5334 C=CC(SC[N+](C)(C)C)c1ccccc1 62a_200000085779_200000036245 [0,1,0,0,0,1|0,0,1]=3 2048 B15R1.5334 C=CC(SC[Si](C)(C)C)c1ccccc1 62a_100000037933_200000085779 [0,1,0,0,0,1|1,0,1]=4 2049 B15R1.5334 C=CC(SC[Si](C)(C)C)c1ccccc1 62a_200000085779_100000037933 [0,1,0,0,0,1|1,0,1]=4 2050 B15R1.5334 CC(C)(C)CNC(CO)c1ccccn1 270004a_100015196888_100011204126 [0,1,0,0,0,1|2,0,0]=4 2051 B15R1.5334 CC(C)(C)CN[C@H](CO)c1ccccc1 270004a_100000751927_100011204126 [0,1,0,0,0,1|1,0,0]=3 2052 B15R1.5334 CC(C)(C)CN[C@H](CO)c1ccccc1 34a_100000751927_100011219605 [0,1,0,0,0,1|1,0,0]=3 2053 B15R1.5334 CC(C)(C)CN[C@H](CO)c1ccncc1 270004a_100138412524_100011204126 [0,1,0,0,0,1|2,0,0]=4 2054 B15R1.5334 CC(C)(C)COC(CN)c1ccccc1 34a_100000210709_100011219605 [0,1,0,0,0,1|1,0,0]=3 2055 B15R1.5334 CC(C)(C)CO[C@H](CCl)c1ccccc1 34a_100011933945_100011219605 [0,1,0,0,0,1|1,0,0]=3 2056 B15R1.5334 CC(C)(F)CN[C@H](CO)c1ccccc1 34a_100000751927_100011997219 [0,1,0,0,0,1|2,0,0]=4 2057 B15R1.5334 CC(C)(F)COC(CN)c1ccccc1 34a_100000210709_100011997219 [0,1,0,0,0,1|2,0,0]=4 2058 B15R1.5334 CC(C)(F)CO[C@H](CCl)c1ccccc1 34a_100011933945_100011997219 [0,1,0,0,0,1|2,0,0]=4 2059 B15R1.5334 CC(C)(O)CN[C@H](CO)c1ccccc1 34a_100000751927_100000764493 [0,1,0,0,0,1|2,0,0]=4 2060 B15R1.5334 CC(C)(O)COC(CBr)c1ccccc1 7a_100000185958_100000764493 [0,1,0,0,0,1|2,0,0]=4 2061 B15R1.5334 CC(C)(O)COC(CN)c1ccccc1 34a_100000210709_100000764493 [0,1,0,0,0,1|2,0,0]=4 2062 B15R1.5334 CC(C)(O)CO[C@H](CCl)c1ccccc1 34a_100011933945_100000764493 [0,1,0,0,0,1|2,0,0]=4 2063 B15R1.5334 CC(C)(O)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000764493 [0,1,0,0,0,1|2,0,0]=4 2064 B15R1.5334 CCC(COC(C)(C)C)c1ccccc1 34a_100000752371_100000210625 [0,1,0,0,0,1|1,0,0]=3 2065 B15R1.5334 CCC(NCC(C)(C)C)c1ccccc1 269862a_100000743828_100000210124 [0,1,0,0,0,1|1,0,0]=3 2066 B15R1.5334 CCC(NCC(C)(C)C)c1ccccc1 270004a_100000737752_100011204126 [0,1,0,0,0,1|1,0,0]=3 2067 B15R1.5334 CCC(NCC(C)(C)C)c1ccccn1 269862a_100000743828_100000748178 [0,1,0,0,0,1|2,0,0]=4 2068 B15R1.5334 CCC(NCC(C)(C)C)c1ccccn1 270004a_100015186561_100011204126 [0,1,0,0,0,1|2,0,0]=4 2069 B15R1.5334 CCC(NCC(C)(C)C)c1cccnc1 269862a_100000743828_100011218761 [0,1,0,0,0,1|2,0,0]=4 2070 B15R1.5334 CCC(NCC(C)(C)C)c1cccnc1 270004a_100000246009_100011204126 [0,1,0,0,0,1|2,0,0]=4 2071 B15R1.5334 CCC(NCC(C)(C)C)c1ccncc1 269862a_100000743828_100011216016 [0,1,0,0,0,1|2,0,0]=4 2072 B15R1.5334 CCC(NCC(C)(C)C)c1ccncc1 270004a_100000246010_100011204126 [0,1,0,0,0,1|2,0,0]=4 2073 B15R1.5334 CCC(NCC(C)(C)F)c1ccccc1 269862a_100020643315_100000210124 [0,1,0,0,0,1|2,0,0]=4 2074 B15R1.5334 CCC(NCC(C)(C)O)c1ccccc1 269862a_100000751335_100000210124 [0,1,0,0,0,1|2,0,0]=4 2075 B15R1.5334 CCC(NC[Si](C)(C)C)c1ccccc1 2230a_100000737752_100000037933 [0,1,0,0,0,1|1,0,0]=3 2076 B15R1.5334 CCC(NC[Si](C)(C)C)c1ccccn1 2230a_100015186561_100000037933 [0,1,0,0,0,1|2,0,0]=4 2077 B15R1.5334 CCC(NC[Si](C)(C)C)c1cccnc1 2230a_100000246009_100000037933 [0,1,0,0,0,1|2,0,0]=4 2078 B15R1.5334 CCC(OCC(C)(C)C)c1ccccc1 34a_100000698172_100011219605 [0,1,0,0,0,1|1,0,0]=3 2079 B15R1.5334 CCC(OCC(C)(C)F)c1ccccc1 34a_100000698172_100011997219 [0,1,0,0,0,1|2,0,0]=4 2080 B15R1.5334 CCC(OCC(C)(C)O)c1ccccc1 34a_100000698172_100000764493 [0,1,0,0,0,1|2,0,0]=4 2081 B15R1.5334 CCC(OCC(C)(C)O)c1ccccc1 7a_100000698172_100000764493 [0,1,0,0,0,1|2,0,0]=4 2082 B15R1.5334 CCC(OC[Si](C)(C)C)c1ccccc1 7a_100000698172_100000233785 [0,1,0,0,0,1|1,0,0]=3 2083 B15R1.5334 CCN(CCC(C)(C)C)c1ccccc1 2230a_100000210013_100000755188 [0,1,0,0,0,1|2,0,0]=4 2084 B15R1.5334 CCN(CCC(C)(C)C)c1ccccc1 269982a_100000210013_100000755188 [0,1,0,0,0,1|2,0,0]=4 2085 B15R1.5334 CCN(CCC(C)(C)C)c1ccccc1 34a_100000210013_100000755188 [0,1,0,0,0,1|2,0,0]=4 2086 B15R1.5334 CCN(CC[N+](C)(C)C)c1ccccc1 269982a_100000210013_100000085578 [0,1,0,0,0,1|1,0,0]=3 2087 B15R1.5334 CCN(CC[N+](C)(C)C)c1ccccc1 34a_100000210013_100000085578 [0,1,0,0,0,1|1,0,0]=3 2088 B15R1.5334 CCN(CC[Si](C)(C)C)c1ccccc1 2230a_100000210013_200000733723 [0,1,0,0,0,1|2,0,0]=4 2089 B15R1.5334 CCN(CC[Si](C)(C)C)c1ccccc1 269982a_100000210013_200000733723 [0,1,0,0,0,1|2,0,0]=4 2090 B15R1.5334 CCN(CC[Si](C)(C)C)c1ccccc1 34a_100000210013_200000733723 [0,1,0,0,0,1|2,0,0]=4 2091 B15R1.5334 COC(C#C[Si](C)(C)C)c1ccccc1 7a_200000067856_200000210301 [0,1,0,0,0,1|1,0,1]=4 2092 B15R1.5334 COC(COC(C)(C)C)c1ccccc1 34a_100011215540_100000210625 [0,1,0,0,0,1|1,0,0]=3 2093 B15R1.5334 C[Si](C)(C)C#CC(O[13CH3])c1ccccc1 7a_200000067856_200025704644 [0,1,0,0,0,1|1,0,1]=4 2094 B15R1.5334 C[Si](C)(C)CNC(CO)c1ccccn1 2230a_100015196888_100000037933 [0,1,0,0,0,1|2,0,0]=4 2095 B15R1.5334 C[Si](C)(C)CN[C@H](CO)c1ccccc1 2230a_100000751927_100000037933 [0,1,0,0,0,1|1,0,0]=3 2096 B15R1.5334 C[Si](C)(C)CN[C@H](CO)c1ccncc1 2230a_100138412524_100000037933 [0,1,0,0,0,1|2,0,0]=4 2097 B15R1.5334 C[Si](C)(C)COC(C#N)c1ccccc1 7a_100011217353_100000233785 [0,1,0,0,0,1|1,0,1]=4 2098 B15R1.5334 C[Si](C)(C)COC(CBr)c1ccccc1 7a_100000185958_100000233785 [0,1,0,0,0,1|1,0,0]=3 2099 B15R1.5334 C[Si](C)(C)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000233785 [0,1,0,0,0,1|1,0,0]=3 2100 B15R1.5392 CC(C)(C)C(=O)CC(O)c1ccccc1 1458a_106744555173_100000185958 [0,1,0,0,0,1|2,0,0]=4 2101 B15R1.5392 CC(C)(C)C(=O)C[C@@H](O)c1ccccc1 1458a_106744555173_100011933945 [0,1,0,0,0,1|2,0,0]=4 2102 B15R1.5392 CC(CC(=O)C(C)(C)C)c1ccccc1 1458a_106744555173_100000756946 [0,1,0,0,0,1|1,0,0]=3 2103 B15R1.5392 CC(CC(=O)C(C)(C)F)c1ccccc1 1458a_100000765255_100000756946 [0,1,0,0,0,1|2,0,0]=4 2104 B15R1.5392 CC(CC(=O)C(C)(C)O)c1ccccc1 1458a_100000242741_100000756946 [0,1,0,0,0,1|2,0,0]=4 2105 B15R1.5392 CC(CN(C)C(C)(C)C)c1ccccc1 269982a_100011215553_100000756946 [0,1,0,0,0,1|1,0,0]=3 2106 B15R1.5392 CC(CN(C)C(C)(C)C)c1ccccc1 270004a_100011215553_100000212034 [0,1,0,0,0,1|1,0,0]=3 2107 B15R1.5392 CC(N[C@@H](C)C(C)(C)O)c1ccccc1 2230a_100025708725_100000230085 [0,1,0,0,0,1|2,0,0]=4 2108 B15R1.5392 CC(N[C@@H](C)C(C)(C)O)c1ccccc1 269862a_100025708725_100000185851 [0,1,0,0,0,1|2,0,0]=4 2109 B15R1.5392 CC(N[C@H](C)C(C)(C)C)c1ccccc1 2230a_100025703359_100000230085 [0,1,0,0,0,1|1,0,0]=3 2110 B15R1.5392 CC(N[C@H](C)C(C)(C)C)c1ccccc1 269862a_100025703359_100000185851 [0,1,0,0,0,1|1,0,0]=3 2111 B15R1.5392 CC(N[C@H](C)C(C)(C)C)c1ccccn1 269862a_100025703359_100000210467 [0,1,0,0,0,1|2,0,0]=4 2112 B15R1.5392 CC(N[C@H](C)C(C)(C)C)c1cccnc1 269862a_100025703359_100000210468 [0,1,0,0,0,1|2,0,0]=4 2113 B15R1.5392 CC(N[C@H](C)C(C)(C)C)c1ccncc1 269862a_100025703359_100000185792 [0,1,0,0,0,1|2,0,0]=4 2114 B15R1.5392 CC(N[C@H](C)c1ccccc1)C(C)(C)O 269862a_100000751104_100000747739 [0,1,0,0,0,1|2,0,0]=4 2115 B15R1.5392 CN(CC(=O)C(C)(C)C)c1ccccc1 269982a_100000210012_100000210923 [0,1,0,0,0,1|2,0,0]=4 2116 B15R1.5392 CN(CC(=O)C(C)(C)C)c1ccccc1 34a_100000210012_100000229897 [0,1,0,0,0,1|2,0,0]=4 2117 B15R1.5392 CN(CC(O)c1ccccc1)C(C)(C)C 269982a_100000227976_100000210625 [0,1,0,0,0,1|2,0,0]=4 2118 B15R1.5392 C[C@@H](NC(=O)C(C)(C)C)c1ccccc1 11a_100000751104_106744555173 [0,1,0,0,0,1|1,0,1]=4 2119 B15R1.5392 C[C@@H](NC(=O)C(C)(C)C)c1ccccc1 1626a_100000751104_106744555173 [0,1,0,0,0,1|1,0,1]=4 2120 B15R1.5392 C[C@@H](NC(=O)C(C)(C)C)c1ccccc1 240690a_100000751104_106744555173 [0,1,0,0,0,1|1,0,1]=4 2121 B15R1.5392 C[C@@H](NC(=O)C(C)(C)C)c1ccccc1 527a_100000751104_106744555173 [0,1,0,0,0,1|1,0,1]=4 2122 B15R1.8018 CC(C)(C)NCC(O)c1ccccc1Cl 34a_200000759403_100000210625 [0,1,0,0,0,1|2,0,0]=4 2123 B15R1.8018 CC(C)(C)OCC(N)c1ccccc1Cl 34a_100138412506_100000210625 [0,1,0,0,0,1|2,0,0]=4 2124 B15R1.8018 CC(C)(C)OC[C@@H](N)c1ccccc1Br 34a_100161155918_100000210625 [0,1,0,0,0,1|2,0,0]=4 2125 B15R1.8018 CC(C)(C)OC[C@H](N)c1ccccc1F 34a_100009818778_100000210625 [0,1,0,0,0,1|2,0,0]=4 2126 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Br 269862a_100000743828_100000187085 [0,1,0,0,0,1|1,0,0]=3 2127 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Br 270004a_100000181357_100011204126 [0,1,0,0,0,1|1,0,0]=3 2128 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Cl 2230a_100000743828_100000181259 [0,1,0,0,0,1|1,0,0]=3 2129 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Cl 269862a_100000743828_100000210134 [0,1,0,0,0,1|1,0,0]=3 2130 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Cl 270004a_100000174978_100011204126 [0,1,0,0,0,1|1,0,0]=3 2131 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1Cl 34a_100000174978_100011219605 [0,1,0,0,0,1|1,0,0]=3 2132 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1F 2230a_100000743828_200000741388 [0,1,0,0,0,1|1,0,0]=3 2133 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1F 269862a_100000743828_100000210632 [0,1,0,0,0,1|1,0,0]=3 2134 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1F 270004a_100000181408_100011204126 [0,1,0,0,0,1|1,0,0]=3 2135 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1F 34a_100000181408_100011219605 [0,1,0,0,0,1|1,0,0]=3 2136 B15R1.8018 CC(NCC(C)(C)C)c1ccccc1I 269862a_100000743828_100000751169 [0,1,0,0,0,1|1,0,0]=3 2137 B15R1.8018 CC(NCC(C)(C)C)c1ccncc1Br 269862a_100000743828_100009993184 [0,1,0,0,0,1|2,0,0]=4 2138 B15R1.8018 CC(NCC(C)(C)C)c1ccncc1Cl 269862a_100000743828_100012001414 [0,1,0,0,0,1|2,0,0]=4 2139 B15R1.8018 CC(NCC(C)(C)C)c1ccncc1F 269862a_100000743828_100000727669 [0,1,0,0,0,1|2,0,0]=4 2140 B15R1.8018 CC(NCC(C)(C)C)c1cnccc1Cl 269862a_100000743828_100160469449 [0,1,0,0,0,1|2,0,0]=4 2141 B15R1.8018 CC(NCC(C)(C)C)c1ncccc1Br 269862a_100000743828_100012348690 [0,1,0,0,0,1|2,0,0]=4 2142 B15R1.8018 CC(NCC(C)(C)C)c1ncccc1Br 270004a_100159271932_100011204126 [0,1,0,0,0,1|2,0,0]=4 2143 B15R1.8018 CC(NCC(C)(C)C)c1ncccc1Cl 269862a_100000743828_100015267551 [0,1,0,0,0,1|2,0,0]=4 2144 B15R1.8018 CC(NCC(C)(C)C)c1ncccc1F 269862a_100000743828_100011997767 [0,1,0,0,0,1|2,0,0]=4 2145 B15R1.8018 CC(NCC(C)(C)C)c1ncccc1I 269862a_100000743828_200015599370 [0,1,0,0,0,1|2,0,0]=4 2146 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1Br 269862a_100020643315_100000187085 [0,1,0,0,0,1|2,0,0]=4 2147 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1Cl 2230a_100020643315_100000181259 [0,1,0,0,0,1|2,0,0]=4 2148 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1Cl 269862a_100020643315_100000210134 [0,1,0,0,0,1|2,0,0]=4 2149 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1Cl 34a_100000174978_100011997219 [0,1,0,0,0,1|2,0,0]=4 2150 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1F 2230a_100020643315_200000741388 [0,1,0,0,0,1|2,0,0]=4 2151 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1F 269862a_100020643315_100000210632 [0,1,0,0,0,1|2,0,0]=4 2152 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1F 34a_100000181408_100011997219 [0,1,0,0,0,1|2,0,0]=4 2153 B15R1.8018 CC(NCC(C)(C)F)c1ccccc1I 269862a_100020643315_100000751169 [0,1,0,0,0,1|2,0,0]=4 2154 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1Br 269862a_100000751335_100000187085 [0,1,0,0,0,1|2,0,0]=4 2155 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1Cl 2230a_100000751335_100000181259 [0,1,0,0,0,1|2,0,0]=4 2156 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1Cl 269862a_100000751335_100000210134 [0,1,0,0,0,1|2,0,0]=4 2157 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1Cl 34a_100000174978_100000764493 [0,1,0,0,0,1|2,0,0]=4 2158 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1F 2230a_100000751335_200000741388 [0,1,0,0,0,1|2,0,0]=4 2159 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1F 269862a_100000751335_100000210632 [0,1,0,0,0,1|2,0,0]=4 2160 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1F 34a_100000181408_100000764493 [0,1,0,0,0,1|2,0,0]=4 2161 B15R1.8018 CC(NCC(C)(C)O)c1ccccc1I 269862a_100000751335_100000751169 [0,1,0,0,0,1|2,0,0]=4 2162 B15R1.8018 CC(NC[Si](C)(C)C)c1ccccc1Br 2230a_100000181357_100000037933 [0,1,0,0,0,1|1,0,0]=3 2163 B15R1.8018 CC(NC[Si](C)(C)C)c1ccccc1Cl 2230a_100000174978_100000037933 [0,1,0,0,0,1|1,0,0]=3 2164 B15R1.8018 CC(NC[Si](C)(C)C)c1ccccc1F 2230a_100000181408_100000037933 [0,1,0,0,0,1|1,0,0]=3 2165 B15R1.8018 CC(NC[Si](C)(C)C)c1cccnc1O 2230a_100159269580_100000037933 [0,1,0,0,0,1|2,0,0]=4 2166 B15R1.8018 CC(NC[Si](C)(C)C)c1ncccc1Br 2230a_100159271932_100000037933 [0,1,0,0,0,1|2,0,0]=4 2167 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1Br 34a_100000702211_100011219605 [0,1,0,0,0,1|1,0,0]=3 2168 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1Cl 34a_100000740796_100011219605 [0,1,0,0,0,1|1,0,0]=3 2169 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1F 34a_100000697922_100011219605 [0,1,0,0,0,1|1,0,0]=3 2170 B15R1.8018 CC(OCC(C)(C)C)c1cccnc1Cl 34a_100009865335_100011219605 [0,1,0,0,0,1|2,0,0]=4 2171 B15R1.8018 CC(OCC(C)(C)C)c1ccncc1F 34a_100012180158_100011219605 [0,1,0,0,0,1|2,0,0]=4 2172 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1Br 34a_100000702211_100011997219 [0,1,0,0,0,1|2,0,0]=4 2173 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1Cl 34a_100000740796_100011997219 [0,1,0,0,0,1|2,0,0]=4 2174 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1F 34a_100000697922_100011997219 [0,1,0,0,0,1|2,0,0]=4 2175 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1F 34a_100000716592_200000741388 [0,1,0,0,0,1|2,0,0]=4 2176 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Br 34a_100000702211_100000764493 [0,1,0,0,0,1|2,0,0]=4 2177 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Br 7a_100000702211_100000764493 [0,1,0,0,0,1|2,0,0]=4 2178 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Cl 34a_100000740796_100000764493 [0,1,0,0,0,1|2,0,0]=4 2179 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Cl 7a_100000740796_100000764493 [0,1,0,0,0,1|2,0,0]=4 2180 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1F 34a_100000697922_100000764493 [0,1,0,0,0,1|2,0,0]=4 2181 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1F 7a_100000697922_100000764493 [0,1,0,0,0,1|2,0,0]=4 2182 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1N 7a_100011405641_100000764493 [0,1,0,0,0,1|2,0,0]=4 2183 B15R1.8018 CC(OC[Si](C)(C)C)c1ccccc1Br 7a_100000702211_100000233785 [0,1,0,0,0,1|1,0,0]=3 2184 B15R1.8018 CC(OC[Si](C)(C)C)c1ccccc1Cl 7a_100000740796_100000233785 [0,1,0,0,0,1|1,0,0]=3 2185 B15R1.8018 CC(OC[Si](C)(C)C)c1ccccc1F 7a_100000697922_100000233785 [0,1,0,0,0,1|1,0,0]=3 2186 B15R1.8018 CC(OC[Si](C)(C)C)c1ccccc1N 7a_100011405641_100000233785 [0,1,0,0,0,1|1,0,0]=3 2187 B15R1.8018 CC(OC[Si](C)(C)C)c1cccnc1Cl 7a_100009865335_100000233785 [0,1,0,0,0,1|2,0,0]=4 2188 B15R1.8018 CC(SCC(C)(C)C)c1ccccc1Cl 62a_100000181259_100011219605 [0,1,0,0,0,1|1,0,0]=3 2189 B15R1.8018 CC(SCC(C)(C)C)c1ccccc1Cl 62a_100011219605_100000181259 [0,1,0,0,0,1|1,0,0]=3 2190 B15R1.8018 CC(SCC(C)(C)C)c1ccccc1F 62a_100011219605_200000741388 [0,1,0,0,0,1|1,0,0]=3 2191 B15R1.8018 CC(SCC(C)(C)C)c1ccccc1F 62a_200000741388_100011219605 [0,1,0,0,0,1|1,0,0]=3 2192 B15R1.8018 CC(SCC(C)(C)F)c1ccccc1Cl 62a_100000181259_100011997219 [0,1,0,0,0,1|2,0,0]=4 2193 B15R1.8018 CC(SCC(C)(C)F)c1ccccc1Cl 62a_100011997219_100000181259 [0,1,0,0,0,1|2,0,0]=4 2194 B15R1.8018 CC(SCC(C)(C)F)c1ccccc1F 62a_100011997219_200000741388 [0,1,0,0,0,1|2,0,0]=4 2195 B15R1.8018 CC(SCC(C)(C)F)c1ccccc1F 62a_200000741388_100011997219 [0,1,0,0,0,1|2,0,0]=4 2196 B15R1.8018 CC(SCC(C)(C)O)c1ccccc1Cl 62a_100000181259_100000764493 [0,1,0,0,0,1|2,0,0]=4 2197 B15R1.8018 CC(SCC(C)(C)O)c1ccccc1Cl 62a_100000764493_100000181259 [0,1,0,0,0,1|2,0,0]=4 2198 B15R1.8018 CC(SCC(C)(C)O)c1ccccc1F 62a_100000764493_200000741388 [0,1,0,0,0,1|2,0,0]=4 2199 B15R1.8018 CC(SCC(C)(C)O)c1ccccc1F 62a_200000741388_100000764493 [0,1,0,0,0,1|2,0,0]=4 2200 B15R1.8018 CC(SC[N+](C)(C)C)c1ccccc1Cl 62a_100000181259_200000036245 [0,1,0,0,0,1|0,0,0]=2 2201 B15R1.8018 CC(SC[N+](C)(C)C)c1ccccc1Cl 62a_200000036245_100000181259 [0,1,0,0,0,1|0,0,0]=2 2202 B15R1.8018 CC(SC[N+](C)(C)C)c1ccccc1F 62a_200000036245_200000741388 [0,1,0,0,0,1|0,0,0]=2 2203 B15R1.8018 CC(SC[N+](C)(C)C)c1ccccc1F 62a_200000741388_200000036245 [0,1,0,0,0,1|0,0,0]=2 2204 B15R1.8018 CC(SC[Si](C)(C)C)c1ccccc1Cl 62a_100000037933_100000181259 [0,1,0,0,0,1|1,0,0]=3 2205 B15R1.8018 CC(SC[Si](C)(C)C)c1ccccc1Cl 62a_100000181259_100000037933 [0,1,0,0,0,1|1,0,0]=3 2206 B15R1.8018 CC(SC[Si](C)(C)C)c1ccccc1F 62a_100000037933_200000741388 [0,1,0,0,0,1|1,0,0]=3 2207 B15R1.8018 CC(SC[Si](C)(C)C)c1ccccc1F 62a_200000741388_100000037933 [0,1,0,0,0,1|1,0,0]=3 2208 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Br 2230a_100020606079_100000755188 [0,1,0,0,0,1|2,0,0]=4 2209 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Br 269982a_100020606079_100000755188 [0,1,0,0,0,1|2,0,0]=4 2210 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Br 34a_100020606079_100000755188 [0,1,0,0,0,1|2,0,0]=4 2211 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Cl 2230a_100000219374_100000755188 [0,1,0,0,0,1|2,0,0]=4 2212 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Cl 269982a_100000219374_100000755188 [0,1,0,0,0,1|2,0,0]=4 2213 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1Cl 34a_100000219374_100000755188 [0,1,0,0,0,1|2,0,0]=4 2214 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1F 2230a_100000220357_100000755188 [0,1,0,0,0,1|2,0,0]=4 2215 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1F 269982a_100000220357_100000755188 [0,1,0,0,0,1|2,0,0]=4 2216 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1F 34a_100000220357_100000755188 [0,1,0,0,0,1|2,0,0]=4 2217 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1F 38a_100000220357_100000755188 [0,1,0,0,0,1|2,0,0]=4 2218 B15R1.8018 CN(CCC(C)(C)C)c1ccccc1O 269982a_100000033821_100000755188 [0,1,0,0,0,1|2,0,0]=4 2219 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1Br 269982a_100020606079_100000085578 [0,1,0,0,0,1|1,0,0]=3 2220 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1Br 34a_100020606079_100000085578 [0,1,0,0,0,1|1,0,0]=3 2221 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1Cl 269982a_100000219374_100000085578 [0,1,0,0,0,1|1,0,0]=3 2222 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1Cl 34a_100000219374_100000085578 [0,1,0,0,0,1|1,0,0]=3 2223 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1F 269982a_100000220357_100000085578 [0,1,0,0,0,1|1,0,0]=3 2224 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1F 34a_100000220357_100000085578 [0,1,0,0,0,1|1,0,0]=3 2225 B15R1.8018 CN(CC[N+](C)(C)C)c1ccccc1O 269982a_100000033821_100000085578 [0,1,0,0,0,1|1,0,0]=3 2226 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Br 2230a_100020606079_200000733723 [0,1,0,0,0,1|2,0,0]=4 2227 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Br 269982a_100020606079_200000733723 [0,1,0,0,0,1|2,0,0]=4 2228 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Br 34a_100020606079_200000733723 [0,1,0,0,0,1|2,0,0]=4 2229 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Cl 2230a_100000219374_200000733723 [0,1,0,0,0,1|2,0,0]=4 2230 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Cl 269982a_100000219374_200000733723 [0,1,0,0,0,1|2,0,0]=4 2231 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1Cl 34a_100000219374_200000733723 [0,1,0,0,0,1|2,0,0]=4 2232 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1F 2230a_100000220357_200000733723 [0,1,0,0,0,1|2,0,0]=4 2233 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1F 269982a_100000220357_200000733723 [0,1,0,0,0,1|2,0,0]=4 2234 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1F 34a_100000220357_200000733723 [0,1,0,0,0,1|2,0,0]=4 2235 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1F 38a_100000220357_200000733723 [0,1,0,0,0,1|2,0,0]=4 2236 B15R1.8018 CN(CC[Si](C)(C)C)c1ccccc1O 269982a_100000033821_200000733723 [0,1,0,0,0,1|2,0,0]=4 2237 B15R1.8018 C[C@@H](NCC(C)(C)C)c1ccccc1O 270004a_100025703389_100011204126 [0,1,0,0,0,1|1,0,0]=3 2238 B15R1.8018 C[C@@H](NC[Si](C)(C)C)c1ccccc1O 2230a_100025703389_100000037933 [0,1,0,0,0,1|1,0,0]=3 2239 B15R1.8018 C[C@H](OC[Si](C)(C)C)c1ncccc1Br 7a_100013325542_100000233785 [0,1,0,0,0,1|2,0,0]=4 2240 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000085578 [0,1,0,0,0,1|1,0,1]=4 2241 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000085578 [0,1,0,0,0,1|1,0,1]=4 2242 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000085578 [0,1,0,0,0,1|1,0,1]=4 2243 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000085578 [0,1,0,0,0,1|1,0,1]=4 2244 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000085578 [0,1,0,0,0,1|1,0,1]=4 2245 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000085578 [0,1,0,0,0,1|1,0,1]=4 2246 B15R1.8018 Cc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000212026_100000085578 [0,1,0,0,0,1|1,0,1]=4 2247 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)C 269862a_100000743828_100000211656 [0,1,0,0,0,1|1,0,0]=3 2248 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)C 270004a_100000181355_100011204126 [0,1,0,0,0,1|1,0,0]=3 2249 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)C 34a_100000181355_100011219605 [0,1,0,0,0,1|1,0,0]=3 2250 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)F 269862a_100020643315_100000211656 [0,1,0,0,0,1|2,0,0]=4 2251 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)F 34a_100000181355_100011997219 [0,1,0,0,0,1|2,0,0]=4 2252 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)O 269862a_100000751335_100000211656 [0,1,0,0,0,1|2,0,0]=4 2253 B15R1.8018 Cc1ccccc1C(C)NCC(C)(C)O 34a_100000181355_100000764493 [0,1,0,0,0,1|2,0,0]=4 2254 B15R1.8018 Cc1ccccc1C(C)NC[Si](C)(C)C 2230a_100000181355_100000037933 [0,1,0,0,0,1|1,0,0]=3 2255 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)C 34a_100000742021_100011219605 [0,1,0,0,0,1|1,0,0]=3 2256 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)F 34a_100000742021_100011997219 [0,1,0,0,0,1|2,0,0]=4 2257 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 34a_100000742021_100000764493 [0,1,0,0,0,1|2,0,0]=4 2258 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 7a_100000742021_100000764493 [0,1,0,0,0,1|2,0,0]=4 2259 B15R1.8018 Cc1ccccc1C(C)OC[Si](C)(C)C 7a_100000742021_100000233785 [0,1,0,0,0,1|1,0,0]=3 2260 B15R1.8018 Cc1ccccc1N(C)CCC(C)(C)C 2230a_100000219699_100000755188 [0,1,0,0,0,1|2,0,0]=4 2261 B15R1.8018 Cc1ccccc1N(C)CCC(C)(C)C 269982a_100000219699_100000755188 [0,1,0,0,0,1|2,0,0]=4 2262 B15R1.8018 Cc1ccccc1N(C)CCC(C)(C)C 34a_100000219699_100000755188 [0,1,0,0,0,1|2,0,0]=4 2263 B15R1.8018 Cc1ccccc1N(C)CC[N+](C)(C)C 269982a_100000219699_100000085578 [0,1,0,0,0,1|1,0,0]=3 2264 B15R1.8018 Cc1ccccc1N(C)CC[N+](C)(C)C 34a_100000219699_100000085578 [0,1,0,0,0,1|1,0,0]=3 2265 B15R1.8018 Cc1ccccc1N(C)CC[Si](C)(C)C 2230a_100000219699_200000733723 [0,1,0,0,0,1|2,0,0]=4 2266 B15R1.8018 Cc1ccccc1N(C)CC[Si](C)(C)C 269982a_100000219699_200000733723 [0,1,0,0,0,1|2,0,0]=4 2267 B15R1.8018 Cc1ccccc1N(C)CC[Si](C)(C)C 34a_100000219699_200000733723 [0,1,0,0,0,1|2,0,0]=4 2268 B15R1.8018 Cc1cccnc1C(C)NCC(C)(C)C 269862a_100000743828_100011536074 [0,1,0,0,0,1|2,0,0]=4 2269 B15R1.8018 Cc1cccnc1C(C)NCC(C)(C)C 270004a_100011536111_100011204126 [0,1,0,0,0,1|2,0,0]=4 2270 B15R1.8018 Cc1cccnc1C(C)NC[Si](C)(C)C 2230a_100011536111_100000037933 [0,1,0,0,0,1|2,0,0]=4 2271 B15R1.8018 Cc1ccncc1C(C)NCC(C)(C)C 269862a_100000743828_100000693228 [0,1,0,0,0,1|2,0,0]=4 2272 B15R1.8018 Cc1ncccc1C(C)NCC(C)(C)C 269862a_100000743828_100011995960 [0,1,0,0,0,1|2,0,0]=4 2273 B15R1.8277 CC(C)(C)NCC(O)c1cccc(c1)O 34a_100020657549_100000210625 [0,1,0,0,0,1|2,0,0]=4 2274 B15R1.8277 CC(C)(C)OCC(N)c1cccc(c1)Br 34a_100000690078_100000210625 [0,1,0,0,0,1|2,0,0]=4 2275 B15R1.8277 CC(C)(C)OC[C@@H](N)c1cccc(c1)F 34a_100020641251_100000210625 [0,1,0,0,0,1|2,0,0]=4 2276 B15R1.8277 CC(C)(C)OC[C@H](N)c1cccc(c1)Cl 34a_100032004910_100000210625 [0,1,0,0,0,1|2,0,0]=4 2277 B15R1.8277 CC(NCC(C)(C)C)c1cc(ccn1)Br 269862a_100000743828_100000709912 [0,1,0,0,0,1|2,0,0]=4 2278 B15R1.8277 CC(NCC(C)(C)C)c1cc(ccn1)Br 270004a_100000743828_100000709912 [0,1,0,0,0,1|2,0,0]=4 2279 B15R1.8277 CC(NCC(C)(C)C)c1cc(ccn1)Cl 269862a_100000743828_100000099826 [0,1,0,0,0,1|2,0,0]=4 2280 B15R1.8277 CC(NCC(C)(C)C)c1cc(ccn1)Cl 270004a_100000743828_100000099826 [0,1,0,0,0,1|2,0,0]=4 2281 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)Br 269862a_100000743828_100000210093 [0,1,0,0,0,1|1,0,0]=3 2282 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)Br 270004a_100020642005_100011204126 [0,1,0,0,0,1|1,0,0]=3 2283 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)Cl 269862a_100000743828_200000210964 [0,1,0,0,0,1|1,0,0]=3 2284 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)Cl 270004a_100102723534_100011204126 [0,1,0,0,0,1|1,0,0]=3 2285 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)Cl 34a_100102723534_100011219605 [0,1,0,0,0,1|1,0,0]=3 2286 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)F 269862a_100000743828_100000187083 [0,1,0,0,0,1|1,0,0]=3 2287 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)I 269862a_100000743828_100011356966 [0,1,0,0,0,1|1,0,0]=3 2288 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)O 269862a_100000743828_100000211620 [0,1,0,0,0,1|1,0,0]=3 2289 B15R1.8277 CC(NCC(C)(C)C)c1cccc(c1)O 270004a_100000740644_100011204126 [0,1,0,0,0,1|1,0,0]=3 2290 B15R1.8277 CC(NCC(C)(C)C)c1cccc(n1)Br 269862a_100000743828_100009816502 [0,1,0,0,0,1|2,0,0]=4 2291 B15R1.8277 CC(NCC(C)(C)C)c1cccc(n1)Br 270004a_200010173468_100011204126 [0,1,0,0,0,1|2,0,0]=4 2292 B15R1.8277 CC(NCC(C)(C)C)c1cccc(n1)Cl 269862a_100000743828_100000085735 [0,1,0,0,0,1|2,0,0]=4 2293 B15R1.8277 CC(NCC(C)(C)C)c1cccc(n1)F 269862a_100000743828_100000092306 [0,1,0,0,0,1|2,0,0]=4 2294 B15R1.8277 CC(NCC(C)(C)C)c1ccnc(c1)Br 269862a_100000743828_100010177706 [0,1,0,0,0,1|2,0,0]=4 2295 B15R1.8277 CC(NCC(C)(C)C)c1ccnc(c1)Cl 269862a_100000743828_100000685609 [0,1,0,0,0,1|2,0,0]=4 2296 B15R1.8277 CC(NCC(C)(C)C)c1cncc(c1)Br 269862a_100000743828_100011216243 [0,1,0,0,0,1|2,0,0]=4 2297 B15R1.8277 CC(NCC(C)(C)C)c1cncc(c1)F 269862a_100000743828_100000758212 [0,1,0,0,0,1|2,0,0]=4 2298 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)Br 269862a_100020643315_100000210093 [0,1,0,0,0,1|2,0,0]=4 2299 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)Cl 269862a_100020643315_200000210964 [0,1,0,0,0,1|2,0,0]=4 2300 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)Cl 34a_100102723534_100011997219 [0,1,0,0,0,1|2,0,0]=4 2301 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)F 269862a_100020643315_100000187083 [0,1,0,0,0,1|2,0,0]=4 2302 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)I 269862a_100020643315_100011356966 [0,1,0,0,0,1|2,0,0]=4 2303 B15R1.8277 CC(NCC(C)(C)F)c1cccc(c1)O 269862a_100020643315_100000211620 [0,1,0,0,0,1|2,0,0]=4 2304 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)Br 269862a_100000751335_100000210093 [0,1,0,0,0,1|2,0,0]=4 2305 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)Cl 269862a_100000751335_200000210964 [0,1,0,0,0,1|2,0,0]=4 2306 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)Cl 34a_100102723534_100000764493 [0,1,0,0,0,1|2,0,0]=4 2307 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)F 269862a_100000751335_100000187083 [0,1,0,0,0,1|2,0,0]=4 2308 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)I 269862a_100000751335_100011356966 [0,1,0,0,0,1|2,0,0]=4 2309 B15R1.8277 CC(NCC(C)(C)O)c1cccc(c1)O 269862a_100000751335_100000211620 [0,1,0,0,0,1|2,0,0]=4 2310 B15R1.8277 CC(NC[Si](C)(C)C)c1cccc(c1)Br 2230a_100020642005_100000037933 [0,1,0,0,0,1|1,0,0]=3 2311 B15R1.8277 CC(NC[Si](C)(C)C)c1cccc(c1)Cl 2230a_100102723534_100000037933 [0,1,0,0,0,1|1,0,0]=3 2312 B15R1.8277 CC(NC[Si](C)(C)C)c1cccc(c1)O 2230a_100000740644_100000037933 [0,1,0,0,0,1|1,0,0]=3 2313 B15R1.8277 CC(NC[Si](C)(C)C)c1cccc(n1)Br 2230a_200010173468_100000037933 [0,1,0,0,0,1|2,0,0]=4 2314 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)Br 34a_100000246457_100011219605 [0,1,0,0,0,1|1,0,0]=3 2315 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)F 34a_100000744526_100011219605 [0,1,0,0,0,1|1,0,0]=3 2316 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)I 34a_100013085317_100011219605 [0,1,0,0,0,1|1,0,0]=3 2317 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)N 34a_100011217120_100011219605 [0,1,0,0,0,1|1,0,0]=3 2318 B15R1.8277 CC(OCC(C)(C)C)c1cncc(c1)Br 34a_100012351597_100011219605 [0,1,0,0,0,1|2,0,0]=4 2319 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)Br 34a_100000246457_100011997219 [0,1,0,0,0,1|2,0,0]=4 2320 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)F 34a_100000744526_100011997219 [0,1,0,0,0,1|2,0,0]=4 2321 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)I 34a_100013085317_100011997219 [0,1,0,0,0,1|2,0,0]=4 2322 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)N 34a_100011217120_100011997219 [0,1,0,0,0,1|2,0,0]=4 2323 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)Br 34a_100000246457_100000764493 [0,1,0,0,0,1|2,0,0]=4 2324 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)Br 7a_100000246457_100000764493 [0,1,0,0,0,1|2,0,0]=4 2325 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)F 34a_100000744526_100000764493 [0,1,0,0,0,1|2,0,0]=4 2326 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)F 7a_100000744526_100000764493 [0,1,0,0,0,1|2,0,0]=4 2327 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)I 34a_100013085317_100000764493 [0,1,0,0,0,1|2,0,0]=4 2328 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)I 7a_100013085317_100000764493 [0,1,0,0,0,1|2,0,0]=4 2329 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)N 34a_100011217120_100000764493 [0,1,0,0,0,1|2,0,0]=4 2330 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)N 7a_100011217120_100000764493 [0,1,0,0,0,1|2,0,0]=4 2331 B15R1.8277 CC(OC[Si](C)(C)C)c1cc(ccn1)Cl 7a_100000144657_100000233785 [0,1,0,0,0,1|2,0,0]=4 2332 B15R1.8277 CC(OC[Si](C)(C)C)c1cccc(c1)Br 7a_100000246457_100000233785 [0,1,0,0,0,1|1,0,0]=3 2333 B15R1.8277 CC(OC[Si](C)(C)C)c1cccc(c1)F 7a_100000744526_100000233785 [0,1,0,0,0,1|1,0,0]=3 2334 B15R1.8277 CC(OC[Si](C)(C)C)c1cccc(c1)I 7a_100013085317_100000233785 [0,1,0,0,0,1|1,0,0]=3 2335 B15R1.8277 CC(OC[Si](C)(C)C)c1cccc(c1)N 7a_100011217120_100000233785 [0,1,0,0,0,1|1,0,0]=3 2336 B15R1.8277 CC(OC[Si](C)(C)C)c1cccc(n1)Br 7a_100009820884_100000233785 [0,1,0,0,0,1|2,0,0]=4 2337 B15R1.8277 CC(OC[Si](C)(C)C)c1cncc(c1)Br 7a_100012351597_100000233785 [0,1,0,0,0,1|2,0,0]=4 2338 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Br 2230a_100000219648_100000755188 [0,1,0,0,0,1|2,0,0]=4 2339 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Br 269982a_100000219648_100000755188 [0,1,0,0,0,1|2,0,0]=4 2340 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Br 34a_100000219648_100000755188 [0,1,0,0,0,1|2,0,0]=4 2341 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Cl 2230a_100000220044_100000755188 [0,1,0,0,0,1|2,0,0]=4 2342 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Cl 269982a_100000220044_100000755188 [0,1,0,0,0,1|2,0,0]=4 2343 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)Cl 34a_100000220044_100000755188 [0,1,0,0,0,1|2,0,0]=4 2344 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)F 2230a_100020633736_100000755188 [0,1,0,0,0,1|2,0,0]=4 2345 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)F 269982a_100020633736_100000755188 [0,1,0,0,0,1|2,0,0]=4 2346 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)F 34a_100020633736_100000755188 [0,1,0,0,0,1|2,0,0]=4 2347 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)I 2230a_100000221217_100000755188 [0,1,0,0,0,1|2,0,0]=4 2348 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)I 269982a_100000221217_100000755188 [0,1,0,0,0,1|2,0,0]=4 2349 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)I 34a_100000221217_100000755188 [0,1,0,0,0,1|2,0,0]=4 2350 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)O 2230a_100000756613_100000755188 [0,1,0,0,0,1|2,0,0]=4 2351 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)O 269982a_100000756613_100000755188 [0,1,0,0,0,1|2,0,0]=4 2352 B15R1.8277 CN(CCC(C)(C)C)c1cccc(c1)O 34a_100000756613_100000755188 [0,1,0,0,0,1|2,0,0]=4 2353 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)Br 269982a_100000219648_100000085578 [0,1,0,0,0,1|1,0,0]=3 2354 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)Br 34a_100000219648_100000085578 [0,1,0,0,0,1|1,0,0]=3 2355 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)Cl 269982a_100000220044_100000085578 [0,1,0,0,0,1|1,0,0]=3 2356 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)Cl 34a_100000220044_100000085578 [0,1,0,0,0,1|1,0,0]=3 2357 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)F 269982a_100020633736_100000085578 [0,1,0,0,0,1|1,0,0]=3 2358 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)F 34a_100020633736_100000085578 [0,1,0,0,0,1|1,0,0]=3 2359 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)I 269982a_100000221217_100000085578 [0,1,0,0,0,1|1,0,0]=3 2360 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)I 34a_100000221217_100000085578 [0,1,0,0,0,1|1,0,0]=3 2361 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)O 269982a_100000756613_100000085578 [0,1,0,0,0,1|1,0,0]=3 2362 B15R1.8277 CN(CC[N+](C)(C)C)c1cccc(c1)O 34a_100000756613_100000085578 [0,1,0,0,0,1|1,0,0]=3 2363 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Br 2230a_100000219648_200000733723 [0,1,0,0,0,1|2,0,0]=4 2364 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Br 269982a_100000219648_200000733723 [0,1,0,0,0,1|2,0,0]=4 2365 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Br 34a_100000219648_200000733723 [0,1,0,0,0,1|2,0,0]=4 2366 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Cl 2230a_100000220044_200000733723 [0,1,0,0,0,1|2,0,0]=4 2367 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Cl 269982a_100000220044_200000733723 [0,1,0,0,0,1|2,0,0]=4 2368 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)Cl 34a_100000220044_200000733723 [0,1,0,0,0,1|2,0,0]=4 2369 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)F 2230a_100020633736_200000733723 [0,1,0,0,0,1|2,0,0]=4 2370 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)F 269982a_100020633736_200000733723 [0,1,0,0,0,1|2,0,0]=4 2371 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)F 34a_100020633736_200000733723 [0,1,0,0,0,1|2,0,0]=4 2372 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)I 2230a_100000221217_200000733723 [0,1,0,0,0,1|2,0,0]=4 2373 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)I 269982a_100000221217_200000733723 [0,1,0,0,0,1|2,0,0]=4 2374 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)I 34a_100000221217_200000733723 [0,1,0,0,0,1|2,0,0]=4 2375 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)O 2230a_100000756613_200000733723 [0,1,0,0,0,1|2,0,0]=4 2376 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)O 269982a_100000756613_200000733723 [0,1,0,0,0,1|2,0,0]=4 2377 B15R1.8277 CN(CC[Si](C)(C)C)c1cccc(c1)O 34a_100000756613_200000733723 [0,1,0,0,0,1|2,0,0]=4 2378 B15R1.8277 C[C@@H](NCC(C)(C)C)c1cccc(c1)F 270004a_100015193778_100011204126 [0,1,0,0,0,1|1,0,0]=3 2379 B15R1.8277 C[C@@H](NCC(C)(C)C)c1cccc(c1)F 34a_100015193778_100011219605 [0,1,0,0,0,1|1,0,0]=3 2380 B15R1.8277 C[C@@H](NCC(C)(C)C)c1cncc(c1)Br 270004a_100012350620_100011204126 [0,1,0,0,0,1|2,0,0]=4 2381 B15R1.8277 C[C@@H](NCC(C)(C)F)c1cccc(c1)F 34a_100015193778_100011997219 [0,1,0,0,0,1|2,0,0]=4 2382 B15R1.8277 C[C@@H](NCC(C)(C)O)c1cccc(c1)F 34a_100015193778_100000764493 [0,1,0,0,0,1|2,0,0]=4 2383 B15R1.8277 C[C@@H](NC[Si](C)(C)C)c1cccc(c1)F 2230a_100015193778_100000037933 [0,1,0,0,0,1|1,0,0]=3 2384 B15R1.8277 C[C@@H](NC[Si](C)(C)C)c1cncc(c1)Br 2230a_100012350620_100000037933 [0,1,0,0,0,1|2,0,0]=4 2385 B15R1.8277 C[C@@H](OCC(C)(C)C)c1cccc(c1)Cl 34a_100000747380_100011219605 [0,1,0,0,0,1|1,0,0]=3 2386 B15R1.8277 C[C@@H](OCC(C)(C)F)c1cccc(c1)Cl 34a_100000747380_100011997219 [0,1,0,0,0,1|2,0,0]=4 2387 B15R1.8277 C[C@@H](OCC(C)(C)O)c1cccc(c1)Cl 34a_100000747380_100000764493 [0,1,0,0,0,1|2,0,0]=4 2388 B15R1.8277 C[C@@H](OCC(C)(C)O)c1cccc(c1)Cl 7a_100000747380_100000764493 [0,1,0,0,0,1|2,0,0]=4 2389 B15R1.8277 C[C@@H](OC[Si](C)(C)C)c1cccc(c1)Cl 7a_100000747380_100000233785 [0,1,0,0,0,1|1,0,0]=3 2390 B15R1.8277 C[C@H](NCC(C)(C)C)c1cccc(n1)F 270004a_100025709760_100011204126 [0,1,0,0,0,1|2,0,0]=4 2391 B15R1.8277 C[C@H](NCC(C)(C)C)c1cccc(n1)F 34a_100025709760_100011219605 [0,1,0,0,0,1|2,0,0]=4 2392 B15R1.8277 C[C@H](NC[Si](C)(C)C)c1cccc(n1)F 2230a_100025709760_100000037933 [0,1,0,0,0,1|2,0,0]=4 2393 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000085578 [0,1,0,0,0,1|1,0,1]=4 2394 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000085578 [0,1,0,0,0,1|1,0,1]=4 2395 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000085578 [0,1,0,0,0,1|1,0,1]=4 2396 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000085578 [0,1,0,0,0,1|1,0,1]=4 2397 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000085578 [0,1,0,0,0,1|1,0,1]=4 2398 B15R1.8277 Cc1cc(ccn1)C(C)NCC(C)(C)C 269862a_100000743828_100011998260 [0,1,0,0,0,1|2,0,0]=4 2399 B15R1.8277 Cc1cccc(c1)C(=O)CC[N+](C)(C)C 1458a_100000189346_100000085578 [0,1,0,0,0,1|1,0,1]=4 2400 B15R1.8277 Cc1cccc(c1)C(C)NCC(C)(C)C 269862a_100000743828_100000211476 [0,1,0,0,0,1|1,0,0]=3 2401 B15R1.8277 Cc1cccc(c1)C(C)NCC(C)(C)F 269862a_100020643315_100000211476 [0,1,0,0,0,1|2,0,0]=4 2402 B15R1.8277 Cc1cccc(c1)C(C)NCC(C)(C)O 269862a_100000751335_100000211476 [0,1,0,0,0,1|2,0,0]=4 2403 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)C 34a_100000757818_100011219605 [0,1,0,0,0,1|1,0,0]=3 2404 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)F 34a_100000757818_100011997219 [0,1,0,0,0,1|2,0,0]=4 2405 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)O 34a_100000757818_100000764493 [0,1,0,0,0,1|2,0,0]=4 2406 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)O 7a_100000757818_100000764493 [0,1,0,0,0,1|2,0,0]=4 2407 B15R1.8277 Cc1cccc(c1)C(C)OC[Si](C)(C)C 7a_100000757818_100000233785 [0,1,0,0,0,1|1,0,0]=3 2408 B15R1.8277 Cc1cccc(c1)N(C)CCC(C)(C)C 2230a_100000219674_100000755188 [0,1,0,0,0,1|2,0,0]=4 2409 B15R1.8277 Cc1cccc(c1)N(C)CCC(C)(C)C 269982a_100000219674_100000755188 [0,1,0,0,0,1|2,0,0]=4 2410 B15R1.8277 Cc1cccc(c1)N(C)CCC(C)(C)C 34a_100000219674_100000755188 [0,1,0,0,0,1|2,0,0]=4 2411 B15R1.8277 Cc1cccc(c1)N(C)CC[N+](C)(C)C 269982a_100000219674_100000085578 [0,1,0,0,0,1|1,0,0]=3 2412 B15R1.8277 Cc1cccc(c1)N(C)CC[N+](C)(C)C 34a_100000219674_100000085578 [0,1,0,0,0,1|1,0,0]=3 2413 B15R1.8277 Cc1cccc(c1)N(C)CC[Si](C)(C)C 2230a_100000219674_200000733723 [0,1,0,0,0,1|2,0,0]=4 2414 B15R1.8277 Cc1cccc(c1)N(C)CC[Si](C)(C)C 269982a_100000219674_200000733723 [0,1,0,0,0,1|2,0,0]=4 2415 B15R1.8277 Cc1cccc(c1)N(C)CC[Si](C)(C)C 34a_100000219674_200000733723 [0,1,0,0,0,1|2,0,0]=4 2416 B15R1.8277 Cc1cccc(c1)[C@@H](C)NCC(C)(C)C 270004a_100000698126_100011204126 [0,1,0,0,0,1|1,0,0]=3 2417 B15R1.8277 Cc1cccc(c1)[C@@H](C)NCC(C)(C)C 34a_100000698126_100011219605 [0,1,0,0,0,1|1,0,0]=3 2418 B15R1.8277 Cc1cccc(c1)[C@@H](C)NCC(C)(C)F 34a_100000698126_100011997219 [0,1,0,0,0,1|2,0,0]=4 2419 B15R1.8277 Cc1cccc(c1)[C@@H](C)NCC(C)(C)O 34a_100000698126_100000764493 [0,1,0,0,0,1|2,0,0]=4 2420 B15R1.8277 Cc1cccc(c1)[C@@H](C)NC[Si](C)(C)C 2230a_100000698126_100000037933 [0,1,0,0,0,1|1,0,0]=3 2421 B15R1.8277 Cc1cccc(c1)[C@H](N)COC(C)(C)C 34a_100009818812_100000210625 [0,1,0,0,0,1|2,0,0]=4 2422 B15R1.8277 Cc1cccc(n1)C(C)NCC(C)(C)C 269862a_100000743828_100011877301 [0,1,0,0,0,1|2,0,0]=4 2423 B15R1.8277 Cc1cccc(n1)C(C)NCC(C)(C)C 270004a_100011877385_100011204126 [0,1,0,0,0,1|2,0,0]=4 2424 B15R1.8277 Cc1cccc(n1)C(C)NC[Si](C)(C)C 2230a_100011877385_100000037933 [0,1,0,0,0,1|2,0,0]=4 2425 B15R1.8277 Cc1cccc(n1)C(C)OCC(C)(C)C 34a_200011877368_100011219605 [0,1,0,0,0,1|2,0,0]=4 2426 B15R1.8277 Cc1cccc(n1)C(C)OC[Si](C)(C)C 7a_200011877368_100000233785 [0,1,0,0,0,1|2,0,0]=4 2427 B15R1.8277 Cc1ccnc(c1)C(C)NCC(C)(C)C 269862a_100000743828_100000728896 [0,1,0,0,0,1|2,0,0]=4 2428 B15R1.8277 Cc1ccnc(c1)C(C)NCC(C)(C)C 270004a_100000743828_100000728896 [0,1,0,0,0,1|2,0,0]=4 2429 B15R1.8277 Cc1ccnc(c1)C(C)NCC(C)(C)C 270004a_100011933787_100011204126 [0,1,0,0,0,1|2,0,0]=4 2430 B15R1.8277 Cc1ccnc(c1)C(C)NC[Si](C)(C)C 2230a_100011933787_100000037933 [0,1,0,0,0,1|2,0,0]=4 2431 B15R1.8277 Cc1cncc(c1)C(C)NCC(C)(C)C 269862a_100000743828_100000702010 [0,1,0,0,0,1|2,0,0]=4 2432 B15R1.23261 CC(C)(C)CNC(C)(C)c1ccccc1 2230a_100000743828_100000034625 [0,1,0,0,0,1|1,0,0]=3 2433 B15R1.23261 CC(C)(C)CNC(C)(C)c1ccccc1 270004a_100011218174_100011204126 [0,1,0,0,0,1|1,0,0]=3 2434 B15R1.23261 CC(C)(C)CNC(C)(C)c1ccccn1 270004a_100011999416_100011204126 [0,1,0,0,0,1|2,0,0]=4 2435 B15R1.23261 CC(C)(C)CNC(C)(C)c1cccnc1 270004a_100011376175_100011204126 [0,1,0,0,0,1|2,0,0]=4 2436 B15R1.23261 CC(C)(C)CSC(C)(C)c1ccccc1 62a_100000034625_100011219605 [0,1,0,0,0,1|1,0,0]=3 2437 B15R1.23261 CC(C)(C)CSC(C)(C)c1ccccc1 62a_100011219605_100000034625 [0,1,0,0,0,1|1,0,0]=3 2438 B15R1.23261 CC(C)(C)CSC(F)(F)c1ccccc1 62a_100011219605_100000036403 [0,1,0,0,0,1|2,0,0]=4 2439 B15R1.23261 CC(C)(C)NCC(F)(F)c1ccccc1 34a_100000717977_100000210625 [0,1,0,0,0,1|2,0,0]=4 2440 B15R1.23261 CC(C)(C)NC[Si](C)(C)c1ccccc1 2230a_100000715429_100000038972 [0,1,0,0,0,1|1,1,0]=4 2441 B15R1.23261 CC(C)(C)OCC(F)(F)c1ccccc1 34a_100015890283_100009875531 [0,1,0,0,0,1|2,0,0]=4 2442 B15R1.23261 CC(C)(C)OC[Si](C)(C)c1ccccc1 7a_100015890283_100000038972 [0,1,0,0,0,1|1,1,0]=4 2443 B15R1.23261 CC(C)(C)SCC(C)(C)c1ccccc1 62a_100000211941_100000703224 [0,1,0,0,0,1|1,0,0]=3 2444 B15R1.23261 CC(C)(C)SCC(C)(C)c1ccccc1 62a_100000703224_100000211941 [0,1,0,0,0,1|1,0,0]=3 2445 B15R1.23261 CC(C)(C)SCC(F)(F)c1ccccc1 62a_100000211941_100009875531 [0,1,0,0,0,1|2,0,0]=4 2446 B15R1.23261 CC(C)(C)SCC(F)(F)c1ccccc1 62a_100009875531_100000211941 [0,1,0,0,0,1|2,0,0]=4 2447 B15R1.23261 CC(C)(C)SC[Si](C)(C)c1ccccc1 62a_100000038972_100000211941 [0,1,0,0,0,1|1,1,0]=4 2448 B15R1.23261 CC(C)(C)SC[Si](C)(C)c1ccccc1 62a_100000211941_100000038972 [0,1,0,0,0,1|1,1,0]=4 2449 B15R1.23261 CC(C)(F)CNC(C)(C)c1ccccc1 2230a_100020643315_100000034625 [0,1,0,0,0,1|2,0,0]=4 2450 B15R1.23261 CC(C)(F)CSC(C)(C)c1ccccc1 62a_100000034625_100011997219 [0,1,0,0,0,1|2,0,0]=4 2451 B15R1.23261 CC(C)(F)CSC(C)(C)c1ccccc1 62a_100011997219_100000034625 [0,1,0,0,0,1|2,0,0]=4 2452 B15R1.23261 CC(C)(NC[Si](C)(C)C)c1ccccc1 2230a_100011218174_100000037933 [0,1,0,0,0,1|1,0,0]=3 2453 B15R1.23261 CC(C)(NC[Si](C)(C)C)c1ccccn1 2230a_100011999416_100000037933 [0,1,0,0,0,1|2,0,0]=4 2454 B15R1.23261 CC(C)(NC[Si](C)(C)C)c1cccnc1 2230a_100011376175_100000037933 [0,1,0,0,0,1|2,0,0]=4 2455 B15R1.23261 CC(C)(O)CNC(C)(C)c1ccccc1 2230a_100000751335_100000034625 [0,1,0,0,0,1|2,0,0]=4 2456 B15R1.23261 CC(C)(O)COC(C)(C)c1ccccc1 7a_100000694644_100000764493 [0,1,0,0,0,1|2,0,0]=4 2457 B15R1.23261 CC(C)(O)CSC(C)(C)c1ccccc1 62a_100000034625_100000764493 [0,1,0,0,0,1|2,0,0]=4 2458 B15R1.23261 CC(C)(O)CSC(C)(C)c1ccccc1 62a_100000764493_100000034625 [0,1,0,0,0,1|2,0,0]=4 2459 B15R1.23261 CC(C)(OC[Si](C)(C)C)c1ccccc1 7a_100000694644_100000233785 [0,1,0,0,0,1|1,0,0]=3 2460 B15R1.23261 CC(C)(OC[Si](C)(C)C)c1ccccn1 7a_100000041474_100000233785 [0,1,0,0,0,1|2,0,0]=4 2461 B15R1.23261 CC(C)(SC[N+](C)(C)C)c1ccccc1 62a_100000034625_200000036245 [0,1,0,0,0,1|0,0,0]=2 2462 B15R1.23261 CC(C)(SC[N+](C)(C)C)c1ccccc1 62a_200000036245_100000034625 [0,1,0,0,0,1|0,0,0]=2 2463 B15R1.23261 CC(C)(SC[Si](C)(C)C)c1ccccc1 62a_100000034625_100000037933 [0,1,0,0,0,1|1,0,0]=3 2464 B15R1.23261 CC(C)(SC[Si](C)(C)C)c1ccccc1 62a_100000037933_100000034625 [0,1,0,0,0,1|1,0,0]=3 2465 B15R1.23261 C[N+](C)(C)CSC(F)(F)c1ccccc1 62a_200000036245_100000036403 [0,1,0,0,0,1|1,0,0]=3 2466 B15R1.23261 C[Si](C)(C)CSC(F)(F)c1ccccc1 62a_100000037933_100000036403 [0,1,0,0,0,1|2,0,0]=4 2467 B15R1.299 CC(NC(C)(C)CO)c1ccc(cc1)Br 2230a_100000210608_100000755118 [0,2,0,0,0,0|2,0,0]=4 2468 B15R1.299 CC(NC(C)(C)CO)c1ccc(cc1)Cl 2230a_100000210608_100000684792 [0,2,0,0,0,0|2,0,0]=4 2469 B15R1.299 CC(NC(C)(C)CO)c1ccc(cc1)F 2230a_100000210608_100000743420 [0,2,0,0,0,0|2,0,0]=4 2470 B15R1.299 CC(OC(C)(C)CCl)c1ccc(cc1)Cl 7a_100000764493_100000684792 [0,2,0,0,0,0|2,0,0]=4 2471 B15R1.299 CC(OC(C)(C)CCl)c1ccc(cc1)F 7a_100000764493_100000743420 [0,2,0,0,0,0|2,0,0]=4 2472 B15R1.299 CCC(C)(C)NC(C)c1ccc(cc1)Br 2230a_100000211385_100000755118 [0,2,0,0,0,0|2,0,0]=4 2473 B15R1.299 CCC(C)(C)NC(C)c1ccc(cc1)C 2230a_100000211385_100011261388 [0,2,0,0,0,0|2,0,0]=4 2474 B15R1.299 CCC(C)(C)NC(C)c1ccc(cc1)Cl 2230a_100000211385_100000684792 [0,2,0,0,0,0|2,0,0]=4 2475 B15R1.299 CCC(C)(C)NC(C)c1ccc(cc1)F 2230a_100000211385_100000743420 [0,2,0,0,0,0|2,0,0]=4 2476 B15R1.299 CCC(C)(C)OC(C)c1ccc(cc1)Br 7a_100000745893_100000210677 [0,2,0,0,0,0|2,0,0]=4 2477 B15R1.299 CCC(C)(C)OC(C)c1ccc(cc1)C 7a_100000210230_100011261388 [0,2,0,0,0,0|2,0,0]=4 2478 B15R1.299 CCC(C)(C)OC(C)c1ccc(cc1)Cl 7a_100000210230_100000684792 [0,2,0,0,0,0|2,0,0]=4 2479 B15R1.299 CCC(C)(C)OC(C)c1ccc(cc1)F 7a_100000181323_100000210677 [0,2,0,0,0,0|2,0,0]=4 2480 B15R1.299 CCC(C)(C)OC(C)c1ccc(cc1)F 7a_100000210230_100000743420 [0,2,0,0,0,0|2,0,0]=4 2481 B15R1.299 CCC(C)(C)O[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210677 [0,2,0,0,0,0|2,0,0]=4 2482 B15R1.299 CCC(C)(C)O[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210677 [0,2,0,0,0,0|2,0,0]=4 2483 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)Br 62a_100000032637_100000755118 [0,2,0,0,0,0|2,0,0]=4 2484 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)Br 62a_100000755118_100000032637 [0,2,0,0,0,0|2,0,0]=4 2485 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)C 62a_100000032637_100011261388 [0,2,0,0,0,0|2,0,0]=4 2486 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)C 62a_100011261388_100000032637 [0,2,0,0,0,0|2,0,0]=4 2487 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)Cl 62a_100000032637_100000684792 [0,2,0,0,0,0|2,0,0]=4 2488 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)Cl 62a_100000684792_100000032637 [0,2,0,0,0,0|2,0,0]=4 2489 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)F 62a_100000032637_100000743420 [0,2,0,0,0,0|2,0,0]=4 2490 B15R1.299 CCC(C)(C)SC(C)c1ccc(cc1)F 62a_100000743420_100000032637 [0,2,0,0,0,0|2,0,0]=4 2491 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)Br 34a_100000219623_100009813988 [0,2,0,0,0,0|2,0,0]=4 2492 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)Cl 34a_100020629279_100009813988 [0,2,0,0,0,0|2,0,0]=4 2493 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)F 34a_100000219829_100009813988 [0,2,0,0,0,0|2,0,0]=4 2494 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)I 34a_100000743151_100009813988 [0,2,0,0,0,0|2,0,0]=4 2495 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)O 34a_100000182112_100009813988 [0,2,0,0,0,0|2,0,0]=4 2496 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000701081 [0,2,0,0,0,0|2,0,0]=4 2497 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)Br 34a_100000219623_100000701081 [0,2,0,0,0,0|2,0,0]=4 2498 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)C 269982a_100000219977_100000701081 [0,2,0,0,0,0|2,0,0]=4 2499 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)C 34a_100000219977_100000701081 [0,2,0,0,0,0|2,0,0]=4 2500 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000701081 [0,2,0,0,0,0|2,0,0]=4 2501 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000701081 [0,2,0,0,0,0|2,0,0]=4 2502 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)F 269982a_100000219829_100000701081 [0,2,0,0,0,0|2,0,0]=4 2503 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)F 34a_100000219829_100000701081 [0,2,0,0,0,0|2,0,0]=4 2504 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)I 269982a_100000743151_100000701081 [0,2,0,0,0,0|2,0,0]=4 2505 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)I 34a_100000743151_100000701081 [0,2,0,0,0,0|2,0,0]=4 2506 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)O 269982a_100000182112_100000701081 [0,2,0,0,0,0|2,0,0]=4 2507 B15R1.299 COC(C)(C)CN(C)c1ccc(cc1)O 34a_100000182112_100000701081 [0,2,0,0,0,0|2,0,0]=4 2508 B15R1.299 Cc1ccc(cc1)C(C)NC(C)(C)CO 2230a_100000210608_100011261388 [0,2,0,0,0,0|2,0,0]=4 2509 B15R1.299 Cc1ccc(cc1)C(C)OC(C)(C)CCl 7a_100000764493_100011261388 [0,2,0,0,0,0|2,0,0]=4 2510 B15R1.299 Cc1ccc(cc1)N(C)CC(C)(C)CO 34a_100000219977_100009813988 [0,2,0,0,0,0|2,0,0]=4 2511 B15R1.300 CCC(C)(C)OC(C)c1cccc(c1)Br 7a_100000246457_100000210677 [0,2,0,0,0,0|2,0,0]=4 2512 B15R1.300 CCC(C)(C)OC(C)c1cccc(c1)C 7a_100000757818_100000210677 [0,2,0,0,0,0|2,0,0]=4 2513 B15R1.300 CCC(C)(C)OC(C)c1cccc(c1)F 7a_100000744526_100000210677 [0,2,0,0,0,0|2,0,0]=4 2514 B15R1.300 CCC(C)(C)OC(C)c1cccc(c1)I 7a_100013085317_100000210677 [0,2,0,0,0,0|2,0,0]=4 2515 B15R1.300 CCC(C)(C)OC(C)c1cccc(c1)N 7a_100011217120_100000210677 [0,2,0,0,0,0|2,0,0]=4 2516 B15R1.300 CCC(C)(C)O[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210677 [0,2,0,0,0,0|2,0,0]=4 2517 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)Br 34a_100000219648_100009813988 [0,2,0,0,0,0|2,0,0]=4 2518 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)Cl 34a_100000220044_100009813988 [0,2,0,0,0,0|2,0,0]=4 2519 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)F 34a_100020633736_100009813988 [0,2,0,0,0,0|2,0,0]=4 2520 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)I 34a_100000221217_100009813988 [0,2,0,0,0,0|2,0,0]=4 2521 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)O 34a_100000756613_100009813988 [0,2,0,0,0,0|2,0,0]=4 2522 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)Br 269982a_100000219648_100000701081 [0,2,0,0,0,0|2,0,0]=4 2523 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)Br 34a_100000219648_100000701081 [0,2,0,0,0,0|2,0,0]=4 2524 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)C 269982a_100000219674_100000701081 [0,2,0,0,0,0|2,0,0]=4 2525 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)C 34a_100000219674_100000701081 [0,2,0,0,0,0|2,0,0]=4 2526 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000701081 [0,2,0,0,0,0|2,0,0]=4 2527 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)Cl 34a_100000220044_100000701081 [0,2,0,0,0,0|2,0,0]=4 2528 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)F 269982a_100020633736_100000701081 [0,2,0,0,0,0|2,0,0]=4 2529 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)F 34a_100020633736_100000701081 [0,2,0,0,0,0|2,0,0]=4 2530 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)I 269982a_100000221217_100000701081 [0,2,0,0,0,0|2,0,0]=4 2531 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)I 34a_100000221217_100000701081 [0,2,0,0,0,0|2,0,0]=4 2532 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000701081 [0,2,0,0,0,0|2,0,0]=4 2533 B15R1.300 COC(C)(C)CN(C)c1cccc(c1)O 34a_100000756613_100000701081 [0,2,0,0,0,0|2,0,0]=4 2534 B15R1.300 Cc1cccc(c1)N(C)CC(C)(C)CO 34a_100000219674_100009813988 [0,2,0,0,0,0|2,0,0]=4 2535 B15R1.337 CC(C)(CO)NC(C)(C)c1ccccc1 2230a_100000210608_100000034625 [0,2,0,0,0,0|2,0,0]=4 2536 B15R1.337 CCC(C)(C)NC(C)(C)c1ccccc1 2230a_100000211385_100000034625 [0,2,0,0,0,0|2,0,0]=4 2537 B15R1.337 CCC(C)(C)OC(C)(C)c1ccccc1 7a_100000694644_100000210677 [0,2,0,0,0,0|2,0,0]=4 2538 B15R1.337 CCC(C)(C)SC(C)(C)c1ccccc1 62a_100000032637_100000034625 [0,2,0,0,0,0|2,0,0]=4 2539 B15R1.337 CCC(C)(C)SC(C)(C)c1ccccc1 62a_100000034625_100000032637 [0,2,0,0,0,0|2,0,0]=4 2540 B15R1.2992 CCC(C)(CC)OC(C)c1ccccc1 7a_100000755174_100000230085 [0,2,0,0,0,0|2,0,0]=4 2541 B15R1.2992 CCC(C)(CC)O[C@H](C)c1ccccc1 7a_100000761318_100009817345 [0,2,0,0,0,0|2,0,0]=4 2542 B15R1.2992 CCC(C)(CC)SC(C)c1ccccc1 62a_100000230085_100009817345 [0,2,0,0,0,0|2,0,0]=4 2543 B15R1.2992 CCC(C)(CC)SC(C)c1ccccc1 62a_100009817345_100000230085 [0,2,0,0,0,0|2,0,0]=4 2544 B15R1.2992 COC(C)(CN(C)c1ccccc1)OC 2230a_100000210012_100000064154 [0,2,0,0,0,0|2,0,0]=4 2545 B15R1.2992 COC(C)(CN(C)c1ccccc1)OC 269982a_100000210012_100000766008 [0,2,0,0,0,0|2,0,0]=4 2546 B15R1.2992 COC(C)(CN(C)c1ccccc1)OC 34a_100000210012_100000766008 [0,2,0,0,0,0|2,0,0]=4 2547 B15R1.2992 CO[Si](C)(CN(C)c1ccccc1)OC 269982a_100000210012_100000067953 [0,2,0,0,0,0|2,0,0]=4 2548 B15R1.3001 CC(C(=O)C(C)(C)CF)c1ccccc1 1458a_100000138116_100000230085 [0,2,0,0,0,0|1,0,1]=4 2549 B15R1.3001 CC(C(=O)C(C)(C)CO)c1ccccc1 1458a_100000749806_100000230085 [0,2,0,0,0,0|1,0,1]=4 2550 B15R1.3001 CC(c1ccccc1)N(C)C(C)(C)CO 269982a_100015204102_100000230085 [0,2,0,0,0,0|2,0,0]=4 2551 B15R1.3001 CCC(C)(C)C(=O)C(C)c1ccccc1 1458a_100000749717_100000230085 [0,2,0,0,0,0|1,0,1]=4 2552 B15R1.3001 CCC(C)(C)N(C)C(C)c1ccccc1 2230a_200000755171_100000230085 [0,2,0,0,0,0|2,0,0]=4 2553 B15R1.3001 CCC(C)(C)N(C)C(C)c1ccccc1 269982a_100000195388_100000032637 [0,2,0,0,0,0|2,0,0]=4 2554 B15R1.3001 CCC(C)(C)N(C)C(C)c1ccccc1 269982a_200000755171_100000230085 [0,2,0,0,0,0|2,0,0]=4 2555 B15R1.3001 COC(C)(C)C(=O)C(C)c1ccccc1 1458a_100000753492_100000230085 [0,2,0,0,0,0|1,0,1]=4 2556 B15R1.7724 CC(NC(C)(C)CO)c1ccccc1Cl 2230a_100000210608_100000181259 [0,2,0,0,0,0|2,0,0]=4 2557 B15R1.7724 CC(NC(C)(C)CO)c1ccccc1F 2230a_100000210608_200000741388 [0,2,0,0,0,0|2,0,0]=4 2558 B15R1.7724 CC(OC(C)(C)CCl)c1ccccc1Cl 7a_100000764493_100000181259 [0,2,0,0,0,0|2,0,0]=4 2559 B15R1.7724 CC(OC(C)(C)CCl)c1ccccc1F 7a_100000764493_200000741388 [0,2,0,0,0,0|2,0,0]=4 2560 B15R1.7724 CCC(C)(C)NC(C)c1ccccc1Cl 2230a_100000211385_100000181259 [0,2,0,0,0,0|2,0,0]=4 2561 B15R1.7724 CCC(C)(C)NC(C)c1ccccc1F 2230a_100000211385_200000741388 [0,2,0,0,0,0|2,0,0]=4 2562 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1Br 7a_100000702211_100000210677 [0,2,0,0,0,0|2,0,0]=4 2563 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1C 7a_100000742021_100000210677 [0,2,0,0,0,0|2,0,0]=4 2564 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1Cl 7a_100000210230_100000181259 [0,2,0,0,0,0|2,0,0]=4 2565 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1Cl 7a_100000740796_100000210677 [0,2,0,0,0,0|2,0,0]=4 2566 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1F 7a_100000210230_200000741388 [0,2,0,0,0,0|2,0,0]=4 2567 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1F 7a_100000697922_100000210677 [0,2,0,0,0,0|2,0,0]=4 2568 B15R1.7724 CCC(C)(C)OC(C)c1ccccc1N 7a_100011405641_100000210677 [0,2,0,0,0,0|2,0,0]=4 2569 B15R1.7724 CCC(C)(C)SC(C)c1ccccc1Cl 62a_100000032637_100000181259 [0,2,0,0,0,0|2,0,0]=4 2570 B15R1.7724 CCC(C)(C)SC(C)c1ccccc1Cl 62a_100000181259_100000032637 [0,2,0,0,0,0|2,0,0]=4 2571 B15R1.7724 CCC(C)(C)SC(C)c1ccccc1F 62a_100000032637_200000741388 [0,2,0,0,0,0|2,0,0]=4 2572 B15R1.7724 CCC(C)(C)SC(C)c1ccccc1F 62a_200000741388_100000032637 [0,2,0,0,0,0|2,0,0]=4 2573 B15R1.7724 CN(CC(C)(C)CO)c1ccccc1Br 34a_100020606079_100009813988 [0,2,0,0,0,0|2,0,0]=4 2574 B15R1.7724 CN(CC(C)(C)CO)c1ccccc1Cl 34a_100000219374_100009813988 [0,2,0,0,0,0|2,0,0]=4 2575 B15R1.7724 CN(CC(C)(C)CO)c1ccccc1F 34a_100000220357_100009813988 [0,2,0,0,0,0|2,0,0]=4 2576 B15R1.7724 COC(C)(C)CN(C)c1ccccc1Br 269982a_100020606079_100000701081 [0,2,0,0,0,0|2,0,0]=4 2577 B15R1.7724 COC(C)(C)CN(C)c1ccccc1Br 34a_100020606079_100000701081 [0,2,0,0,0,0|2,0,0]=4 2578 B15R1.7724 COC(C)(C)CN(C)c1ccccc1C 269982a_100000219699_100000701081 [0,2,0,0,0,0|2,0,0]=4 2579 B15R1.7724 COC(C)(C)CN(C)c1ccccc1C 34a_100000219699_100000701081 [0,2,0,0,0,0|2,0,0]=4 2580 B15R1.7724 COC(C)(C)CN(C)c1ccccc1Cl 269982a_100000219374_100000701081 [0,2,0,0,0,0|2,0,0]=4 2581 B15R1.7724 COC(C)(C)CN(C)c1ccccc1Cl 34a_100000219374_100000701081 [0,2,0,0,0,0|2,0,0]=4 2582 B15R1.7724 COC(C)(C)CN(C)c1ccccc1F 269982a_100000220357_100000701081 [0,2,0,0,0,0|2,0,0]=4 2583 B15R1.7724 COC(C)(C)CN(C)c1ccccc1F 34a_100000220357_100000701081 [0,2,0,0,0,0|2,0,0]=4 2584 B15R1.7724 COC(C)(C)CN(C)c1ccccc1O 269982a_100000033821_100000701081 [0,2,0,0,0,0|2,0,0]=4 2585 B15R1.7724 Cc1ccccc1N(C)CC(C)(C)CO 34a_100000219699_100009813988 [0,2,0,0,0,0|2,0,0]=4 2586 B15R1.9011 CC(=O)C(C)(C)OC(C)c1ccccc1 34a_100000747739_100000211855 [0,2,0,0,0,0|2,0,0]=4 2587 B15R1.9011 CC(=O)C(C)(C)OC(C)c1ccccc1 7a_100000747739_100000230085 [0,2,0,0,0,0|2,0,0]=4 2588 B15R1.9011 CC(=O)C(C)(C)O[C@H](C)c1ccccc1 7a_100000761318_100000075568 [0,2,0,0,0,0|2,0,0]=4 2589 B15R1.9011 CC(=O)C(C)(C)SC(C)c1ccccc1 62a_100000075568_100000230085 [0,2,0,0,0,0|2,0,0]=4 2590 B15R1.9011 CC(=O)C(C)(C)SC(C)c1ccccc1 62a_100000230085_100000075568 [0,2,0,0,0,0|2,0,0]=4 2591 B15R1.9011 CC(NC(C)(C)C(C)C)c1ccccc1 2230a_200160471154_100000230085 [0,2,0,0,0,0|2,0,0]=4 2592 B15R1.9011 CC(OC(C)(C)C(C)C)c1ccccc1 7a_100011215261_100000230085 [0,2,0,0,0,0|2,0,0]=4 2593 B15R1.9011 CC(SC(C)(C)N(C)C)c1ccccc1 62a_100000230085_217856628674 [0,2,0,0,0,0|2,0,0]=4 2594 B15R1.9011 CC(SC(C)(C)N(C)C)c1ccccc1 62a_217856628674_100000230085 [0,2,0,0,0,0|2,0,0]=4 2595 B15R1.9724 C=CCC(C)(C)OC(C)c1ccccc1 7a_100011995686_100000230085 [0,2,0,0,0,0|2,0,0]=4 2596 B15R1.9724 C=CC[Si](C)(C)CN(C)c1ccccc1 2230a_100000210012_100000046978 [0,2,0,0,0,0|2,0,0]=4 2597 B15R1.9724 CC(OC(C)(C)CCBr)c1ccccc1 7a_100000702414_100000230085 [0,2,0,0,0,0|2,0,0]=4 2598 B15R1.9724 CCCC(C)(C)OC(C)c1ccccc1 7a_100000748436_100000230085 [0,2,0,0,0,0|2,0,0]=4 2599 B15R1.9724 CN(C[N+](C)(C)CCO)c1ccccc1 269982a_100000210012_200010270792 [0,2,0,0,0,0|1,0,0]=3 2600 B15R1.9724 COCC(C)(C)NC(C)c1ccccc1 2230a_100000752728_100000230085 [0,2,0,0,0,0|2,0,0]=4 2601 B15R1.9724 CSCC(C)(C)NC(C)c1ccccc1 2230a_100000759623_100000230085 [0,2,0,0,0,0|2,0,0]=4 2602 B15R1.9724 CSCC(C)(C)NC(C)c1ccccc1 7a_100000759623_100000230085 [0,2,0,0,0,0|2,0,0]=4 2603 B15R1.10044 CCC(C)(C)OC(CBr)c1ccccc1 7a_100000185958_100000210677 [0,2,0,0,0,0|2,0,0]=4 2604 B15R1.10044 CCC(C)(C)O[C@H](CCl)c1ccccc1 7a_100011933945_100000210677 [0,2,0,0,0,0|2,0,0]=4 2605 B15R1.10044 CCC(OC(C)(C)CC)c1ccccc1 7a_100000698172_100000210677 [0,2,0,0,0,0|2,0,0]=4 2606 B15R1.10044 CCN(CC(C)(C)CO)c1ccccc1 34a_100000210013_100009813988 [0,2,0,0,0,0|2,0,0]=4 2607 B15R1.10044 CCN(CC(C)(C)OC)c1ccccc1 269982a_100000210013_100000701081 [0,2,0,0,0,0|2,0,0]=4 2608 B15R1.10044 CCN(CC(C)(C)OC)c1ccccc1 34a_100000210013_100000701081 [0,2,0,0,0,0|2,0,0]=4 2609 B15R1.665 CC(C)(C)NC(CO)c1ccc(cc1)Br 34a_100000734186_100000210625 [0,2,0,0,0,0|2,0,0]=4 2610 B15R1.665 CC(C)(C)NC(CO)c1ccc(cc1)F 34a_100000705410_100000210625 [0,2,0,0,0,0|2,0,0]=4 2611 B15R1.665 CC(C)(C)N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000210625 [0,2,0,0,0,0|2,0,0]=4 2612 B15R1.665 CC(C)(C)OC(CCl)c1ccc(cc1)Cl 34a_200011996143_100000210625 [0,2,0,0,0,0|2,0,0]=4 2613 B15R1.665 CC(C)(C)OC(CN)c1ccc(cc1)Br 34a_100020626992_100000210625 [0,2,0,0,0,0|2,0,0]=4 2614 B15R1.665 CC(C)(C)OC(CN)c1ccc(cc1)Cl 34a_100000736658_100000210625 [0,2,0,0,0,0|2,0,0]=4 2615 B15R1.665 CC(C)(C)O[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_100000210625 [0,2,0,0,0,0|2,0,0]=4 2616 B15R1.665 CCC(NC(C)(C)C)c1ccc(cc1)C 34a_100000749201_100000210625 [0,2,0,0,0,0|2,0,0]=4 2617 B15R1.665 CCC(NC(C)(C)C)c1ccc(cc1)F 34a_100011191751_100000210625 [0,2,0,0,0,0|2,0,0]=4 2618 B15R1.665 CCC(NC(C)(C)C)c1ccc(cc1)O 34a_100015187210_100000210625 [0,2,0,0,0,0|2,0,0]=4 2619 B15R1.665 CCC(OC(C)(C)C)c1ccc(cc1)Br 34a_100000246506_100000210625 [0,2,0,0,0,0|2,0,0]=4 2620 B15R1.665 CCC(OC(C)(C)C)c1ccc(cc1)C 34a_100000246521_100000210625 [0,2,0,0,0,0|2,0,0]=4 2621 B15R1.665 CCC(OC(C)(C)C)c1ccc(cc1)Cl 34a_100000246471_100000210625 [0,2,0,0,0,0|2,0,0]=4 2622 B15R1.665 CCC(OC(C)(C)C)c1ccc(cc1)F 34a_100000246474_100000210625 [0,2,0,0,0,0|2,0,0]=4 2623 B15R1.665 CCN(CC(C)(C)C)c1ccc(cc1)Br 34a_100000219632_100011219605 [0,2,0,0,0,0|2,0,0]=4 2624 B15R1.665 CCN(CC(C)(C)C)c1ccc(cc1)C 34a_100000219985_100011219605 [0,2,0,0,0,0|2,0,0]=4 2625 B15R1.665 CCN(CC(C)(C)C)c1ccc(cc1)Cl 34a_100000220165_100011219605 [0,2,0,0,0,0|2,0,0]=4 2626 B15R1.665 CCN(CC(C)(C)C)c1ccc(cc1)F 34a_100102640331_100011219605 [0,2,0,0,0,0|2,0,0]=4 2627 B15R1.665 CCN(CC(C)(C)C)c1ccc(cc1)O 34a_100011337800_100011219605 [0,2,0,0,0,0|2,0,0]=4 2628 B15R1.665 CCN(C[N+](C)(C)C)c1ccc(cc1)Br 269982a_100000219632_200000036245 [0,2,0,0,0,0|1,0,0]=3 2629 B15R1.665 CCN(C[N+](C)(C)C)c1ccc(cc1)C 269982a_100000219985_200000036245 [0,2,0,0,0,0|1,0,0]=3 2630 B15R1.665 CCN(C[N+](C)(C)C)c1ccc(cc1)Cl 269982a_100000220165_200000036245 [0,2,0,0,0,0|1,0,0]=3 2631 B15R1.665 CCN(C[N+](C)(C)C)c1ccc(cc1)F 269982a_100102640331_200000036245 [0,2,0,0,0,0|1,0,0]=3 2632 B15R1.665 CCN(C[N+](C)(C)C)c1ccc(cc1)O 269982a_100011337800_200000036245 [0,2,0,0,0,0|1,0,0]=3 2633 B15R1.665 CCN(C[Si](C)(C)C)c1ccc(cc1)Br 2230a_100000219632_100000037933 [0,2,0,0,0,0|2,0,0]=4 2634 B15R1.665 CCN(C[Si](C)(C)C)c1ccc(cc1)C 2230a_100000219985_100000037933 [0,2,0,0,0,0|2,0,0]=4 2635 B15R1.665 CCN(C[Si](C)(C)C)c1ccc(cc1)Cl 2230a_100000220165_100000037933 [0,2,0,0,0,0|2,0,0]=4 2636 B15R1.665 CCN(C[Si](C)(C)C)c1ccc(cc1)F 2230a_100102640331_100000037933 [0,2,0,0,0,0|2,0,0]=4 2637 B15R1.665 CCN(C[Si](C)(C)C)c1ccc(cc1)O 2230a_100011337800_100000037933 [0,2,0,0,0,0|2,0,0]=4 2638 B15R1.665 CC[C@H](NC(C)(C)C)c1ccc(cc1)Br 34a_100025736560_100000210625 [0,2,0,0,0,0|2,0,0]=4 2639 B15R1.665 CC[C@H](NC(C)(C)C)c1ccc(cc1)Cl 34a_100015186824_100000210625 [0,2,0,0,0,0|2,0,0]=4 2640 B15R1.665 Cc1ccc(cc1)[C@H](CO)NC(C)(C)C 34a_100009818840_100000210625 [0,2,0,0,0,0|2,0,0]=4 2641 B15R1.666 CC(C)(C)NC(CO)c1cccc(c1)Br 34a_100000690078_100000210625 [0,2,0,0,0,0|2,0,0]=4 2642 B15R1.666 CC(C)(C)NC(CO)c1cccc(c1)O 34a_100025717460_100000210625 [0,2,0,0,0,0|2,0,0]=4 2643 B15R1.666 CC(C)(C)N[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_100000210625 [0,2,0,0,0,0|2,0,0]=4 2644 B15R1.666 CC(C)(C)N[C@H](CO)c1cccc(c1)F 34a_100020641251_100000210625 [0,2,0,0,0,0|2,0,0]=4 2645 B15R1.666 CCC(NC(C)(C)C)c1cccc(c1)Cl 34a_100000737531_100000210625 [0,2,0,0,0,0|2,0,0]=4 2646 B15R1.666 CCC(NC(C)(C)C)c1cccc(c1)F 34a_100159265421_100000210625 [0,2,0,0,0,0|2,0,0]=4 2647 B15R1.666 CCC(NC(C)(C)C)c1cccc(c1)O 34a_100159312145_100000210625 [0,2,0,0,0,0|2,0,0]=4 2648 B15R1.666 CCC(OC(C)(C)C)c1cccc(c1)Cl 34a_100000766619_100000210625 [0,2,0,0,0,0|2,0,0]=4 2649 B15R1.666 CCC(OC(C)(C)C)c1cccc(c1)F 34a_100011350881_100000210625 [0,2,0,0,0,0|2,0,0]=4 2650 B15R1.666 CCC(OC(C)(C)C)c1cccc(c1)I 34a_200013212081_100000210625 [0,2,0,0,0,0|2,0,0]=4 2651 B15R1.666 CCN(CC(C)(C)C)c1cccc(c1)Br 34a_100000738899_100011219605 [0,2,0,0,0,0|2,0,0]=4 2652 B15R1.666 CCN(CC(C)(C)C)c1cccc(c1)C 34a_100000182157_100011219605 [0,2,0,0,0,0|2,0,0]=4 2653 B15R1.666 CCN(CC(C)(C)C)c1cccc(c1)O 34a_100000717746_100011219605 [0,2,0,0,0,0|2,0,0]=4 2654 B15R1.666 CCN(C[N+](C)(C)C)c1cccc(c1)Br 269982a_100000738899_200000036245 [0,2,0,0,0,0|1,0,0]=3 2655 B15R1.666 CCN(C[N+](C)(C)C)c1cccc(c1)C 269982a_100000182157_200000036245 [0,2,0,0,0,0|1,0,0]=3 2656 B15R1.666 CCN(C[N+](C)(C)C)c1cccc(c1)O 269982a_100000717746_200000036245 [0,2,0,0,0,0|1,0,0]=3 2657 B15R1.666 CCN(C[Si](C)(C)C)c1cccc(c1)Br 2230a_100000738899_100000037933 [0,2,0,0,0,0|2,0,0]=4 2658 B15R1.666 CCN(C[Si](C)(C)C)c1cccc(c1)C 2230a_100000182157_100000037933 [0,2,0,0,0,0|2,0,0]=4 2659 B15R1.666 CCN(C[Si](C)(C)C)c1cccc(c1)C 7a_100000182157_100000233785 [0,2,0,0,0,0|2,0,0]=4 2660 B15R1.666 CCN(C[Si](C)(C)C)c1cccc(c1)O 2230a_100000717746_100000037933 [0,2,0,0,0,0|2,0,0]=4 2661 B15R1.666 CC[C@@H](NC(C)(C)C)c1cccc(c1)C 34a_200016991486_100000210625 [0,2,0,0,0,0|2,0,0]=4 2662 B15R1.666 CC[C@H](NC(C)(C)C)c1cccc(c1)Br 34a_100102422761_100000210625 [0,2,0,0,0,0|2,0,0]=4 2663 B15R1.666 Cc1cccc(c1)[C@@H](CO)NC(C)(C)C 34a_100009818812_100000210625 [0,2,0,0,0,0|2,0,0]=4 2664 B15R1.1304 C=CCC(OC(C)(C)C)c1ccccc1 34a_100000687291_100000210625 [0,2,0,0,0,0|2,0,0]=4 2665 B15R1.1304 C=CCN(CC(C)(C)C)c1ccccc1 34a_100000211662_100011219605 [0,2,0,0,0,0|2,0,0]=4 2666 B15R1.1304 C=CCN(C[N+](C)(C)C)c1ccccc1 269982a_100000211662_200000036245 [0,2,0,0,0,0|1,0,0]=3 2667 B15R1.1304 C=CCN(C[Si](C)(C)C)c1ccccc1 2230a_100000211662_100000037933 [0,2,0,0,0,0|2,0,0]=4 2668 B15R1.1304 CC(C)(C)CN(CCO)c1ccccc1 34a_100000211345_100011219605 [0,2,0,0,0,0|2,0,0]=4 2669 B15R1.1304 CC(C)(C)NC(CCCl)c1ccccc1 2230a_100000715429_200010132975 [0,2,0,0,0,0|2,0,0]=4 2670 B15R1.1304 CC(C)(C)OC(CCCl)c1ccccc1 7a_100015890283_200010132975 [0,2,0,0,0,0|2,0,0]=4 2671 B15R1.1304 CC(C)(C)OC(CCN)c1ccccc1 34a_100000763605_100000210625 [0,2,0,0,0,0|2,0,0]=4 2672 B15R1.1304 CC(C)(C)O[C@H](CCCl)c1ccccc1 34a_100000729684_100000210625 [0,2,0,0,0,0|2,0,0]=4 2673 B15R1.1304 CC(C)(C)SC(CCCl)c1ccccc1 62a_100000211941_200010132975 [0,2,0,0,0,0|2,0,0]=4 2674 B15R1.1304 CC(C)(C)SC(CCCl)c1ccccc1 62a_200010132975_100000211941 [0,2,0,0,0,0|2,0,0]=4 2675 B15R1.1304 CCCC(NC(C)(C)C)c1ccccc1 34a_100000189686_100000210625 [0,2,0,0,0,0|2,0,0]=4 2676 B15R1.1304 CCCC(OC(C)(C)C)c1ccccc1 34a_100000747916_100000210625 [0,2,0,0,0,0|2,0,0]=4 2677 B15R1.1304 CCCN(CC(C)(C)C)c1ccccc1 34a_200011218496_100011219605 [0,2,0,0,0,0|2,0,0]=4 2678 B15R1.1304 CCCN(C[N+](C)(C)C)c1ccccc1 269982a_200011218496_200000036245 [0,2,0,0,0,0|1,0,0]=3 2679 B15R1.1304 CCCN(C[Si](C)(C)C)c1ccccc1 2230a_200011218496_100000037933 [0,2,0,0,0,0|2,0,0]=4 2680 B15R1.1304 CCNC(CC(C)(C)C)c1cccnc1 2230a_100011935037_100000210202 [0,2,0,0,0,0|2,0,0]=4 2681 B15R1.1304 COC[C@@H](NC(C)(C)C)c1ccccc1 34a_103619048568_100000210625 [0,2,0,0,0,0|2,0,0]=4 2682 B15R1.1304 C[N+](C)(C)CN(CCO)c1ccccc1 269982a_100000211345_200000036245 [0,2,0,0,0,0|1,0,0]=3 2683 B15R1.1304 C[Si](C)(C)CN(CCO)c1ccccc1 2230a_100000211345_100000037933 [0,2,0,0,0,0|2,0,0]=4 2684 B15R1.3036 CCC(c1ccccc1)N(C)C(C)(C)C 269982a_100000737544_100000210625 [0,2,0,0,0,0|2,0,0]=4 2685 B15R1.5903 C=C(C)C(OC(C)(C)C)c1ccccc1 34a_200011216824_100000210625 [0,2,0,0,0,0|2,0,0]=4 2686 B15R1.5903 CC(=O)C(NC(C)(C)C)c1ccccc1 2230a_100000715429_100009888967 [0,2,0,0,0,0|2,0,0]=4 2687 B15R1.5903 CC(=O)C(OC(C)(C)C)c1ccccc1 1458a_100000692874_200000210301 [0,2,0,0,0,0|2,0,0]=4 2688 B15R1.5903 CC(=O)C(OC(C)(C)C)c1ccccc1 7a_100015890283_100009888967 [0,2,0,0,0,0|2,0,0]=4 2689 B15R1.5903 CC(=O)C(SC(C)(C)C)c1ccccc1 62a_100000211941_100009888967 [0,2,0,0,0,0|2,0,0]=4 2690 B15R1.5903 CC(=O)C(SC(C)(C)C)c1ccccc1 62a_100009888967_100000211941 [0,2,0,0,0,0|2,0,0]=4 2691 B15R1.5903 CC(C)(C)OC(C(=O)[13CH3])c1ccccc1 1458a_100000692874_200025704644 [0,2,0,0,0,0|2,0,0]=4 2692 B15R1.5903 CC(C)C(OC(C)(C)C)c1ccccc1 34a_200011217822_100000210625 [0,2,0,0,0,0|2,0,0]=4 2693 B15R1.5903 CC(C)N(CC(C)(C)C)c1ccccc1 34a_100000210572_100011219605 [0,2,0,0,0,0|2,0,0]=4 2694 B15R1.5903 CC(C)N(C[N+](C)(C)C)c1ccccc1 269982a_100000210572_200000036245 [0,2,0,0,0,0|1,0,0]=3 2695 B15R1.5903 CC(C)N(C[Si](C)(C)C)c1ccccc1 2230a_100000210572_100000037933 [0,2,0,0,0,0|2,0,0]=4 2696 B15R1.5903 CC(C)N(C[Si](C)(C)C)c1ccccc1 7a_100000210572_100000233785 [0,2,0,0,0,0|2,0,0]=4 2697 B15R1.5903 CC(C)[C@H](NC(C)(C)C)c1ccccc1 34a_100015186014_100000210625 [0,2,0,0,0,0|2,0,0]=4 2698 B15R1.10034 CC(C)(C)NC(CO)c1ccccc1Cl 34a_100138412506_100000210625 [0,2,0,0,0,0|2,0,0]=4 2699 B15R1.10034 CC(C)(C)N[C@@H](CO)c1ccccc1F 34a_100009818778_100000210625 [0,2,0,0,0,0|2,0,0]=4 2700 B15R1.10034 CC(C)(C)N[C@H](CO)c1ccccc1Br 34a_100161155918_100000210625 [0,2,0,0,0,0|2,0,0]=4 2701 B15R1.10034 CC(C)(C)OC(CN)c1ccccc1Br 34a_100011236429_100000210625 [0,2,0,0,0,0|2,0,0]=4 2702 B15R1.10034 CC(C)(C)OC(CN)c1ccccc1Cl 34a_200000759403_100000210625 [0,2,0,0,0,0|2,0,0]=4 2703 B15R1.10034 CCC(OC(C)(C)C)c1ccccc1F 34a_200011689290_100000210625 [0,2,0,0,0,0|2,0,0]=4 2704 B15R1.10034 CCN(CC(C)(C)C)c1ccccc1Br 34a_114873767003_100011219605 [0,2,0,0,0,0|2,0,0]=4 2705 B15R1.10034 CCN(CC(C)(C)C)c1ccccc1C 34a_100000211084_100011219605 [0,2,0,0,0,0|2,0,0]=4 2706 B15R1.10034 CCN(CC(C)(C)C)c1ccccc1F 34a_100000220365_100011219605 [0,2,0,0,0,0|2,0,0]=4 2707 B15R1.10034 CCN(C[N+](C)(C)C)c1ccccc1Br 269982a_114873767003_200000036245 [0,2,0,0,0,0|1,0,0]=3 2708 B15R1.10034 CCN(C[N+](C)(C)C)c1ccccc1C 269982a_100000211084_200000036245 [0,2,0,0,0,0|1,0,0]=3 2709 B15R1.10034 CCN(C[N+](C)(C)C)c1ccccc1F 269982a_100000220365_200000036245 [0,2,0,0,0,0|1,0,0]=3 2710 B15R1.10034 CCN(C[N+](C)(C)C)c1ccccc1O 269982a_103624766699_200000036245 [0,2,0,0,0,0|1,0,0]=3 2711 B15R1.10034 CCN(C[Si](C)(C)C)c1ccccc1Br 2230a_114873767003_100000037933 [0,2,0,0,0,0|2,0,0]=4 2712 B15R1.10034 CCN(C[Si](C)(C)C)c1ccccc1C 2230a_100000211084_100000037933 [0,2,0,0,0,0|2,0,0]=4 2713 B15R1.10034 CCN(C[Si](C)(C)C)c1ccccc1F 2230a_100000220365_100000037933 [0,2,0,0,0,0|2,0,0]=4 2714 B15R1.10034 CC[C@H](NC(C)(C)C)c1ccccc1Cl 34a_200016987949_100000210625 [0,2,0,0,0,0|2,0,0]=4 2715 B15R1.10034 CC[C@H](NC(C)(C)C)c1ccccc1F 34a_100015190424_100000210625 [0,2,0,0,0,0|2,0,0]=4 2716 B15R1.13398 C#CC(C)(OC(C)(C)C)c1ccccc1 34a_100000198054_100000210625 [0,2,0,0,0,0|2,0,0]=4 2717 B15R1.210 C=Cc1ccc(cc1)C(C)NC(C)(C)C 34a_200012023546_100000210625 [0,2,0,0,0,0|2,0,0]=4 2718 B15R1.210 CC(OC(C)(C)C)c1ccc(cc1)CN 34a_200000048501_100000210625 [0,2,0,0,0,0|2,0,0]=4 2719 B15R1.210 CCc1ccc(cc1)C(C)NC(C)(C)C 34a_100015186439_100000210625 [0,2,0,0,0,0|2,0,0]=4 2720 B15R1.210 CCc1ccc(cc1)C(C)OC(C)(C)C 34a_100011232672_100000210625 [0,2,0,0,0,0|2,0,0]=4 2721 B15R1.210 CN(CC(C)(C)C)c1ccc(cc1)C#N 34a_100000739737_100011219605 [0,2,0,0,0,0|2,0,0]=4 2722 B15R1.210 CN(C[N+](C)(C)C)c1ccc(cc1)C#N 269982a_100000739737_200000036245 [0,2,0,0,0,0|1,0,0]=3 2723 B15R1.210 COc1ccc(cc1)C(C)OC(C)(C)C 34a_100000742907_100000210625 [0,2,0,0,0,0|2,0,0]=4 2724 B15R1.210 COc1ccc(cc1)N(C)CC(C)(C)C 34a_100000220023_100011219605 [0,2,0,0,0,0|2,0,0]=4 2725 B15R1.210 COc1ccc(cc1)N(C)C[N+](C)(C)C 269982a_100000220023_200000036245 [0,2,0,0,0,0|1,0,0]=3 2726 B15R1.210 COc1ccc(cc1)N(C)C[Si](C)(C)C 2230a_100000220023_100000037933 [0,2,0,0,0,0|2,0,0]=4 2727 B15R1.210 C[C@@H](NC(C)(C)C)c1ccc(cc1)C#N 34a_100016991473_100000210625 [0,2,0,0,0,0|2,0,0]=4 2728 B15R1.210 C[C@H](OC(C)(C)C)c1ccc(cc1)C#N 34a_100011852132_100000210625 [0,2,0,0,0,0|2,0,0]=4 2729 B15R1.886 CC(C(=O)C(C)(C)C)c1ccc(cc1)Br 1458a_106744555173_100000755118 [0,2,0,0,0,0|1,0,1]=4 2730 B15R1.886 CC(C(=O)C(C)(C)C)c1ccc(cc1)Cl 1458a_106744555173_100000684792 [0,2,0,0,0,0|1,0,1]=4 2731 B15R1.886 CC(C(=O)C(C)(C)C)c1ccc(cc1)F 1458a_106744555173_100000743420 [0,2,0,0,0,0|1,0,1]=4 2732 B15R1.886 CC(c1ccc(cc1)Br)N(C)C(C)(C)C 269982a_100000231103_100000210625 [0,2,0,0,0,0|2,0,0]=4 2733 B15R1.886 CC(c1ccc(cc1)Br)N(C)C(C)(C)C 269982a_100011215553_100000755118 [0,2,0,0,0,0|2,0,0]=4 2734 B15R1.886 CC(c1ccc(cc1)Cl)N(C)C(C)(C)C 269982a_100000231102_100000210625 [0,2,0,0,0,0|2,0,0]=4 2735 B15R1.886 CC(c1ccc(cc1)Cl)N(C)C(C)(C)C 269982a_100011215553_100000684792 [0,2,0,0,0,0|2,0,0]=4 2736 B15R1.886 CC(c1ccc(cc1)F)N(C)C(C)(C)C 269982a_100000222788_100000210625 [0,2,0,0,0,0|2,0,0]=4 2737 B15R1.886 CC(c1ccc(cc1)F)N(C)C(C)(C)C 269982a_100011215553_100000743420 [0,2,0,0,0,0|2,0,0]=4 2738 B15R1.886 CC(c1ccc(cc1)F)N(C)C(C)(C)C 34a_100000222788_100000210625 [0,2,0,0,0,0|2,0,0]=4 2739 B15R1.886 Cc1ccc(cc1)C(C)C(=O)C(C)(C)C 1458a_106744555173_100011261388 [0,2,0,0,0,0|1,0,1]=4 2740 B15R1.886 Cc1ccc(cc1)C(C)N(C)C(C)(C)C 269982a_100011215553_100011261388 [0,2,0,0,0,0|2,0,0]=4 2741 B15R1.904 CC(C)(C)NC(C)(C)c1ccc(cc1)F 34a_100015193028_100000210625 [0,2,0,0,0,0|2,0,0]=4 2742 B15R1.904 CC(C)(C)OC(C)(C)c1ccc(cc1)Br 34a_100000753367_100000210625 [0,2,0,0,0,0|2,0,0]=4 2743 B15R1.904 CC(C)(C)OC(C)(C)c1ccc(cc1)Cl 34a_100000750429_100000210625 [0,2,0,0,0,0|2,0,0]=4 2744 B15R1.904 CC(C)(C)OC(C)(C)c1ccc(cc1)F 34a_100011219992_100000210625 [0,2,0,0,0,0|2,0,0]=4 2745 B15R1.904 Cc1ccc(cc1)C(C)(C)NC(C)(C)C 34a_200011345931_100000210625 [0,2,0,0,0,0|2,0,0]=4 2746 B15R1.904 Cc1ccc(cc1)C(C)(C)OC(C)(C)C 34a_200011345916_100000210625 [0,2,0,0,0,0|2,0,0]=4 2747 B15R1.923 CC(NC(C)(C)C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100000210625 [0,2,0,0,0,0|2,0,0]=4 2748 B15R1.923 CC(NC(C)(C)C)c1ccc(c(c1)F)F 34a_100000756309_100000210625 [0,2,0,0,0,0|2,0,0]=4 2749 B15R1.923 CC(OC(C)(C)C)c1ccc(c(c1)Br)F 34a_100011191524_100000210625 [0,2,0,0,0,0|2,0,0]=4 2750 B15R1.923 CC(OC(C)(C)C)c1ccc(c(c1)Cl)Cl 34a_100000742046_100000210625 [0,2,0,0,0,0|2,0,0]=4 2751 B15R1.923 CC(OC(C)(C)C)c1ccc(c(c1)F)Cl 34a_100011944057_100000210625 [0,2,0,0,0,0|2,0,0]=4 2752 B15R1.923 CC(OC(C)(C)C)c1ccc(c(c1)F)F 34a_100000246517_100000210625 [0,2,0,0,0,0|2,0,0]=4 2753 B15R1.923 CN(CC(C)(C)C)c1ccc(c(c1)Cl)Cl 34a_100000219944_100011219605 [0,2,0,0,0,0|2,0,0]=4 2754 B15R1.923 CN(CC(C)(C)C)c1ccc(c(c1)Cl)F 34a_100000697440_100011219605 [0,2,0,0,0,0|2,0,0]=4 2755 B15R1.923 CN(CC(C)(C)C)c1ccc(c(c1)F)Br 34a_100012285320_100011219605 [0,2,0,0,0,0|2,0,0]=4 2756 B15R1.923 CN(CC(C)(C)C)c1ccc(c(c1)F)F 34a_100000221014_100011219605 [0,2,0,0,0,0|2,0,0]=4 2757 B15R1.923 CN(C[N+](C)(C)C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_200000036245 [0,2,0,0,0,0|1,0,0]=3 2758 B15R1.923 CN(C[N+](C)(C)C)c1ccc(c(c1)Cl)F 269982a_100000697440_200000036245 [0,2,0,0,0,0|1,0,0]=3 2759 B15R1.923 CN(C[N+](C)(C)C)c1ccc(c(c1)F)Br 269982a_100012285320_200000036245 [0,2,0,0,0,0|1,0,0]=3 2760 B15R1.923 CN(C[N+](C)(C)C)c1ccc(c(c1)F)F 269982a_100000221014_200000036245 [0,2,0,0,0,0|1,0,0]=3 2761 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_100000037933 [0,2,0,0,0,0|2,0,0]=4 2762 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)Cl)F 2230a_100000697440_100000037933 [0,2,0,0,0,0|2,0,0]=4 2763 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)Cl)F 7a_100000697440_100000233785 [0,2,0,0,0,0|2,0,0]=4 2764 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)F)Br 2230a_100012285320_100000037933 [0,2,0,0,0,0|2,0,0]=4 2765 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)F)Br 7a_100012285320_100000233785 [0,2,0,0,0,0|2,0,0]=4 2766 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)F)F 2230a_100000221014_100000037933 [0,2,0,0,0,0|2,0,0]=4 2767 B15R1.923 CN(C[Si](C)(C)C)c1ccc(c(c1)F)F 7a_100000221014_100000233785 [0,2,0,0,0,0|2,0,0]=4 2768 B15R1.923 C[C@@H](NC(C)(C)C)c1ccc(c(c1)Cl)F 34a_100016987892_100000210625 [0,2,0,0,0,0|2,0,0]=4 2769 B15R1.923 C[C@@H](NC(C)(C)C)c1ccc(c(c1)F)Cl 34a_100016987903_100000210625 [0,2,0,0,0,0|2,0,0]=4 2770 B15R1.923 C[C@H](NC(C)(C)C)c1ccc(c(c1)Br)F 34a_100000753309_100000210625 [0,2,0,0,0,0|2,0,0]=4 2771 B15R1.923 C[C@H](NC(C)(C)C)c1ccc(c(c1)F)Br 34a_100134618348_100000210625 [0,2,0,0,0,0|2,0,0]=4 2772 B15R1.923 Cc1cc(ccc1Br)N(C)CC(C)(C)C 34a_100102888905_100011219605 [0,2,0,0,0,0|2,0,0]=4 2773 B15R1.923 Cc1cc(ccc1Br)N(C)C[N+](C)(C)C 269982a_100102888905_200000036245 [0,2,0,0,0,0|1,0,0]=3 2774 B15R1.923 Cc1cc(ccc1Br)N(C)C[Si](C)(C)C 2230a_100102888905_100000037933 [0,2,0,0,0,0|2,0,0]=4 2775 B15R1.923 Cc1cc(ccc1Cl)N(C)CC(C)(C)C 34a_114849113799_100011219605 [0,2,0,0,0,0|2,0,0]=4 2776 B15R1.923 Cc1cc(ccc1Cl)N(C)C[N+](C)(C)C 269982a_114849113799_200000036245 [0,2,0,0,0,0|1,0,0]=3 2777 B15R1.923 Cc1cc(ccc1Cl)N(C)C[Si](C)(C)C 2230a_114849113799_100000037933 [0,2,0,0,0,0|2,0,0]=4 2778 B15R1.923 Cc1cc(ccc1F)C(C)NC(C)(C)C 34a_100000705826_100000210625 [0,2,0,0,0,0|2,0,0]=4 2779 B15R1.923 Cc1cc(ccc1F)N(C)CC(C)(C)C 34a_100011756966_100011219605 [0,2,0,0,0,0|2,0,0]=4 2780 B15R1.923 Cc1cc(ccc1F)N(C)C[N+](C)(C)C 269982a_100011756966_200000036245 [0,2,0,0,0,0|1,0,0]=3 2781 B15R1.923 Cc1cc(ccc1F)N(C)C[Si](C)(C)C 2230a_100011756966_100000037933 [0,2,0,0,0,0|2,0,0]=4 2782 B15R1.923 Cc1cc(ccc1F)N(C)C[Si](C)(C)C 7a_100011756966_100000233785 [0,2,0,0,0,0|2,0,0]=4 2783 B15R1.923 Cc1ccc(cc1Br)N(C)CC(C)(C)C 34a_100000707694_100011219605 [0,2,0,0,0,0|2,0,0]=4 2784 B15R1.923 Cc1ccc(cc1Br)N(C)C[N+](C)(C)C 269982a_100000707694_200000036245 [0,2,0,0,0,0|1,0,0]=3 2785 B15R1.923 Cc1ccc(cc1Br)N(C)C[Si](C)(C)C 2230a_100000707694_100000037933 [0,2,0,0,0,0|2,0,0]=4 2786 B15R1.923 Cc1ccc(cc1C)[C@@H](C)NC(C)(C)C 34a_100015184928_100000210625 [0,2,0,0,0,0|2,0,0]=4 2787 B15R1.923 Cc1ccc(cc1Cl)C(C)NC(C)(C)C 34a_100012005020_100000210625 [0,2,0,0,0,0|2,0,0]=4 2788 B15R1.923 Cc1ccc(cc1Cl)N(C)CC(C)(C)C 34a_100000220120_100011219605 [0,2,0,0,0,0|2,0,0]=4 2789 B15R1.923 Cc1ccc(cc1Cl)N(C)C[N+](C)(C)C 269982a_100000220120_200000036245 [0,2,0,0,0,0|1,0,0]=3 2790 B15R1.923 Cc1ccc(cc1Cl)N(C)C[Si](C)(C)C 2230a_100000220120_100000037933 [0,2,0,0,0,0|2,0,0]=4 2791 B15R1.923 Cc1ccc(cc1F)N(C)CC(C)(C)C 34a_100160572069_100011219605 [0,2,0,0,0,0|2,0,0]=4 2792 B15R1.923 Cc1ccc(cc1F)N(C)C[N+](C)(C)C 269982a_100160572069_200000036245 [0,2,0,0,0,0|1,0,0]=3 2793 B15R1.923 Cc1ccc(cc1F)N(C)C[Si](C)(C)C 2230a_100160572069_100000037933 [0,2,0,0,0,0|2,0,0]=4 2794 B15R1.923 Cc1ccc(cc1F)N(C)C[Si](C)(C)C 7a_100160572069_100000233785 [0,2,0,0,0,0|2,0,0]=4 2795 B15R1.923 Cc1ccc(cc1F)[C@H](C)NC(C)(C)C 34a_100011997884_100000210625 [0,2,0,0,0,0|2,0,0]=4 2796 B15R1.8443 CC(NC(C)(C)C)c1ccc(cc1Cl)Cl 34a_100000179772_100000210625 [0,2,0,0,0,0|2,0,0]=4 2797 B15R1.8443 CC(NC(C)(C)C)c1ccc(cc1F)Br 34a_100000730447_100000210625 [0,2,0,0,0,0|2,0,0]=4 2798 B15R1.8443 CC(NC(C)(C)C)c1ccc(cc1F)F 34a_100000181410_100000210625 [0,2,0,0,0,0|2,0,0]=4 2799 B15R1.8443 CC(OC(C)(C)C)c1ccc(cc1Cl)Cl 34a_100000743050_100000210625 [0,2,0,0,0,0|2,0,0]=4 2800 B15R1.8443 CC(OC(C)(C)C)c1ccc(cc1Cl)F 34a_200011245020_100000210625 [0,2,0,0,0,0|2,0,0]=4 2801 B15R1.8443 CC(OC(C)(C)C)c1ccc(cc1F)Cl 34a_200011805215_100000210625 [0,2,0,0,0,0|2,0,0]=4 2802 B15R1.8443 CC(OC(C)(C)C)c1ccc(cc1F)F 34a_200000246518_100000210625 [0,2,0,0,0,0|2,0,0]=4 2803 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1Br)Br 34a_200000221195_100011219605 [0,2,0,0,0,0|2,0,0]=4 2804 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1Br)Cl 34a_100020633009_100011219605 [0,2,0,0,0,0|2,0,0]=4 2805 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1Br)F 34a_100011246292_100011219605 [0,2,0,0,0,0|2,0,0]=4 2806 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1Cl)Br 34a_100000221650_100011219605 [0,2,0,0,0,0|2,0,0]=4 2807 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1Cl)Cl 34a_114849113696_100011219605 [0,2,0,0,0,0|2,0,0]=4 2808 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1F)Br 34a_100000743884_100011219605 [0,2,0,0,0,0|2,0,0]=4 2809 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1F)F 34a_100020633734_100011219605 [0,2,0,0,0,0|2,0,0]=4 2810 B15R1.8443 CN(CC(C)(C)C)c1ccc(cc1F)I 34a_114948340911_100011219605 [0,2,0,0,0,0|2,0,0]=4 2811 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1Br)Br 269982a_200000221195_200000036245 [0,2,0,0,0,0|1,0,0]=3 2812 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1Br)Cl 269982a_100020633009_200000036245 [0,2,0,0,0,0|1,0,0]=3 2813 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1Br)F 269982a_100011246292_200000036245 [0,2,0,0,0,0|1,0,0]=3 2814 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1Cl)Br 269982a_100000221650_200000036245 [0,2,0,0,0,0|1,0,0]=3 2815 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1Cl)Cl 269982a_114849113696_200000036245 [0,2,0,0,0,0|1,0,0]=3 2816 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1F)Br 269982a_100000743884_200000036245 [0,2,0,0,0,0|1,0,0]=3 2817 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1F)F 269982a_100020633734_200000036245 [0,2,0,0,0,0|1,0,0]=3 2818 B15R1.8443 CN(C[N+](C)(C)C)c1ccc(cc1F)I 269982a_114948340911_200000036245 [0,2,0,0,0,0|1,0,0]=3 2819 B15R1.8443 CN(C[Si](C)(C)C)c1ccc(cc1F)Br 2230a_100000743884_100000037933 [0,2,0,0,0,0|2,0,0]=4 2820 B15R1.8443 CN(C[Si](C)(C)C)c1ccc(cc1F)F 2230a_100020633734_100000037933 [0,2,0,0,0,0|2,0,0]=4 2821 B15R1.8443 C[C@@H](NC(C)(C)C)c1ccc(cc1Br)F 34a_100025704064_100000210625 [0,2,0,0,0,0|2,0,0]=4 2822 B15R1.8443 C[C@@H](NC(C)(C)C)c1ccc(cc1Cl)F 34a_100015196781_100000210625 [0,2,0,0,0,0|2,0,0]=4 2823 B15R1.8443 Cc1cc(ccc1N(C)CC(C)(C)C)Br 34a_100000221803_100011219605 [0,2,0,0,0,0|2,0,0]=4 2824 B15R1.8443 Cc1cc(ccc1N(C)CC(C)(C)C)Cl 34a_114849113698_100011219605 [0,2,0,0,0,0|2,0,0]=4 2825 B15R1.8443 Cc1cc(ccc1N(C)CC(C)(C)C)O 34a_100161107805_100011219605 [0,2,0,0,0,0|2,0,0]=4 2826 B15R1.8443 Cc1cc(ccc1N(C)C[N+](C)(C)C)Br 269982a_100000221803_200000036245 [0,2,0,0,0,0|1,0,0]=3 2827 B15R1.8443 Cc1cc(ccc1N(C)C[N+](C)(C)C)Cl 269982a_114849113698_200000036245 [0,2,0,0,0,0|1,0,0]=3 2828 B15R1.8443 Cc1cc(ccc1N(C)C[N+](C)(C)C)O 269982a_100161107805_200000036245 [0,2,0,0,0,0|1,0,0]=3 2829 B15R1.8443 Cc1cc(ccc1N(C)C[Si](C)(C)C)Br 2230a_100000221803_100000037933 [0,2,0,0,0,0|2,0,0]=4 2830 B15R1.8443 Cc1cc(ccc1N(C)C[Si](C)(C)C)Cl 2230a_114849113698_100000037933 [0,2,0,0,0,0|2,0,0]=4 2831 B15R1.8443 Cc1cc(ccc1[C@H](C)NC(C)(C)C)Cl 34a_100020633667_100000210625 [0,2,0,0,0,0|2,0,0]=4 2832 B15R1.8443 Cc1ccc(c(c1)Br)N(C)CC(C)(C)C 34a_100000221369_100011219605 [0,2,0,0,0,0|2,0,0]=4 2833 B15R1.8443 Cc1ccc(c(c1)Br)N(C)C[N+](C)(C)C 269982a_100000221369_200000036245 [0,2,0,0,0,0|1,0,0]=3 2834 B15R1.8443 Cc1ccc(c(c1)Br)N(C)C[Si](C)(C)C 2230a_100000221369_100000037933 [0,2,0,0,0,0|2,0,0]=4 2835 B15R1.8443 Cc1ccc(c(c1)C)C(C)OC(C)(C)C 34a_100000246504_100000210625 [0,2,0,0,0,0|2,0,0]=4 2836 B15R1.8443 Cc1ccc(c(c1)C)[C@H](C)NC(C)(C)C 34a_100000745882_100000210625 [0,2,0,0,0,0|2,0,0]=4 2837 B15R1.5813 CC(C)(C)NC(C)(C)c1ccccc1Cl 34a_100020606166_100000210625 [0,2,0,0,0,0|2,0,0]=4 2838 B15R1.5813 CC(C)(C)NC(C)(C)c1ccccc1F 34a_100000734538_100000210625 [0,2,0,0,0,0|2,0,0]=4 2839 B15R1.5813 CC(C)(C)OC(C)(C)c1ccccc1Br 34a_100011346021_100000210625 [0,2,0,0,0,0|2,0,0]=4 2840 B15R1.5813 CC(C)(C)OC(C)(C)c1ccccc1Cl 34a_100000690508_100000210625 [0,2,0,0,0,0|2,0,0]=4 2841 B15R1.5813 CC(C)(C)OC(C)(C)c1ccccc1F 34a_100011345963_100000210625 [0,2,0,0,0,0|2,0,0]=4 2842 B15R1.5813 CC(C)(C)OC(C)(C)c1ccccc1I 34a_100010296449_100000210625 [0,2,0,0,0,0|2,0,0]=4 2843 B15R1.6821 CC(C)(C)C(=O)C(C)(C)c1ccccc1 1458a_106744555173_100000034625 [0,2,0,0,0,0|1,0,1]=4 2844 B15R1.6821 CN(C(C)(C)C)C(C)(C)c1ccccc1 269982a_100011215553_100000034625 [0,2,0,0,0,0|2,0,0]=4 2845 B15R1.8293 CC(C)(C)NC(C)(C)c1cccc(c1)F 34a_100016993694_100000210625 [0,2,0,0,0,0|2,0,0]=4 2846 B15R1.8293 CC(C)(C)OC(C)(C)c1cccc(c1)Br 34a_100011346009_100000210625 [0,2,0,0,0,0|2,0,0]=4 2847 B15R1.8293 CC(C)(C)OC(C)(C)c1cccc(c1)Cl 34a_100011345980_100000210625 [0,2,0,0,0,0|2,0,0]=4 2848 B15R1.8293 CC(C)(C)OC(C)(C)c1cccc(c1)F 34a_200011345953_100000210625 [0,2,0,0,0,0|2,0,0]=4 2849 B15R1.4541 CN(C[N+](C)(C)C)c1ccccc1C#N 269982a_100000744078_200000036245 [0,2,0,0,0,0|1,0,0]=3 2850 B15R1.4541 CN(C[Si](C)(C)C)c1ccccc1C#N 2230a_100000744078_100000037933 [0,2,0,0,0,0|2,0,0]=4 2851 B15R1.4541 COc1ccccc1N(C)CC(C)(C)C 34a_100000219746_100011219605 [0,2,0,0,0,0|2,0,0]=4 2852 B15R1.4541 COc1ccccc1N(C)C[N+](C)(C)C 269982a_100000219746_200000036245 [0,2,0,0,0,0|1,0,0]=3 2853 B15R1.4541 COc1ccccc1N(C)C[Si](C)(C)C 2230a_100000219746_100000037933 [0,2,0,0,0,0|2,0,0]=4 2854 B15R1.8024 CC(C(=O)C(C)(C)C)c1ccccc1Cl 1458a_106744555173_100000181259 [0,2,0,0,0,0|1,0,1]=4 2855 B15R1.8024 CC(C(=O)C(C)(C)C)c1ccccc1F 1458a_106744555173_200000741388 [0,2,0,0,0,0|1,0,1]=4 2856 B15R1.8024 CC(c1ccccc1Br)N(C)C(C)(C)C 269982a_100000692418_100000210625 [0,2,0,0,0,0|2,0,0]=4 2857 B15R1.8024 CC(c1ccccc1Cl)N(C)C(C)(C)C 269982a_100011215553_100000181259 [0,2,0,0,0,0|2,0,0]=4 2858 B15R1.8024 CC(c1ccccc1F)N(C)C(C)(C)C 269982a_100000231110_100000210625 [0,2,0,0,0,0|2,0,0]=4 2859 B15R1.8024 CC(c1ccccc1F)N(C)C(C)(C)C 269982a_100011215553_200000741388 [0,2,0,0,0,0|2,0,0]=4 2860 B15R1.8024 CC(c1ccccc1F)N(C)C(C)(C)C 34a_100000231110_100000210625 [0,2,0,0,0,0|2,0,0]=4 2861 B15R1.8313 CC(NC(C)(C)C)c1c(cccc1F)F 34a_100025772709_100000210625 [0,2,0,0,0,0|2,0,0]=4 2862 B15R1.8313 CC(OC(C)(C)C)c1c(cccc1Br)F 34a_100013085324_100000210625 [0,2,0,0,0,0|2,0,0]=4 2863 B15R1.8313 CC(OC(C)(C)C)c1c(cccc1Cl)Cl 34a_100011215154_100000210625 [0,2,0,0,0,0|2,0,0]=4 2864 B15R1.8313 CC(OC(C)(C)C)c1c(cccc1F)F 34a_100000742607_100000210625 [0,2,0,0,0,0|2,0,0]=4 2865 B15R1.8313 CN(CC(C)(C)C)c1c(cccc1Cl)Cl 34a_100000691019_100011219605 [0,2,0,0,0,0|2,0,0]=4 2866 B15R1.8313 CN(CC(C)(C)C)c1c(cccc1F)F 34a_100000743377_100011219605 [0,2,0,0,0,0|2,0,0]=4 2867 B15R1.8313 CN(C[N+](C)(C)C)c1c(cccc1Cl)Cl 269982a_100000691019_200000036245 [0,2,0,0,0,0|1,0,0]=3 2868 B15R1.8313 CN(C[N+](C)(C)C)c1c(cccc1F)F 269982a_100000743377_200000036245 [0,2,0,0,0,0|1,0,0]=3 2869 B15R1.8313 CN(C[Si](C)(C)C)c1c(cccc1F)F 2230a_100000743377_100000037933 [0,2,0,0,0,0|2,0,0]=4 2870 B15R1.8313 C[C@@H](NC(C)(C)C)c1c(cccc1Cl)Cl 34a_100016989663_100000210625 [0,2,0,0,0,0|2,0,0]=4 2871 B15R1.8313 C[C@@H](NC(C)(C)C)c1c(cccc1Cl)F 34a_100011997870_100000210625 [0,2,0,0,0,0|2,0,0]=4 2872 B15R1.8313 C[C@@H](OC(C)(C)C)c1c(cccc1Cl)F 34a_200012136785_100000210625 [0,2,0,0,0,0|2,0,0]=4 2873 B15R1.8313 Cc1cccc(c1C(C)OC(C)(C)C)C 34a_200000695261_100000210625 [0,2,0,0,0,0|2,0,0]=4 2874 B15R1.8313 Cc1cccc(c1N(C)CC(C)(C)C)C 34a_100011645471_100011219605 [0,2,0,0,0,0|2,0,0]=4 2875 B15R1.8313 Cc1cccc(c1N(C)C[N+](C)(C)C)C 269982a_100011645471_200000036245 [0,2,0,0,0,0|1,0,0]=3 2876 B15R1.8313 Cc1cccc(c1N(C)C[Si](C)(C)C)C 2230a_100011645471_100000037933 [0,2,0,0,0,0|2,0,0]=4 2877 B15R1.8313 Cc1cccc(c1[C@H](C)NC(C)(C)C)C 34a_100016987977_100000210625 [0,2,0,0,0,0|2,0,0]=4 2878 B15R1.8318 CC(NC(C)(C)C)c1cccc(c1Cl)Cl 34a_100015335525_100000210625 [0,2,0,0,0,0|2,0,0]=4 2879 B15R1.8318 CC(NC(C)(C)C)c1cccc(c1Cl)F 34a_100103153465_100000210625 [0,2,0,0,0,0|2,0,0]=4 2880 B15R1.8318 CC(OC(C)(C)C)c1cccc(c1F)Br 34a_200012356376_100000210625 [0,2,0,0,0,0|2,0,0]=4 2881 B15R1.8318 CC(OC(C)(C)C)c1cccc(c1F)F 34a_100011944069_100000210625 [0,2,0,0,0,0|2,0,0]=4 2882 B15R1.8318 CN(CC(C)(C)C)c1cccc(c1Cl)Cl 34a_100000742713_100011219605 [0,2,0,0,0,0|2,0,0]=4 2883 B15R1.8318 CN(CC(C)(C)C)c1cccc(c1F)Cl 34a_100020633735_100011219605 [0,2,0,0,0,0|2,0,0]=4 2884 B15R1.8318 CN(C[N+](C)(C)C)c1cccc(c1Cl)Cl 269982a_100000742713_200000036245 [0,2,0,0,0,0|1,0,0]=3 2885 B15R1.8318 CN(C[N+](C)(C)C)c1cccc(c1F)Cl 269982a_100020633735_200000036245 [0,2,0,0,0,0|1,0,0]=3 2886 B15R1.8318 CN(C[Si](C)(C)C)c1cccc(c1Cl)Cl 2230a_100000742713_100000037933 [0,2,0,0,0,0|2,0,0]=4 2887 B15R1.8318 CN(C[Si](C)(C)C)c1cccc(c1F)Cl 2230a_100020633735_100000037933 [0,2,0,0,0,0|2,0,0]=4 2888 B15R1.8318 C[C@@H](NC(C)(C)C)c1cccc(c1F)Cl 34a_100016987989_100000210625 [0,2,0,0,0,0|2,0,0]=4 2889 B15R1.8318 C[C@H](NC(C)(C)C)c1cccc(c1F)F 34a_100020612118_100000210625 [0,2,0,0,0,0|2,0,0]=4 2890 B15R1.8318 Cc1c(cccc1N(C)CC(C)(C)C)Cl 34a_100020606106_100011219605 [0,2,0,0,0,0|2,0,0]=4 2891 B15R1.8318 Cc1c(cccc1N(C)C[N+](C)(C)C)Cl 269982a_100020606106_200000036245 [0,2,0,0,0,0|1,0,0]=3 2892 B15R1.8318 Cc1c(cccc1N(C)C[Si](C)(C)C)Cl 2230a_100020606106_100000037933 [0,2,0,0,0,0|2,0,0]=4 2893 B15R1.8318 Cc1cccc(c1C)C(C)NC(C)(C)C 2230a_100000715429_100012183177 [0,2,0,0,0,0|2,0,0]=4 2894 B15R1.8318 Cc1cccc(c1C)C(C)OC(C)(C)C 34a_100015890283_100012183177 [0,2,0,0,0,0|2,0,0]=4 2895 B15R1.8318 Cc1cccc(c1C)C(C)OC(C)(C)C 7a_100015890283_100012183177 [0,2,0,0,0,0|2,0,0]=4 2896 B15R1.8318 Cc1cccc(c1C)C(C)SC(C)(C)C 62a_100000211941_100012183177 [0,2,0,0,0,0|2,0,0]=4 2897 B15R1.8318 Cc1cccc(c1C)C(C)SC(C)(C)C 62a_100012183177_100000211941 [0,2,0,0,0,0|2,0,0]=4 2898 B15R1.8421 CC(NC(C)(C)C)c1cc(ccc1Br)F 34a_100012343209_100000210625 [0,2,0,0,0,0|2,0,0]=4 2899 B15R1.8421 CC(NC(C)(C)C)c1cc(ccc1Cl)Cl 34a_100000737532_100000210625 [0,2,0,0,0,0|2,0,0]=4 2900 B15R1.8421 CC(NC(C)(C)C)c1cc(ccc1F)F 34a_100000737541_100000210625 [0,2,0,0,0,0|2,0,0]=4 2901 B15R1.8421 CC(OC(C)(C)C)c1cc(ccc1Cl)Cl 34a_100000742519_100000210625 [0,2,0,0,0,0|2,0,0]=4 2902 B15R1.8421 CC(OC(C)(C)C)c1cc(ccc1F)Br 34a_100011943926_100000210625 [0,2,0,0,0,0|2,0,0]=4 2903 B15R1.8421 CC(OC(C)(C)C)c1cc(ccc1F)F 34a_100000246540_100000210625 [0,2,0,0,0,0|2,0,0]=4 2904 B15R1.8421 CN(CC(C)(C)C)c1cc(ccc1Br)Cl 34a_100020633006_100011219605 [0,2,0,0,0,0|2,0,0]=4 2905 B15R1.8421 CN(CC(C)(C)C)c1cc(ccc1Br)F 34a_100020633008_100011219605 [0,2,0,0,0,0|2,0,0]=4 2906 B15R1.8421 CN(CC(C)(C)C)c1cc(ccc1Cl)Br 34a_100011772073_100011219605 [0,2,0,0,0,0|2,0,0]=4 2907 B15R1.8421 CN(CC(C)(C)C)c1cc(ccc1Cl)Cl 34a_100000742562_100011219605 [0,2,0,0,0,0|2,0,0]=4 2908 B15R1.8421 CN(CC(C)(C)C)c1cc(ccc1F)Br 34a_100011314990_100011219605 [0,2,0,0,0,0|2,0,0]=4 2909 B15R1.8421 CN(C[N+](C)(C)C)c1cc(ccc1Br)Cl 269982a_100020633006_200000036245 [0,2,0,0,0,0|1,0,0]=3 2910 B15R1.8421 CN(C[N+](C)(C)C)c1cc(ccc1Br)F 269982a_100020633008_200000036245 [0,2,0,0,0,0|1,0,0]=3 2911 B15R1.8421 CN(C[N+](C)(C)C)c1cc(ccc1Cl)Br 269982a_100011772073_200000036245 [0,2,0,0,0,0|1,0,0]=3 2912 B15R1.8421 CN(C[N+](C)(C)C)c1cc(ccc1Cl)Cl 269982a_100000742562_200000036245 [0,2,0,0,0,0|1,0,0]=3 2913 B15R1.8421 CN(C[N+](C)(C)C)c1cc(ccc1F)Br 269982a_100011314990_200000036245 [0,2,0,0,0,0|1,0,0]=3 2914 B15R1.8421 CN(C[Si](C)(C)C)c1cc(ccc1Br)F 2230a_100020633008_100000037933 [0,2,0,0,0,0|2,0,0]=4 2915 B15R1.8421 CN(C[Si](C)(C)C)c1cc(ccc1F)Br 2230a_100011314990_100000037933 [0,2,0,0,0,0|2,0,0]=4 2916 B15R1.8421 C[C@@H](NC(C)(C)C)c1cc(ccc1O)Cl 34a_100011853016_100000210625 [0,2,0,0,0,0|2,0,0]=4 2917 B15R1.8421 C[C@H](NC(C)(C)C)c1cc(ccc1F)Cl 34a_100000695052_100000210625 [0,2,0,0,0,0|2,0,0]=4 2918 B15R1.8421 C[C@H](NC(C)(C)C)c1cc(ccc1O)F 34a_100160469477_100000210625 [0,2,0,0,0,0|2,0,0]=4 2919 B15R1.8421 C[C@H](OC(C)(C)C)c1cc(ccc1I)F 34a_100134768474_100000210625 [0,2,0,0,0,0|2,0,0]=4 2920 B15R1.8421 Cc1ccc(c(c1)C(C)OC(C)(C)C)C 34a_200000246511_100000210625 [0,2,0,0,0,0|2,0,0]=4 2921 B15R1.8421 Cc1ccc(c(c1)[C@H](C)NC(C)(C)C)C 34a_100000695983_100000210625 [0,2,0,0,0,0|2,0,0]=4 2922 B15R1.8421 Cc1ccc(cc1C(C)NC(C)(C)C)F 34a_100011191733_100000210625 [0,2,0,0,0,0|2,0,0]=4 2923 B15R1.8421 Cc1ccc(cc1C(C)OC(C)(C)C)Cl 34a_100012002745_100000210625 [0,2,0,0,0,0|2,0,0]=4 2924 B15R1.8421 Cc1ccc(cc1N(C)CC(C)(C)C)Br 34a_100020629602_100011219605 [0,2,0,0,0,0|2,0,0]=4 2925 B15R1.8421 Cc1ccc(cc1N(C)CC(C)(C)C)Cl 34a_100000221440_100011219605 [0,2,0,0,0,0|2,0,0]=4 2926 B15R1.8421 Cc1ccc(cc1N(C)CC(C)(C)C)F 34a_114849113390_100011219605 [0,2,0,0,0,0|2,0,0]=4 2927 B15R1.8421 Cc1ccc(cc1N(C)C[N+](C)(C)C)Br 269982a_100020629602_200000036245 [0,2,0,0,0,0|1,0,0]=3 2928 B15R1.8421 Cc1ccc(cc1N(C)C[N+](C)(C)C)Cl 269982a_100000221440_200000036245 [0,2,0,0,0,0|1,0,0]=3 2929 B15R1.8421 Cc1ccc(cc1N(C)C[N+](C)(C)C)F 269982a_114849113390_200000036245 [0,2,0,0,0,0|1,0,0]=3 2930 B15R1.8421 Cc1ccc(cc1N(C)C[Si](C)(C)C)Br 2230a_100020629602_100000037933 [0,2,0,0,0,0|2,0,0]=4 2931 B15R1.8421 Cc1ccc(cc1N(C)C[Si](C)(C)C)Cl 2230a_100000221440_100000037933 [0,2,0,0,0,0|2,0,0]=4 2932 B15R1.8421 Cc1ccc(cc1N(C)C[Si](C)(C)C)F 2230a_114849113390_100000037933 [0,2,0,0,0,0|2,0,0]=4 2933 B15R1.1591 CC(NC(C)(C)C)c1cccc(c1)C#N 34a_100016987922_100000210625 [0,2,0,0,0,0|2,0,0]=4 2934 B15R1.1591 CN(CC(C)(C)C)c1cccc(c1)C#N 34a_100000221292_100011219605 [0,2,0,0,0,0|2,0,0]=4 2935 B15R1.1591 CN(C[N+](C)(C)C)c1cccc(c1)C#N 269982a_100000221292_200000036245 [0,2,0,0,0,0|1,0,0]=3 2936 B15R1.1591 CN(C[Si](C)(C)C)c1cccc(c1)C#N 2230a_100000221292_100000037933 [0,2,0,0,0,0|2,0,0]=4 2937 B15R1.1591 CN(C[Si](C)(C)C)c1cccc(c1)C#N 7a_100000221292_100000233785 [0,2,0,0,0,0|2,0,0]=4 2938 B15R1.1591 COc1cccc(c1)C(C)OC(C)(C)C 34a_100000246466_100000210625 [0,2,0,0,0,0|2,0,0]=4 2939 B15R1.1591 COc1cccc(c1)N(C)CC(C)(C)C 34a_100000219725_100011219605 [0,2,0,0,0,0|2,0,0]=4 2940 B15R1.1591 COc1cccc(c1)N(C)C[N+](C)(C)C 269982a_100000219725_200000036245 [0,2,0,0,0,0|1,0,0]=3 2941 B15R1.1591 COc1cccc(c1)N(C)C[Si](C)(C)C 2230a_100000219725_100000037933 [0,2,0,0,0,0|2,0,0]=4 2942 B15R1.1591 CSc1cccc(c1)N(C)CC(C)(C)C 34a_100020672454_100011219605 [0,2,0,0,0,0|2,0,0]=4 2943 B15R1.1591 CSc1cccc(c1)N(C)C[N+](C)(C)C 269982a_100020672454_200000036245 [0,2,0,0,0,0|1,0,0]=3 2944 B15R1.1591 CSc1cccc(c1)N(C)C[Si](C)(C)C 2230a_100020672454_100000037933 [0,2,0,0,0,0|2,0,0]=4 2945 B15R1.5451 CC(NC(C)(C)C)c1cc(cc(c1)Cl)Cl 34a_100020620772_100000210625 [0,2,0,0,0,0|2,0,0]=4 2946 B15R1.5451 CN(CC(C)(C)C)c1cc(cc(c1)Br)Br 27a_100000742839_100009814770 [0,2,0,0,0,0|2,0,0]=4 2947 B15R1.5451 CN(CC(C)(C)C)c1cc(cc(c1)Br)F 34a_106741647397_100011219605 [0,2,0,0,0,0|2,0,0]=4 2948 B15R1.5451 CN(CC(C)(C)C)c1cc(cc(c1)Cl)Cl 34a_100000220458_100011219605 [0,2,0,0,0,0|2,0,0]=4 2949 B15R1.5451 CN(CC(C)(C)C)c1cc(cc(c1)F)F 34a_100011233154_100011219605 [0,2,0,0,0,0|2,0,0]=4 2950 B15R1.5451 CN(C[N+](C)(C)C)c1cc(cc(c1)Br)F 269982a_106741647397_200000036245 [0,2,0,0,0,0|1,0,0]=3 2951 B15R1.5451 CN(C[N+](C)(C)C)c1cc(cc(c1)Cl)Cl 269982a_100000220458_200000036245 [0,2,0,0,0,0|1,0,0]=3 2952 B15R1.5451 CN(C[N+](C)(C)C)c1cc(cc(c1)F)F 269982a_100011233154_200000036245 [0,2,0,0,0,0|1,0,0]=3 2953 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)Br)Br 27a_200020589227_100009814770 [0,2,0,0,0,0|2,0,0]=4 2954 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)Br)F 7a_106741647397_100000233785 [0,2,0,0,0,0|2,0,0]=4 2955 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)Cl)Cl 2230a_100000220458_100000037933 [0,2,0,0,0,0|2,0,0]=4 2956 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)Cl)Cl 7a_100000220458_100000233785 [0,2,0,0,0,0|2,0,0]=4 2957 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)F)F 2230a_100011233154_100000037933 [0,2,0,0,0,0|2,0,0]=4 2958 B15R1.5451 CN(C[Si](C)(C)C)c1cc(cc(c1)F)F 7a_100011233154_100000233785 [0,2,0,0,0,0|2,0,0]=4 2959 B15R1.5451 C[C@@H](NC(C)(C)C)c1cc(cc(c1)F)F 34a_100016987943_100000210625 [0,2,0,0,0,0|2,0,0]=4 2960 B15R1.5451 C[C@H](NC(C)(C)C)c1cc(cc(c1)Cl)F 34a_100020639286_100000210625 [0,2,0,0,0,0|2,0,0]=4 2961 B15R1.5451 C[C@H](OC(C)(C)C)c1cc(cc(c1)F)F 34a_100012136759_100000210625 [0,2,0,0,0,0|2,0,0]=4 2962 B15R1.5451 Cc1cc(cc(c1)C(C)NC(C)(C)C)C 34a_100000753145_100000210625 [0,2,0,0,0,0|2,0,0]=4 2963 B15R1.5451 Cc1cc(cc(c1)N(C)CC(C)(C)C)F 34a_103496528823_100011219605 [0,2,0,0,0,0|2,0,0]=4 2964 B15R1.5451 Cc1cc(cc(c1)N(C)C[N+](C)(C)C)F 269982a_103496528823_200000036245 [0,2,0,0,0,0|1,0,0]=3 2965 B15R1.5451 Cc1cc(cc(c1)N(C)C[Si](C)(C)C)F 2230a_103496528823_100000037933 [0,2,0,0,0,0|2,0,0]=4 2966 B15R1.5451 Cc1cc(cc(c1)N(C)C[Si](C)(C)C)F 7a_103496528823_100000233785 [0,2,0,0,0,0|2,0,0]=4 2967 B15R1.8276 CC(c1cccc(c1)Br)N(C)C(C)(C)C 269982a_100025717457_100000210625 [0,2,0,0,0,0|2,0,0]=4 2968 B15R1.8276 CC(c1cccc(c1)F)N(C)C(C)(C)C 269982a_100000231114_100000210625 [0,2,0,0,0,0|2,0,0]=4 2969 B15R1.8276 CC(c1cccc(c1)F)N(C)C(C)(C)C 34a_100000231114_100000210625 [0,2,0,0,0,0|2,0,0]=4 2970 B15R1.3976 CN(c1ccccc1)C(F)(F)[Si](C)(C)C 269982a_100000210012_100010009690 [0,2,0,0,0,0|2,0,0]=4 2971 B15R1.4536 CCN(C(C)c1ccccc1)C(C)(C)C 2230a_100011200764_100000230085 [0,2,0,0,0,0|2,0,0]=4 2972 B15R1.4536 CCN(C(C)c1ccccc1)C(C)(C)C 269982a_100011200764_100000230085 [0,2,0,0,0,0|2,0,0]=4 2973 B13R2.10 CN1CCC(C1)c2ccccc2 2230a_100000747531_200000210301 [1,0,0,1,0,0|0,0,1]=3 2974 B13R2.10 CN1CCC(C1)c2ccccc2 269982a_100000747531_200000210301 [1,0,0,1,0,0|0,0,1]=3 2975 B13R2.10 CN1CCC(C1)c2ccccc2 34a_100000747531_200000210301 [1,0,0,1,0,0|0,0,1]=3 2976 B13R2.10 CN1CCC(C1)c2ccccn2 2230a_100102730755_200000210301 [1,0,0,1,0,0|1,0,1]=4 2977 B13R2.10 CN1CCC(C1)c2ccccn2 269982a_100102730755_200000210301 [1,0,0,1,0,0|1,0,1]=4 2978 B13R2.10 CN1CCC(C1)c2cccnc2 2230a_200015204282_200000210301 [1,0,0,1,0,0|1,0,1]=4 2979 B13R2.10 CN1CCC(C1)c2cccnc2 269982a_200015204282_200000210301 [1,0,0,1,0,0|1,0,1]=4 2980 B13R2.10 [13CH3]N1CCC(C1)c2ccccc2 2230a_100000747531_200025704644 [1,0,0,1,0,0|0,0,1]=3 2981 B13R2.10 [13CH3]N1CCC(C1)c2ccccc2 269982a_100000747531_200025704644 [1,0,0,1,0,0|0,0,1]=3 2982 B13R2.10 [13CH3]N1CCC(C1)c2ccccc2 34a_100000747531_200025704644 [1,0,0,1,0,0|0,0,1]=3 2983 B13R2.10 [13CH3]N1CCC(C1)c2ccccn2 2230a_100102730755_200025704644 [1,0,0,1,0,0|1,0,1]=4 2984 B13R2.10 [13CH3]N1CCC(C1)c2ccccn2 269982a_100102730755_200025704644 [1,0,0,1,0,0|1,0,1]=4 2985 B13R2.10 [13CH3]N1CCC(C1)c2cccnc2 2230a_200015204282_200025704644 [1,0,0,1,0,0|1,0,1]=4 2986 B13R2.10 [13CH3]N1CCC(C1)c2cccnc2 269982a_200015204282_200025704644 [1,0,0,1,0,0|1,0,1]=4 2987 B13R2.238 CN1CC(C1)(O)c2ccccc2 2230a_100000717221_200000210301 [1,0,0,1,0,0|1,0,1]=4 2988 B13R2.238 CN1CC(C1)(O)c2ccccc2 269982a_100000717221_200000210301 [1,0,0,1,0,0|1,0,1]=4 2989 B13R2.238 [13CH3]N1CC(C1)(O)c2ccccc2 2230a_100000717221_200025704644 [1,0,0,1,0,0|1,0,1]=4 2990 B13R2.238 [13CH3]N1CC(C1)(O)c2ccccc2 269982a_100000717221_200025704644 [1,0,0,1,0,0|1,0,1]=4 2991 B13R2.328 CC1CN(Cc2c1cccc2)C 2230a_100015190047_200000210301 [1,0,0,1,0,0|0,0,1]=3 2992 B13R2.328 CC1CN(Cc2c1cccc2)C 269982a_100015190047_200000210301 [1,0,0,1,0,0|0,0,1]=3 2993 B13R2.328 CC1CN(Cc2c1cccc2)C 34a_100015190047_200000210301 [1,0,0,1,0,0|0,0,1]=3 2994 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 2230a_100015190047_200025704644 [1,0,0,1,0,0|0,0,1]=3 2995 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 269982a_100015190047_200025704644 [1,0,0,1,0,0|0,0,1]=3 2996 B13R2.328 CC1CN(Cc2c1cccc2)[13CH3] 34a_100015190047_200025704644 [1,0,0,1,0,0|0,0,1]=3 2997 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200000210301 [1,0,0,1,0,0|2,0,0]=4 2998 B13R2.423 [13CH3]C(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200025704644 [1,0,0,1,0,0|2,0,0]=4 2999 B13R2.690 CC(NC1CC1)c2ccccc2 34a_100000212008_100000211855 [1,0,0,1,0,0|2,0,0]=4 3000 B13R2.690 CC(SC1CC1)c2ccccc2 62a_100000230085_100000211595 [1,0,0,1,0,0|2,0,0]=4 3001 B13R2.690 CN(CC1CC1)c2ccccc2 2230a_100000210012_100000742324 [1,0,0,1,0,0|2,0,0]=4 3002 B13R2.690 CN(CC1CC1)c2ccccc2 269982a_100000210012_100000756562 [1,0,0,1,0,0|2,0,0]=4 3003 B13R2.690 CN(CC1CC1)c2ccccc2 34a_100000210012_100000742324 [1,0,0,1,0,0|2,0,0]=4 3004 B13R2.690 C[C@@H](OC1CC1)c2ccccc2 34a_100000761318_100000211595 [1,0,0,1,0,0|2,0,0]=4 3005 B13R2.5881 CC(C)SC1Cc2c1cccc2 62a_100000210206_100009813401 [1,0,0,1,0,0|2,0,0]=4 3006 B13R2.5881 CC(C)SC1Cc2c1cccc2 62a_100009813401_100000210206 [1,0,0,1,0,0|2,0,0]=4 3007 B13R2.3203 CC1(CC1)NCc2ccccc2 207a_100000757604_100015611070 [1,0,0,1,0,0|2,0,0]=4 3008 B13R2.3203 CC1(CC1)NCc2ccccc2 2230a_100000757604_100015291786 [1,0,0,1,0,0|2,0,0]=4 3009 B13R2.3203 CC1(CC1)OCc2ccccc2 7a_100011725673_100000211182 [1,0,0,1,0,0|2,0,0]=4 3010 B15R2.1257 CC(Cc1ccccc1)OC2(CC2)C 7a_100011725673_200011218536 [0,0,0,1,0,1|2,0,0]=4 3011 B15R2.4425 CC(C)(C)N1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000210625 [0,0,0,1,0,1|2,0,0]=4 3012 B15R2.4425 CC(C)(C)N1C[C@@H]1Cc2ccccc2 34a_100016998360_100000210625 [0,0,0,1,0,1|2,0,0]=4 3013 B15R2.4429 CC(C)(C)CN1Cc2ccccc2C1 270004a_100000752595_100011204126 [0,0,0,1,0,1|2,0,0]=4 3014 B15R2.4429 CC(C)(C)CN1Cc2ccccc2C1 34a_100000752595_100011219605 [0,0,0,1,0,1|2,0,0]=4 3015 B15R2.4429 CC(C)(C)NC1Cc2ccccc2C1 34a_100000753258_100000210625 [0,0,0,1,0,1|2,0,0]=4 3016 B15R2.4429 CC(C)(C)OC1Cc2ccccc2C1 34a_100011215286_100000210625 [0,0,0,1,0,1|2,0,0]=4 3017 B15R2.4429 CC(C)(C)OC1Cc2ccccc2C1 34a_100015890283_100000753484 [0,0,0,1,0,1|2,0,0]=4 3018 B15R2.4429 CC(C)(C)OC1Cc2ccccc2C1 7a_100015890283_100000753484 [0,0,0,1,0,1|2,0,0]=4 3019 B15R2.4429 CC(C)(C)SC1Cc2ccccc2C1 62a_100000211941_100000753484 [0,0,0,1,0,1|2,0,0]=4 3020 B15R2.4429 C[N+](C)(C)CN1Cc2ccccc2C1 269982a_100000752595_200000036245 [0,0,0,1,0,1|1,0,0]=3 3021 B15R2.4429 C[N+](C)(C)CN1Cc2cccnc2C1 269982a_100000726175_200000036245 [0,0,0,1,0,1|2,0,0]=4 3022 B15R2.4429 C[N+](C)(C)CN1Cc2ccncc2C1 269982a_100000730608_200000036245 [0,0,0,1,0,1|2,0,0]=4 3023 B15R2.4429 C[Si](C)(C)CN1Cc2ccccc2C1 2230a_100000752595_100000037933 [0,0,0,1,0,1|2,0,0]=4 3024 B15R2.4444 CC(C)(C)N[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000210625 [0,0,0,1,0,1|2,0,0]=4 3025 B15R2.7532 CC1(CCN(C1)Cc2ccccc2)C 2230a_100000764714_100015291786 [0,0,0,1,0,1|2,0,0]=4 3026 B15R2.7532 CC1(CCN(C1)Cc2ccccc2)C 269982a_100000764714_100000211182 [0,0,0,1,0,1|2,0,0]=4 3027 B15R2.7532 CC1(CCN(C1)Cc2ccccc2)C 270004a_100000764714_100015611070 [0,0,0,1,0,1|2,0,0]=4 3028 B15R2.467 CC1(CC=C(CC1)c2ccccc2)C 271570a_100000069032_100000210277 [0,0,0,1,0,1|1,0,1]=4 3029 B15R2.4439 CC(C)(C)N1CC(C1)c2cccnc2 269982a_100015183634_100000210625 [0,0,0,1,0,1|2,0,0]=4 3030 B15R2.4439 CC(C)(C)N1CC(C1)c2ccncc2 269982a_100015185986_100000210625 [0,0,0,1,0,1|2,0,0]=4 3031 B15R2.24496 CC(CNC1(CC1)C)c2ccccc2 2230a_100000757604_100000756946 [0,0,0,1,0,1|1,0,0]=3 3032 B15R2.24496 CC(COC1(CC1)C)c2ccccc2 7a_100011725673_100000756946 [0,0,0,1,0,1|1,0,0]=3 3033 B15R2.24496 CC(NCC1(CC1)C)c2ccccc2 2230a_100000766693_100000230085 [0,0,0,1,0,1|1,0,0]=3 3034 B15R2.24496 CC(NCC1(CC1)C)c2ccccc2 269862a_100000766693_100000185851 [0,0,0,1,0,1|1,0,0]=3 3035 B15R2.24496 CC(NCC1(CC1)C)c2ccccn2 269862a_100000766693_100000210467 [0,0,0,1,0,1|2,0,0]=4 3036 B15R2.24496 CC(NCC1(CC1)C)c2cccnc2 269862a_100000766693_100000210468 [0,0,0,1,0,1|2,0,0]=4 3037 B15R2.24496 CC(NCC1(CC1)C)c2ccncc2 269862a_100000766693_100000185792 [0,0,0,1,0,1|2,0,0]=4 3038 B15R2.24496 CC(NCC1(CC1)O)c2ccccc2 2230a_100011936951_100000230085 [0,0,0,1,0,1|2,0,0]=4 3039 B15R2.24496 CC(NCC1(CC1)O)c2ccccc2 269862a_100011936951_100000185851 [0,0,0,1,0,1|2,0,0]=4 3040 B15R2.24496 CC(OCC1(CC1)C)c2ccccc2 7a_100000698024_100000230085 [0,0,0,1,0,1|1,0,0]=3 3041 B15R2.24496 CC(OCC1(CC1)F)c2ccccc2 34a_200000703853_100000211855 [0,0,0,1,0,1|2,0,0]=4 3042 B15R2.24496 CC(OCC1(CC1)F)c2ccccc2 7a_200000703853_100000230085 [0,0,0,1,0,1|2,0,0]=4 3043 B15R2.24496 CC(SCC1(CO1)C)c2ccccc2 62a_100000230085_100000760498 [0,0,0,1,0,1|2,0,0]=4 3044 B15R2.24496 CC(SCC1(CO1)C)c2ccccc2 62a_100000760498_100000230085 [0,0,0,1,0,1|2,0,0]=4 3045 B15R2.24496 CC1(CC1)NCC(O)c2ccccc2 2230a_100000757604_100000185958 [0,0,0,1,0,1|2,0,0]=4 3046 B15R2.24496 CC1(CC1)NC[C@@H](O)c2ccccc2 2230a_100000757604_100011933945 [0,0,0,1,0,1|2,0,0]=4 3047 B15R2.24496 CC1(CC1)OCC(O)c2ccccc2 7a_100011725673_100000185958 [0,0,0,1,0,1|2,0,0]=4 3048 B15R2.24496 CC1(CC1)OC[C@@H](O)c2ccccc2 7a_100011725673_100011933945 [0,0,0,1,0,1|2,0,0]=4 3049 B15R2.24496 C[C@@H](OCC1(CO1)C)c2ccccc2 34a_100000761318_100000760498 [0,0,0,1,0,1|2,0,0]=4 3050 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)C 2230a_100000753659_100000230085 [0,0,0,1,0,1|1,0,0]=3 3051 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)C 269982a_100000753659_100000230085 [0,0,0,1,0,1|1,0,0]=3 3052 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)F 2230a_100000696199_100000230085 [0,0,0,1,0,1|2,0,0]=4 3053 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)F 269982a_100000696199_100000230085 [0,0,0,1,0,1|2,0,0]=4 3054 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)O 2230a_100000718560_100000230085 [0,0,0,1,0,1|2,0,0]=4 3055 B15R2.29383 CC(c1ccccc1)N2CC(C2)(C)O 269982a_100000718560_100000230085 [0,0,0,1,0,1|2,0,0]=4 3056 B15R2.109405 CC(C)(C)CSC1Cc2c1cccc2 62a_100009813401_100011219605 [0,0,0,1,0,1|1,0,0]=3 3057 B15R2.109405 CC(C)(C)CSC1Cc2c1cccc2 62a_100011219605_100009813401 [0,0,0,1,0,1|1,0,0]=3 3058 B15R2.109405 CC(C)(C)OCC1Cc2c1cccc2 34a_100012476685_100000210625 [0,0,0,1,0,1|1,0,0]=3 3059 B15R2.109405 CC(C)(F)CSC1Cc2c1cccc2 62a_100009813401_100011997219 [0,0,0,1,0,1|2,0,0]=4 3060 B15R2.109405 CC(C)(F)CSC1Cc2c1cccc2 62a_100011997219_100009813401 [0,0,0,1,0,1|2,0,0]=4 3061 B15R2.109405 CC(C)(O)CSC1Cc2c1cccc2 62a_100000764493_100009813401 [0,0,0,1,0,1|2,0,0]=4 3062 B15R2.109405 CC(C)(O)CSC1Cc2c1cccc2 62a_100009813401_100000764493 [0,0,0,1,0,1|2,0,0]=4 3063 B15R2.109405 C[N+](C)(C)CSC1Cc2c1cccc2 62a_100009813401_200000036245 [0,0,0,1,0,1|0,0,0]=2 3064 B15R2.109405 C[N+](C)(C)CSC1Cc2c1cccc2 62a_200000036245_100009813401 [0,0,0,1,0,1|0,0,0]=2 3065 B15R2.109405 C[Si](C)(C)CSC1Cc2c1cccc2 62a_100000037933_100009813401 [0,0,0,1,0,1|1,0,0]=3 3066 B15R2.109405 C[Si](C)(C)CSC1Cc2c1cccc2 62a_100009813401_100000037933 [0,0,0,1,0,1|1,0,0]=3 3067 B15R2.5216 CC(NC1(CC1)CF)c2ccccc2 2230a_100000054953_100000230085 [0,1,0,1,0,0|2,0,0]=4 3068 B15R2.5216 CC(NC1(CC1)CF)c2ccccc2 34a_100000054953_100000211855 [0,1,0,1,0,0|2,0,0]=4 3069 B15R2.5216 CCC1(CC1)NC(C)c2ccccc2 2230a_100000732774_100000230085 [0,1,0,1,0,0|2,0,0]=4 3070 B15R2.16456 CC(NC1(CCC1)C)c2ccccc2 2230a_100000692455_100000230085 [0,1,0,1,0,0|2,0,0]=4 3071 B15R2.16456 CC(NC1(CCC1)C)c2ccccc2 34a_100000692455_100000211855 [0,1,0,1,0,0|2,0,0]=4 3072 B15R2.16456 CC(NC1(COC1)C)c2ccccc2 2230a_100000732644_100000230085 [0,1,0,1,0,0|2,0,0]=4 3073 B15R2.16456 CC(OC1(CCC1)C)c2ccccc2 34a_100000759064_100000211855 [0,1,0,1,0,0|2,0,0]=4 3074 B15R2.16456 CC(OC1(CCC1)C)c2ccccc2 7a_100000759064_100000230085 [0,1,0,1,0,0|2,0,0]=4 3075 B15R2.16456 CC(OC1(CSC1)C)c2ccccc2 7a_100016018533_100000230085 [0,1,0,1,0,0|2,0,0]=4 3076 B15R2.16456 CN(CC1(CCC1)C)c2ccccc2 2230a_100000210012_100000726658 [0,1,0,1,0,0|2,0,0]=4 3077 B15R2.16456 CN(CC1(CCC1)C)c2ccccc2 269982a_100000210012_100000726658 [0,1,0,1,0,0|2,0,0]=4 3078 B15R2.16456 CN(CC1(CCC1)C)c2ccccc2 34a_100000210012_100000726658 [0,1,0,1,0,0|2,0,0]=4 3079 B15R2.16456 CN(CC1(COC1)C)c2ccccc2 2230a_100000210012_100000066812 [0,1,0,1,0,0|2,0,0]=4 3080 B15R2.16456 CN(CC1(COC1)C)c2ccccc2 34a_100000210012_100009817586 [0,1,0,1,0,0|2,0,0]=4 3081 B15R2.59561 CC(C)(CCl)OC1Cc2c1cccc2 7a_100000764493_100009813401 [0,1,0,1,0,0|2,0,0]=4 3082 B15R2.59561 CCC(C)(C)OC1Cc2c1cccc2 7a_100000210230_100009813401 [0,1,0,1,0,0|2,0,0]=4 3083 B15R2.59561 CCC(C)(C)SC1Cc2c1cccc2 62a_100000032637_100009813401 [0,1,0,1,0,0|2,0,0]=4 3084 B15R2.59561 CCC(C)(C)SC1Cc2c1cccc2 62a_100009813401_100000032637 [0,1,0,1,0,0|2,0,0]=4 3085 B15R2.11 CC(C)(C)NC1CCc2c1cccc2 2230a_100000715429_200000721974 [0,1,0,1,0,0|2,0,0]=4 3086 B15R2.11 CC(C)(C)N[C@H]1CCc2c1cccc2 34a_100016989578_100000210625 [0,1,0,1,0,0|2,0,0]=4 3087 B15R2.11 CC(C)(C)OC1CCc2c1cccc2 34a_100000212247_100000210625 [0,1,0,1,0,0|2,0,0]=4 3088 B15R2.11 CC(C)(C)SC1CCc2c1cccc2 62a_100000211941_200000721974 [0,1,0,1,0,0|2,0,0]=4 3089 B15R2.4440 CC(C)(C)N1CCC1c2ccccc2 269982a_100000739605_100000210625 [0,1,0,1,0,0|2,0,0]=4 3090 B15R2.89951 CC1(CC(c2ccccc2O1)N[13CH3])C 2230a_100000686917_200025704644 [0,1,0,1,0,0|2,0,0]=4 3091 B15R2.89951 CC1(CC(c2ccccc2O1)N[13CH3])C 34a_100000686917_200025704644 [0,1,0,1,0,0|2,0,0]=4 3092 B15R2.89951 CNC1CC(Oc2c1cccc2)(C)C 2230a_100000686917_200000210301 [0,1,0,1,0,0|2,0,0]=4 3093 B15R2.89951 CNC1CC(Oc2c1cccc2)(C)C 34a_100000686917_200000210301 [0,1,0,1,0,0|2,0,0]=4 3094 B15R2.1521 CC(NC1(CC1)C)c2ccc(cc2)Br 2230a_100000757604_100000755118 [0,1,0,1,0,0|2,0,0]=4 3095 B15R2.1521 CC(NC1(CC1)C)c2ccc(cc2)Cl 2230a_100000757604_100000684792 [0,1,0,1,0,0|2,0,0]=4 3096 B15R2.1521 CC(NC1(CC1)C)c2ccc(cc2)F 2230a_100000757604_100000743420 [0,1,0,1,0,0|2,0,0]=4 3097 B15R2.1521 CC(OC1(CC1)C)c2ccc(cc2)Cl 7a_100011725673_100000684792 [0,1,0,1,0,0|2,0,0]=4 3098 B15R2.1521 CC(OC1(CC1)C)c2ccc(cc2)F 7a_100011725673_100000743420 [0,1,0,1,0,0|2,0,0]=4 3099 B15R2.1521 Cc1ccc(cc1)C(C)NC2(CC2)C 2230a_100000757604_100011261388 [0,1,0,1,0,0|2,0,0]=4 3100 B15R2.1521 Cc1ccc(cc1)C(C)OC2(CC2)C 7a_100011725673_100011261388 [0,1,0,1,0,0|2,0,0]=4 3101 B15R2.7513 CC1(CC1)NC(C)(C)c2ccccc2 2230a_100000757604_100000034625 [0,1,0,1,0,0|2,0,0]=4 3102 B15R2.7433 CC(NC1(CC1)C)c2ccccc2Cl 2230a_100000757604_100000181259 [0,1,0,1,0,0|2,0,0]=4 3103 B15R2.7433 CC(NC1(CC1)C)c2ccccc2F 2230a_100000757604_200000741388 [0,1,0,1,0,0|2,0,0]=4 3104 B15R2.7433 CC(OC1(CC1)C)c2ccccc2Cl 7a_100011725673_100000181259 [0,1,0,1,0,0|2,0,0]=4 3105 B15R2.7433 CC(OC1(CC1)C)c2ccccc2F 7a_100011725673_200000741388 [0,1,0,1,0,0|2,0,0]=4 3106 B15R2.3771 CN(C1Cc2c1cccc2)C(C)(C)C 269982a_100011215553_100009813401 [0,1,0,1,0,0|2,0,0]=4 3107 B15R2.110155 CC(C(=O)C1(CC1)C)c2ccccc2 1458a_100000756474_100000230085 [0,1,0,1,0,0|1,0,1]=4 3108 B15R3.6744 CC1(CC1)OC2Cc3c2cccc3 7a_100011725673_100009813401 [0,0,0,2,0,0|2,0,0]=4 3109 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [1,0,0,0,1,0|1,0,1]=4 3110 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [1,0,0,0,1,0|2,0,0]=4 3111 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [1,0,0,0,1,0|2,0,0]=4 3112 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [1,0,0,0,1,0|2,0,0]=4 3113 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [1,0,0,0,1,0|2,0,0]=4 3114 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [1,0,0,0,1,0|2,0,0]=4 3115 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [1,0,0,0,1,0|2,0,0]=4 3116 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [1,0,0,0,1,0|2,0,0]=4 3117 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [1,0,0,0,1,0|2,0,0]=4 3118 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [1,0,0,0,1,0|2,0,0]=4 3119 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [1,0,0,0,1,0|2,0,0]=4 3120 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [1,0,0,0,1,0|2,0,0]=4 3121 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [1,0,0,0,1,0|2,0,0]=4 3122 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [1,0,0,0,1,0|2,0,0]=4 3123 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [1,0,0,0,1,0|0,0,1]=3 3124 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [1,0,0,0,1,0|0,0,1]=3 3125 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [1,0,0,0,1,0|0,0,1]=3 3126 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [1,0,0,0,1,0|0,0,1]=3 3127 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [1,0,0,0,1,0|0,0,1]=3 3128 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [1,0,0,0,1,0|0,0,1]=3 3129 B11R1.36 CC(c1ccccn1)N(C)C 2230a_100000231138_200000210301 [1,0,0,0,1,0|1,0,1]=4 3130 B11R1.36 CC(c1ccccn1)N(C)C 269982a_100000231138_200000210301 [1,0,0,0,1,0|1,0,1]=4 3131 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 2230a_100000231138_200025704644 [1,0,0,0,1,0|1,0,1]=4 3132 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 269982a_100000231138_200025704644 [1,0,0,0,1,0|1,0,1]=4 3133 B11R1.36 CC(c1cccnc1)N(C)C 2230a_100000232774_200000210301 [1,0,0,0,1,0|1,0,1]=4 3134 B11R1.36 CC(c1cccnc1)N(C)C 269982a_100000232774_200000210301 [1,0,0,0,1,0|1,0,1]=4 3135 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 2230a_100000232774_200025704644 [1,0,0,0,1,0|1,0,1]=4 3136 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 269982a_100000232774_200025704644 [1,0,0,0,1,0|1,0,1]=4 3137 B11R1.36 CC(c1ccncc1)N(C)C 2230a_100000231139_200000210301 [1,0,0,0,1,0|1,0,1]=4 3138 B11R1.36 CC(c1ccncc1)N(C)C 269982a_100000231139_200000210301 [1,0,0,0,1,0|1,0,1]=4 3139 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 2230a_100000231139_200025704644 [1,0,0,0,1,0|1,0,1]=4 3140 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 269982a_100000231139_200025704644 [1,0,0,0,1,0|1,0,1]=4 3141 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [1,0,0,0,1,0|2,0,0]=4 3142 B11R1.509 CC(C)(C)Nc1ccccc1 34a_100000106764_100000210625 [1,0,0,0,1,0|2,0,0]=4 3143 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [1,0,0,0,1,0|2,0,0]=4 3144 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000211941_100000041952 [1,0,0,0,1,0|2,0,0]=4 3145 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000719477_100000211941 [1,0,0,0,1,0|2,0,0]=4 3146 B11R1.510 C[N+](C)(C)CSc1ccco1 62a_100009814098_200000036245 [1,0,0,0,1,0|2,0,0]=4 3147 B11R1.510 C[N+](C)(C)CSc1ccco1 62a_200000036245_100009814098 [1,0,0,0,1,0|2,0,0]=4 3148 B11R1.510 C[N+](C)(C)CSc1cccs1 62a_100011215356_200000036245 [1,0,0,0,1,0|2,0,0]=4 3149 B11R1.510 C[N+](C)(C)CSc1cccs1 62a_200000036245_100011215356 [1,0,0,0,1,0|2,0,0]=4 3150 B11R1.510 C[N+](C)(C)CSc1ccoc1 62a_100011215275_200000036245 [1,0,0,0,1,0|2,0,0]=4 3151 B11R1.510 C[N+](C)(C)CSc1ccoc1 62a_200000036245_100011215275 [1,0,0,0,1,0|2,0,0]=4 3152 B11R1.510 C[N+](C)(C)CSc1ccsc1 62a_100000738268_200000036245 [1,0,0,0,1,0|2,0,0]=4 3153 B11R1.510 C[N+](C)(C)CSc1ccsc1 62a_200000036245_100000738268 [1,0,0,0,1,0|2,0,0]=4 3154 B13R1.45 C=C(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000748629 [1,0,0,0,0,1|1,0,1]=4 3155 B13R1.45 C=C(C)COC(C)c1ccccc1 34a_100000210245_100000211855 [1,0,0,0,0,1|1,0,1]=4 3156 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748629 [1,0,0,0,0,1|1,0,1]=4 3157 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748629 [1,0,0,0,0,1|1,0,1]=4 3158 B13R1.45 C=C(C)CSC(C)c1ccccc1 62a_100000230085_100000211660 [1,0,0,0,0,1|1,0,1]=4 3159 B13R1.45 C=C(C)CSC(C)c1ccccc1 62a_100000748629_100000230085 [1,0,0,0,0,1|1,0,1]=4 3160 B13R1.45 CC(=CCN(C)c1ccccc1)C 2230a_100000210012_100000761012 [1,0,0,0,0,1|2,0,0]=4 3161 B13R1.45 CC(=CCN(C)c1ccccc1)C 269982a_100000210012_100000761012 [1,0,0,0,0,1|2,0,0]=4 3162 B13R1.45 CC(=CCN(C)c1ccccc1)C 34a_100000210012_100000761012 [1,0,0,0,0,1|2,0,0]=4 3163 B13R1.45 CC(=O)COC(C)c1ccccc1 34a_100000211253_100000211855 [1,0,0,0,0,1|2,0,0]=4 3164 B13R1.45 CC(=O)NCC(C)c1ccccc1 11a_100000701038_100015343762 [1,0,0,0,0,1|2,0,0]=4 3165 B13R1.45 CC(=O)NCC(C)c1ccccc1 1626a_100000701038_100015343762 [1,0,0,0,0,1|2,0,0]=4 3166 B13R1.45 CC(=O)NCC(C)c1ccccc1 240690a_100000701038_100015343762 [1,0,0,0,0,1|2,0,0]=4 3167 B13R1.45 CC(=O)NCC(C)c1ccccc1 527a_100000701038_100103153847 [1,0,0,0,0,1|2,0,0]=4 3168 B13R1.45 CC(Br)COC(C)c1ccccc1 34a_100012180447_100000211855 [1,0,0,0,0,1|2,0,0]=4 3169 B13R1.45 CC(C)CCN(C)c1ccccc1 2230a_100000210012_100000210312 [1,0,0,0,0,1|2,0,0]=4 3170 B13R1.45 CC(C)CCN(C)c1ccccc1 269982a_100000210012_100000210312 [1,0,0,0,0,1|2,0,0]=4 3171 B13R1.45 CC(C)CCN(C)c1ccccc1 34a_100000210012_100000210312 [1,0,0,0,0,1|2,0,0]=4 3172 B13R1.45 CC(C)CNC(C)c1ccccc1 2230a_100000210953_100000230085 [1,0,0,0,0,1|1,0,0]=3 3173 B13R1.45 CC(C)CNC(C)c1ccccc1 269862a_100000210953_100000185851 [1,0,0,0,0,1|1,0,0]=3 3174 B13R1.45 CC(C)CNC(C)c1ccccc1 34a_100000210953_100000211855 [1,0,0,0,0,1|1,0,0]=3 3175 B13R1.45 CC(C)CNC(C)c1ccccn1 2230a_100000181244_100000210760 [1,0,0,0,0,1|2,0,0]=4 3176 B13R1.45 CC(C)CNC(C)c1ccccn1 269862a_100000210953_100000210467 [1,0,0,0,0,1|2,0,0]=4 3177 B13R1.45 CC(C)CNC(C)c1ccccn1 270004a_100000181244_100000210432 [1,0,0,0,0,1|2,0,0]=4 3178 B13R1.45 CC(C)CNC(C)c1cccnc1 2230a_100000195435_100000210760 [1,0,0,0,0,1|2,0,0]=4 3179 B13R1.45 CC(C)CNC(C)c1cccnc1 269862a_100000210953_100000210468 [1,0,0,0,0,1|2,0,0]=4 3180 B13R1.45 CC(C)CNC(C)c1cccnc1 270004a_100000195435_100000210432 [1,0,0,0,0,1|2,0,0]=4 3181 B13R1.45 CC(C)CNC(C)c1ccncc1 2230a_100000181269_100000210760 [1,0,0,0,0,1|2,0,0]=4 3182 B13R1.45 CC(C)CNC(C)c1ccncc1 269862a_100000210953_100000185792 [1,0,0,0,0,1|2,0,0]=4 3183 B13R1.45 CC(C)CNC(C)c1ccncc1 270004a_100000181269_100000210432 [1,0,0,0,0,1|2,0,0]=4 3184 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000210760 [1,0,0,0,0,1|1,0,0]=3 3185 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 270004a_100000751104_100000210432 [1,0,0,0,0,1|1,0,0]=3 3186 B13R1.45 CC(C)COC(C)c1ccccc1 34a_100000210257_100000211855 [1,0,0,0,0,1|1,0,0]=3 3187 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000210624 [1,0,0,0,0,1|1,0,0]=3 3188 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000210760 [1,0,0,0,0,1|1,0,0]=3 3189 B13R1.45 CC(C)CSC(C)c1ccccc1 62a_100000210624_100000230085 [1,0,0,0,0,1|1,0,0]=3 3190 B13R1.45 CC(C)CSC(C)c1ccccc1 62a_100000230085_100000210760 [1,0,0,0,0,1|1,0,0]=3 3191 B13R1.45 CC(C)NCC(C)c1ccccc1 2230a_100000701038_100000210206 [1,0,0,0,0,1|1,0,0]=3 3192 B13R1.45 CC(C)NCC(C)c1ccccc1 2230a_100138425928_100000756946 [1,0,0,0,0,1|1,0,0]=3 3193 B13R1.45 CC(C)NCC(C)c1ccccc1 34a_100000701038_100000210206 [1,0,0,0,0,1|1,0,0]=3 3194 B13R1.45 CC(C)NCC(C)c1ccccc1 34a_100138425928_100000756946 [1,0,0,0,0,1|1,0,0]=3 3195 B13R1.45 CC(C)NCC(O)c1ccccc1 2230a_100000210709_100000210206 [1,0,0,0,0,1|2,0,0]=4 3196 B13R1.45 CC(C)NCC(O)c1ccccc1 2230a_100138425928_100000185958 [1,0,0,0,0,1|2,0,0]=4 3197 B13R1.45 CC(C)NCC(O)c1ccccc1 34a_100138425928_100000185958 [1,0,0,0,0,1|2,0,0]=4 3198 B13R1.45 CC(C)NC[C@@H](O)c1ccccc1 2230a_100138425928_100011933945 [1,0,0,0,0,1|2,0,0]=4 3199 B13R1.45 CC(C)NC[C@@H](O)c1ccccc1 34a_100138425928_100011933945 [1,0,0,0,0,1|2,0,0]=4 3200 B13R1.45 CC(C)OCC(C)c1ccccc1 34a_100000212225_100000756946 [1,0,0,0,0,1|1,0,0]=3 3201 B13R1.45 CC(C)OCC(C)c1ccccc1 34a_100011215166_100000210206 [1,0,0,0,0,1|1,0,0]=3 3202 B13R1.45 CC(C)OCC(C)c1ccccc1 7a_100011215166_100000210206 [1,0,0,0,0,1|1,0,0]=3 3203 B13R1.45 CC(C)OCC(O)c1ccccc1 34a_100000212225_100000185958 [1,0,0,0,0,1|2,0,0]=4 3204 B13R1.45 CC(C)OCN(C)c1ccccc1 2230a_100000210012_100000709892 [1,0,0,0,0,1|2,0,0]=4 3205 B13R1.45 CC(C)OCN(C)c1ccccc1 269982a_100000210012_100000709892 [1,0,0,0,0,1|2,0,0]=4 3206 B13R1.45 CC(C)OCN(C)c1ccccc1 34a_100000210012_100000709892 [1,0,0,0,0,1|2,0,0]=4 3207 B13R1.45 CC(C)OC[C@@H](N)c1ccccc1 34a_100000751927_100000210206 [1,0,0,0,0,1|2,0,0]=4 3208 B13R1.45 CC(C)OC[C@@H](O)c1ccccc1 34a_100000212225_100011933945 [1,0,0,0,0,1|2,0,0]=4 3209 B13R1.45 CC(C)SCC(C)c1ccccc1 62a_100000210206_100000756946 [1,0,0,0,0,1|1,0,0]=3 3210 B13R1.45 CC(C)SCC(C)c1ccccc1 62a_100000756946_100000210206 [1,0,0,0,0,1|1,0,0]=3 3211 B13R1.45 CC(C)SCC(O)c1ccccc1 62a_100000185958_100000210206 [1,0,0,0,0,1|2,0,0]=4 3212 B13R1.45 CC(C)SCC(O)c1ccccc1 62a_100000210206_100000185958 [1,0,0,0,0,1|2,0,0]=4 3213 B13R1.45 CC(C)SC[C@@H](O)c1ccccc1 62a_100000210206_100011933945 [1,0,0,0,0,1|2,0,0]=4 3214 B13R1.45 CC(C)SC[C@@H](O)c1ccccc1 62a_100011933945_100000210206 [1,0,0,0,0,1|2,0,0]=4 3215 B13R1.45 CC(CCN(C)C)c1ccccc1 270004a_100102631434_100000189432 [1,0,0,0,0,1|0,0,1]=3 3216 B13R1.45 CC(F)COC(C)c1ccccc1 34a_100015925927_100000211855 [1,0,0,0,0,1|2,0,0]=4 3217 B13R1.45 CC(O)CNC(C)c1ccccc1 2230a_100000210904_100000230085 [1,0,0,0,0,1|2,0,0]=4 3218 B13R1.45 CC(O)CNC(C)c1ccccc1 269862a_100000210904_100000185851 [1,0,0,0,0,1|2,0,0]=4 3219 B13R1.45 CC(O)CNC(C)c1ccccc1 34a_100000210904_100000211855 [1,0,0,0,0,1|2,0,0]=4 3220 B13R1.45 CC(O)CN[C@H](C)c1ccccc1 2230a_100000751104_100011218427 [1,0,0,0,0,1|2,0,0]=4 3221 B13R1.45 CC(O)CO[C@H](C)c1ccccc1 34a_100000761318_100011218427 [1,0,0,0,0,1|2,0,0]=4 3222 B13R1.45 CC(O)CO[C@H](C)c1ccccc1 7a_100000761318_100011218427 [1,0,0,0,0,1|2,0,0]=4 3223 B13R1.45 CC(O)CSC(C)c1ccccc1 62a_100000230085_100011218427 [1,0,0,0,0,1|2,0,0]=4 3224 B13R1.45 CC(O)CSC(C)c1ccccc1 62a_100011218427_100000230085 [1,0,0,0,0,1|2,0,0]=4 3225 B13R1.45 CC(OC[C@@H](C)Cl)c1ccccc1 34a_100016084084_100000211855 [1,0,0,0,0,1|2,0,0]=4 3226 B13R1.45 CC(OC[C@@H](C)N)c1ccccc1 34a_100000737577_100000211855 [1,0,0,0,0,1|2,0,0]=4 3227 B13R1.45 CC(SC[C@@H](C)O)c1ccccc1 62a_100000230085_100009817552 [1,0,0,0,0,1|2,0,0]=4 3228 B13R1.45 CC(SC[C@@H](C)O)c1ccccc1 62a_100009817552_100000230085 [1,0,0,0,0,1|2,0,0]=4 3229 B13R1.45 CN(C)CCC(O)c1ccccc1 2230a_100011218556_200000210301 [1,0,0,0,0,1|1,0,1]=4 3230 B13R1.45 CN(C)CCC(O)c1ccccc1 269982a_100011218556_200000210301 [1,0,0,0,0,1|1,0,1]=4 3231 B13R1.45 CN(C)CCN(C)c1ccccc1 2230a_106657271745_200000210301 [1,0,0,0,0,1|1,0,1]=4 3232 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_100000210012_100000755713 [1,0,0,0,0,1|1,0,1]=4 3233 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_106657271745_200000210301 [1,0,0,0,0,1|1,0,1]=4 3234 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_200000219566_200000210301 [1,0,0,0,0,1|1,0,1]=4 3235 B13R1.45 CN(C)CCN([13CH3])c1ccccc1 269982a_200000219566_200025704644 [1,0,0,0,0,1|1,0,1]=4 3236 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 2230a_100102631434_100000729684 [1,0,0,0,0,1|1,0,1]=4 3237 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 269982a_100102631434_100000729684 [1,0,0,0,0,1|1,0,1]=4 3238 B13R1.45 CN([13CH3])CCC(O)c1ccccc1 2230a_100011218556_200025704644 [1,0,0,0,0,1|1,0,1]=4 3239 B13R1.45 CN([13CH3])CCC(O)c1ccccc1 269982a_100011218556_200025704644 [1,0,0,0,0,1|1,0,1]=4 3240 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 2230a_106657271745_200025704644 [1,0,0,0,0,1|1,0,1]=4 3241 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 269982a_106657271745_200025704644 [1,0,0,0,0,1|1,0,1]=4 3242 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccccc1 2230a_100000751104_100009817552 [1,0,0,0,0,1|2,0,0]=4 3243 B13R1.45 C[C@@H](O)CO[C@H](C)c1ccccc1 34a_100000761318_100009817552 [1,0,0,0,0,1|2,0,0]=4 3244 B13R1.45 C[C@@H](O)CO[C@H](C)c1ccccc1 7a_100000761318_100009817552 [1,0,0,0,0,1|2,0,0]=4 3245 B13R1.348 CC(C)CC(C)Nc1ccccc1 34a_100000106764_100000731052 [1,0,0,0,0,1|1,0,0]=3 3246 B13R1.348 CC(C)CC(C)Oc1ccccc1 34a_100000210340_100000731052 [1,0,0,0,0,1|1,0,0]=3 3247 B13R1.348 CC(C)CC(C)Oc1ccccc1 7a_100000210340_100000731052 [1,0,0,0,0,1|1,0,0]=3 3248 B13R1.348 CC(C)CC(C)Oc1cccnc1 34a_100000210849_100000731052 [1,0,0,0,0,1|2,0,0]=4 3249 B13R1.348 CC(C)CC(C)Oc1cccnc1 7a_100000210849_100000731052 [1,0,0,0,0,1|2,0,0]=4 3250 B13R1.348 CC(C)CC(C)Oc1ccncc1 34a_100000212176_100000731052 [1,0,0,0,0,1|2,0,0]=4 3251 B13R1.348 CC(C)CC(C)Sc1ccccc1 62a_100000719477_100000731052 [1,0,0,0,0,1|1,0,0]=3 3252 B13R1.348 CC(C)CC(C)Sc1ccccc1 62a_100000731052_100000041952 [1,0,0,0,0,1|1,0,0]=3 3253 B13R1.348 CC(C)CC(C)Sc1ccccn1 62a_100000731052_100011216584 [1,0,0,0,0,1|2,0,0]=4 3254 B13R1.348 CC(C)CC(C)Sc1ccccn1 62a_100011216584_100000731052 [1,0,0,0,0,1|2,0,0]=4 3255 B13R1.348 CC(C)CC(C)Sc1cccnc1 62a_100000210063_100000731052 [1,0,0,0,0,1|2,0,0]=4 3256 B13R1.348 CC(C)CC(C)Sc1cccnc1 62a_100000731052_100000210063 [1,0,0,0,0,1|2,0,0]=4 3257 B13R1.348 CC(C)CC(C)Sc1ccncc1 62a_100000728582_100000731052 [1,0,0,0,0,1|2,0,0]=4 3258 B13R1.348 CC(C)CC(C)Sc1ccncc1 62a_100000731052_100000728582 [1,0,0,0,0,1|2,0,0]=4 3259 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000186898_100000210760 [1,0,0,0,0,1|2,0,0]=4 3260 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000189081_200000210301 [1,0,0,0,0,1|2,0,0]=4 3261 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000747067_100015291786 [1,0,0,0,0,1|2,0,0]=4 3262 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000186898_100000210624 [1,0,0,0,0,1|2,0,0]=4 3263 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000189081_200000210301 [1,0,0,0,0,1|2,0,0]=4 3264 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000747067_100000211182 [1,0,0,0,0,1|2,0,0]=4 3265 B13R1.348 CC(C)CN(C)Cc1ccccc1 270004a_100000186898_100000210432 [1,0,0,0,0,1|2,0,0]=4 3266 B13R1.348 CC(C)CN(C)Cc1ccccc1 270004a_100000747067_100015611070 [1,0,0,0,0,1|2,0,0]=4 3267 B13R1.348 CC(C)CN(C)Cc1ccccc1 34a_100000189081_200000210301 [1,0,0,0,0,1|2,0,0]=4 3268 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 2230a_100000189081_200025704644 [1,0,0,0,0,1|2,0,0]=4 3269 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 269982a_100000189081_200025704644 [1,0,0,0,0,1|2,0,0]=4 3270 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 34a_100000189081_200025704644 [1,0,0,0,0,1|2,0,0]=4 3271 B13R1.348 CC(C)NC(C)Cc1ccccc1 34a_100138425928_200011218536 [1,0,0,0,0,1|2,0,0]=4 3272 B13R1.348 CC(C)OC(C)Cc1ccccc1 34a_100000212225_200011218536 [1,0,0,0,0,1|2,0,0]=4 3273 B13R1.348 CC(C)OC(C)Cc1ccccc1 34a_100000748627_100000210206 [1,0,0,0,0,1|2,0,0]=4 3274 B13R1.348 CC(C)OC(C)Cc1ccccc1 7a_100000748627_100000210206 [1,0,0,0,0,1|2,0,0]=4 3275 B13R1.348 CC(C)SC(C)Cc1ccccc1 62a_100000210206_200011218536 [1,0,0,0,0,1|2,0,0]=4 3276 B13R1.348 CC(C)SC(C)Cc1ccccc1 62a_200011218536_100000210206 [1,0,0,0,0,1|2,0,0]=4 3277 B13R1.348 CC(CN(C)C)Sc1ccccc1 62a_100000719477_100020606517 [1,0,0,0,0,1|0,0,1]=3 3278 B13R1.348 CC(CN(C)C)Sc1ccccc1 62a_100020606517_100000041952 [1,0,0,0,0,1|0,0,1]=3 3279 B13R1.348 CC(CN(C)C)Sc1ccccn1 62a_100011216584_100020606517 [1,0,0,0,0,1|1,0,1]=4 3280 B13R1.348 CC(CN(C)C)Sc1ccccn1 62a_100020606517_100011216584 [1,0,0,0,0,1|1,0,1]=4 3281 B13R1.348 CC(CN(C)C)Sc1cccnc1 62a_100000210063_100020606517 [1,0,0,0,0,1|1,0,1]=4 3282 B13R1.348 CC(CN(C)C)Sc1cccnc1 62a_100020606517_100000210063 [1,0,0,0,0,1|1,0,1]=4 3283 B13R1.348 CC(CN(C)C)Sc1ccncc1 62a_100000728582_100020606517 [1,0,0,0,0,1|1,0,1]=4 3284 B13R1.348 CC(CN(C)C)Sc1ccncc1 62a_100020606517_100000728582 [1,0,0,0,0,1|1,0,1]=4 3285 B13R1.348 CN(C)C[C@@H](O)Cc1ccccc1 2230a_100102631434_100000729385 [1,0,0,0,0,1|1,0,1]=4 3286 B13R1.348 CN(C)C[C@@H](O)Cc1ccccc1 269982a_100102631434_100000729385 [1,0,0,0,0,1|1,0,1]=4 3287 B13R1.3523 CC(C)(C)CCNc1ccccc1 34a_100000106764_100000755188 [1,0,0,0,0,1|1,0,0]=3 3288 B13R1.3523 CC(C)(C)CCOc1ccccc1 34a_100000210340_100000755188 [1,0,0,0,0,1|1,0,0]=3 3289 B13R1.3523 CC(C)(C)CCOc1ccccc1 7a_100000210340_100000755188 [1,0,0,0,0,1|1,0,0]=3 3290 B13R1.3523 CC(C)(C)CCOc1cccnc1 34a_100000210849_100000755188 [1,0,0,0,0,1|2,0,0]=4 3291 B13R1.3523 CC(C)(C)CCOc1cccnc1 7a_100000210849_100000755188 [1,0,0,0,0,1|2,0,0]=4 3292 B13R1.3523 CC(C)(C)CCOc1ccncc1 34a_100000212176_100000755188 [1,0,0,0,0,1|2,0,0]=4 3293 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000719477_100000755188 [1,0,0,0,0,1|1,0,0]=3 3294 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000755188_100000041952 [1,0,0,0,0,1|1,0,0]=3 3295 B13R1.3523 CC(C)(C)CCSc1ccccn1 62a_100000755188_100011216584 [1,0,0,0,0,1|2,0,0]=4 3296 B13R1.3523 CC(C)(C)CCSc1ccccn1 62a_100011216584_100000755188 [1,0,0,0,0,1|2,0,0]=4 3297 B13R1.3523 CC(C)(C)CCSc1cccnc1 62a_100000210063_100000755188 [1,0,0,0,0,1|2,0,0]=4 3298 B13R1.3523 CC(C)(C)CCSc1cccnc1 62a_100000755188_100000210063 [1,0,0,0,0,1|2,0,0]=4 3299 B13R1.3523 CC(C)(C)CCSc1ccncc1 62a_100000728582_100000755188 [1,0,0,0,0,1|2,0,0]=4 3300 B13R1.3523 CC(C)(C)CCSc1ccncc1 62a_100000755188_100000728582 [1,0,0,0,0,1|2,0,0]=4 3301 B13R1.3523 CC(C)(C)CNCc1ccccc1 207a_100000743828_100015611070 [1,0,0,0,0,1|1,0,0]=3 3302 B13R1.3523 CC(C)(C)CNCc1ccccc1 2230a_100000743828_100015291786 [1,0,0,0,0,1|1,0,0]=3 3303 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100000743828_100015611070 [1,0,0,0,0,1|1,0,0]=3 3304 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100015324214_100011204126 [1,0,0,0,0,1|1,0,0]=3 3305 B13R1.3523 CC(C)(C)CNCc1ccccc1 34a_100015324214_100011219605 [1,0,0,0,0,1|1,0,0]=3 3306 B13R1.3523 CC(C)(C)CNCc1ccccn1 207a_100000743828_100000209966 [1,0,0,0,0,1|2,0,0]=4 3307 B13R1.3523 CC(C)(C)CNCc1ccccn1 2230a_100000743828_100000721315 [1,0,0,0,0,1|2,0,0]=4 3308 B13R1.3523 CC(C)(C)CNCc1ccccn1 270004a_100000210449_100011204126 [1,0,0,0,0,1|2,0,0]=4 3309 B13R1.3523 CC(C)(C)CNCc1ccccn1 270004a_100000743828_100000209966 [1,0,0,0,0,1|2,0,0]=4 3310 B13R1.3523 CC(C)(C)CNCc1cccnc1 207a_100000743828_100000209961 [1,0,0,0,0,1|2,0,0]=4 3311 B13R1.3523 CC(C)(C)CNCc1cccnc1 2230a_100000743828_100000741622 [1,0,0,0,0,1|2,0,0]=4 3312 B13R1.3523 CC(C)(C)CNCc1cccnc1 270004a_100000210453_100011204126 [1,0,0,0,0,1|2,0,0]=4 3313 B13R1.3523 CC(C)(C)CNCc1cccnc1 270004a_100000743828_100000209961 [1,0,0,0,0,1|2,0,0]=4 3314 B13R1.3523 CC(C)(C)CNCc1ccncc1 207a_100000743828_100000186114 [1,0,0,0,0,1|2,0,0]=4 3315 B13R1.3523 CC(C)(C)CNCc1ccncc1 2230a_100000743828_100015193705 [1,0,0,0,0,1|2,0,0]=4 3316 B13R1.3523 CC(C)(C)COCc1ccccc1 34a_100000210790_100011219605 [1,0,0,0,0,1|1,0,0]=3 3317 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100000211182_100011219605 [1,0,0,0,0,1|1,0,0]=3 3318 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100011219605_100015291786 [1,0,0,0,0,1|1,0,0]=3 3319 B13R1.3523 CC(C)(C)CSCc1ccccn1 62a_100000721315_100011219605 [1,0,0,0,0,1|2,0,0]=4 3320 B13R1.3523 CC(C)(C)CSCc1ccccn1 62a_100011219605_100000721315 [1,0,0,0,0,1|2,0,0]=4 3321 B13R1.3523 CC(C)(C)CSCc1cccnc1 62a_100000741622_100011219605 [1,0,0,0,0,1|2,0,0]=4 3322 B13R1.3523 CC(C)(C)CSCc1cccnc1 62a_100011219605_100000741622 [1,0,0,0,0,1|2,0,0]=4 3323 B13R1.3523 CC(C)(C)CSCc1ccncc1 62a_100011219605_100015193705 [1,0,0,0,0,1|2,0,0]=4 3324 B13R1.3523 CC(C)(C)CSCc1ccncc1 62a_100015193705_100011219605 [1,0,0,0,0,1|2,0,0]=4 3325 B13R1.3523 CC(C)(C)NCCc1ccccc1 2230a_100000715429_100000765856 [1,0,0,0,0,1|1,0,0]=3 3326 B13R1.3523 CC(C)(C)NCCc1ccccc1 34a_100000106460_100000210625 [1,0,0,0,0,1|1,0,0]=3 3327 B13R1.3523 CC(C)(C)NCCc1ccccn1 2230a_100000715429_100015183660 [1,0,0,0,0,1|2,0,0]=4 3328 B13R1.3523 CC(C)(C)NCCc1cccnc1 2230a_100000715429_200011713674 [1,0,0,0,0,1|2,0,0]=4 3329 B13R1.3523 CC(C)(C)NCCc1ccncc1 2230a_100000715429_100000723409 [1,0,0,0,0,1|2,0,0]=4 3330 B13R1.3523 CC(C)(C)NCSc1ccccc1 2230a_100000715429_100011218342 [1,0,0,0,0,1|2,0,0]=4 3331 B13R1.3523 CC(C)(C)OCCc1ccccc1 34a_100000210268_100000210625 [1,0,0,0,0,1|1,0,0]=3 3332 B13R1.3523 CC(C)(C)OCCc1ccccc1 34a_100015890283_100000765856 [1,0,0,0,0,1|1,0,0]=3 3333 B13R1.3523 CC(C)(C)OCCc1ccccc1 7a_100015890283_100000765856 [1,0,0,0,0,1|1,0,0]=3 3334 B13R1.3523 CC(C)(C)OCCc1ccccn1 34a_100000210271_100000210625 [1,0,0,0,0,1|2,0,0]=4 3335 B13R1.3523 CC(C)(C)OCCc1ccccn1 7a_100015890283_100015183660 [1,0,0,0,0,1|2,0,0]=4 3336 B13R1.3523 CC(C)(C)OCCc1cccnc1 34a_100011217484_100000210625 [1,0,0,0,0,1|2,0,0]=4 3337 B13R1.3523 CC(C)(C)OCCc1cccnc1 7a_100015890283_200011713674 [1,0,0,0,0,1|2,0,0]=4 3338 B13R1.3523 CC(C)(C)OCCc1ccncc1 34a_100011216225_100000210625 [1,0,0,0,0,1|2,0,0]=4 3339 B13R1.3523 CC(C)(C)OCCc1ccncc1 7a_100015890283_100000723409 [1,0,0,0,0,1|2,0,0]=4 3340 B13R1.3523 CC(C)(C)SCCc1ccccc1 62a_100000211941_100011218657 [1,0,0,0,0,1|1,0,0]=3 3341 B13R1.3523 CC(C)(C)SCCc1ccccc1 62a_100000765856_100000211941 [1,0,0,0,0,1|1,0,0]=3 3342 B13R1.3523 CC(C)(C)SCCc1ccccn1 62a_100000211941_100015183660 [1,0,0,0,0,1|2,0,0]=4 3343 B13R1.3523 CC(C)(C)SCCc1ccccn1 62a_100015183660_100000211941 [1,0,0,0,0,1|2,0,0]=4 3344 B13R1.3523 CC(C)(C)SCCc1cccnc1 62a_100000211941_200011713674 [1,0,0,0,0,1|2,0,0]=4 3345 B13R1.3523 CC(C)(C)SCCc1cccnc1 62a_200011713674_100000211941 [1,0,0,0,0,1|2,0,0]=4 3346 B13R1.3523 CC(C)(C)SCCc1ccncc1 62a_100000211941_100000723409 [1,0,0,0,0,1|2,0,0]=4 3347 B13R1.3523 CC(C)(C)SCCc1ccncc1 62a_100000723409_100000211941 [1,0,0,0,0,1|2,0,0]=4 3348 B13R1.3523 CC(C)(C)SCSc1ccccc1 62a_100000211941_100011218342 [1,0,0,0,0,1|2,0,0]=4 3349 B13R1.3523 CC(C)(C)SCSc1ccccc1 62a_100011218342_100000211941 [1,0,0,0,0,1|2,0,0]=4 3350 B13R1.3523 CC(C)(F)CNCc1ccccc1 207a_100020643315_100015611070 [1,0,0,0,0,1|2,0,0]=4 3351 B13R1.3523 CC(C)(F)CNCc1ccccc1 2230a_100020643315_100015291786 [1,0,0,0,0,1|2,0,0]=4 3352 B13R1.3523 CC(C)(F)CNCc1ccccc1 270004a_100020643315_100015611070 [1,0,0,0,0,1|2,0,0]=4 3353 B13R1.3523 CC(C)(F)CNCc1ccccc1 34a_100015324214_100011997219 [1,0,0,0,0,1|2,0,0]=4 3354 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000210790_100011997219 [1,0,0,0,0,1|2,0,0]=4 3355 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000716592_100015291786 [1,0,0,0,0,1|2,0,0]=4 3356 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100000211182_100011997219 [1,0,0,0,0,1|2,0,0]=4 3357 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100011997219_100015291786 [1,0,0,0,0,1|2,0,0]=4 3358 B13R1.3523 CC(C)(O)CCNc1ccccc1 34a_100000106764_100000702414 [1,0,0,0,0,1|2,0,0]=4 3359 B13R1.3523 CC(C)(O)CCOc1ccccc1 34a_100000210340_100000702414 [1,0,0,0,0,1|2,0,0]=4 3360 B13R1.3523 CC(C)(O)CCOc1ccccc1 7a_100000210340_100000702414 [1,0,0,0,0,1|2,0,0]=4 3361 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000702414_100000041952 [1,0,0,0,0,1|2,0,0]=4 3362 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000719477_100000702414 [1,0,0,0,0,1|2,0,0]=4 3363 B13R1.3523 CC(C)(O)CNCc1ccccc1 207a_100000751335_100015611070 [1,0,0,0,0,1|2,0,0]=4 3364 B13R1.3523 CC(C)(O)CNCc1ccccc1 2230a_100000751335_100015291786 [1,0,0,0,0,1|2,0,0]=4 3365 B13R1.3523 CC(C)(O)CNCc1ccccc1 270004a_100000751335_100015611070 [1,0,0,0,0,1|2,0,0]=4 3366 B13R1.3523 CC(C)(O)CNCc1ccccc1 34a_100015324214_100000764493 [1,0,0,0,0,1|2,0,0]=4 3367 B13R1.3523 CC(C)(O)COCc1ccccc1 34a_100000210790_100000764493 [1,0,0,0,0,1|2,0,0]=4 3368 B13R1.3523 CC(C)(O)COCc1ccccc1 7a_100000210790_100000764493 [1,0,0,0,0,1|2,0,0]=4 3369 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000211182_100000764493 [1,0,0,0,0,1|2,0,0]=4 3370 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000764493_100015291786 [1,0,0,0,0,1|2,0,0]=4 3371 B13R1.3523 C[N+](C)(C)CCNc1ccccc1 34a_100000106764_100000085578 [1,0,0,0,0,1|0,0,0]=2 3372 B13R1.3523 C[N+](C)(C)CCNc1cccnn1 27a_100000106457_100016991348 [1,0,0,0,0,1|2,0,0]=4 3373 B13R1.3523 C[N+](C)(C)CCNc1ccncn1 27a_100000106457_100000703185 [1,0,0,0,0,1|2,0,0]=4 3374 B13R1.3523 C[N+](C)(C)CCNc1cnccn1 27a_100000106457_100000211759 [1,0,0,0,0,1|2,0,0]=4 3375 B13R1.3523 C[N+](C)(C)CCNc1ncccn1 27a_100000106457_100000211032 [1,0,0,0,0,1|2,0,0]=4 3376 B13R1.3523 C[N+](C)(C)CCOc1ccccc1 34a_100000210340_100000085578 [1,0,0,0,0,1|0,0,0]=2 3377 B13R1.3523 C[N+](C)(C)CCOc1ccccc1 7a_100000210340_100000085578 [1,0,0,0,0,1|0,0,0]=2 3378 B13R1.3523 C[N+](C)(C)CCOc1cccnc1 34a_100000210849_100000085578 [1,0,0,0,0,1|1,0,0]=3 3379 B13R1.3523 C[N+](C)(C)CCOc1cccnc1 7a_100000210849_100000085578 [1,0,0,0,0,1|1,0,0]=3 3380 B13R1.3523 C[N+](C)(C)CCOc1ccncc1 34a_100000212176_100000085578 [1,0,0,0,0,1|1,0,0]=3 3381 B13R1.3523 C[N+](C)(C)CCOc1ccnnc1 34a_100015204005_100000085578 [1,0,0,0,0,1|2,0,0]=4 3382 B13R1.3523 C[N+](C)(C)CCOc1cncnc1 7a_100000754086_100000085578 [1,0,0,0,0,1|2,0,0]=4 3383 B13R1.3523 C[N+](C)(C)CCSc1ccccc1 62a_100000085578_100000041952 [1,0,0,0,0,1|0,0,0]=2 3384 B13R1.3523 C[N+](C)(C)CCSc1ccccc1 62a_100000719477_100000085578 [1,0,0,0,0,1|0,0,0]=2 3385 B13R1.3523 C[N+](C)(C)CCSc1ccccn1 62a_100000085578_100011216584 [1,0,0,0,0,1|1,0,0]=3 3386 B13R1.3523 C[N+](C)(C)CCSc1ccccn1 62a_100011216584_100000085578 [1,0,0,0,0,1|1,0,0]=3 3387 B13R1.3523 C[N+](C)(C)CCSc1cccnc1 62a_100000085578_100000210063 [1,0,0,0,0,1|1,0,0]=3 3388 B13R1.3523 C[N+](C)(C)CCSc1cccnc1 62a_100000210063_100000085578 [1,0,0,0,0,1|1,0,0]=3 3389 B13R1.3523 C[N+](C)(C)CCSc1cccnn1 62a_100000085578_100016991348 [1,0,0,0,0,1|2,0,0]=4 3390 B13R1.3523 C[N+](C)(C)CCSc1cccnn1 62a_100016991348_100000085578 [1,0,0,0,0,1|2,0,0]=4 3391 B13R1.3523 C[N+](C)(C)CCSc1ccncc1 62a_100000085578_100000728582 [1,0,0,0,0,1|1,0,0]=3 3392 B13R1.3523 C[N+](C)(C)CCSc1ccncc1 62a_100000728582_100000085578 [1,0,0,0,0,1|1,0,0]=3 3393 B13R1.3523 C[N+](C)(C)CCSc1ccncn1 62a_100000085578_100000703185 [1,0,0,0,0,1|2,0,0]=4 3394 B13R1.3523 C[N+](C)(C)CCSc1ccncn1 62a_100000703185_100000085578 [1,0,0,0,0,1|2,0,0]=4 3395 B13R1.3523 C[N+](C)(C)CCSc1ccnnc1 62a_100000085578_100000732662 [1,0,0,0,0,1|2,0,0]=4 3396 B13R1.3523 C[N+](C)(C)CCSc1ccnnc1 62a_100000732662_100000085578 [1,0,0,0,0,1|2,0,0]=4 3397 B13R1.3523 C[N+](C)(C)CCSc1cnccn1 62a_100000085578_100000211759 [1,0,0,0,0,1|2,0,0]=4 3398 B13R1.3523 C[N+](C)(C)CCSc1cnccn1 62a_100000211759_100000085578 [1,0,0,0,0,1|2,0,0]=4 3399 B13R1.3523 C[N+](C)(C)CCSc1cncnc1 62a_100000085578_100011206942 [1,0,0,0,0,1|2,0,0]=4 3400 B13R1.3523 C[N+](C)(C)CCSc1cncnc1 62a_100011206942_100000085578 [1,0,0,0,0,1|2,0,0]=4 3401 B13R1.3523 C[N+](C)(C)CCSc1ncccn1 62a_100000085578_100000211032 [1,0,0,0,0,1|2,0,0]=4 3402 B13R1.3523 C[N+](C)(C)CCSc1ncccn1 62a_100000211032_100000085578 [1,0,0,0,0,1|2,0,0]=4 3403 B13R1.3523 C[N+](C)(C)CSCc1ccccc1 62a_100000211182_200000036245 [1,0,0,0,0,1|0,0,0]=2 3404 B13R1.3523 C[N+](C)(C)CSCc1ccccc1 62a_200000036245_100015291786 [1,0,0,0,0,1|0,0,0]=2 3405 B13R1.3523 C[N+](C)(C)CSCc1ccccn1 62a_100000721315_200000036245 [1,0,0,0,0,1|1,0,0]=3 3406 B13R1.3523 C[N+](C)(C)CSCc1ccccn1 62a_200000036245_100000721315 [1,0,0,0,0,1|1,0,0]=3 3407 B13R1.3523 C[N+](C)(C)CSCc1cccnc1 62a_100000741622_200000036245 [1,0,0,0,0,1|1,0,0]=3 3408 B13R1.3523 C[N+](C)(C)CSCc1cccnc1 62a_200000036245_100000741622 [1,0,0,0,0,1|1,0,0]=3 3409 B13R1.3523 C[N+](C)(C)CSCc1cccnn1 62a_100016990269_200000036245 [1,0,0,0,0,1|2,0,0]=4 3410 B13R1.3523 C[N+](C)(C)CSCc1cccnn1 62a_200000036245_100016990269 [1,0,0,0,0,1|2,0,0]=4 3411 B13R1.3523 C[N+](C)(C)CSCc1ccncc1 62a_100015193705_200000036245 [1,0,0,0,0,1|1,0,0]=3 3412 B13R1.3523 C[N+](C)(C)CSCc1ccncc1 62a_200000036245_100015193705 [1,0,0,0,0,1|1,0,0]=3 3413 B13R1.3523 C[N+](C)(C)CSCc1cnccn1 62a_100016995436_200000036245 [1,0,0,0,0,1|2,0,0]=4 3414 B13R1.3523 C[N+](C)(C)CSCc1cnccn1 62a_200000036245_100016995436 [1,0,0,0,0,1|2,0,0]=4 3415 B13R1.3523 C[N+](C)(C)CSCc1cncnc1 62a_100015196519_200000036245 [1,0,0,0,0,1|2,0,0]=4 3416 B13R1.3523 C[N+](C)(C)CSCc1cncnc1 62a_200000036245_100015196519 [1,0,0,0,0,1|2,0,0]=4 3417 B13R1.3523 C[N+](C)(C)CSCc1ncccn1 62a_100000703007_200000036245 [1,0,0,0,0,1|2,0,0]=4 3418 B13R1.3523 C[N+](C)(C)CSCc1ncccn1 62a_200000036245_100000703007 [1,0,0,0,0,1|2,0,0]=4 3419 B13R1.3523 C[Si](C)(C)/C=C/Cc1ccccc1 271570a_100160482004_100000210277 [1,0,0,0,0,1|1,0,1]=4 3420 B13R1.3523 C[Si](C)(C)CCNc1ccccc1 34a_100000106764_200000733723 [1,0,0,0,0,1|1,0,0]=3 3421 B13R1.3523 C[Si](C)(C)CCOc1ccccc1 34a_100000210340_200000733723 [1,0,0,0,0,1|1,0,0]=3 3422 B13R1.3523 C[Si](C)(C)CCOc1ccccc1 7a_100000210340_200000733723 [1,0,0,0,0,1|1,0,0]=3 3423 B13R1.3523 C[Si](C)(C)CCOc1cccnc1 34a_100000210849_200000733723 [1,0,0,0,0,1|2,0,0]=4 3424 B13R1.3523 C[Si](C)(C)CCOc1cccnc1 7a_100000210849_200000733723 [1,0,0,0,0,1|2,0,0]=4 3425 B13R1.3523 C[Si](C)(C)CCOc1ccncc1 34a_100000212176_200000733723 [1,0,0,0,0,1|2,0,0]=4 3426 B13R1.3523 C[Si](C)(C)CCSc1ccccc1 62a_100000719477_200000733723 [1,0,0,0,0,1|1,0,0]=3 3427 B13R1.3523 C[Si](C)(C)CCSc1ccccc1 62a_200000733723_100000041952 [1,0,0,0,0,1|1,0,0]=3 3428 B13R1.3523 C[Si](C)(C)CCSc1ccccn1 62a_100011216584_200000733723 [1,0,0,0,0,1|2,0,0]=4 3429 B13R1.3523 C[Si](C)(C)CCSc1ccccn1 62a_200000733723_100011216584 [1,0,0,0,0,1|2,0,0]=4 3430 B13R1.3523 C[Si](C)(C)CCSc1cccnc1 62a_100000210063_200000733723 [1,0,0,0,0,1|2,0,0]=4 3431 B13R1.3523 C[Si](C)(C)CCSc1cccnc1 62a_200000733723_100000210063 [1,0,0,0,0,1|2,0,0]=4 3432 B13R1.3523 C[Si](C)(C)CCSc1ccncc1 62a_100000728582_200000733723 [1,0,0,0,0,1|2,0,0]=4 3433 B13R1.3523 C[Si](C)(C)CCSc1ccncc1 62a_200000733723_100000728582 [1,0,0,0,0,1|2,0,0]=4 3434 B13R1.3523 C[Si](C)(C)CNCc1ccccc1 2230a_100015324214_100000037933 [1,0,0,0,0,1|1,0,0]=3 3435 B13R1.3523 C[Si](C)(C)COCc1ccccc1 7a_100000210790_100000233785 [1,0,0,0,0,1|1,0,0]=3 3436 B13R1.3523 C[Si](C)(C)CSCc1ccccc1 62a_100000037933_100015291786 [1,0,0,0,0,1|1,0,0]=3 3437 B13R1.3523 C[Si](C)(C)CSCc1ccccc1 62a_100000211182_100000037933 [1,0,0,0,0,1|1,0,0]=3 3438 B13R1.3523 C[Si](C)(C)CSCc1ccccn1 62a_100000037933_100000721315 [1,0,0,0,0,1|2,0,0]=4 3439 B13R1.3523 C[Si](C)(C)CSCc1ccccn1 62a_100000721315_100000037933 [1,0,0,0,0,1|2,0,0]=4 3440 B13R1.3523 C[Si](C)(C)CSCc1cccnc1 62a_100000037933_100000741622 [1,0,0,0,0,1|2,0,0]=4 3441 B13R1.3523 C[Si](C)(C)CSCc1cccnc1 62a_100000741622_100000037933 [1,0,0,0,0,1|2,0,0]=4 3442 B13R1.3523 C[Si](C)(C)CSCc1ccncc1 62a_100000037933_100015193705 [1,0,0,0,0,1|2,0,0]=4 3443 B13R1.3523 C[Si](C)(C)CSCc1ccncc1 62a_100015193705_100000037933 [1,0,0,0,0,1|2,0,0]=4 3444 B13R1.2780 CC(NCC(C)(C)C)c1cc[nH]c1 269862a_100000743828_100000753940 [0,0,0,0,1,1|2,0,0]=4 3445 B13R1.2780 CC(NCC(C)(C)C)c1ccc[nH]1 269862a_100000743828_100000183661 [0,0,0,0,1,1|2,0,0]=4 3446 B13R1.2780 CC(NCC(C)(C)C)c1cccs1 269862a_100000743828_100000185736 [0,0,0,0,1,1|2,0,0]=4 3447 B13R1.2780 CC(NCC(C)(C)C)c1cccs1 270004a_100000703493_100011204126 [0,0,0,0,1,1|2,0,0]=4 3448 B13R1.2780 CC(NCC(C)(C)C)c1ccoc1 270004a_100000690049_100011204126 [0,0,0,0,1,1|2,0,0]=4 3449 B13R1.2780 CC(NCC(C)(C)C)c1ccsc1 269862a_100000743828_100000747891 [0,0,0,0,1,1|2,0,0]=4 3450 B13R1.2780 CC(NCC(C)(C)C)c1ccsc1 270004a_100000748604_100011204126 [0,0,0,0,1,1|2,0,0]=4 3451 B13R1.2780 CC(NC[Si](C)(C)C)c1cccs1 2230a_100000703493_100000037933 [0,0,0,0,1,1|2,0,0]=4 3452 B13R1.2780 CC(NC[Si](C)(C)C)c1ccoc1 2230a_100000690049_100000037933 [0,0,0,0,1,1|2,0,0]=4 3453 B13R1.2780 CC(NC[Si](C)(C)C)c1ccsc1 2230a_100000748604_100000037933 [0,0,0,0,1,1|2,0,0]=4 3454 B13R1.2780 CC(OCC(C)(C)C)c1ccsc1 34a_100011350980_100011219605 [0,0,0,0,1,1|2,0,0]=4 3455 B13R1.2780 CC(OC[Si](C)(C)C)c1ccsc1 7a_100011350980_100000233785 [0,0,0,0,1,1|2,0,0]=4 3456 B13R1.2780 C[C@@H](NCC(C)(C)C)c1ccco1 270004a_100160469435_100011204126 [0,0,0,0,1,1|2,0,0]=4 3457 B13R1.2780 C[C@@H](NC[Si](C)(C)C)c1ccco1 2230a_100160469435_100000037933 [0,0,0,0,1,1|2,0,0]=4 3458 B13R1.2780 C[C@@H](OC[Si](C)(C)C)c1cccs1 7a_100000750433_100000233785 [0,0,0,0,1,1|2,0,0]=4 3459 B13R1.2780 C[C@H](OCC(C)(C)C)c1ccco1 34a_100000755270_100011219605 [0,0,0,0,1,1|2,0,0]=4 3460 B13R1.2780 C[C@H](OC[Si](C)(C)C)c1ccco1 7a_100000755270_100000233785 [0,0,0,0,1,1|2,0,0]=4 3461 B15R1.3465 CC(C#Cc1ccccc1)OC(C)(C)C 34a_200000065209_100000210625 [0,0,0,0,0,2|2,0,0]=4 3462 B15R1.3465 CC(CC(C)(C)C)OCc1ccccc1 7a_200011218616_100000211182 [0,0,0,0,0,2|1,0,0]=3 3463 B15R1.3465 CC(CC(C)(C)C)OCc1ccccn1 7a_200011218616_100000721315 [0,0,0,0,0,2|2,0,0]=4 3464 B15R1.3465 CC(CC(C)(C)C)OCc1cccnc1 7a_200011218616_100000741622 [0,0,0,0,0,2|2,0,0]=4 3465 B15R1.3465 CC(CC(C)(C)C)OCc1ccncc1 7a_200011218616_100015193705 [0,0,0,0,0,2|2,0,0]=4 3466 B15R1.3465 CC(CCc1ccccc1)NC(C)(C)C 34a_100000210798_100000210625 [0,0,0,0,0,2|2,0,0]=4 3467 B15R1.3465 CC(COc1ccccc1)NC(C)(C)C 34a_100000746794_100000210625 [0,0,0,0,0,2|2,0,0]=4 3468 B15R1.3465 CC(COc1ccccc1)OC(C)(C)C 34a_100000210911_100000210625 [0,0,0,0,0,2|2,0,0]=4 3469 B15R1.3465 CN(CCc1ccccc1)CC(C)(C)C 2230a_100000742839_100000765856 [0,0,0,0,0,2|2,0,0]=4 3470 B15R1.3465 CN(CCc1ccccc1)CC(C)(C)C 269982a_100000742839_100000765856 [0,0,0,0,0,2|2,0,0]=4 3471 B15R1.3465 CN(CCc1ccccc1)CC(C)(C)C 270004a_100000207497_100011204126 [0,0,0,0,0,2|2,0,0]=4 3472 B15R1.3465 CN(CCc1ccccc1)C[N+](C)(C)C 269982a_100000207497_200000036245 [0,0,0,0,0,2|1,0,0]=3 3473 B15R1.3465 CN(CCc1ccccc1)C[Si](C)(C)C 2230a_100000207497_100000037933 [0,0,0,0,0,2|2,0,0]=4 3474 B15R1.3465 CN(CCc1ccccc1)C[Si](C)(C)C 269982a_200020589227_100000765856 [0,0,0,0,0,2|2,0,0]=4 3475 B15R1.3465 CN(CCc1ccccn1)C[N+](C)(C)C 269982a_100000737206_200000036245 [0,0,0,0,0,2|2,0,0]=4 3476 B15R1.3465 CN(CCc1cccnc1)C[N+](C)(C)C 269982a_100000763209_200000036245 [0,0,0,0,0,2|2,0,0]=4 3477 B15R1.3465 CN(CCc1ccncc1)C[N+](C)(C)C 269982a_100000742850_200000036245 [0,0,0,0,0,2|2,0,0]=4 3478 B15R1.3465 CN(CSc1ccccc1)CC(C)(C)C 2230a_100000742839_100011218342 [0,0,0,0,0,2|2,0,0]=4 3479 B15R1.3465 CN(CSc1ccccc1)CC(C)(C)C 269982a_100000742839_100011218342 [0,0,0,0,0,2|2,0,0]=4 3480 B15R1.3465 CN(CSc1ccccc1)C[Si](C)(C)C 269982a_200020589227_100011218342 [0,0,0,0,0,2|2,0,0]=4 3481 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccc1 207a_106358413534_100015611070 [0,0,0,0,0,2|1,0,0]=3 3482 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccc1 2230a_106358413534_100015291786 [0,0,0,0,0,2|1,0,0]=3 3483 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccc1 270004a_106358413534_100015611070 [0,0,0,0,0,2|1,0,0]=3 3484 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccn1 207a_106358413534_100000209966 [0,0,0,0,0,2|2,0,0]=4 3485 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccn1 2230a_106358413534_100000721315 [0,0,0,0,0,2|2,0,0]=4 3486 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccccn1 270004a_106358413534_100000209966 [0,0,0,0,0,2|2,0,0]=4 3487 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1cccnc1 207a_106358413534_100000209961 [0,0,0,0,0,2|2,0,0]=4 3488 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1cccnc1 2230a_106358413534_100000741622 [0,0,0,0,0,2|2,0,0]=4 3489 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1cccnc1 270004a_106358413534_100000209961 [0,0,0,0,0,2|2,0,0]=4 3490 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccncc1 207a_106358413534_100000186114 [0,0,0,0,0,2|2,0,0]=4 3491 B15R1.3465 C[C@@H](CC(C)(C)C)NCc1ccncc1 2230a_106358413534_100015193705 [0,0,0,0,0,2|2,0,0]=4 3492 B15R1.3465 C[C@@H](CCc1ccccc1)OC(C)(C)C 34a_100009815974_100000210625 [0,0,0,0,0,2|2,0,0]=4 3493 B15R1.3465 C[N+](C)(C)CC(=O)CCc1ccccc1 1458a_100000033712_100000765856 [0,0,0,0,0,2|1,0,1]=4 3494 B15R1.3465 C[N+](C)(C)CC(=O)NCc1ccccc1 11a_100015324214_100000033712 [0,0,0,0,0,2|1,0,1]=4 3495 B15R1.3465 C[N+](C)(C)CC(=O)NCc1ccccc1 1626a_100015324214_100000033712 [0,0,0,0,0,2|1,0,1]=4 3496 B15R1.3465 C[N+](C)(C)CC(=O)NCc1ccccc1 240690a_100015324214_100000033712 [0,0,0,0,0,2|1,0,1]=4 3497 B15R1.3465 C[N+](C)(C)CC(=O)NCc1ccccc1 527a_100015324214_100000033712 [0,0,0,0,0,2|1,0,1]=4 3498 B15R1.3465 C[N+](C)(C)CC(=O)NNc1ccccc1 22a_100015195140_100000033712 [0,0,0,0,0,2|1,0,1]=4 3499 B15R1.3465 C[N+](C)(C)CC(O)CNc1ccccc1 34a_100000106764_100000032816 [0,0,0,0,0,2|1,0,0]=3 3500 B15R1.3465 C[N+](C)(C)CC(O)COc1ccccc1 34a_100000210340_100000032816 [0,0,0,0,0,2|1,0,0]=3 3501 B15R1.3465 C[N+](C)(C)CC(O)COc1ccccc1 7a_100000210340_100000032816 [0,0,0,0,0,2|1,0,0]=3 3502 B15R1.3465 C[N+](C)(C)CC(O)COc1cccnc1 34a_100000210849_100000032816 [0,0,0,0,0,2|2,0,0]=4 3503 B15R1.3465 C[N+](C)(C)CC(O)COc1cccnc1 7a_100000210849_100000032816 [0,0,0,0,0,2|2,0,0]=4 3504 B15R1.3465 C[N+](C)(C)CC(O)COc1ccncc1 34a_100000212176_100000032816 [0,0,0,0,0,2|2,0,0]=4 3505 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccccc1 62a_100000032816_100000041952 [0,0,0,0,0,2|1,0,0]=3 3506 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccccc1 62a_100000719477_100000032816 [0,0,0,0,0,2|1,0,0]=3 3507 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccccn1 62a_100000032816_100011216584 [0,0,0,0,0,2|2,0,0]=4 3508 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccccn1 62a_100011216584_100000032816 [0,0,0,0,0,2|2,0,0]=4 3509 B15R1.3465 C[N+](C)(C)CC(O)CSc1cccnc1 62a_100000032816_100000210063 [0,0,0,0,0,2|2,0,0]=4 3510 B15R1.3465 C[N+](C)(C)CC(O)CSc1cccnc1 62a_100000210063_100000032816 [0,0,0,0,0,2|2,0,0]=4 3511 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccncc1 62a_100000032816_100000728582 [0,0,0,0,0,2|2,0,0]=4 3512 B15R1.3465 C[N+](C)(C)CC(O)CSc1ccncc1 62a_100000728582_100000032816 [0,0,0,0,0,2|2,0,0]=4 3513 B15R1.9108 C/C(=C\c1ccccc1)/COC(C)(C)C 34a_200025717232_100000210625 [0,0,0,0,0,2|1,0,1]=4 3514 B15R1.9108 CC(C)(C)NC[C@@H](O)Cc1ccccc1 2230a_100000715429_100000729385 [0,0,0,0,0,2|2,0,0]=4 3515 B15R1.9108 CC(C)(C)OCC(N)Cc1ccccc1 34a_100000739027_100000210625 [0,0,0,0,0,2|2,0,0]=4 3516 B15R1.9108 CC(C)(C)OC[C@@H](O)Cc1ccccc1 34a_100015890283_100000729385 [0,0,0,0,0,2|2,0,0]=4 3517 B15R1.9108 CC(C)(C)OC[C@@H](O)Cc1ccccc1 7a_100015890283_100000729385 [0,0,0,0,0,2|2,0,0]=4 3518 B15R1.9108 CC(C)(C)SC[C@@H](O)Cc1ccccc1 62a_100000211941_100000729385 [0,0,0,0,0,2|2,0,0]=4 3519 B15R1.9108 CC(C)(C)SC[C@@H](O)Cc1ccccc1 62a_100000729385_100000211941 [0,0,0,0,0,2|2,0,0]=4 3520 B15R1.9108 CC(CNC(C)(C)C)Oc1ccccc1 34a_100000755676_100000210625 [0,0,0,0,0,2|1,0,0]=3 3521 B15R1.9108 CC(COC(C)(C)C)Cc1ccccc1 34a_100012125295_100000210625 [0,0,0,0,0,2|1,0,0]=3 3522 B15R1.9108 CC(COC(C)(C)C)Oc1ccccc1 34a_200000036796_100000210625 [0,0,0,0,0,2|1,0,0]=3 3523 B15R1.9108 CC(C[n+]1ccccc1)NCC(C)(C)C 270004a_100000743828_100000034229 [0,0,0,0,0,2|2,0,0]=4 3524 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)C 34a_100000748627_100011219605 [0,0,0,0,0,2|1,0,0]=3 3525 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)F 34a_100000716592_200011218536 [0,0,0,0,0,2|2,0,0]=4 3526 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)F 34a_100000748627_100011997219 [0,0,0,0,0,2|2,0,0]=4 3527 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)O 34a_100000748627_100000764493 [0,0,0,0,0,2|2,0,0]=4 3528 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)O 7a_100000748627_100000764493 [0,0,0,0,0,2|2,0,0]=4 3529 B15R1.9108 CC(Cc1ccccc1)OC[Si](C)(C)C 7a_100000748627_100000233785 [0,0,0,0,0,2|1,0,0]=3 3530 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)C 62a_100011219605_200011218536 [0,0,0,0,0,2|1,0,0]=3 3531 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)C 62a_200011218536_100011219605 [0,0,0,0,0,2|1,0,0]=3 3532 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)F 62a_100011997219_200011218536 [0,0,0,0,0,2|2,0,0]=4 3533 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)F 62a_200011218536_100011997219 [0,0,0,0,0,2|2,0,0]=4 3534 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)O 62a_100000764493_200011218536 [0,0,0,0,0,2|2,0,0]=4 3535 B15R1.9108 CC(Cc1ccccc1)SCC(C)(C)O 62a_200011218536_100000764493 [0,0,0,0,0,2|2,0,0]=4 3536 B15R1.9108 CC(Cc1ccccc1)SC[N+](C)(C)C 62a_200000036245_200011218536 [0,0,0,0,0,2|0,0,0]=2 3537 B15R1.9108 CC(Cc1ccccc1)SC[N+](C)(C)C 62a_200011218536_200000036245 [0,0,0,0,0,2|0,0,0]=2 3538 B15R1.9108 CC(Cc1ccccc1)SC[Si](C)(C)C 62a_100000037933_200011218536 [0,0,0,0,0,2|1,0,0]=3 3539 B15R1.9108 CC(Cc1ccccc1)SC[Si](C)(C)C 62a_200011218536_100000037933 [0,0,0,0,0,2|1,0,0]=3 3540 B15R1.9108 CC(Cc1ccccn1)NCC(C)(C)C 270004a_100000238496_100011204126 [0,0,0,0,0,2|2,0,0]=4 3541 B15R1.9108 CC(Cc1ccccn1)NC[Si](C)(C)C 2230a_100000238496_100000037933 [0,0,0,0,0,2|2,0,0]=4 3542 B15R1.9108 CC(Cc1cccnc1)NCC(C)(C)C 270004a_100000743828_100015187140 [0,0,0,0,0,2|2,0,0]=4 3543 B15R1.9108 CC(Cc1cccnc1)NCC(C)(C)C 270004a_100011207255_100011204126 [0,0,0,0,0,2|2,0,0]=4 3544 B15R1.9108 CC(Cc1cccnc1)NC[Si](C)(C)C 2230a_100011207255_100000037933 [0,0,0,0,0,2|2,0,0]=4 3545 B15R1.9108 CC(Cc1ccncc1)NCC(C)(C)C 270004a_100000743828_100000238508 [0,0,0,0,0,2|2,0,0]=4 3546 B15R1.9108 CN(CCC(C)(C)C)Cc1ccccc1 2230a_100000186898_100000755188 [0,0,0,0,0,2|2,0,0]=4 3547 B15R1.9108 CN(CCC(C)(C)C)Cc1ccccc1 269982a_100000186898_100000755188 [0,0,0,0,0,2|2,0,0]=4 3548 B15R1.9108 CN(CC[N+](C)(C)C)Cc1ccccc1 269982a_100000186898_100000085578 [0,0,0,0,0,2|1,0,0]=3 3549 B15R1.9108 CN(CC[N+](C)(C)C)Cc1ccccn1 269982a_100000207498_100000085578 [0,0,0,0,0,2|2,0,0]=4 3550 B15R1.9108 CN(CC[N+](C)(C)C)Cc1cccnc1 269982a_100000184577_100000085578 [0,0,0,0,0,2|2,0,0]=4 3551 B15R1.9108 CN(CC[N+](C)(C)C)Cc1ccncc1 269982a_100000187231_100000085578 [0,0,0,0,0,2|2,0,0]=4 3552 B15R1.9108 CN(CC[Si](C)(C)C)Cc1ccccc1 2230a_100000186898_200000733723 [0,0,0,0,0,2|2,0,0]=4 3553 B15R1.9108 CN(CC[Si](C)(C)C)Cc1ccccc1 269982a_100000186898_200000733723 [0,0,0,0,0,2|2,0,0]=4 3554 B15R1.9094 CC(C)(C)CNCC(O)c1ccccc1 2230a_100000743828_100000185958 [0,0,0,0,0,2|2,0,0]=4 3555 B15R1.9094 CC(C)(C)CNCC(O)c1ccccc1 270004a_100000210709_100011204126 [0,0,0,0,0,2|2,0,0]=4 3556 B15R1.9094 CC(C)(C)CNC[C@@H](O)c1ccccc1 2230a_100000743828_100011933945 [0,0,0,0,0,2|2,0,0]=4 3557 B15R1.9094 CC(C)(C)COC[C@@H](N)c1ccccc1 34a_100000751927_100011219605 [0,0,0,0,0,2|2,0,0]=4 3558 B15R1.9094 CC(C)(C)CSCC(O)c1ccccc1 62a_100000185958_100011219605 [0,0,0,0,0,2|2,0,0]=4 3559 B15R1.9094 CC(C)(C)CSCC(O)c1ccccc1 62a_100011219605_100000185958 [0,0,0,0,0,2|2,0,0]=4 3560 B15R1.9094 CC(C)(C)CSC[C@@H](O)c1ccccc1 62a_100011219605_100011933945 [0,0,0,0,0,2|2,0,0]=4 3561 B15R1.9094 CC(C)(C)CSC[C@@H](O)c1ccccc1 62a_100011933945_100011219605 [0,0,0,0,0,2|2,0,0]=4 3562 B15R1.9094 CC(C)(C)NCC[C@@H](O)c1ccccc1 2230a_100000715429_100000729684 [0,0,0,0,0,2|2,0,0]=4 3563 B15R1.9094 CC(C)(C)OCC[C@@H](O)c1ccccc1 34a_100015890283_100000729684 [0,0,0,0,0,2|2,0,0]=4 3564 B15R1.9094 CC(C)(C)OCC[C@@H](O)c1ccccc1 7a_100015890283_100000729684 [0,0,0,0,0,2|2,0,0]=4 3565 B15R1.9094 CC(C)(C)OCC[C@H](N)c1ccccc1 34a_100025705951_100000210625 [0,0,0,0,0,2|2,0,0]=4 3566 B15R1.9094 CC(C)(C)SCC[C@@H](O)c1ccccc1 62a_100000211941_100000729684 [0,0,0,0,0,2|2,0,0]=4 3567 B15R1.9094 CC(C)(C)SCC[C@@H](O)c1ccccc1 62a_100000729684_100000211941 [0,0,0,0,0,2|2,0,0]=4 3568 B15R1.9094 CC(C=NNC(C)(C)C)c1ccccc1 4a_100000725372_100000212034 [0,0,0,0,0,2|1,0,1]=4 3569 B15R1.9094 CC(CNCC(C)(C)C)c1ccccc1 2230a_100000743828_100000756946 [0,0,0,0,0,2|1,0,0]=3 3570 B15R1.9094 CC(CNCC(C)(C)C)c1ccccc1 270004a_100000701038_100011204126 [0,0,0,0,0,2|1,0,0]=3 3571 B15R1.9094 CC(CNCC(C)(C)C)c1ccccc1 270004a_100000743828_100000212034 [0,0,0,0,0,2|1,0,0]=3 3572 B15R1.9094 CC(CNCC(C)(C)C)c1ccccc1 34a_100000701038_100011219605 [0,0,0,0,0,2|1,0,0]=3 3573 B15R1.9094 CC(CNCC(C)(C)F)c1ccccc1 2230a_100020643315_100000756946 [0,0,0,0,0,2|2,0,0]=4 3574 B15R1.9094 CC(CNCC(C)(C)F)c1ccccc1 270004a_100020643315_100000212034 [0,0,0,0,0,2|2,0,0]=4 3575 B15R1.9094 CC(CNCC(C)(C)F)c1ccccc1 34a_100000701038_100011997219 [0,0,0,0,0,2|2,0,0]=4 3576 B15R1.9094 CC(CNCC(C)(C)O)c1ccccc1 2230a_100000751335_100000756946 [0,0,0,0,0,2|2,0,0]=4 3577 B15R1.9094 CC(CNCC(C)(C)O)c1ccccc1 270004a_100000751335_100000212034 [0,0,0,0,0,2|2,0,0]=4 3578 B15R1.9094 CC(CNCC(C)(C)O)c1ccccc1 34a_100000701038_100000764493 [0,0,0,0,0,2|2,0,0]=4 3579 B15R1.9094 CC(CNC[Si](C)(C)C)c1ccccc1 2230a_100000701038_100000037933 [0,0,0,0,0,2|1,0,0]=3 3580 B15R1.9094 CC(COCC(C)(C)C)c1ccccc1 34a_100011215166_100011219605 [0,0,0,0,0,2|1,0,0]=3 3581 B15R1.9094 CC(COCC(C)(C)F)c1ccccc1 34a_100000716592_100000756946 [0,0,0,0,0,2|2,0,0]=4 3582 B15R1.9094 CC(COCC(C)(C)F)c1ccccc1 34a_100011215166_100011997219 [0,0,0,0,0,2|2,0,0]=4 3583 B15R1.9094 CC(COCC(C)(C)O)c1ccccc1 34a_100011215166_100000764493 [0,0,0,0,0,2|2,0,0]=4 3584 B15R1.9094 CC(COCC(C)(C)O)c1ccccc1 7a_100011215166_100000764493 [0,0,0,0,0,2|2,0,0]=4 3585 B15R1.9094 CC(COC[Si](C)(C)C)c1ccccc1 7a_100011215166_100000233785 [0,0,0,0,0,2|1,0,0]=3 3586 B15R1.9094 CC(CSCC(C)(C)C)c1ccccc1 62a_100000756946_100011219605 [0,0,0,0,0,2|1,0,0]=3 3587 B15R1.9094 CC(CSCC(C)(C)C)c1ccccc1 62a_100011219605_100000756946 [0,0,0,0,0,2|1,0,0]=3 3588 B15R1.9094 CC(CSCC(C)(C)F)c1ccccc1 62a_100000756946_100011997219 [0,0,0,0,0,2|2,0,0]=4 3589 B15R1.9094 CC(CSCC(C)(C)F)c1ccccc1 62a_100011997219_100000756946 [0,0,0,0,0,2|2,0,0]=4 3590 B15R1.9094 CC(CSCC(C)(C)O)c1ccccc1 62a_100000756946_100000764493 [0,0,0,0,0,2|2,0,0]=4 3591 B15R1.9094 CC(CSCC(C)(C)O)c1ccccc1 62a_100000764493_100000756946 [0,0,0,0,0,2|2,0,0]=4 3592 B15R1.9094 CC(CSC[N+](C)(C)C)c1ccccc1 62a_100000756946_200000036245 [0,0,0,0,0,2|0,0,0]=2 3593 B15R1.9094 CC(CSC[N+](C)(C)C)c1ccccc1 62a_200000036245_100000756946 [0,0,0,0,0,2|0,0,0]=2 3594 B15R1.9094 CC(CSC[Si](C)(C)C)c1ccccc1 62a_100000037933_100000756946 [0,0,0,0,0,2|1,0,0]=3 3595 B15R1.9094 CC(CSC[Si](C)(C)C)c1ccccc1 62a_100000756946_100000037933 [0,0,0,0,0,2|1,0,0]=3 3596 B15R1.9094 CC(NCCC(C)(C)C)c1ccccc1 2230a_100000738805_100000230085 [0,0,0,0,0,2|1,0,0]=3 3597 B15R1.9094 CC(NCCC(C)(C)C)c1ccccc1 269862a_100000738805_100000185851 [0,0,0,0,0,2|1,0,0]=3 3598 B15R1.9094 CC(NCCC(C)(C)C)c1ccccn1 2230a_100000181244_100000755188 [0,0,0,0,0,2|2,0,0]=4 3599 B15R1.9094 CC(NCCC(C)(C)C)c1ccccn1 269862a_100000738805_100000210467 [0,0,0,0,0,2|2,0,0]=4 3600 B15R1.9094 CC(NCCC(C)(C)C)c1cccnc1 2230a_100000195435_100000755188 [0,0,0,0,0,2|2,0,0]=4 3601 B15R1.9094 CC(NCCC(C)(C)C)c1cccnc1 269862a_100000738805_100000210468 [0,0,0,0,0,2|2,0,0]=4 3602 B15R1.9094 CC(NCCC(C)(C)C)c1ccncc1 2230a_100000181269_100000755188 [0,0,0,0,0,2|2,0,0]=4 3603 B15R1.9094 CC(NCCC(C)(C)C)c1ccncc1 269862a_100000738805_100000185792 [0,0,0,0,0,2|2,0,0]=4 3604 B15R1.9094 CC(NCCC(C)(C)F)c1ccccc1 2230a_100016253952_100000230085 [0,0,0,0,0,2|2,0,0]=4 3605 B15R1.9094 CC(NCCC(C)(C)F)c1ccccc1 269862a_100016253952_100000185851 [0,0,0,0,0,2|2,0,0]=4 3606 B15R1.9094 CC(NCCC(C)(C)O)c1ccccc1 269862a_100000707701_100000185851 [0,0,0,0,0,2|2,0,0]=4 3607 B15R1.9094 CC(NCC[N+](C)(C)C)c1ccccc1 269862a_100000106457_100000185851 [0,0,0,0,0,2|0,0,0]=2 3608 B15R1.9094 CC(NCC[N+](C)(C)C)c1ccccn1 269862a_100000106457_100000210467 [0,0,0,0,0,2|1,0,0]=3 3609 B15R1.9094 CC(NCC[N+](C)(C)C)c1cccnc1 269862a_100000106457_100000210468 [0,0,0,0,0,2|1,0,0]=3 3610 B15R1.9094 CC(NCC[N+](C)(C)C)c1cccnn1 269862a_100000106457_100009866853 [0,0,0,0,0,2|2,0,0]=4 3611 B15R1.9094 CC(NCC[N+](C)(C)C)c1ccncc1 269862a_100000106457_100000185792 [0,0,0,0,0,2|1,0,0]=3 3612 B15R1.9094 CC(NCC[N+](C)(C)C)c1ccnnc1 269862a_100000106457_100012182992 [0,0,0,0,0,2|2,0,0]=4 3613 B15R1.9094 CC(NCC[N+](C)(C)C)c1cnccn1 269862a_100000106457_100000751083 [0,0,0,0,0,2|2,0,0]=4 3614 B15R1.9094 CC(NCC[N+](C)(C)C)c1cncnc1 269862a_100000106457_100000757475 [0,0,0,0,0,2|2,0,0]=4 3615 B15R1.9094 CC(NCC[N+](C)(C)C)c1ncccn1 270004a_100000106457_100011350828 [0,0,0,0,0,2|2,0,0]=4 3616 B15R1.9094 CC(NCC[Si](C)(C)C)c1ccccn1 2230a_100000181244_200000733723 [0,0,0,0,0,2|2,0,0]=4 3617 B15R1.9094 CC(NCC[Si](C)(C)C)c1cccnc1 2230a_100000195435_200000733723 [0,0,0,0,0,2|2,0,0]=4 3618 B15R1.9094 CC(NCC[Si](C)(C)C)c1ccncc1 2230a_100000181269_200000733723 [0,0,0,0,0,2|2,0,0]=4 3619 B15R1.9094 CC(OCCC(C)(C)C)c1ccccc1 7a_100000765024_100000230085 [0,0,0,0,0,2|1,0,0]=3 3620 B15R1.9094 CC(OCC[N+](C)(C)C)c1ccccc1 7a_200020618287_100000230085 [0,0,0,0,0,2|0,0,0]=2 3621 B15R1.9094 CC(OCC[N+](C)(C)C)c1cnccn1 7a_200020618287_200000703233 [0,0,0,0,0,2|2,0,0]=4 3622 B15R1.9094 CC(OCC[Si](C)(C)C)c1ccccc1 7a_100000039746_100000230085 [0,0,0,0,0,2|1,0,0]=3 3623 B15R1.9094 CC(SCCC(C)(C)C)c1ccccc1 62a_100000230085_100000755188 [0,0,0,0,0,2|1,0,0]=3 3624 B15R1.9094 CC(SCCC(C)(C)C)c1ccccc1 62a_100000755188_100000230085 [0,0,0,0,0,2|1,0,0]=3 3625 B15R1.9094 CC(SCCC(C)(C)O)c1ccccc1 62a_100000230085_100000702414 [0,0,0,0,0,2|2,0,0]=4 3626 B15R1.9094 CC(SCCC(C)(C)O)c1ccccc1 62a_100000702414_100000230085 [0,0,0,0,0,2|2,0,0]=4 3627 B15R1.9094 CC(SCC[N+](C)(C)C)c1ccccc1 62a_100000085578_100000230085 [0,0,0,0,0,2|0,0,0]=2 3628 B15R1.9094 CC(SCC[N+](C)(C)C)c1ccccc1 62a_100000230085_100000085578 [0,0,0,0,0,2|0,0,0]=2 3629 B15R1.9094 CC(SCC[N+](C)(C)C)c1cnccn1 62a_100000085578_200000703233 [0,0,0,0,0,2|2,0,0]=4 3630 B15R1.9094 CC(SCC[N+](C)(C)C)c1cnccn1 62a_200000703233_100000085578 [0,0,0,0,0,2|2,0,0]=4 3631 B15R1.9094 CC(SCC[Si](C)(C)C)c1ccccc1 62a_100000230085_200000733723 [0,0,0,0,0,2|1,0,0]=3 3632 B15R1.9094 CC(SCC[Si](C)(C)C)c1ccccc1 62a_200000733723_100000230085 [0,0,0,0,0,2|1,0,0]=3 3633 B15R1.9094 CN(CC#C[Si](C)(C)C)c1ccccc1 34a_100000210012_100000764098 [0,0,0,0,0,2|2,0,0]=4 3634 B15R1.9094 CN(CCC[N+](C)(C)C)c1ccccc1 2230a_100000210012_100016990835 [0,0,0,0,0,2|1,0,0]=3 3635 B15R1.9094 CN(CCC[N+](C)(C)C)c1ccccc1 269982a_100000210012_100016990835 [0,0,0,0,0,2|1,0,0]=3 3636 B15R1.9094 CN(CCC[N+](C)(C)C)c1ccccc1 34a_100000210012_100016990835 [0,0,0,0,0,2|1,0,0]=3 3637 B15R1.9094 CN(CCC[Si](C)(C)C)c1ccccc1 2230a_100000210012_100011219597 [0,0,0,0,0,2|2,0,0]=4 3638 B15R1.9094 CN(CCC[Si](C)(C)C)c1ccccc1 269982a_100000210012_100011219597 [0,0,0,0,0,2|2,0,0]=4 3639 B15R1.9094 CN(CCC[Si](C)(C)C)c1ccccc1 34a_100000210012_100011219597 [0,0,0,0,0,2|2,0,0]=4 3640 B15R1.9094 CN(CCO[Si](C)(C)C)c1ccccc1 2230a_100000210012_200000032530 [0,0,0,0,0,2|2,0,0]=4 3641 B15R1.9094 CN(CCO[Si](C)(C)C)c1ccccc1 34a_100000210012_200000032530 [0,0,0,0,0,2|2,0,0]=4 3642 B15R1.9094 C[C@@H](NCCC(C)(C)C)c1ccccc1 2230a_100000751104_100000755188 [0,0,0,0,0,2|1,0,0]=3 3643 B15R1.9094 C[C@@H](NCCC(C)(C)O)c1ccccc1 2230a_100000751104_100000702414 [0,0,0,0,0,2|2,0,0]=4 3644 B15R1.9094 C[C@@H](NCC[Si](C)(C)C)c1ccccc1 2230a_100000751104_200000733723 [0,0,0,0,0,2|1,0,0]=3 3645 B15R1.9094 C[C@@H](OCCC(C)(C)C)c1ccccc1 34a_100000761318_100000755188 [0,0,0,0,0,2|1,0,0]=3 3646 B15R1.9094 C[C@@H](OCCC(C)(C)C)c1ccccc1 7a_100000761318_100000755188 [0,0,0,0,0,2|1,0,0]=3 3647 B15R1.9094 C[C@@H](OCCC(C)(C)O)c1ccccc1 34a_100000761318_100000702414 [0,0,0,0,0,2|2,0,0]=4 3648 B15R1.9094 C[C@@H](OCCC(C)(C)O)c1ccccc1 7a_100000761318_100000702414 [0,0,0,0,0,2|2,0,0]=4 3649 B15R1.9094 C[C@@H](OCC[N+](C)(C)C)c1ccccc1 34a_100000761318_100000085578 [0,0,0,0,0,2|0,0,0]=2 3650 B15R1.9094 C[C@@H](OCC[N+](C)(C)C)c1ccccc1 7a_100000761318_100000085578 [0,0,0,0,0,2|0,0,0]=2 3651 B15R1.9094 C[C@@H](OCC[Si](C)(C)C)c1ccccc1 34a_100000761318_200000733723 [0,0,0,0,0,2|1,0,0]=3 3652 B15R1.9094 C[C@@H](OCC[Si](C)(C)C)c1ccccc1 7a_100000761318_200000733723 [0,0,0,0,0,2|1,0,0]=3 3653 B15R1.9094 C[N+](C)(C)CCCC(=O)c1ccccc1 1458a_100000185807_100016990835 [0,0,0,0,0,2|1,0,1]=4 3654 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 1626a_100000106457_100000185807 [0,0,0,0,0,2|1,0,1]=4 3655 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 240690a_100000106457_100000185807 [0,0,0,0,0,2|1,0,1]=4 3656 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 527a_100000106457_100000185807 [0,0,0,0,0,2|1,0,1]=4 3657 B15R1.9094 C[N+](C)(C)CSCC(=O)c1ccccc1 62a_100000211460_200000036245 [0,0,0,0,0,2|1,0,1]=4 3658 B15R1.9094 C[N+](C)(C)CSCC(=O)c1ccccc1 62a_200000036245_100000211460 [0,0,0,0,0,2|1,0,1]=4 3659 B15R1.9094 C[N+](C)(C)CSCC(O)c1ccccc1 62a_100000185958_200000036245 [0,0,0,0,0,2|1,0,0]=3 3660 B15R1.9094 C[N+](C)(C)CSCC(O)c1ccccc1 62a_200000036245_100000185958 [0,0,0,0,0,2|1,0,0]=3 3661 B15R1.9094 C[N+](C)(C)CSCS(=O)c1ccccc1 62a_200000036245_100000031784 [0,0,0,0,0,2|2,0,0]=4 3662 B15R1.9094 C[N+](C)(C)CSC[C@@H](O)c1ccccc1 62a_100011933945_200000036245 [0,0,0,0,0,2|1,0,0]=3 3663 B15R1.9094 C[N+](C)(C)CSC[C@@H](O)c1ccccc1 62a_200000036245_100011933945 [0,0,0,0,0,2|1,0,0]=3 3664 B15R1.9094 C[Si](C)(C)CNCC(O)c1ccccc1 2230a_100000210709_100000037933 [0,0,0,0,0,2|2,0,0]=4 3665 B15R1.9094 C[Si](C)(C)CSCC(O)c1ccccc1 62a_100000037933_100000185958 [0,0,0,0,0,2|2,0,0]=4 3666 B15R1.9094 C[Si](C)(C)CSCC(O)c1ccccc1 62a_100000185958_100000037933 [0,0,0,0,0,2|2,0,0]=4 3667 B15R1.9094 C[Si](C)(C)CSC[C@@H](O)c1ccccc1 62a_100000037933_100011933945 [0,0,0,0,0,2|2,0,0]=4 3668 B15R1.9094 C[Si](C)(C)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000037933 [0,0,0,0,0,2|2,0,0]=4