0 B12R1.75 C#CC1=NC=CN=C1NC(C)C m_38__23815264__6579028 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.75 C=CC1=CC=CN=C1CC(C)C m_271570__15607576__16969488 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.75 CC(C)NC1=NC=CC=C1C#N m_27__3115962__61094 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.75 CC(C)NC1=NC=CN=C1C#N m_27__3115962__2745374 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.75 CC(C)OC1=CC=CN=C1C#N m_7__9582536__5048 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.75 CC(C)SC1=NC=CC=C1C#N m_7__134531__5048 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.75 CC(C)SC1=NC=CN=C1C#N m_7__22987412__5048 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.75 CCC1=CC=CC=C1CN(C)C m_2230__22406784__2463448 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.75 CCC1=CC=CC=C1NC(C)C m_38__56224__6579028 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.75 CCC1=CC=CN=C1C=C(C)C m_271570__13019924__13419880 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.75 CCC1=NC=NC=C1OC(C)C m_7__22985156__5048 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.75 CNC1=CC=CC=C1CC(C)C m_38__7043816__7022558 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.75 CNC1=CC=CC=C1OC(C)C m_38__736534__7022558 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.75 CNC1=CC=CC=C1SC(C)C m_38__7108124__7022558 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.75 CNC1=NC=CN=C1OC(C)C m_27__61257__8370460 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.75 COC1=CC=CC=C1C=C(C)C m_271570__13019924__11652092 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.75 COC1=CC=CC=C1CN(C)C m_2230__678672__2463448 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.75 COC1=CC=CC=C1NC(C)C m_38__56055__6579028 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.75 COC1=CC=CC=C1OC(C)C m_7__26874__5048 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.75 COC1=CC=CC=C1SC(C)C m_7__2162778__5048 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.75 COC1=CC=CN=C1C=C(C)C m_271570__13019924__16463414 [0,0,0,0,0,0|1,0,2]=3 21 B12R1.75 COC1=CC=CN=C1CC(=O)N m_22__58357__9475954 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.75 COC1=CC=CN=C1NC(=O)C m_270062__7609866__15585492 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.75 COC1=CC=CN=C1OC(C)C m_34__8627270__7119626 [0,0,0,0,0,0|2,0,0]=2 24 B12R1.75 COC1=CC=CN=C1SC(C)C m_7__15368240__5048 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.75 COC1=NC=CC=C1C=C(C)C m_271570__13019924__18352954 [0,0,0,0,0,0|1,0,2]=3 26 B12R1.75 COC1=NC=CC=C1CC(=O)N m_22__58357__18327882 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.75 COC1=NC=CC=C1CN(C)C m_2230__20764904__2463448 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.75 COC1=NC=CC=C1NC(=O)C m_270062__7602436__15585492 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.75 COC1=NC=CC=C1OC(=O)C m_276436__23172564__14088324 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.75 COC1=NC=CC=C1OC(C)C m_7__22984962__5048 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.75 COC1=NC=CC=C1SC(C)C m_7__22987990__5048 [0,0,0,0,0,0|2,0,0]=2 32 B12R1.75 COC1=NC=CN=C1NC(=O)C m_11__22176356__53455 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.75 COC1=NC=CN=C1NC(=O)N m_2430__22522814__741846 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.75 COC1=NC=NC=C1C=C(C)C m_271570__13019924__16463916 [0,0,0,0,0,0|2,0,2]=4 35 B12R1.75 CSC1=CC=CC=C1CN(C)C m_2230__9478772__2463448 [0,0,0,0,0,0|3,1,0]=4 36 B12R1.75 CSC1=CC=CC=C1NC(C)C m_38__151771__6579028 [0,0,0,0,0,0|3,1,0]=4 37 B12R1.75 CSC1=CC=CC=C1OC(C)C m_7__22984868__5048 [0,0,0,0,0,0|3,1,0]=4 38 B12R1.75 CSC1=CC=CN=C1C=C(C)C m_271570__13019924__21747776 [0,0,0,0,0,0|1,1,2]=4 39 B11R1.41 C#CC1=NC=CN=C1NCC m_38__23815264__6579420 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.41 CC=CC1=CC=CN=C1OC m_271570__16945674__18352954 [1,0,0,0,0,0|1,0,2]=4 41 B11R1.41 CC=CC1=NC=CC=C1OC m_271570__16945674__16463414 [1,0,0,0,0,0|1,0,2]=4 42 B11R1.41 CCC1=CC=CN=C1CSC m_62__875850__17854098 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.41 CCC1=NC=CN=C1CNC m_2230__21223004__2463448 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.41 CCCC1=CC=CC=C1NC m_38__24545030__7022558 [1,0,0,0,0,0|3,0,0]=4 45 B11R1.41 CCCC1=CC=CC=C1OC m_34__12332116__7119626 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.41 CCNC1=CC=CC=C1OC m_38__56055__6579420 [1,0,0,0,0,0|3,0,0]=4 47 B11R1.41 CCNC1=CC=CN=C1CC m_270004__14060182__24715004 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.41 CCNC1=CC=CN=C1OC m_270004__8299388__24715004 [1,0,0,0,0,0|2,0,0]=3 49 B11R1.41 CCNC1=CC=CN=C1SC m_270004__25071934__24715004 [1,0,0,0,0,0|2,1,0]=4 50 B11R1.41 CCNC1=CC=NN=C1OC m_270004__25070802__24715004 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.41 CCNC1=CN=CN=C1OC m_270004__25069492__24715004 [1,0,0,0,0,0|3,0,0]=4 52 B11R1.41 CCNC1=NC=CC=C1CC m_270004__8350426__24715004 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.41 CCNC1=NC=CC=C1OC m_27__61262__12218954 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.41 CCNC1=NC=CC=C1SC m_270004__11687508__24715004 [1,0,0,0,0,0|2,1,0]=4 55 B11R1.41 CCNC1=NC=CN=C1C#N m_27__61262__2745374 [1,0,0,0,0,0|3,0,0]=4 56 B11R1.41 CCNC1=NC=CN=C1OC m_270004__25069386__24715004 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.41 CCNC1=NC=NC=C1OC m_27__61262__20650720 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.41 CCNC1=NN=CC=C1OC m_270004__25071242__24715004 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.41 CCOC1=CC=CC=C1OC m_34__34865__7119626 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.41 CCOC1=CC=CN=C1OC m_34__8616224__7791662 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.41 CCOC1=NC=NN=C1CC m_34__17665752__7791662 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.41 CCSC1=CC=CC=C1OC m_34__7825810__7119626 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.41 CCSC1=CC=CN=C1OC m_7__22987990__5047 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.41 CCSC1=NC=CC=C1OC m_7__15368240__5047 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.41 CCSC1=NC=CN=C1C#N m_7__22987412__5047 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.41 CNCC1=CC=CC=C1OC m_207__134027__109763 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.41 CNCC1=CC=CN=C1OC m_207__134027__11948386 [1,0,0,0,0,0|2,0,0]=3 68 B11R1.41 CNCC1=NC=CN=C1OC m_207__134027__10427880 [1,0,0,0,0,0|1,0,0]=2 69 B11R1.41 COC1=CC=CC=C1CCO m_34__9328950__7119626 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.41 COC1=CC=CC=C1CSC m_62__875850__81559 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.41 COC1=CC=CN=C1CSC m_62__875850__15746976 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.41 COC1=NC=CN=C1C=NO m_4__388124__10428162 [1,0,0,0,0,0|2,0,1]=4 73 B11R1.41 COCC1=CC=CC=C1OC m_34__10909252__7119626 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.86 CC(=CC1=CC=CN=C1C)C m_271570__13019924__13358636 [1,0,0,0,0,0|1,0,2]=4 75 B11R1.86 CC(=CC1=NC=CC=C1C)C m_271570__13019924__11652192 [1,0,0,0,0,0|1,0,2]=4 76 B11R1.86 CC(=CC1=NC=CC=C1O)C m_271570__13019924__13967786 [1,0,0,0,0,0|1,0,2]=4 77 B11R1.86 CC(=CC1=NC=CN=C1C)C m_271570__13019924__13972798 [1,0,0,0,0,0|0,0,2]=3 78 B11R1.86 CC(=CC1=NC=CN=C1O)C m_271570__13019924__16969462 [1,0,0,0,0,0|0,0,2]=3 79 B11R1.86 CC(=O)NC1=NC=CN=C1C m_270062__17654670__15585492 [1,0,0,0,0,0|2,0,1]=4 80 B11R1.86 CC(=O)NC1=NC=CN=C1O m_11__22184108__53455 [1,0,0,0,0,0|2,0,1]=4 81 B11R1.86 CC(C)CN1C=CC=NC1=O m_34__1159026__6894142 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.86 CC(C)CN1N=CC=CC1=O m_34__9172694__6894142 [1,0,0,0,0,0|2,0,1]=4 83 B11R1.86 CC(C)NC1=NC=CC=C1Br m_27__3115962__12151846 [1,0,0,0,0,0|3,0,0]=4 84 B11R1.86 CC(C)NC1=NC=CN=C1F m_27__3115962__11555254 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.86 CC(C)OC1=CC=CN=C1Br m_7__22984958__5048 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.86 CC(C)OC1=CC=CN=C1Cl m_7__5126468__5048 [1,0,0,0,0,0|3,0,0]=4 87 B11R1.86 CC(C)OC1=CC=CN=C1I m_7__22984730__5048 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.86 CC(C)SC1=CC=CC=C1O m_7__2559060__5048 [1,0,0,0,0,0|3,0,0]=4 89 B11R1.86 CC(C)SC1=NC=CC=C1Br m_7__5136778__5048 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.86 CC(C)SC1=NC=CC=C1Cl m_62__2390328__524386 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.86 CC(C)SC1=NC=CC=C1F m_7__10856258__5048 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.86 CC(C)SC1=NC=CC=C1N m_7__22849186__5048 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.86 CC(C)SC1=NC=CC=C1O m_7__13775788__5048 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.86 CC(C)SC1=NC=CN=C1N m_7__9358712__5048 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.86 CC1=CC=CC=C1CN(C)C m_2230__665290__2463448 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.86 CC1=CC=CC=C1NC(C)C m_38__56054__6579028 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.86 CC1=CC=CC=C1OC(C)C m_7__26856__5048 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.86 CC1=CC=CC=C1SC(C)C m_7__1199018__5048 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.86 CC1=CC=CN=C1SC(C)C m_7__10211412__5048 [1,0,0,0,0,0|2,0,0]=3 100 B11R1.86 CC1=NC=CC=C1OC(C)C m_7__22985646__5048 [1,0,0,0,0,0|2,0,0]=3 101 B11R1.86 CC1=NC=CN=C1NC(C)C m_27__3115962__16945852 [1,0,0,0,0,0|1,0,0]=2 102 B11R1.86 CC1=NC=NC=C1OC(C)C m_7__22986672__5048 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.86 CN(C)CC1=CC=CC=C1O m_2230__24508898__2463448 [1,0,0,0,0,0|3,0,0]=4 104 B11R1.86 CN(C)CC1=CC=CN=C1Cl m_2230__22407612__2463448 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.86 CN(C)CC1=NC=CC=C1Cl m_2230__22406252__2463448 [1,0,0,0,0,0|3,0,0]=4 106 B13R1.51 CC1=CN=C(C(=N1)C#N)NC(C)C m_27__3115962__17519954 [0,1,0,0,0,0|3,0,0]=4 107 B13R1.51 CCC1=NC(=CC=C1OC(C)C)C m_7__22984414__5048 [0,1,0,0,0,0|3,0,0]=4 108 B13R1.51 COC1=CC(=CC=C1CN(C)C)F m_2230__22405552__2463448 [0,1,0,0,0,0|3,0,0]=4 109 B13R1.51 COC1=CC(=CC=C1NC(C)C)Br m_38__12525466__6579028 [0,1,0,0,0,0|3,0,0]=4 110 B13R1.51 COC1=CC(=CC=C1NC(C)C)C m_38__2069628__6579028 [0,1,0,0,0,0|3,0,0]=4 111 B13R1.51 COC1=CC(=CC=C1NC(C)C)Cl m_38__8990524__6579028 [0,1,0,0,0,0|3,0,0]=4 112 B13R1.51 COC1=CC(=CC=C1NC(C)C)F m_38__548192__6579028 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.51 COC1=CC(=CC=C1NC(C)C)I m_38__10644252__6579028 [0,1,0,0,0,0|3,0,0]=4 114 B13R1.51 COC1=CC(=CC=C1OC(C)C)Br m_7__22985614__5048 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.51 COC1=CC(=CC=C1OC(C)C)Cl m_7__22985064__5048 [0,1,0,0,0,0|3,0,0]=4 116 B13R1.51 COC1=CC(=CC=C1OC(C)C)F m_7__22984058__5048 [0,1,0,0,0,0|3,0,0]=4 117 B13R1.51 COC1=CC(=CN=C1C=C(C)C)Cl m_271570__13019924__15064140 [0,1,0,0,0,0|1,0,2]=4 118 B13R1.51 COC1=CC(=CN=C1C=C(C)C)N m_271570__13019924__15141686 [0,1,0,0,0,0|1,0,2]=4 119 B13R1.51 COC1=NC(=CC=C1C=C(C)C)N m_271570__13019924__21749422 [0,1,0,0,0,0|1,0,2]=4 120 B13R1.51 COC1=NC(=CC=C1OC(C)C)C m_7__22985622__5048 [0,1,0,0,0,0|2,0,0]=3 121 B13R1.51 COC1=NC(=CN=C1NC(=O)C)Br m_11__22180378__53455 [0,1,0,0,0,0|2,0,1]=4 122 B13R1.51 COC1=NC(=CN=C1NC(=O)C)Cl m_11__22171934__53455 [0,1,0,0,0,0|2,0,1]=4 123 B13R1.89 C=C(C1=CC=CN=C1OC)[C@@H](C)O m_271570__20608166__18352954 [0,1,0,0,0,0|2,0,1]=4 124 B13R1.89 C=C(C1=NC=CC=C1OC)[C@@H](C)O m_271570__20608166__16463414 [0,1,0,0,0,0|2,0,1]=4 125 B13R1.89 CCC1=NC=CN=C1C(=O)N(C)C m_1626__24364878__22134144 [0,1,0,0,0,0|2,0,1]=4 126 B13R1.89 COC1=CC=CC=C1C(C)N(C)C m_2230__24458230__2463448 [0,1,0,0,0,0|3,0,0]=4 127 B13R1.89 COC1=CC=CC=C1N(C)C(C)C m_2230__10346230__2463448 [0,1,0,0,0,0|3,0,0]=4 128 B13R1.89 COC1=CC=CN=C1C(=C(C)C)C m_271570__18051862__16463414 [0,1,0,0,0,0|1,0,2]=4 129 B13R1.89 COC1=NC=CC=C1C(=C(C)C)C m_271570__18051862__18352954 [0,1,0,0,0,0|1,0,2]=4 130 B13R1.89 COC1=NC=CC=C1C(=O)N(C)C m_1626__24364878__22016334 [0,1,0,0,0,0|2,0,1]=4 131 B13R1.89 COC1=NC=CN=C1C(=O)N(C)C m_1626__24364878__23857380 [0,1,0,0,0,0|1,0,1]=3 132 B13R1.89 COC1=NC=CN=C1C(=O)N(C)N m_240690__21583792__23857392 [0,1,0,0,0,0|2,0,1]=4 133 B13R1.91 C#CC1=NC=CN=C1NC(C)CC m_38__23815264__14247832 [0,1,0,0,0,0|2,0,1]=4 134 B13R1.91 CC(CO)NC1=NC=CN=C1C#N m_27__308690__2745374 [0,1,0,0,0,0|3,0,0]=4 135 B13R1.91 CC(CO)SC1=NC=CN=C1C#N m_27__6338930__2745374 [0,1,0,0,0,0|3,0,0]=4 136 B13R1.91 CCC(=O)NC1=NC=CN=C1OC m_11__22176356__53504 [0,1,0,0,0,0|2,0,1]=4 137 B13R1.91 CCC(C)NC1=CC=CC=C1OC m_38__56055__14247832 [0,1,0,0,0,0|3,0,0]=4 138 B13R1.91 CCC(C)OC1=CC=CC=C1OC m_7__26874__14247828 [0,1,0,0,0,0|3,0,0]=4 139 B13R1.91 CCC(C)OC1=CC=CN=C1OC m_7__22984962__14247828 [0,1,0,0,0,0|2,0,0]=3 140 B13R1.91 CCC(C)SC1=CC=CC=C1OC m_7__2162778__14247828 [0,1,0,0,0,0|3,0,0]=4 141 B13R1.91 CCC(C)SC1=CC=CN=C1OC m_7__22987990__14247828 [0,1,0,0,0,0|2,0,0]=3 142 B13R1.91 CCC(C)SC1=NC=CC=C1OC m_7__15368240__14247828 [0,1,0,0,0,0|2,0,0]=3 143 B13R1.91 CCC(C)SC1=NC=CN=C1C#N m_7__22987412__14247828 [0,1,0,0,0,0|3,0,0]=4 144 B13R1.91 CCC1=CC=CN=C1CN(C)OC m_2230__679026__17854106 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.91 CCC1=NC=CC=C1CN(C)OC m_2230__679026__22994158 [0,1,0,0,0,0|3,0,0]=4 146 B13R1.91 CCN(C)CC1=CC=CC=C1OC m_2230__678672__22383854 [0,1,0,0,0,0|3,0,0]=4 147 B13R1.91 CCN(C)CC1=CC=CN=C1OC m_2230__20764904__22383854 [0,1,0,0,0,0|2,0,0]=3 148 B13R1.91 CCS(=O)CC1=CC=CN=C1OC m_1498__7021596__12155014 [0,1,0,0,0,0|3,0,0]=4 149 B13R1.91 CCS(=O)CC1=NC=CC=C1OC m_1498__7021596__15746980 [0,1,0,0,0,0|3,0,0]=4 150 B13R1.91 CNC(=O)CC1=CC=CN=C1OC m_22__387492__18327882 [0,1,0,0,0,0|2,0,1]=4 151 B13R1.91 CNC(=O)CC1=NC=CC=C1OC m_22__387492__9475954 [0,1,0,0,0,0|2,0,1]=4 152 B13R1.91 CNC(=O)NC1=NC=CN=C1OC m_2430__22522814__740906 [0,1,0,0,0,0|2,0,1]=4 153 B13R1.91 CNC(C)CC1=CC=CC=C1OC m_269862__7193148__7200422 [0,1,0,0,0,0|2,0,0]=3 154 B13R1.91 CNC(C)CC1=CC=CC=C1SC m_269862__7193148__8644412 [0,1,0,0,0,0|2,1,0]=4 155 B13R1.91 COC(=O)CC1=CC=CN=C1OC m_276436__14076652__18327898 [0,1,0,0,0,0|2,0,1]=4 156 B13R1.91 COC(=O)CC1=NC=CC=C1OC m_276436__14076652__14103138 [0,1,0,0,0,0|2,0,1]=4 157 B13R1.91 COC1=CC=CC=C1CN(C)OC m_2230__10341150__2463448 [0,1,0,0,0,0|3,0,0]=4 158 B13R1.91 COC1=CC=CC=C1NC(C)CO m_269862__8315672__15157990 [0,1,0,0,0,0|3,0,0]=4 159 B13R1.91 COC1=CC=CC=C1OC(C)CO m_7__26874__17610454 [0,1,0,0,0,0|3,0,0]=4 160 B13R1.91 COC1=CC=CC=C1SC(C)CO m_7__2162778__17610454 [0,1,0,0,0,0|3,0,0]=4 161 B13R1.91 COC1=CC=CN=C1CN(C)OC m_2230__679026__15746984 [0,1,0,0,0,0|2,0,0]=3 162 B13R1.91 COC1=CC=CN=C1NC(C)CO m_27__308690__12218954 [0,1,0,0,0,0|2,0,0]=3 163 B13R1.91 COC1=CC=CN=C1N[C@H](C)CN m_270166__16815602__16819100 [0,1,0,0,0,0|2,0,0]=3 164 B13R1.91 COC1=CC=CN=C1SC(C)C#N m_7__15368240__6057 [0,1,0,0,0,0|2,0,1]=4 165 B13R1.91 COC1=CC=CN=C1SC(C)CO m_7__15368240__17610454 [0,1,0,0,0,0|2,0,0]=3 166 B13R1.91 COC1=CN=CN=C1NC(C)CO m_27__308690__20650720 [0,1,0,0,0,0|3,0,0]=4 167 B13R1.91 COC1=NC=CC=C1CN(C)OC m_2230__679026__9436012 [0,1,0,0,0,0|2,0,0]=3 168 B13R1.91 COC1=NC=CC=C1OC(C)C#N m_7__22984962__6057 [0,1,0,0,0,0|2,0,1]=4 169 B13R1.91 COC1=NC=CC=C1OC(C)CO m_7__22984962__17610454 [0,1,0,0,0,0|2,0,0]=3 170 B13R1.91 COC1=NC=CC=C1SC(C)C#N m_7__22987990__6057 [0,1,0,0,0,0|2,0,1]=4 171 B13R1.91 COC1=NC=CC=C1SC(C)CO m_7__22987990__17610454 [0,1,0,0,0,0|2,0,0]=3 172 B13R1.91 C[C@@H](CN)SC1=NC=CN=C1C#N m_27__20871334__2745374 [0,1,0,0,0,0|3,0,0]=4 173 B13R1.91 C[C@H](CN)NC1=NC=CN=C1C#N m_270166__16815602__16817396 [0,1,0,0,0,0|3,0,0]=4 174 B13R1.115 COC1=C(C=CC=C1CN(C)C)Cl m_2230__22406228__2463448 [0,1,0,0,0,0|3,0,0]=4 175 B13R1.115 COC1=C(C=CC=C1NC(C)C)Cl m_38__1316372__6579028 [0,1,0,0,0,0|3,0,0]=4 176 B13R1.115 COC1=C(C=CC=C1NC(C)C)F m_38__14787936__6579028 [0,1,0,0,0,0|3,0,0]=4 177 B13R1.115 COC1=C(C=CC=C1SC(C)C)Br m_7__22986836__5048 [0,1,0,0,0,0|3,0,0]=4 178 B13R1.115 COC1=C(C=CN=C1C=C(C)C)Br m_271570__13019924__22849102 [0,1,0,0,0,0|1,0,2]=4 179 B13R1.380 CC=CC1=CC=CN=C1CC(C)C m_271570__16945674__16969488 [0,1,0,0,0,0|2,0,0]=3 180 B13R1.380 CCNC1=CC=CC=C1CC(C)C m_38__7043816__6579420 [0,1,0,0,0,0|3,0,0]=4 181 B13R1.380 CCNC1=CC=CN=C1CC(C)C m_270004__16980938__24715004 [0,1,0,0,0,0|2,0,0]=3 182 B13R1.380 CCNC1=CC=CN=C1OC(C)C m_270004__8299402__24715004 [0,1,0,0,0,0|3,0,0]=4 183 B13R1.380 CCNC1=NC=CC=C1OC(C)C m_270004__9193724__24715004 [0,1,0,0,0,0|3,0,0]=4 184 B13R1.380 CCNC1=NC=CN=C1OC(C)C m_27__61262__8370460 [0,1,0,0,0,0|2,0,0]=3 185 B13R1.380 CCOC1=CC=CC=C1CN(C)C m_2230__1027468__2463448 [0,1,0,0,0,0|3,0,0]=4 186 B13R1.380 CCOC1=CC=CC=C1NC(C)C m_38__56157__6579028 [0,1,0,0,0,0|3,0,0]=4 187 B13R1.380 CCOC1=CC=CN=C1C=C(C)C m_271570__13019924__16463442 [0,1,0,0,0,0|1,0,2]=4 188 B13R1.380 CCOC1=CC=CN=C1OC(C)C m_34__8627270__7791662 [0,1,0,0,0,0|2,0,0]=3 189 B13R1.380 CNCC1=CC=CC=C1CC(C)C m_207__134027__13946102 [0,1,0,0,0,0|3,0,0]=4 190 B13R1.380 COCC1=CC=CC=C1NC(C)C m_38__765450__6579028 [0,1,0,0,0,0|3,0,0]=4 191 B13R1.380 COCC1=CC=CC=C1OC(C)C m_7__22985094__5048 [0,1,0,0,0,0|3,0,0]=4 192 B13R1.380 COCC1=CC=CN=C1C=C(C)C m_271570__13019924__18726508 [0,1,0,0,0,0|1,0,2]=4 193 B13R1.380 CSCC1=CC=CC=C1CC(C)C m_62__875850__13944822 [0,1,0,0,0,0|2,1,0]=4 194 B13R1.589 C=C(C)C1=CC=CN=C1CC(C)C m_271570__19608422__16969488 [0,1,0,0,0,0|2,0,0]=3 195 B13R1.589 CC(=CC1=NC=CN=C1N(C)C)C m_271570__13019924__21546854 [0,1,0,0,0,0|1,0,2]=4 196 B13R1.589 CC(=O)C1=CC=CN=C1NC(C)C m_27__3115962__22326974 [0,1,0,0,0,0|3,0,0]=4 197 B13R1.589 CC(C)OC1=CC=CN=C1N(C)C m_7__22985854__5048 [0,1,0,0,0,0|3,0,0]=4 198 B13R1.589 CC(C)SC1=CC=CN=C1N(C)C m_7__22987992__5048 [0,1,0,0,0,0|3,0,0]=4 199 B13R1.622 COC1=CC=CN=C1OC(C)(C)C m_7__22984286__5046 [0,1,0,0,0,0|2,0,0]=3 200 B13R1.622 COC1=CC=CN=C1SC(C)(F)F m_7__15368240__16733592 [0,1,0,0,0,0|3,0,0]=4 201 B13R1.622 COC1=NC=CC=C1CS(=O)(=O)C m_1500__766206__12155046 [0,1,0,0,0,0|3,0,0]=4 202 B13R1.622 COC1=NC=CC=C1OC(C)(F)F m_7__22984962__16733592 [0,1,0,0,0,0|3,0,0]=4 203 B13R1.622 COC1=NC=CC=C1SC(C)(F)F m_7__22987990__16733592 [0,1,0,0,0,0|3,0,0]=4 204 B13R1.2135 COC1=CC=CC(=C1CN(C)C)F m_2230__22405556__2463448 [0,1,0,0,0,0|3,0,0]=4 205 B13R1.2135 COC1=CC=CC(=C1NC(C)C)Br m_38__24418010__6579028 [0,1,0,0,0,0|3,0,0]=4 206 B13R1.2135 COC1=CC=CC(=C1NC(C)C)C m_38__9396902__6579028 [0,1,0,0,0,0|3,0,0]=4 207 B13R1.2135 COC1=CC=CC(=C1NC(C)C)Cl m_38__12638802__6579028 [0,1,0,0,0,0|3,0,0]=4 208 B13R1.2135 COC1=CC=CC(=C1NC(C)C)F m_38__8961924__6579028 [0,1,0,0,0,0|3,0,0]=4 209 B13R1.2135 COC1=CC=CC(=C1SC(C)C)Br m_7__16904098__5048 [0,1,0,0,0,0|3,0,0]=4 210 B13R1.2135 COC1=CC=CC(=C1SC(C)C)Cl m_7__16645968__5048 [0,1,0,0,0,0|3,0,0]=4 211 B13R1.2135 COC1=CC=CC(=C1SC(C)C)F m_7__22987646__5048 [0,1,0,0,0,0|3,0,0]=4 212 B13R1.3089 COC1=CC=C(C=C1CN(C)C)Br m_2230__7591690__2463448 [0,1,0,0,0,0|3,0,0]=4 213 B13R1.3089 COC1=CC=C(C=C1CN(C)C)C m_2230__678912__2463448 [0,1,0,0,0,0|3,0,0]=4 214 B13R1.3089 COC1=CC=C(C=C1CN(C)C)Cl m_2230__665786__2463448 [0,1,0,0,0,0|3,0,0]=4 215 B13R1.3089 COC1=CC=C(C=C1NC(C)C)Br m_38__1161516__6579028 [0,1,0,0,0,0|3,0,0]=4 216 B13R1.3089 COC1=CC=C(C=C1NC(C)C)C m_38__56122__6579028 [0,1,0,0,0,0|3,0,0]=4 217 B13R1.3089 COC1=CC=C(C=C1NC(C)C)Cl m_38__56072__6579028 [0,1,0,0,0,0|3,0,0]=4 218 B13R1.3089 COC1=CC=C(C=C1NC(C)C)F m_38__8157906__6579028 [0,1,0,0,0,0|3,0,0]=4 219 B13R1.3089 COC1=CC=C(C=C1NC(C)C)I m_38__16898902__6579028 [0,1,0,0,0,0|3,0,0]=4 220 B13R1.3089 COC1=CC=C(C=C1OC(C)C)Br m_7__22984696__5048 [0,1,0,0,0,0|3,0,0]=4 221 B13R1.3089 COC1=CC=C(C=C1OC(C)C)C m_7__22985314__5048 [0,1,0,0,0,0|3,0,0]=4 222 B13R1.3089 COC1=CC=C(C=C1OC(C)C)Cl m_7__22985414__5048 [0,1,0,0,0,0|3,0,0]=4 223 B13R1.3089 COC1=CC=C(C=C1OC(C)C)F m_34__9286154__7119626 [0,1,0,0,0,0|3,0,0]=4 224 B13R1.3089 COC1=CC=C(C=C1SC(C)C)Br m_7__5636490__5048 [0,1,0,0,0,0|3,0,0]=4 225 B13R1.3089 COC1=CC=C(C=C1SC(C)C)Cl m_7__22987924__5048 [0,1,0,0,0,0|3,0,0]=4 226 B13R1.3089 COC1=CC=C(N=C1C=C(C)C)C m_271570__13019924__14686358 [0,1,0,0,0,0|1,0,2]=4 227 B13R1.3089 COC1=CC=C(N=C1C=C(C)C)F m_271570__13019924__21747956 [0,1,0,0,0,0|1,0,2]=4 228 B13R1.3089 COC1=NC=C(C=C1C=C(C)C)Cl m_271570__13019924__21751418 [0,1,0,0,0,0|1,0,2]=4 229 B13R1.3089 COC1=NC=C(C=C1C=C(C)C)F m_271570__13019924__21751428 [0,1,0,0,0,0|1,0,2]=4 230 B13R1.3089 COC1=NC=C(C=C1C=C(C)C)N m_271570__13019924__21751046 [0,1,0,0,0,0|1,0,2]=4 231 B13R1.3089 COC1=NC=C(C=C1C=C(C)C)S m_271570__13019924__20004990 [0,1,0,0,0,0|1,0,2]=4 232 B13R1.3089 COC1=NC=C(C=C1SC(C)C)Br m_7__20080774__5048 [0,1,0,0,0,0|2,0,0]=3 233 B11R0.39 C=CCC(CC(C)C)C(=O)OC m_276436__14076652__14930768 [0,0,1,0,0,0|2,0,1]=4 234 B11R0.133 C=CCN(OC)C(=O)CC(C)C m_22__21004862__58916 [0,0,1,0,0,0|3,0,0]=4 235 B13R2.92 C#CC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__20606020 [0,0,0,1,0,0|2,0,1]=4 236 B13R2.92 C#CC1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__21359126 [0,0,0,1,0,0|2,0,1]=4 237 B13R2.92 C=C1CC1C2=CC=CN=C2OC m_271570__24797904__18352954 [0,0,0,1,0,0|1,0,2]=4 238 B13R2.92 C=C1CC1C2=NC=CC=C2OC m_271570__24797904__16463414 [0,0,0,1,0,0|1,0,2]=4 239 B13R2.92 CCC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11652252 [0,0,0,1,0,0|3,0,0]=4 240 B13R2.92 CCC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__13419880 [0,0,0,1,0,0|2,0,0]=3 241 B13R2.92 CNC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__24879990 [0,0,0,1,0,0|3,0,0]=4 242 B13R2.92 CNC1=NC=NC=C1[C@@H]2C[C@H]2C m_271570__24798142__24880340 [0,0,0,1,0,0|3,0,0]=4 243 B13R2.92 COC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11652092 [0,0,0,1,0,0|2,0,0]=3 244 B13R2.92 COC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__16463414 [0,0,0,1,0,0|1,0,0]=2 245 B13R2.92 COC1=CC=NC=C1[C@@H]2C[C@H]2C m_271570__24798142__13455702 [0,0,0,1,0,0|3,0,0]=4 246 B13R2.92 COC1=CN=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__22607622 [0,0,0,1,0,0|3,0,0]=4 247 B13R2.92 COC1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__18352954 [0,0,0,1,0,0|1,0,0]=2 248 B13R2.92 COC1=NC=NC=C1[C@@H]2C[C@H]2C m_271570__24798142__16463916 [0,0,0,1,0,0|2,0,0]=3 249 B13R2.92 CSC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__12495572 [0,0,0,1,0,0|2,1,0]=4 250 B13R2.92 CSC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__21747776 [0,0,0,1,0,0|1,1,0]=3 251 B13R2.92 CSC1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11944124 [0,0,0,1,0,0|1,1,0]=3 252 B13R2.92 C[C@H]1C[C@@H]1C2=CC=CN=C2C#N m_271570__24798142__21751160 [0,0,0,1,0,0|3,0,0]=4 253 B13R2.92 C[C@H]1C[C@@H]1C2=CC=CN=C2CO m_271570__24798142__12360046 [0,0,0,1,0,0|3,0,0]=4 254 B13R2.92 C[C@H]1C[C@@H]1C2=NC=CC=C2C#N m_271570__24798142__21751036 [0,0,0,1,0,0|3,0,0]=4 255 B13R2.92 C[C@H]1C[C@@H]1C2=NC=CC=C2CN m_271570__24798142__24879768 [0,0,0,1,0,0|3,0,0]=4 256 B13R2.92 C[C@H]1C[C@@H]1C2=NC=CC=C2CO m_271570__24798142__21750500 [0,0,0,1,0,0|3,0,0]=4 257 B13R2.163 CN1CCCC2=NC=CC=C2C1 m_2230__24523810__2463448 [0,0,0,1,0,0|3,0,0]=4 258 B13R2.163 CN1CCOC2=CC=CC=C2C1 m_2230__2028396__2463448 [0,0,0,1,0,0|3,0,0]=4 259 B13R2.163 CN1CCOC2=CC=CN=C2C1 m_2230__12639582__2463448 [0,0,0,1,0,0|2,0,0]=3 260 B13R2.243 CN1C2=CC=CC=C2CC1(C)C m_2230__12332214__2463448 [0,0,0,1,0,0|3,0,0]=4 261 B13R2.328 CC1CC2=CC=CC=C2N(C1)C m_2230__3392730__2463448 [0,0,0,1,0,0|3,0,0]=4 262 B13R2.621 COC1=CC=CC=C1CC2CC2 m_34__14686522__7119626 [0,0,0,1,0,0|2,0,0]=3 263 B13R2.621 COC1=CC=CC=C1OC2CC2 m_7__26874__16761930 [0,0,0,1,0,0|3,0,0]=4 264 B13R2.621 COC1=CC=CC=C1SC2CC2 m_7__2162778__16761930 [0,0,0,1,0,0|3,0,0]=4 265 B13R2.621 COC1=CC=CN=C1SC2CC2 m_7__15368240__16761930 [0,0,0,1,0,0|2,0,0]=3 266 B13R2.621 COC1=NC=CC=C1OC2CC2 m_7__22984962__16761930 [0,0,0,1,0,0|2,0,0]=3 267 B13R2.621 COC1=NC=CC=C1SC2CC2 m_7__22987990__16761930 [0,0,0,1,0,0|2,0,0]=3 268 B13R2.621 N#CC1=NC=CN=C1SC2CC2 m_7__22987412__16761930 [0,0,0,1,0,0|3,0,0]=4 269 B11R1.53 C=C(C)C1=CC=CN=C1OC m_271570__19608422__18352954 [0,0,0,0,1,0|1,0,2]=4 270 B11R1.53 C=C(C)C1=NC=CC=C1OC m_271570__19608422__16463414 [0,0,0,0,1,0|1,0,2]=4 271 B11R1.53 C=CC1=NC=CC=C1C(C)C m_271570__15607576__21748916 [0,0,0,0,1,0|2,0,1]=4 272 B11R1.53 C=CC1=NC=CN=C1N(C)C m_271570__15607576__21546854 [0,0,0,0,1,0|2,0,1]=4 273 B11R1.53 CNC1=CC=CC=C1C(C)C m_38__204791__7022558 [0,0,0,0,1,0|3,0,0]=4 274 B11R1.53 COC1=CC=CC=C1C(C)C m_34__35371__7119628 [0,0,0,0,1,0|2,0,0]=3 275 B11R1.53 COC1=CC=CC=C1N(C)C m_2230__11975216__2463448 [0,0,0,0,1,0|3,0,0]=4 276 B11R1.53 COC1=CC=CN=C1N(C)C m_7__22985854__5046 [0,0,0,0,1,0|2,0,0]=3 277 B11R1.53 COC1=CN=CN=C1C(C)C m_7__22984476__5046 [0,0,0,0,1,0|2,0,0]=3 278 B11R1.53 COC1=NC=CN=C1C(=O)N m_34__16604340__7119626 [0,0,0,0,1,0|2,0,1]=4 279 B11R1.53 CSC1=CC=CN=C1N(C)C m_7__22987992__5046 [0,0,0,0,1,0|2,1,0]=4 280 B11R1.57 C=CC1=NC=NN1CC(C)C m_271570__15607576__15505242 [0,0,0,0,1,0|2,0,1]=4 281 B11R1.57 CC(C)CN1C=CN=C1C#N m_7__19647464__1010132 [0,0,0,0,1,0|3,0,0]=4 282 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[0,0,0,0,1,0|1,0,2]=4 295 B11R1.57 COC1=NNC=C1C=C(C)C m_271570__13019924__16711526 [0,0,0,0,1,0|1,0,2]=4 296 B11R1.57 COC1=NSC=C1C=C(C)C m_271570__13019924__11651900 [0,0,0,0,1,0|1,0,2]=4 297 B11R1.57 COC1=NSC=C1CN(C)C m_2230__13421080__2463448 [0,0,0,0,1,0|2,0,0]=3 298 B11R1.57 CSC1=NC=CN1CC(C)C m_34__7103804__6894142 [0,0,0,0,1,0|1,1,0]=3 299 B11R1.57 CSC1=NC=CN1CC(C)F m_34__7103804__16970748 [0,0,0,0,1,0|2,1,0]=4 300 B11R1.57 CSC1=NC=CN1CC(C)O m_63__8741388__10903854 [0,0,0,0,1,0|2,1,0]=4 301 B11R1.57 CSC1=NN=NN1CC(C)C m_7__148435__5046 [0,0,0,0,1,0|2,1,0]=4 302 B13R1.90 C#CC1=CC=CN=C1NCC(C)C m_27__61318__11243716 [0,0,0,0,0,1|2,0,1]=4 303 B13R1.90 C#CC1=NC=CN=C1NCC(C)C m_207__23815268__121216 [0,0,0,0,0,1|1,0,1]=3 304 B13R1.90 C#CC1=NC=CN=C1NCC(C)O m_273610__23815284__11516404 [0,0,0,0,0,1|2,0,1]=4 305 B13R1.90 C=C(C)COC1=CC=CN=C1OC m_34__8616224__7653136 [0,0,0,0,0,1|1,0,2]=4 306 B13R1.90 C=C(C)CSC1=CC=CN=C1OC m_7__22987990__5949 [0,0,0,0,0,1|1,0,2]=4 307 B13R1.90 C=C(C)CSC1=NC=CC=C1OC m_7__15368240__5949 [0,0,0,0,0,1|1,0,2]=4 308 B13R1.90 CC(C)CNC1=CC=CN=C1C#N m_27__61318__9403548 [0,0,0,0,0,1|3,0,0]=4 309 B13R1.90 CC(C)CNC1=NC=CC=C1C#N m_27__61318__61094 [0,0,0,0,0,1|3,0,0]=4 310 B13R1.90 CC(C)CNC1=NC=CC=C1CO m_207__12297066__121216 [0,0,0,0,0,1|3,0,0]=4 311 B13R1.90 CC(C)CNC1=NC=CN=C1C#N m_27__61318__2745374 [0,0,0,0,0,1|2,0,0]=3 312 B13R1.90 CC(C)COC1=CC=CN=C1C#N m_7__9582536__1010132 [0,0,0,0,0,1|3,0,0]=4 313 B13R1.90 CC(C)CSC1=NC=CC=C1C#N m_7__134531__1010132 [0,0,0,0,0,1|3,0,0]=4 314 B13R1.90 CC(C)CSC1=NC=CN=C1C#N m_7__22987412__1010132 [0,0,0,0,0,1|2,0,0]=3 315 B13R1.90 CC(F)CNC1=NC=CN=C1C#N m_27__13461110__2745374 [0,0,0,0,0,1|3,0,0]=4 316 B13R1.90 CC(F)CSC1=NC=CN=C1C#N m_7__22987412__16970746 [0,0,0,0,0,1|3,0,0]=4 317 B13R1.90 CC(O)CNC1=NC=CN=C1C#N m_27__61393__2745374 [0,0,0,0,0,1|3,0,0]=4 318 B13R1.90 CC(O)CSC1=NC=CN=C1C#N m_7__22987412__10902704 [0,0,0,0,0,1|3,0,0]=4 319 B13R1.90 CCC1=CC=CC=C1CNC(C)C m_269862__7198548__7204804 [0,0,0,0,0,1|3,0,0]=4 320 B13R1.90 CCC1=CC=CC=C1CSC(C)C m_62__2390328__9141210 [0,0,0,0,0,1|3,0,0]=4 321 B13R1.90 CCC1=CC=CC=C1NCC(C)C m_207__1077834__121216 [0,0,0,0,0,1|3,0,0]=4 322 B13R1.90 CCC1=CC=CN=C1C=CC(C)C m_271570__17312298__13419880 [0,0,0,0,0,1|2,0,1]=4 323 B13R1.90 CCC1=CC=CN=C1CNC(C)C m_270004__23845338__24720556 [0,0,0,0,0,1|2,0,0]=3 324 B13R1.90 CCC1=CC=CN=C1CSC(C)C m_62__2390328__17854098 [0,0,0,0,0,1|2,0,0]=3 325 B13R1.90 CCC1=CC=CN=C1NCC(C)C m_270004__8350426__8127718 [0,0,0,0,0,1|2,0,0]=3 326 B13R1.90 CCC1=NC=CC=C1CNC(C)C m_270004__23845338__24720540 [0,0,0,0,0,1|2,0,0]=3 327 B13R1.90 CCC1=NC=CC=C1NCC(C)C m_207__14060174__121216 [0,0,0,0,0,1|2,0,0]=3 328 B13R1.90 CCC1=NC=CN=C1CNC(=O)C m_270062__21223020__15585492 [0,0,0,0,0,1|2,0,1]=4 329 B13R1.90 CCC1=NC=CN=C1CNC(C)C m_2230__21223004__680832 [0,0,0,0,0,1|1,0,0]=2 330 B13R1.90 CCC1=NC=NC=C1NCC(C)C m_270004__25071244__8127718 [0,0,0,0,0,1|3,0,0]=4 331 B13R1.90 CCC1=NC=NC=C1OCC(C)C m_7__22985156__1010132 [0,0,0,0,0,1|3,0,0]=4 332 B13R1.90 CCC1=NN=CN=C1OCC(C)C m_34__17665752__6894142 [0,0,0,0,0,1|2,0,0]=3 333 B13R1.90 CCC1=NN=CN=C1OCC(C)F m_34__17665752__16970748 [0,0,0,0,0,1|3,0,0]=4 334 B13R1.90 CNC1=CC=CC=C1CCC(C)C m_38__2264318__7022558 [0,0,0,0,0,1|3,0,0]=4 335 B13R1.90 CNC1=CC=CC=C1OCC(C)C m_38__1033546__7022558 [0,0,0,0,0,1|3,0,0]=4 336 B13R1.90 CNC1=NC=CC=C1CNC(C)C m_270004__23845338__24721940 [0,0,0,0,0,1|2,0,0]=3 337 B13R1.90 COC1=CC=CC=C1C=CC(C)C m_271570__17312298__11652092 [0,0,0,0,0,1|2,0,1]=4 338 B13R1.90 COC1=CC=CC=C1CCN(C)C m_2230__3391196__2463448 [0,0,0,0,0,1|3,0,0]=4 339 B13R1.90 COC1=CC=CC=C1CNC(C)C m_270004__23845338__7547528 [0,0,0,0,0,1|2,0,0]=3 340 B13R1.90 COC1=CC=CC=C1CSC(C)C m_62__2390328__81559 [0,0,0,0,0,1|2,0,0]=3 341 B13R1.90 COC1=CC=CC=C1NCC(C)C m_207__1077820__121216 [0,0,0,0,0,1|2,0,0]=3 342 B13R1.90 COC1=CC=CC=C1NCC(C)O m_273610__11531028__11516404 [0,0,0,0,0,1|3,0,0]=4 343 B13R1.90 COC1=CC=CC=C1OCC(C)C m_34__34784__6894142 [0,0,0,0,0,1|2,0,0]=3 344 B13R1.90 COC1=CC=CC=C1OCC(C)F m_34__34784__16970748 [0,0,0,0,0,1|3,0,0]=4 345 B13R1.90 COC1=CC=CC=C1OCC(C)O m_273790__11716406__11718204 [0,0,0,0,0,1|3,0,0]=4 346 B13R1.90 COC1=CC=CC=C1SCC(C)C m_7__2162778__1010132 [0,0,0,0,0,1|2,0,0]=3 347 B13R1.90 COC1=CC=CC=C1SCC(C)F m_7__2162778__16970746 [0,0,0,0,0,1|3,0,0]=4 348 B13R1.90 COC1=CC=CC=C1SCC(C)O m_63__2162782__10903854 [0,0,0,0,0,1|3,0,0]=4 349 B13R1.90 COC1=CC=CN=C1C=CC(C)C m_271570__17312298__16463414 [0,0,0,0,0,1|1,0,1]=3 350 B13R1.90 COC1=CC=CN=C1CNC(=O)C m_270062__16413756__15585492 [0,0,0,0,0,1|2,0,1]=4 351 B13R1.90 COC1=CC=CN=C1CNC(C)C m_269862__10859216__7204804 [0,0,0,0,0,1|1,0,0]=2 352 B13R1.90 COC1=CC=CN=C1COC(=O)C m_1458__473186__15746978 [0,0,0,0,0,1|2,0,1]=4 353 B13R1.90 COC1=CC=CN=C1CSC(C)C m_62__2390328__15746976 [0,0,0,0,0,1|1,0,0]=2 354 B13R1.90 COC1=CC=CN=C1NCC(C)C m_27__61318__12218954 [0,0,0,0,0,1|1,0,0]=2 355 B13R1.90 COC1=CC=CN=C1NCC(C)F m_27__13461110__12218954 [0,0,0,0,0,1|2,0,0]=3 356 B13R1.90 COC1=CC=CN=C1NCC(C)O m_27__61393__12218954 [0,0,0,0,0,1|2,0,0]=3 357 B13R1.90 COC1=CC=CN=C1NCC(F)Cl m_27__21631444__12218954 [0,0,0,0,0,1|3,0,0]=4 358 B13R1.90 COC1=CC=CN=C1NC[C@@H](C)N m_270166__16816388__16819100 [0,0,0,0,0,1|2,0,0]=3 359 B13R1.90 COC1=CC=CN=C1SCC(=O)C m_7__15368240__5065 [0,0,0,0,0,1|2,0,1]=4 360 B13R1.90 COC1=CC=CN=C1SCC(C)C m_7__15368240__1010132 [0,0,0,0,0,1|1,0,0]=2 361 B13R1.90 COC1=CC=CN=C1SCC(C)F m_7__15368240__16970746 [0,0,0,0,0,1|2,0,0]=3 362 B13R1.90 COC1=CC=CN=C1SCC(C)O m_63__15368242__10903854 [0,0,0,0,0,1|2,0,0]=3 363 B13R1.90 COC1=CC=CN=C1SCC(F)F m_7__15368240__16886816 [0,0,0,0,0,1|3,0,0]=4 364 B13R1.90 COC1=CC=NC=C1CNC(C)C m_269862__10464616__7204804 [0,0,0,0,0,1|3,0,0]=4 365 B13R1.90 COC1=CC=NC=C1NCC(C)C m_207__7592344__121216 [0,0,0,0,0,1|3,0,0]=4 366 B13R1.90 COC1=CC=NN=C1NCC(C)C m_270004__25071242__8127718 [0,0,0,0,0,1|2,0,0]=3 367 B13R1.90 COC1=CN=CC=C1NCC(C)C m_270004__25069512__8127718 [0,0,0,0,0,1|3,0,0]=4 368 B13R1.90 COC1=CN=CN=C1NCC(C)C m_27__61318__20650720 [0,0,0,0,0,1|2,0,0]=3 369 B13R1.90 COC1=CN=CN=C1NCC(C)F m_27__13461110__20650720 [0,0,0,0,0,1|3,0,0]=4 370 B13R1.90 COC1=CN=CN=C1NCC(C)O m_27__61393__20650720 [0,0,0,0,0,1|3,0,0]=4 371 B13R1.90 COC1=NC=CC=C1C=CC(C)C m_271570__17312298__18352954 [0,0,0,0,0,1|1,0,1]=3 372 B13R1.90 COC1=NC=CC=C1CNC(C)C m_270004__23845338__11948388 [0,0,0,0,0,1|1,0,0]=2 373 B13R1.90 COC1=NC=CC=C1COC(=O)C m_276436__14082556__14088324 [0,0,0,0,0,1|2,0,1]=4 374 B13R1.90 COC1=NC=CC=C1NCC(C)C m_207__7592314__121216 [0,0,0,0,0,1|1,0,0]=2 375 B13R1.90 COC1=NC=CC=C1OCC(=O)C m_7__22984962__5065 [0,0,0,0,0,1|2,0,1]=4 376 B13R1.90 COC1=NC=CC=C1OCC(C)C m_34__8616224__6894142 [0,0,0,0,0,1|1,0,0]=2 377 B13R1.90 COC1=NC=CC=C1OCC(C)F m_34__8616224__16970748 [0,0,0,0,0,1|2,0,0]=3 378 B13R1.90 COC1=NC=CC=C1OCC(C)O m_7__22984962__10902704 [0,0,0,0,0,1|2,0,0]=3 379 B13R1.90 COC1=NC=CC=C1OCC(F)F m_7__22984962__16886816 [0,0,0,0,0,1|3,0,0]=4 380 B13R1.90 COC1=NC=CC=C1SCC(=O)C m_7__22987990__5065 [0,0,0,0,0,1|2,0,1]=4 381 B13R1.90 COC1=NC=CC=C1SCC(C)C m_7__22987990__1010132 [0,0,0,0,0,1|1,0,0]=2 382 B13R1.90 COC1=NC=CC=C1SCC(C)F m_7__22987990__16970746 [0,0,0,0,0,1|2,0,0]=3 383 B13R1.90 COC1=NC=CC=C1SCC(C)O m_7__22987990__10902704 [0,0,0,0,0,1|2,0,0]=3 384 B13R1.90 COC1=NC=CC=C1SCC(F)F m_7__22987990__16886816 [0,0,0,0,0,1|3,0,0]=4 385 B13R1.90 COC1=NC=CN=C1CNC(C)C m_270004__23845338__10427894 [0,0,0,0,0,1|0,0,0]=1 386 B13R1.90 COC1=NC=CN=C1COC(=O)C m_276436__14085636__14088324 [0,0,0,0,0,1|1,0,1]=3 387 B13R1.90 COC1=NC=CN=C1NCC(C)C m_270004__25069386__8127718 [0,0,0,0,0,1|0,0,0]=1 388 B13R1.90 COC1=NC=CN=C1NNC(=O)C m_270062__21861092__15585492 [0,0,0,0,0,1|2,0,1]=4 389 B13R1.90 COC1=NC=NC=C1C=CC(C)C m_271570__17312298__16463916 [0,0,0,0,0,1|2,0,1]=4 390 B13R1.90 COC1=NC=NC=C1NCC(C)C m_270004__25069492__8127718 [0,0,0,0,0,1|2,0,0]=3 391 B13R1.90 COC1=NN=CC=C1NCC(C)C m_270004__25070802__8127718 [0,0,0,0,0,1|2,0,0]=3 392 B13R1.90 CSC1=CC=CC=C1CSC(C)C m_62__2390328__8625194 [0,0,0,0,0,1|2,1,0]=4 393 B13R1.90 CSC1=CC=CC=C1NCC(C)C m_38__151771__6579052 [0,0,0,0,0,1|2,1,0]=4 394 B13R1.90 CSC1=CC=CC=C1OCC(C)C m_34__10855336__6894142 [0,0,0,0,0,1|2,1,0]=4 395 B13R1.90 CSC1=CC=CN=C1C=CC(C)C m_271570__17312298__21747776 [0,0,0,0,0,1|1,1,1]=4 396 B13R1.90 CSC1=CC=CN=C1NCC(C)C m_270004__11687508__8127718 [0,0,0,0,0,1|1,1,0]=3 397 B13R1.90 CSC1=NC=CC=C1NCC(C)C m_270004__25071934__8127718 [0,0,0,0,0,1|1,1,0]=3 398 B13R1.90 C[C@@H](N)CNC1=NC=CN=C1C#N m_270166__16816388__16817396 [0,0,0,0,0,1|3,0,0]=4 399 B13R1.90 C[C@H](N)CSC1=NC=CN=C1C#N m_27__20871340__2745374 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.4 CC=CC1=NC=CN=C1C m_271570__16945674__13972798 [2,0,0,0,0,0|0,0,2]=4 401 B10R1.4 CC=CC1=NC=CN=C1O m_271570__16945674__16969462 [2,0,0,0,0,0|0,0,2]=4 402 B10R1.4 CCNC1=CC=CN=C1C m_270004__8299390__24715004 [2,0,0,0,0,0|2,0,0]=4 403 B10R1.4 CCNC1=NC=CN=C1Br m_27__61262__16799386 [2,0,0,0,0,0|2,0,0]=4 404 B10R1.4 CCNC1=NC=CN=C1C m_27__61262__16945852 [2,0,0,0,0,0|1,0,0]=3 405 B10R1.4 CCNC1=NC=CN=C1Cl m_27__61262__2280638 [2,0,0,0,0,0|2,0,0]=4 406 B10R1.4 CCNC1=NC=CN=C1F m_27__61262__11555254 [2,0,0,0,0,0|2,0,0]=4 407 B10R1.4 CCNC1=NC=CN=C1I m_27__61262__16799388 [2,0,0,0,0,0|2,0,0]=4 408 B10R1.4 CCNC1=NC=CN=C1N m_27__61262__16968076 [2,0,0,0,0,0|2,0,0]=4 409 B10R1.4 CCOC1=CC=CN=C1C m_34__7425160__7791662 [2,0,0,0,0,0|2,0,0]=4 410 B10R1.4 CCOC1=NC=CN=C1Br m_34__14390322__7791662 [2,0,0,0,0,0|2,0,0]=4 411 B10R1.4 CCOC1=NC=CN=C1I m_34__16913470__7791662 [2,0,0,0,0,0|2,0,0]=4 412 B10R1.4 CCOC1=NC=NN=C1C m_34__17541624__7791662 [2,0,0,0,0,0|2,0,0]=4 413 B10R1.4 CCSC1=NC=CC=C1C m_7__10211412__5047 [2,0,0,0,0,0|2,0,0]=4 414 B10R1.4 CCSC1=NC=CC=C1O m_7__13775788__5047 [2,0,0,0,0,0|2,0,0]=4 415 B10R1.4 CCSC1=NC=CN=C1N m_7__9358712__5047 [2,0,0,0,0,0|2,0,0]=4 416 B10R1.4 CNCC1=CC=CN=C1C m_207__134027__3313112 [2,0,0,0,0,0|2,0,0]=4 417 B10R1.4 CNCC1=NC=CC=C1C m_207__134027__15115506 [2,0,0,0,0,0|2,0,0]=4 418 B10R1.4 CNCC1=NC=CN=C1C m_207__134027__12154932 [2,0,0,0,0,0|1,0,0]=3 419 B10R1.4 CSCC1=NC=CC=C1C m_62__875850__8331318 [2,0,0,0,0,0|2,0,0]=4 420 B10R1.20 CCC1=NC=NC=C1OC m_7__22985156__5046 [2,0,0,0,0,0|2,0,0]=4 421 B10R1.20 CCC1=NN=CN=C1OC m_34__17665752__7119626 [2,0,0,0,0,0|1,0,0]=3 422 B10R1.20 COC1=CC=CN=C1OC m_34__8616224__7119626 [2,0,0,0,0,0|2,0,0]=4 423 B10R1.20 COC1=CC=CN=C1SC m_7__15368240__5046 [2,0,0,0,0,0|2,0,0]=4 424 B10R1.20 COC1=NC=CC=C1SC m_7__22987990__5046 [2,0,0,0,0,0|2,0,0]=4 425 B10R1.18 CC(=CC1=CN=CC=N1)C m_271570__13019924__16597590 [2,0,0,0,0,0|0,0,2]=4 426 B10R1.18 CC(C)NC1=CN=CC=N1 m_27__3115962__12102068 [2,0,0,0,0,0|1,0,0]=3 427 B10R1.18 CC(C)OC1=CC=CN=C1 m_34__770212__6950544 [2,0,0,0,0,0|2,0,0]=4 428 B10R1.18 CC(C)SC1=CC=CC=N1 m_7__27300__5048 [2,0,0,0,0,0|2,0,0]=4 429 B10R1.18 CC(C)SC1=CC=CN=C1 m_7__22987478__5048 [2,0,0,0,0,0|2,0,0]=4 430 B10R1.18 CC(C)SC1=CN=CC=N1 m_7__6103422__5048 [2,0,0,0,0,0|1,0,0]=3 431 B10R1.18 CN(C)CC1=CC=CC=N1 m_2230__10709972__2463448 [2,0,0,0,0,0|2,0,0]=4 432 B10R1.18 CN(C)CC1=CC=CN=C1 m_2230__7791514__2463448 [2,0,0,0,0,0|2,0,0]=4 433 B10R1.18 CN(C)CC1=CN=CC=N1 m_2230__6671222__2463448 [2,0,0,0,0,0|1,0,0]=3 434 B12R1.77 C=C(CC)C1=CC=CN=C1OC m_271570__22840458__18352954 [1,1,0,0,0,0|1,0,1]=4 435 B12R1.77 C=C(CC)C1=NC=CC=C1OC m_271570__22840458__16463414 [1,1,0,0,0,0|1,0,1]=4 436 B12R1.77 CNC(=O)C1=NC=CN=C1OC m_22__387492__23857374 [1,1,0,0,0,0|1,0,1]=4 437 B12R1.77 CNC(C)C1=CC=CN=C1OC m_269862__7193148__16770724 [1,1,0,0,0,0|2,0,0]=4 438 B12R1.77 CNC(C)C1=NC=CC=C1OC m_2230__22404374__2463448 [1,1,0,0,0,0|2,0,0]=4 439 B12R1.77 COC(=O)C1=NC=CN=C1OC m_1458__23857378__483916 [1,1,0,0,0,0|1,0,1]=4 440 B12R1.112 CCNC1=CC=C(N=C1OC)Br m_270004__9227832__24715004 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.112 CCNC1=CC=C(N=C1OC)Cl m_270004__19888928__24715004 [1,1,0,0,0,0|2,0,0]=4 442 B12R1.112 CCNC1=NC=C(C=C1OC)Br m_27__61262__22153524 [1,1,0,0,0,0|2,0,0]=4 443 B12R1.112 CCNC1=NC=C(C=C1OC)Cl m_27__61262__22153522 [1,1,0,0,0,0|2,0,0]=4 444 B12R1.112 CCNC1=NC=C(N=C1OC)Br m_270004__25308494__24715004 [1,1,0,0,0,0|1,0,0]=3 445 B12R1.112 CCNC1=NC=C(N=C1OC)Cl m_270004__25308700__24715004 [1,1,0,0,0,0|1,0,0]=3 446 B12R1.112 CCOC1=CC=C(N=C1OC)C m_34__12220114__7791662 [1,1,0,0,0,0|2,0,0]=4 447 B12R1.112 CNCC1=CC=C(N=C1OC)Cl m_207__134027__14187426 [1,1,0,0,0,0|2,0,0]=4 448 B12R1.121 CCCCC1=CC=CC=C1OC m_34__15345166__7119626 [1,1,0,0,0,0|2,0,0]=4 449 B12R1.121 CCCOC1=CC=CC=C1OC m_34__35687__7119626 [1,1,0,0,0,0|2,0,0]=4 450 B12R1.121 CCCOC1=CC=CN=C1OC m_34__8616224__13271108 [1,1,0,0,0,0|1,0,0]=3 451 B12R1.121 CCCOC1=NC=NN=C1CC m_34__17665752__13271108 [1,1,0,0,0,0|2,0,0]=4 452 B12R1.121 CCCSC1=CC=CC=C1OC m_7__2162778__14390332 [1,1,0,0,0,0|2,0,0]=4 453 B12R1.121 CCCSC1=CC=CN=C1OC m_7__22987990__14390332 [1,1,0,0,0,0|1,0,0]=3 454 B12R1.121 CCCSC1=NC=CC=C1OC m_7__15368240__14390332 [1,1,0,0,0,0|1,0,0]=3 455 B12R1.121 CCCSC1=NC=CN=C1C#N m_7__22987412__14390332 [1,1,0,0,0,0|2,0,0]=4 456 B12R1.121 CCNCC1=CC=CC=C1OC m_207__121480__109763 [1,1,0,0,0,0|2,0,0]=4 457 B12R1.121 CCNCC1=CC=CN=C1CC m_270004__8160850__24720540 [1,1,0,0,0,0|2,0,0]=4 458 B12R1.121 CCNCC1=CC=CN=C1NC m_270004__25344916__24715004 [1,1,0,0,0,0|2,0,0]=4 459 B12R1.121 CCNCC1=CC=CN=C1OC m_207__121480__11948386 [1,1,0,0,0,0|1,0,0]=3 460 B12R1.121 CCNCC1=NC=CC=C1CC m_270004__24336190__24715004 [1,1,0,0,0,0|2,0,0]=4 461 B12R1.121 CCNCC1=NC=CC=C1OC m_270004__10859218__24715004 [1,1,0,0,0,0|1,0,0]=3 462 B12R1.121 CCNCC1=NC=CN=C1CC m_2230__21223004__22383854 [1,1,0,0,0,0|1,0,0]=3 463 B12R1.121 CCNCC1=NC=CN=C1OC m_207__121480__10427880 [1,1,0,0,0,0|0,0,0]=2 464 B12R1.121 CCSCC1=CC=CC=C1OC m_62__875846__81559 [1,1,0,0,0,0|2,0,0]=4 465 B12R1.121 CCSCC1=CC=CN=C1OC m_7__22987770__6950566 [1,1,0,0,0,0|1,0,0]=3 466 B12R1.121 CCSCC1=NC=CC=C1CC m_62__875846__17854098 [1,1,0,0,0,0|2,0,0]=4 467 B12R1.121 CCSCC1=NC=CC=C1OC m_62__875846__15746976 [1,1,0,0,0,0|1,0,0]=3 468 B12R1.121 COC1=CC=CC=C1CCSC m_62__875850__14416298 [1,1,0,0,0,0|2,0,0]=4 469 B12R1.121 COC1=CC=CN=C1NCCN m_270166__16815364__16819100 [1,1,0,0,0,0|2,0,0]=4 470 B12R1.121 COC1=CC=CN=C1NCCO m_27__61206__12218954 [1,1,0,0,0,0|2,0,0]=4 471 B12R1.121 COC1=CC=CN=C1SCCF m_7__15368240__22320828 [1,1,0,0,0,0|2,0,0]=4 472 B12R1.121 COC1=CC=CN=C1SCCO m_7__15368240__102708 [1,1,0,0,0,0|2,0,0]=4 473 B12R1.121 COC1=CC=CN=C1SCSC m_7__15368240__10542644 [1,1,0,0,0,0|2,0,0]=4 474 B12R1.121 COC1=NC=CC=C1OCCF m_34__8616224__22320830 [1,1,0,0,0,0|2,0,0]=4 475 B12R1.121 COC1=NC=CC=C1OCCO m_7__22984962__102708 [1,1,0,0,0,0|2,0,0]=4 476 B12R1.121 COC1=NC=CC=C1OCSC m_7__22984962__10542644 [1,1,0,0,0,0|2,0,0]=4 477 B12R1.121 COC1=NC=CC=C1SCCF m_7__22987990__22320828 [1,1,0,0,0,0|2,0,0]=4 478 B12R1.121 COC1=NC=CC=C1SCCO m_7__22987990__102708 [1,1,0,0,0,0|2,0,0]=4 479 B12R1.121 COC1=NC=CC=C1SCSC m_7__22987990__10542644 [1,1,0,0,0,0|2,0,0]=4 480 B12R1.121 COCCC1=CC=CC=C1OC m_34__15539848__7119626 [1,1,0,0,0,0|2,0,0]=4 481 B12R1.121 COCSC1=CC=CN=C1OC m_7__22987990__6762 [1,1,0,0,0,0|2,0,0]=4 482 B12R1.121 COCSC1=NC=CC=C1OC m_7__15368240__6762 [1,1,0,0,0,0|2,0,0]=4 483 B12R1.121 CON=CC1=NC=CN=C1OC m_4__461206__10428162 [1,1,0,0,0,0|1,0,1]=4 484 B12R1.169 CCCC1=CC=CC=C1OCC m_34__12332116__7791662 [1,1,0,0,0,0|2,0,0]=4 485 B12R1.169 CCCC1=NC=CN=C1NCC m_27__61262__12130480 [1,1,0,0,0,0|1,0,0]=3 486 B12R1.169 CCNC1=CC=CN=C1OCC m_270004__8299396__24715004 [1,1,0,0,0,0|2,0,0]=4 487 B12R1.169 CCNC1=NC=CC=C1OCC m_270004__16727218__24715004 [1,1,0,0,0,0|2,0,0]=4 488 B12R1.169 CCNC1=NC=CN=C1NCC m_27__61262__9016274 [1,1,0,0,0,0|2,0,0]=4 489 B12R1.169 CCNC1=NC=CN=C1OCC m_27__61262__8261144 [1,1,0,0,0,0|1,0,0]=3 490 B12R1.268 CCNC1=CC(=CN=C1OC)Br m_270004__8299410__24715004 [1,1,0,0,0,0|2,0,0]=4 491 B12R1.268 CCNC1=CC(=CN=C1OC)C m_270004__8299424__24715004 [1,1,0,0,0,0|2,0,0]=4 492 B12R1.268 CCNC1=NC(=CC=C1OC)Br m_27__61262__22153526 [1,1,0,0,0,0|2,0,0]=4 493 B12R1.268 CCNC1=NC(=CC=C1OC)C m_270004__8298768__24715004 [1,1,0,0,0,0|2,0,0]=4 494 B12R1.268 CCSC1=CC(=CN=C1OC)Br m_7__20080774__5047 [1,1,0,0,0,0|2,0,0]=4 495 B12R1.268 CNCC1=CC(=CN=C1OC)Br m_207__134027__12366470 [1,1,0,0,0,0|2,0,0]=4 496 B12R1.268 CNCC1=NC(=CC=C1OC)Br m_207__134027__14643868 [1,1,0,0,0,0|2,0,0]=4 497 B12R1.268 COC1=CC=C(N=C1CSC)C m_62__875850__15113214 [1,1,0,0,0,0|2,0,0]=4 498 B12R1.268 COC1=NC=C(C=C1CSC)Br m_62__875850__12121658 [1,1,0,0,0,0|2,0,0]=4 499 B12R1.283 CCNC1=NC=CN=C1C(C)C m_270004__25069352__24715004 [1,1,0,0,0,0|2,0,0]=4 500 B12R1.283 CCNC1=NC=CN=C1N(C)C m_27__61262__8851590 [1,1,0,0,0,0|2,0,0]=4 501 B12R1.542 CCNC1=NC=CC(=C1OC)Br m_27__61262__13418004 [1,1,0,0,0,0|2,0,0]=4 502 B12R1.542 CCNC1=NC=CC(=C1OC)C m_270004__16647886__24715004 [1,1,0,0,0,0|2,0,0]=4 503 B12R1.1112 CCNC1=C(C=CN=C1OC)C m_270004__25071004__24715004 [1,1,0,0,0,0|2,0,0]=4 504 B12R1.124 C=C(C1=NC=CN=C1C)[C@@H](C)O m_271570__20608166__13972798 [1,1,0,0,0,0|1,0,1]=4 505 B12R1.124 C=C(C1=NC=CN=C1O)[C@@H](C)O m_271570__20608166__16969462 [1,1,0,0,0,0|1,0,1]=4 506 B12R1.124 CC(=C(C)C1=NC=CN=C1C)C m_271570__18051862__13972798 [1,1,0,0,0,0|0,0,2]=4 507 B12R1.124 CC(=C(C)C1=NC=CN=C1O)C m_271570__18051862__16969462 [1,1,0,0,0,0|0,0,2]=4 508 B12R1.124 CC(C)N(C)C1=NC=CN=C1F m_27__517228__11555254 [1,1,0,0,0,0|2,0,0]=4 509 B12R1.124 CC1=NC=CN=C1C(=O)N(C)C m_1626__24364878__22116892 [1,1,0,0,0,0|1,0,1]=4 510 B12R1.124 CN(C)C(=O)C1=NC=CN=C1O m_22__387202__16528724 [1,1,0,0,0,0|1,0,1]=4 511 B12R1.127 CC(C)NC1=NC(=CN=C1N)Br m_27__3115962__22560834 [1,1,0,0,0,0|2,0,0]=4 512 B12R1.127 CC1=CC=C(N=C1NC(C)C)Br m_27__3115962__14032018 [1,1,0,0,0,0|2,0,0]=4 513 B12R1.127 CC1=CN=C(C(=C1)OC(C)C)C m_7__22849700__5048 [1,1,0,0,0,0|2,0,0]=4 514 B12R1.127 CC1=CN=C(C(=N1)NC(C)C)C m_27__3115962__12889720 [1,1,0,0,0,0|1,0,0]=3 515 B12R1.127 CC1=NC=C(C=C1OC(C)C)Br m_7__20059154__5048 [1,1,0,0,0,0|2,0,0]=4 516 B12R1.151 CC1=NC=CN=C1CS(=O)(=O)C m_1500__766206__12432564 [1,1,0,0,0,0|2,0,0]=4 517 B12R1.224 CC1=C(C=CN=C1NC(C)C)F m_27__3115962__15703358 [1,1,0,0,0,0|2,0,0]=4 518 B12R1.233 CC1=CC(=CN=C1NC(C)C)I m_27__3115962__22599214 [1,1,0,0,0,0|2,0,0]=4 519 B12R1.233 CC1=CC=C(C(=N1)C)OC(C)C m_7__22984938__5048 [1,1,0,0,0,0|2,0,0]=4 520 B12R1.233 CC1=CN=C(C(=C1)C)SC(C)C m_7__12059398__5048 [1,1,0,0,0,0|2,0,0]=4 521 B12R1.233 CC1=NC(=CC=C1OC(C)C)I m_7__20816526__5048 [1,1,0,0,0,0|2,0,0]=4 522 B12R1.371 C#CC(C)NC1=NC=CN=C1C m_27__8990986__16945852 [1,1,0,0,0,0|1,0,1]=4 523 B12R1.371 CC(CO)NC1=NC=CN=C1Br m_27__308690__16799386 [1,1,0,0,0,0|2,0,0]=4 524 B12R1.371 CC(CO)NC1=NC=CN=C1Cl m_27__308690__2280638 [1,1,0,0,0,0|2,0,0]=4 525 B12R1.371 CC(CO)NC1=NC=CN=C1F m_27__308690__11555254 [1,1,0,0,0,0|2,0,0]=4 526 B12R1.371 CC(CO)NC1=NC=CN=C1I m_27__308690__16799388 [1,1,0,0,0,0|2,0,0]=4 527 B12R1.371 CC(CO)NC1=NC=CN=C1N m_27__308690__16968076 [1,1,0,0,0,0|2,0,0]=4 528 B12R1.371 CC(CO)SC1=NC=CC=C1O m_7__13775788__17610454 [1,1,0,0,0,0|2,0,0]=4 529 B12R1.371 CC(CO)SC1=NC=CN=C1F m_27__6338930__11555254 [1,1,0,0,0,0|2,0,0]=4 530 B12R1.371 CC(CO)SC1=NC=CN=C1N m_7__9358712__17610454 [1,1,0,0,0,0|2,0,0]=4 531 B12R1.371 CC1=CC=CN=C1SC(C)CO m_7__10211412__17610454 [1,1,0,0,0,0|2,0,0]=4 532 B12R1.371 CC1=NC=CC=C1OC(C)CO m_7__22985646__17610454 [1,1,0,0,0,0|2,0,0]=4 533 B12R1.371 CC1=NC=CN=C1NC(C)CO m_27__308690__16945852 [1,1,0,0,0,0|1,0,0]=3 534 B12R1.371 CC1=NC=CN=C1N[C@H](C)CN m_270166__16815602__16818260 [1,1,0,0,0,0|1,0,0]=3 535 B12R1.371 CC1=NC=CN=C1SC(C)CO m_27__6338930__16945852 [1,1,0,0,0,0|1,0,0]=3 536 B12R1.371 CC1=NC=CN=C1S[C@@H](C)CN m_27__20871334__16945852 [1,1,0,0,0,0|1,0,0]=3 537 B12R1.371 CCC(C)NC1=NC=CN=C1F m_88__23109710__23179394 [1,1,0,0,0,0|2,0,0]=4 538 B12R1.371 CCC(C)OC1=CC=CN=C1C m_7__22985646__14247828 [1,1,0,0,0,0|2,0,0]=4 539 B12R1.371 CCC(C)SC1=NC=CC=C1C m_7__10211412__14247828 [1,1,0,0,0,0|2,0,0]=4 540 B12R1.371 CCC(C)SC1=NC=CC=C1O m_7__13775788__14247828 [1,1,0,0,0,0|2,0,0]=4 541 B12R1.371 CCC(C)SC1=NC=CN=C1N m_7__9358712__14247828 [1,1,0,0,0,0|2,0,0]=4 542 B12R1.371 CC[C@H](C)NC1=NC=CN=C1Br m_27__16894778__16799386 [1,1,0,0,0,0|2,0,0]=4 543 B12R1.371 CC[C@H](C)NC1=NC=CN=C1Cl m_27__16894778__2280638 [1,1,0,0,0,0|2,0,0]=4 544 B12R1.371 CC[C@H](C)NC1=NC=CN=C1F m_27__16894778__11555254 [1,1,0,0,0,0|2,0,0]=4 545 B12R1.371 CC[C@H](C)NC1=NC=CN=C1I m_27__16894778__16799388 [1,1,0,0,0,0|2,0,0]=4 546 B12R1.371 CNC(C)CC1=CC=CC=C1C m_269862__7193148__7201356 [1,1,0,0,0,0|2,0,0]=4 547 B12R1.371 CON(C)CC1=CC=CN=C1C m_2230__679026__10302370 [1,1,0,0,0,0|2,0,0]=4 548 B12R1.371 CON(C)CC1=NC=CC=C1C m_2230__679026__9049808 [1,1,0,0,0,0|2,0,0]=4 549 B12R1.371 CON(C)CC1=NC=CN=C1C m_2230__679026__12432566 [1,1,0,0,0,0|1,0,0]=3 550 B12R1.371 C[C@@H](CN)SC1=NC=CN=C1F m_27__20871334__11555254 [1,1,0,0,0,0|2,0,0]=4 551 B12R1.371 C[C@H](CF)NC1=NC=CN=C1F m_27__13811050__11555254 [1,1,0,0,0,0|2,0,0]=4 552 B12R1.371 C[C@H](CN)NC1=NC=CN=C1Cl m_270166__16815602__16818664 [1,1,0,0,0,0|2,0,0]=4 553 B12R1.371 C[C@H](CO)NC1=NC=CN=C1F m_88__23109226__23179394 [1,1,0,0,0,0|2,0,0]=4 554 B12R1.46 COC1=CC=C(C=C1C(C)C)Br m_34__7825814__7119626 [0,1,0,0,1,0|2,0,0]=4 555 B12R1.57 COC1=CC(=CC=C1C(C)C)Br m_34__13952416__7119628 [0,1,0,0,1,0|2,0,0]=4 556 B12R1.57 COC1=CC(=CC=C1C(C)C)C m_34__34801__7119628 [0,1,0,0,1,0|2,0,0]=4 557 B12R1.76 COC1=CC=CC=C1C(C)(C)C m_34__9139752__7119628 [0,1,0,0,1,0|2,0,0]=4 558 B12R1.76 COC1=CC=CN=C1C(C)(C)C m_7__22984592__5046 [0,1,0,0,1,0|1,0,0]=3 559 B12R1.261 C=C(C)C1=NC=CC=C1C(C)C m_271570__19608422__21748916 [0,1,0,0,1,0|2,0,0]=4 560 B12R1.261 C=C(C)C1=NC=CN=C1N(C)C m_271570__19608422__21546854 [0,1,0,0,1,0|2,0,0]=4 561 B12R1.261 CC(C)C1=NC=CN=C1C(=O)N m_22__58357__24597742 [0,1,0,0,1,0|2,0,0]=4 562 B12R1.65 CCC1=NC(=CN1CC(C)C)C m_7__12615812__1010132 [0,1,0,0,1,0|2,0,0]=4 563 B12R1.65 CCC1=NC(=NN1CC(C)C)Br m_34__15369722__6894142 [0,1,0,0,1,0|2,0,0]=4 564 B12R1.65 CCC1=NC(=NN1CC(C)C)Cl m_7__15154218__1010132 [0,1,0,0,1,0|2,0,0]=4 565 B12R1.80 CCC1=NC=CN1C(C)C(C)C m_7__7838068__9435972 [0,1,0,0,1,0|2,0,0]=4 566 B12R1.82 CCC(C)CN1C=CN=C1SC m_34__7103804__7207102 [0,1,0,0,1,0|1,1,0]=4 567 B12R1.82 CCC1=NC=CN1CC(C)CC m_34__7912536__7207102 [0,1,0,0,1,0|2,0,0]=4 568 B12R1.82 CCC1=NC=CN1CC(C)CO m_7__7838068__7968760 [0,1,0,0,1,0|2,0,0]=4 569 B12R1.82 CCC1=NC=CN1CC(C)NC m_2230__22403586__2463448 [0,1,0,0,1,0|2,0,0]=4 570 B12R1.82 CCC1=NC=CN1CC(C)OC m_34__7912536__8635196 [0,1,0,0,1,0|2,0,0]=4 571 B12R1.82 CCN(C)CC1=CSN=C1OC m_2230__13421080__22383854 [0,1,0,0,1,0|2,0,0]=4 572 B12R1.82 COC(C)CN1C=CN=C1SC m_34__7103804__8635196 [0,1,0,0,1,0|1,1,0]=4 573 B12R1.82 COC1=NSC=C1CN(C)OC m_2230__679026__12889660 [0,1,0,0,1,0|2,0,0]=4 574 B12R1.289 CC(C)CN1C=CN=C1CCO m_7__24406968__1010132 [0,1,0,0,1,0|2,0,0]=4 575 B12R1.289 CC=CC1=NC=NN1CC(C)C m_271570__16945674__15505242 [0,1,0,0,1,0|2,0,0]=4 576 B12R1.289 CCCC1=NC=CN1CC(C)C m_34__7290638__6894142 [0,1,0,0,1,0|2,0,0]=4 577 B12R1.289 CNCC1=CC=NN1CC(C)C m_207__134027__11569034 [0,1,0,0,1,0|2,0,0]=4 578 B12R1.289 COCC1=NC=CN1CC(C)C m_34__15541216__6894142 [0,1,0,0,1,0|1,0,0]=3 579 B12R1.289 COCC1=NC=CN1CC(C)F m_34__15541216__16970748 [0,1,0,0,1,0|2,0,0]=4 580 B12R1.289 COCC1=NC=CN1CC(C)O m_63__8992274__10903854 [0,1,0,0,1,0|2,0,0]=4 581 B12R1.289 COCN1C=CN=C1CC(C)O m_7__24547952__6762 [0,1,0,0,1,0|2,0,0]=4 582 B12R1.289 CSCC1=NC=NN1CC(C)C m_62__875850__8377844 [0,1,0,0,1,0|1,1,0]=4 583 B12R1.392 C=C(C)C1=NC=NN1CC(C)C m_271570__19608422__15505242 [0,1,0,0,1,0|2,0,0]=4 584 B12R1.392 CC(=O)C1=NC=CN1CC(C)C m_34__13206240__6894142 [0,1,0,0,1,0|2,0,0]=4 585 B12R1.392 CC(C)CN1C=CN=C1C(C)C m_34__7912534__6894142 [0,1,0,0,1,0|2,0,0]=4 586 B12R1.392 CC(C)CN1C=CN=C1C(C)O m_34__17843124__6894142 [0,1,0,0,1,0|2,0,0]=4 587 B12R1.406 CCC1=NC=CN1CC(C)(C)C m_7__7838068__20018454 [0,1,0,0,1,0|2,0,0]=4 588 B12R1.406 CCC1=NC=CN1CC(C)(C)F m_34__7912536__23075280 [0,1,0,0,1,0|2,0,0]=4 589 B12R1.406 CCC1=NC=CN1CC(C)(C)O m_63__7825844__627702 [0,1,0,0,1,0|2,0,0]=4 590 B12R1.406 CSC1=NC=CN1CC(C)(C)F m_34__7103804__23075280 [0,1,0,0,1,0|1,1,0]=4 591 B12R1.406 CSC1=NC=CN1CC(C)(C)O m_63__8741388__627702 [0,1,0,0,1,0|1,1,0]=4 592 B14R1.93 C#CC1=NC=CN=C1NCC(C)(C)C m_270004__25113342__7548792 [0,1,0,0,0,1|1,0,1]=4 593 B14R1.93 C#CC1=NC=CN=C1NCC(C)(C)F m_38__23815264__23291982 [0,1,0,0,0,1|1,0,1]=4 594 B14R1.93 CC(C)(C)CNC1=NC=CN=C1C#N m_27__2014100__2745374 [0,1,0,0,0,1|2,0,0]=4 595 B14R1.93 CC(C)(C)CSC1=NC=CN=C1C#N m_7__22987412__20018454 [0,1,0,0,0,1|2,0,0]=4 596 B14R1.93 CC(C)(F)CNC1=NC=CN=C1C#N m_27__12362230__2745374 [0,1,0,0,0,1|2,0,0]=4 597 B14R1.93 CC(C)(F)CSC1=NC=CN=C1C#N m_7__22987412__23075278 [0,1,0,0,0,1|2,0,0]=4 598 B14R1.93 CC(C)(N)CNC1=NC=CN=C1C#N m_270166__16815510__16817396 [0,1,0,0,0,1|2,0,0]=4 599 B14R1.93 CC(C)(O)CNC1=NC=CN=C1C#N m_27__3081202__2745374 [0,1,0,0,0,1|2,0,0]=4 600 B14R1.93 CC(C)(O)CSC1=NC=CN=C1C#N m_7__22987412__8331390 [0,1,0,0,0,1|2,0,0]=4 601 B14R1.93 CCC1=CC=CN=C1CNC(C)(C)C m_2230__3081242__17854106 [0,1,0,0,0,1|2,0,0]=4 602 B14R1.93 CCC1=CC=CN=C1NCC(C)(C)C m_270004__8350426__7548792 [0,1,0,0,0,1|2,0,0]=4 603 B14R1.93 CCC1=CC=CN=C1NCC(C)(C)F m_270004__8350426__17541580 [0,1,0,0,0,1|2,0,0]=4 604 B14R1.93 CCC1=NC=CC=C1CNC(C)(C)C m_2230__3081242__22994158 [0,1,0,0,0,1|2,0,0]=4 605 B14R1.93 CCC1=NC=CC=C1NCC(C)(C)C m_270004__14060182__7548792 [0,1,0,0,0,1|2,0,0]=4 606 B14R1.93 CCC1=NC=CC=C1NCC(C)(C)F m_270004__14060182__17541580 [0,1,0,0,0,1|2,0,0]=4 607 B14R1.93 CCC1=NN=CN=C1OCC(C)(C)F m_34__17665752__23075280 [0,1,0,0,0,1|2,0,0]=4 608 B14R1.93 COC1=CC=CC=C1CCC(C)(C)O m_7__22984090__5046 [0,1,0,0,0,1|2,0,0]=4 609 B14R1.93 COC1=CC=CC=C1CNC(C)(C)C m_2230__3081242__680324 [0,1,0,0,0,1|2,0,0]=4 610 B14R1.93 COC1=CC=CC=C1NCC(C)(C)C m_270004__8145264__7548792 [0,1,0,0,0,1|2,0,0]=4 611 B14R1.93 COC1=CC=CC=C1NCC(C)(C)F m_38__56055__23291982 [0,1,0,0,0,1|2,0,0]=4 612 B14R1.93 COC1=CC=CC=C1OCC(C)(C)C m_7__26874__20018454 [0,1,0,0,0,1|2,0,0]=4 613 B14R1.93 COC1=CC=CC=C1OCC(C)(C)F m_34__34784__23075280 [0,1,0,0,0,1|2,0,0]=4 614 B14R1.93 COC1=CC=CC=C1OCC(C)(C)O m_7__26874__8331390 [0,1,0,0,0,1|2,0,0]=4 615 B14R1.93 COC1=CC=CC=C1SCC(C)(C)C m_7__2162778__20018454 [0,1,0,0,0,1|2,0,0]=4 616 B14R1.93 COC1=CC=CC=C1SCC(C)(C)F m_7__2162778__23075278 [0,1,0,0,0,1|2,0,0]=4 617 B14R1.93 COC1=CC=CC=C1SCC(C)(C)O m_63__2162782__627702 [0,1,0,0,0,1|2,0,0]=4 618 B14R1.93 COC1=CC=CN=C1CNC(C)(C)C m_2230__3081242__15746984 [0,1,0,0,0,1|1,0,0]=3 619 B14R1.93 COC1=CC=CN=C1NCC(C)(C)C m_27__2014100__12218954 [0,1,0,0,0,1|1,0,0]=3 620 B14R1.93 COC1=CC=CN=C1NCC(C)(C)F m_27__12362230__12218954 [0,1,0,0,0,1|1,0,0]=3 621 B14R1.93 COC1=CC=CN=C1NCC(C)(C)N m_270166__16815510__16819100 [0,1,0,0,0,1|1,0,0]=3 622 B14R1.93 COC1=CC=CN=C1NCC(C)(C)O m_27__3081202__12218954 [0,1,0,0,0,1|1,0,0]=3 623 B14R1.93 COC1=CC=CN=C1NCC(C)(F)F m_27__10545718__12218954 [0,1,0,0,0,1|2,0,0]=4 624 B14R1.93 COC1=CC=CN=C1SCC(C)(C)C m_7__15368240__20018454 [0,1,0,0,0,1|1,0,0]=3 625 B14R1.93 COC1=CC=CN=C1SCC(C)(C)F m_7__15368240__23075278 [0,1,0,0,0,1|1,0,0]=3 626 B14R1.93 COC1=CC=CN=C1SCC(C)(C)O m_63__15368242__627702 [0,1,0,0,0,1|1,0,0]=3 627 B14R1.93 COC1=CC=CN=C1SCP(=O)(C)C m_7__15368240__18353260 [0,1,0,0,0,1|2,0,0]=4 628 B14R1.93 COC1=CC=CN=C1SC[Si](C)(C)C m_7__15368240__3095236 [0,1,0,0,0,1|1,1,0]=4 629 B14R1.93 COC1=CC=NN=C1NCC(C)(C)C m_270004__25071242__7548792 [0,1,0,0,0,1|2,0,0]=4 630 B14R1.93 COC1=CC=NN=C1NCC(C)(C)F m_270004__25071242__17541580 [0,1,0,0,0,1|2,0,0]=4 631 B14R1.93 COC1=CN=CN=C1NCC(C)(C)C m_27__2014100__20650720 [0,1,0,0,0,1|2,0,0]=4 632 B14R1.93 COC1=CN=CN=C1NCC(C)(C)F m_27__12362230__20650720 [0,1,0,0,0,1|2,0,0]=4 633 B14R1.93 COC1=CN=CN=C1NCC(C)(C)O m_27__3081202__20650720 [0,1,0,0,0,1|2,0,0]=4 634 B14R1.93 COC1=NC=CC=C1CNC(C)(C)C m_2230__3081242__9436012 [0,1,0,0,0,1|1,0,0]=3 635 B14R1.93 COC1=NC=CC=C1NCC(C)(C)C m_270004__8299388__7548792 [0,1,0,0,0,1|1,0,0]=3 636 B14R1.93 COC1=NC=CC=C1NCC(C)(C)F m_270004__8299388__17541580 [0,1,0,0,0,1|1,0,0]=3 637 B14R1.93 COC1=NC=CC=C1OCC(C)(C)C m_7__22984962__20018454 [0,1,0,0,0,1|1,0,0]=3 638 B14R1.93 COC1=NC=CC=C1OCC(C)(C)F m_34__8616224__23075280 [0,1,0,0,0,1|1,0,0]=3 639 B14R1.93 COC1=NC=CC=C1OCC(C)(C)O m_7__22984962__8331390 [0,1,0,0,0,1|1,0,0]=3 640 B14R1.93 COC1=NC=CC=C1OCP(=O)(C)C m_7__22984962__18353260 [0,1,0,0,0,1|2,0,0]=4 641 B14R1.93 COC1=NC=CC=C1OC[Si](C)(C)C m_7__22984962__3095236 [0,1,0,0,0,1|1,1,0]=4 642 B14R1.93 COC1=NC=CC=C1SCC(C)(C)C m_7__22987990__20018454 [0,1,0,0,0,1|1,0,0]=3 643 B14R1.93 COC1=NC=CC=C1SCC(C)(C)F m_7__22987990__23075278 [0,1,0,0,0,1|1,0,0]=3 644 B14R1.93 COC1=NC=CC=C1SCC(C)(C)O m_7__22987990__8331390 [0,1,0,0,0,1|1,0,0]=3 645 B14R1.93 COC1=NC=CC=C1SCP(=O)(C)C m_7__22987990__18353260 [0,1,0,0,0,1|2,0,0]=4 646 B14R1.93 COC1=NC=CC=C1SC[Si](C)(C)C m_7__22987990__3095236 [0,1,0,0,0,1|1,1,0]=4 647 B14R1.93 COC1=NC=CN=C1NCC(C)(C)C m_270004__25069386__7548792 [0,1,0,0,0,1|0,0,0]=2 648 B14R1.93 COC1=NC=CN=C1NCC(C)(C)F m_270004__25069386__17541580 [0,1,0,0,0,1|0,0,0]=2 649 B14R1.93 COC1=NC=NC=C1NCC(C)(C)C m_270004__25069492__7548792 [0,1,0,0,0,1|2,0,0]=4 650 B14R1.93 COC1=NC=NC=C1NCC(C)(C)F m_270004__25069492__17541580 [0,1,0,0,0,1|2,0,0]=4 651 B14R1.93 COC1=NN=CC=C1NCC(C)(C)C m_270004__25070802__7548792 [0,1,0,0,0,1|2,0,0]=4 652 B14R1.93 COC1=NN=CC=C1NCC(C)(C)F m_270004__25070802__17541580 [0,1,0,0,0,1|2,0,0]=4 653 B14R1.93 CSC1=CC=CN=C1NCC(C)(C)C m_270004__11687508__7548792 [0,1,0,0,0,1|1,1,0]=4 654 B14R1.93 CSC1=CC=CN=C1NCC(C)(C)F m_270004__11687508__17541580 [0,1,0,0,0,1|1,1,0]=4 655 B14R1.118 COC1=C(C=CC=C1CNC(C)C)Br m_270004__23845338__8991874 [0,1,0,0,0,1|2,0,0]=4 656 B14R1.118 COC1=C(C=CC=C1CNC(C)C)C m_269862__11760706__7204804 [0,1,0,0,0,1|2,0,0]=4 657 B14R1.118 COC1=C(C=CC=C1CNC(C)C)Cl m_269862__13313476__7204804 [0,1,0,0,0,1|2,0,0]=4 658 B14R1.118 COC1=C(C=CC=C1CNC(C)C)F m_270004__23845338__22640866 [0,1,0,0,0,1|2,0,0]=4 659 B14R1.118 COC1=C(C=CC=C1CNC(C)C)O m_270004__23845338__8370664 [0,1,0,0,0,1|2,0,0]=4 660 B14R1.118 COC1=C(C=CC=C1NCC(C)C)Cl m_207__7457562__121216 [0,1,0,0,0,1|2,0,0]=4 661 B14R1.118 COC1=C(C=CC=C1NCC(C)C)F m_207__14787942__121216 [0,1,0,0,0,1|2,0,0]=4 662 B14R1.118 COC1=C(C=CC=C1SCC(C)C)Br m_7__22986836__1010132 [0,1,0,0,0,1|2,0,0]=4 663 B14R1.118 COC1=C(C=CN=C1C=CC(C)C)Br m_271570__17312298__22849102 [0,1,0,0,0,1|1,0,1]=4 664 B14R1.118 COC1=C(C=CN=C1NCC(C)C)Br m_27__61318__13418004 [0,1,0,0,0,1|1,0,0]=3 665 B14R1.118 COC1=C(C=CN=C1NCC(C)C)C m_270004__16647886__8127718 [0,1,0,0,0,1|1,0,0]=3 666 B14R1.118 COC1=C(C=CN=C1NCC(C)F)Br m_27__13461110__13418004 [0,1,0,0,0,1|2,0,0]=4 667 B14R1.118 COC1=C(C=CN=C1NCC(C)O)Br m_27__61393__13418004 [0,1,0,0,0,1|2,0,0]=4 668 B14R1.118 COC1=C(N=CN=C1NCC(C)C)C m_27__61318__11757280 [0,1,0,0,0,1|2,0,0]=4 669 B14R1.118 COC1=C(N=CN=C1NCC(C)C)N m_27__61318__13817770 [0,1,0,0,0,1|2,0,0]=4 670 B14R1.118 COC1=C(OC=CC1=O)CNC(C)C m_270004__23845338__17507846 [0,1,0,0,0,1|2,0,0]=4 671 B14R1.118 COC1=C(OC=CC1=O)CSC(C)C m_62__2390328__17638582 [0,1,0,0,0,1|2,0,0]=4 672 B14R1.482 CCCC1=NC=CN=C1NCC(C)C m_27__61318__12130480 [0,1,0,0,0,1|1,0,0]=3 673 B14R1.482 CCCC1=NC=CN=C1NCC(C)F m_27__13461110__12130480 [0,1,0,0,0,1|2,0,0]=4 674 B14R1.482 CCCC1=NC=CN=C1NCC(C)O m_27__61393__12130480 [0,1,0,0,0,1|2,0,0]=4 675 B14R1.482 CCCC1=NC=CN=C1NC[C@@H](C)N m_270166__16816388__16819124 [0,1,0,0,0,1|2,0,0]=4 676 B14R1.482 CCNC1=NC=CN=C1NCC(C)C m_27__61318__9016274 [0,1,0,0,0,1|1,0,0]=3 677 B14R1.482 CCNC1=NC=CN=C1NCC(C)F m_27__13461110__9016274 [0,1,0,0,0,1|2,0,0]=4 678 B14R1.482 CCNC1=NC=CN=C1NCC(C)O m_27__61393__9016274 [0,1,0,0,0,1|2,0,0]=4 679 B14R1.482 CCOC1=CC=CC=C1CNC(C)C m_269862__7194780__7204804 [0,1,0,0,0,1|2,0,0]=4 680 B14R1.482 CCOC1=CC=CC=C1CSC(C)C m_62__2390328__81612 [0,1,0,0,0,1|2,0,0]=4 681 B14R1.482 CCOC1=CC=CC=C1NCC(C)C m_207__4928418__121216 [0,1,0,0,0,1|2,0,0]=4 682 B14R1.482 CCOC1=CC=CC=C1OCC(C)C m_34__34865__6894142 [0,1,0,0,0,1|2,0,0]=4 683 B14R1.482 CCOC1=CC=CN=C1C=CC(C)C m_271570__17312298__16463442 [0,1,0,0,0,1|1,0,1]=4 684 B14R1.482 CCOC1=CC=CN=C1NCC(C)C m_270004__16727218__8127718 [0,1,0,0,0,1|1,0,0]=3 685 B14R1.482 CCOC1=NC=CC=C1CNC(C)C m_269862__7193786__7204804 [0,1,0,0,0,1|1,0,0]=3 686 B14R1.482 CCOC1=NC=CC=C1NCC(C)C m_207__7592328__121216 [0,1,0,0,0,1|1,0,0]=3 687 B14R1.482 CCOC1=NC=CN=C1NCC(C)C m_27__61318__8261144 [0,1,0,0,0,1|0,0,0]=2 688 B14R1.482 CCOC1=NC=CN=C1NCC(C)F m_27__13461110__8261144 [0,1,0,0,0,1|1,0,0]=3 689 B14R1.482 CCOC1=NC=CN=C1NCC(C)O m_27__61393__8261144 [0,1,0,0,0,1|1,0,0]=3 690 B14R1.482 CCOC1=NC=CN=C1NCC(F)Cl m_27__21631444__8261144 [0,1,0,0,0,1|2,0,0]=4 691 B14R1.482 CCOC1=NC=CN=C1NC[C@@H](C)N m_270166__16816388__16817204 [0,1,0,0,0,1|1,0,0]=3 692 B14R1.482 COCC1=CC=CC=C1CNC(C)C m_269862__7193418__7204804 [0,1,0,0,0,1|2,0,0]=4 693 B14R1.482 COCC1=CC=CC=C1CSC(C)C m_62__2390328__17837836 [0,1,0,0,0,1|2,0,0]=4 694 B14R1.482 COCC1=CC=CC=C1NCC(C)C m_207__7457692__121216 [0,1,0,0,0,1|2,0,0]=4 695 B14R1.482 COCC1=CC=CC=C1OCC(C)C m_34__10909252__6894142 [0,1,0,0,0,1|2,0,0]=4 696 B14R1.482 COCC1=CC=CN=C1C=CC(C)C m_271570__17312298__18726508 [0,1,0,0,0,1|1,0,1]=4 697 B14R1.840 CC(C)CN(C)C1=NC=CN=C1C#N m_27__2206010__2745374 [0,1,0,0,0,1|2,0,0]=4 698 B14R1.840 CCC1=NC=CN=C1C(=O)NC(C)C m_1626__513594__22134144 [0,1,0,0,0,1|1,0,1]=4 699 B14R1.840 COC1=CC=CC=C1C(C)NC(C)C m_2230__8269660__680832 [0,1,0,0,0,1|2,0,0]=4 700 B14R1.840 COC1=CC=CC=C1N(C)CC(C)C m_2230__11975216__681214 [0,1,0,0,0,1|2,0,0]=4 701 B14R1.840 COC1=CC=CC=C1S(=O)CC(C)C m_265282__4271570__14924542 [0,1,0,0,0,1|2,0,0]=4 702 B14R1.840 COC1=CC=CN=C1C(C)NC(C)C m_269862__21249084__7204804 [0,1,0,0,0,1|1,0,0]=3 703 B14R1.840 COC1=CC=CN=C1N(C)CC(C)C m_27__2206010__12218954 [0,1,0,0,0,1|1,0,0]=3 704 B14R1.840 COC1=CC=CN=C1N(C)CC(C)N m_270166__16815916__16819100 [0,1,0,0,0,1|2,0,0]=4 705 B14R1.840 COC1=CC=CN=C1N(C)CC(C)O m_27__1791530__12218954 [0,1,0,0,0,1|2,0,0]=4 706 B14R1.840 COC1=CN=CN=C1N(C)CC(C)C m_27__2206010__20650720 [0,1,0,0,0,1|2,0,0]=4 707 B14R1.840 COC1=NC=CC=C1C(=O)NC(C)C m_1626__513594__22016334 [0,1,0,0,0,1|1,0,1]=4 708 B14R1.840 COC1=NC=CC=C1C(=O)OC(C)C m_276436__14076930__14098640 [0,1,0,0,0,1|1,0,1]=4 709 B14R1.840 COC1=NC=CC=C1C(C)NC(C)C m_2230__22397022__680832 [0,1,0,0,0,1|1,0,0]=3 710 B14R1.840 COC1=NC=CN=C1C(=O)NC(C)C m_1626__513594__23857380 [0,1,0,0,0,1|0,0,1]=3 711 B14R1.840 COC1=NC=CN=C1C(=O)NN(C)C m_22__134304__23857374 [0,1,0,0,0,1|1,0,1]=4 712 B14R1.840 COC1=NC=CN=C1C(=O)OC(C)C m_1458__23857378__489882 [0,1,0,0,0,1|0,0,1]=3 713 B14R1.863 C#CC(C)CNC1=NC=CC=C1OC m_27__17659342__12218954 [0,1,0,0,0,1|1,0,1]=4 714 B14R1.863 C#CC(C)NCC1=CC=CN=C1OC m_270004__10115238__11948388 [0,1,0,0,0,1|1,0,1]=4 715 B14R1.863 C#CC(C)NCC1=NC=CC=C1OC m_270004__10115238__18323684 [0,1,0,0,0,1|1,0,1]=4 716 B14R1.863 C#CC(C)NCC1=NC=CN=C1CC m_2230__21223004__16604804 [0,1,0,0,0,1|1,0,1]=4 717 B14R1.863 C#CC(C)NCC1=NC=CN=C1OC m_270004__10115238__10427894 [0,1,0,0,0,1|0,0,1]=3 718 B14R1.863 C#CC1=NC=CN=C1NCC(C)CC m_207__23815268__7687310 [0,1,0,0,0,1|1,0,1]=4 719 B14R1.863 C#CC1=NC=CN=C1NCC(C)CO m_38__23815264__7968762 [0,1,0,0,0,1|1,0,1]=4 720 B14R1.863 C=CC(C)CNC1=NC=CC=C1OC m_27__17762534__12218954 [0,1,0,0,0,1|1,0,1]=4 721 B14R1.863 C=CC(C)COC1=CC=CN=C1OC m_7__22984962__23815400 [0,1,0,0,0,1|1,0,1]=4 722 B14R1.863 C=CC(C)CSC1=CC=CN=C1OC m_7__22987990__23815400 [0,1,0,0,0,1|1,0,1]=4 723 B14R1.863 C=CC(C)CSC1=NC=CC=C1OC m_7__15368240__23815400 [0,1,0,0,0,1|1,0,1]=4 724 B14R1.863 C=CC(C)NCC1=CC=CN=C1OC m_2230__22399842__9436012 [0,1,0,0,0,1|1,0,1]=4 725 B14R1.863 C=CC(C)NCC1=NC=CC=C1OC m_2230__22399842__15746984 [0,1,0,0,0,1|1,0,1]=4 726 B14R1.863 C=CC(C)NCC1=NC=CN=C1OC m_270004__8298522__10427894 [0,1,0,0,0,1|0,0,1]=3 727 B14R1.863 CC(CO)CNC1=NC=CN=C1C#N m_27__1291346__2745374 [0,1,0,0,0,1|2,0,0]=4 728 B14R1.863 CC(CO)CSC1=NC=CN=C1C#N m_7__22987412__7968760 [0,1,0,0,0,1|2,0,0]=4 729 B14R1.863 CC=C(C)CNC1=CC=CN=C1OC m_270004__8299388__16464078 [0,1,0,0,0,1|1,0,1]=4 730 B14R1.863 CC=C(C)CNC1=NC=CC=C1OC m_270004__8300174__16464078 [0,1,0,0,0,1|1,0,1]=4 731 B14R1.863 CC=C(C)CNC1=NC=CN=C1OC m_270004__25069386__16464078 [0,1,0,0,0,1|0,0,1]=3 732 B14R1.863 CC=C(C)COC1=CC=CN=C1OC m_7__22984962__15113410 [0,1,0,0,0,1|1,0,1]=4 733 B14R1.863 CC=C(C)CSC1=CC=CN=C1OC m_7__22987990__15113410 [0,1,0,0,0,1|1,0,1]=4 734 B14R1.863 CC=C(C)CSC1=NC=CC=C1OC m_7__15368240__15113410 [0,1,0,0,0,1|1,0,1]=4 735 B14R1.863 CCC(=O)OCC1=NC=CN=C1OC m_276436__14085636__14101862 [0,1,0,0,0,1|1,0,1]=4 736 B14R1.863 CCC(C)CNC1=CC=CC=C1OC m_207__1077820__7687310 [0,1,0,0,0,1|2,0,0]=4 737 B14R1.863 CCC(C)CNC1=CC=CN=C1OC m_207__7592314__7687310 [0,1,0,0,0,1|1,0,0]=3 738 B14R1.863 CCC(C)CNC1=CC=CN=C1SC m_270004__25071934__9139664 [0,1,0,0,0,1|1,1,0]=4 739 B14R1.863 CCC(C)CNC1=CC=NN=C1OC m_270004__25070802__9139664 [0,1,0,0,0,1|2,0,0]=4 740 B14R1.863 CCC(C)CNC1=CN=CN=C1OC m_270004__25069492__9139664 [0,1,0,0,0,1|2,0,0]=4 741 B14R1.863 CCC(C)CNC1=NC=CC=C1OC m_27__11352254__12218954 [0,1,0,0,0,1|1,0,0]=3 742 B14R1.863 CCC(C)CNC1=NC=CC=C1SC m_270004__11687508__9139664 [0,1,0,0,0,1|1,1,0]=4 743 B14R1.863 CCC(C)CNC1=NC=CN=C1C#N m_27__11352254__2745374 [0,1,0,0,0,1|2,0,0]=4 744 B14R1.863 CCC(C)CNC1=NC=CN=C1OC m_270004__25069386__9139664 [0,1,0,0,0,1|0,0,0]=2 745 B14R1.863 CCC(C)CNC1=NC=NC=C1OC m_27__11352254__20650720 [0,1,0,0,0,1|2,0,0]=4 746 B14R1.863 CCC(C)CNC1=NN=CC=C1OC m_270004__25071242__9139664 [0,1,0,0,0,1|2,0,0]=4 747 B14R1.863 CCC(C)COC1=CC=CC=C1OC m_34__34784__7207102 [0,1,0,0,0,1|2,0,0]=4 748 B14R1.863 CCC(C)COC1=CC=CN=C1OC m_34__8616224__7207102 [0,1,0,0,0,1|1,0,0]=3 749 B14R1.863 CCC(C)CSC1=CC=CC=C1OC m_7__2162778__8366958 [0,1,0,0,0,1|2,0,0]=4 750 B14R1.863 CCC(C)CSC1=CC=CN=C1OC m_7__22987990__8366958 [0,1,0,0,0,1|1,0,0]=3 751 B14R1.863 CCC(C)CSC1=NC=CC=C1OC m_7__15368240__8366958 [0,1,0,0,0,1|1,0,0]=3 752 B14R1.863 CCC(C)CSC1=NC=CN=C1C#N m_7__22987412__8366958 [0,1,0,0,0,1|2,0,0]=4 753 B14R1.863 CCC(C)NCC1=CC=CC=C1OC m_207__109487__109763 [0,1,0,0,0,1|2,0,0]=4 754 B14R1.863 CCC(C)NCC1=CC=CN=C1NC m_270004__8288602__24721940 [0,1,0,0,0,1|2,0,0]=4 755 B14R1.863 CCC(C)NCC1=CC=CN=C1OC m_207__109487__11948386 [0,1,0,0,0,1|1,0,0]=3 756 B14R1.863 CCC(C)NCC1=NC=CC=C1OC m_269862__10859216__7200134 [0,1,0,0,0,1|1,0,0]=3 757 B14R1.863 CCC(C)NCC1=NC=CN=C1OC m_207__109487__10427880 [0,1,0,0,0,1|0,0,0]=2 758 B14R1.863 CCC(F)COC1=CC=CN=C1OC m_34__8616224__9787596 [0,1,0,0,0,1|2,0,0]=4 759 B14R1.863 CCC(F)CSC1=CC=CN=C1OC m_7__22987990__9787594 [0,1,0,0,0,1|2,0,0]=4 760 B14R1.863 CCC(F)CSC1=NC=CC=C1OC m_7__15368240__9787594 [0,1,0,0,0,1|2,0,0]=4 761 B14R1.863 CCC(N)CNC1=NC=CC=C1OC m_270166__16815710__16819100 [0,1,0,0,0,1|2,0,0]=4 762 B14R1.863 CCC(O)CNC1=NC=CC=C1OC m_27__11354010__12218954 [0,1,0,0,0,1|2,0,0]=4 763 B14R1.863 CCC(O)COC1=CC=CN=C1OC m_7__22984962__10902710 [0,1,0,0,0,1|2,0,0]=4 764 B14R1.863 CCC(O)CSC1=CC=CN=C1OC m_7__22987990__10902710 [0,1,0,0,0,1|2,0,0]=4 765 B14R1.863 CCC(O)CSC1=NC=CC=C1OC m_63__15368242__9043956 [0,1,0,0,0,1|2,0,0]=4 766 B14R1.863 CCC1=CC=CN=C1CNC(C)CC m_2230__22399526__17854106 [0,1,0,0,0,1|2,0,0]=4 767 B14R1.863 CCC1=CC=CN=C1CNC(C)CCl m_2230__22399894__17854106 [0,1,0,0,0,1|2,0,0]=4 768 B14R1.863 CCC1=CC=CN=C1CNC(C)CF m_270004__10214060__24720556 [0,1,0,0,0,1|2,0,0]=4 769 B14R1.863 CCC1=CC=CN=C1CN[C@H](C)CF m_270004__13811084__24720556 [0,1,0,0,0,1|2,0,0]=4 770 B14R1.863 CCC1=CC=CN=C1CN[C@H](C)CN m_269982__22505378__17854120 [0,1,0,0,0,1|2,0,0]=4 771 B14R1.863 CCC1=CC=CN=C1CN[C@H](C)CO m_2230__22399532__17854106 [0,1,0,0,0,1|2,0,0]=4 772 B14R1.863 CCC1=CC=CN=C1CSC(C)CO m_7__6338928__17854090 [0,1,0,0,0,1|2,0,0]=4 773 B14R1.863 CCC1=CC=CN=C1CS[C@@H](C)CN m_7__20871330__17854090 [0,1,0,0,0,1|2,0,0]=4 774 B14R1.863 CCC1=CC=CN=C1NCC(C)CC m_270004__8350426__9139664 [0,1,0,0,0,1|2,0,0]=4 775 B14R1.863 CCC1=NC=CC=C1CNC(C)CC m_2230__22399526__22994158 [0,1,0,0,0,1|2,0,0]=4 776 B14R1.863 CCC1=NC=CC=C1CNC(C)CCl m_2230__22399894__22994158 [0,1,0,0,0,1|2,0,0]=4 777 B14R1.863 CCC1=NC=CC=C1CNC(C)CF m_270004__10214060__24720540 [0,1,0,0,0,1|2,0,0]=4 778 B14R1.863 CCC1=NC=CC=C1CN[C@H](C)CF m_270004__13811084__24720540 [0,1,0,0,0,1|2,0,0]=4 779 B14R1.863 CCC1=NC=CC=C1CN[C@H](C)CO m_2230__22399532__22994158 [0,1,0,0,0,1|2,0,0]=4 780 B14R1.863 CCC1=NC=CC=C1NCC(C)CC m_207__14060174__7687310 [0,1,0,0,0,1|2,0,0]=4 781 B14R1.863 CCC1=NC=CN=C1CNC(C)C#N m_2230__21223004__8857992 [0,1,0,0,0,1|1,0,1]=4 782 B14R1.863 CCC1=NC=CN=C1CNC(C)CC m_2230__21223004__14247836 [0,1,0,0,0,1|1,0,0]=3 783 B14R1.863 CCC1=NC=CN=C1CNC(C)CF m_2230__21223004__22994052 [0,1,0,0,0,1|1,0,0]=3 784 B14R1.863 CCC1=NC=CN=C1CNC(C)CO m_269862__21223016__15157990 [0,1,0,0,0,1|1,0,0]=3 785 B14R1.863 CCC1=NN=CN=C1OCC(C)CC m_34__17665752__7207102 [0,1,0,0,0,1|2,0,0]=4 786 B14R1.863 CCC1=NN=CN=C1OCC(C)OC m_34__17665752__8635196 [0,1,0,0,0,1|2,0,0]=4 787 B14R1.863 CNC(C)COC1=CC=CC=C1OC m_2230__22397416__2463448 [0,1,0,0,0,1|2,0,0]=4 788 B14R1.863 CNC1=NC=CC=C1CNC(C)CF m_270004__10214060__24721940 [0,1,0,0,0,1|2,0,0]=4 789 B14R1.863 CNC1=NC=CC=C1CN[C@H](C)CF m_270004__13811084__24721940 [0,1,0,0,0,1|2,0,0]=4 790 B14R1.863 CNC1=NC=CC=C1CN[C@H](C)CO m_270004__8291226__24721940 [0,1,0,0,0,1|2,0,0]=4 791 B14R1.863 CN[C@H](C)CNC1=NC=CC=C1OC m_270166__21478450__16819100 [0,1,0,0,0,1|1,0,0]=3 792 B14R1.863 CN[C@H](C)CNC1=NC=CN=C1C#N m_270166__21478450__16817396 [0,1,0,0,0,1|2,0,0]=4 793 B14R1.863 COC(C)CNC1=NC=CN=C1C#N m_27__9164136__2745374 [0,1,0,0,0,1|2,0,0]=4 794 B14R1.863 COC(C)CSC1=NC=CN=C1C#N m_7__22987412__13594080 [0,1,0,0,0,1|2,0,0]=4 795 B14R1.863 COC1=CC=CC=C1CNC(C)CCl m_2230__22399894__680324 [0,1,0,0,0,1|2,0,0]=4 796 B14R1.863 COC1=CC=CC=C1CNC(C)CF m_270004__10214060__7547528 [0,1,0,0,0,1|2,0,0]=4 797 B14R1.863 COC1=CC=CC=C1CN[C@H](C)CF m_207__13811060__109763 [0,1,0,0,0,1|2,0,0]=4 798 B14R1.863 COC1=CC=CC=C1CN[C@H](C)CN m_269982__22505378__22499848 [0,1,0,0,0,1|2,0,0]=4 799 B14R1.863 COC1=CC=CC=C1CN[C@H](C)CO m_207__1299140__109763 [0,1,0,0,0,1|2,0,0]=4 800 B14R1.863 COC1=CC=CC=C1CSC(C)CO m_7__6338928__6352 [0,1,0,0,0,1|2,0,0]=4 801 B14R1.863 COC1=CC=CC=C1CS[C@@H](C)CN m_7__20871330__6352 [0,1,0,0,0,1|2,0,0]=4 802 B14R1.863 COC1=CC=CC=C1NCC(C)CO m_38__56055__7968762 [0,1,0,0,0,1|2,0,0]=4 803 B14R1.863 COC1=CC=CC=C1OCC(C)CO m_7__26874__7968760 [0,1,0,0,0,1|2,0,0]=4 804 B14R1.863 COC1=CC=CC=C1OCC(C)OC m_34__34784__8635196 [0,1,0,0,0,1|2,0,0]=4 805 B14R1.863 COC1=CC=CC=C1SCC(C)CO m_7__2162778__7968760 [0,1,0,0,0,1|2,0,0]=4 806 B14R1.863 COC1=CC=CC=C1SCC(C)OC m_7__2162778__13594080 [0,1,0,0,0,1|2,0,0]=4 807 B14R1.863 COC1=CC=CN=C1CNC(C)C#N m_2230__22392276__15746984 [0,1,0,0,0,1|1,0,1]=4 808 B14R1.863 COC1=CC=CN=C1CNC(C)CCl m_2230__22399894__15746984 [0,1,0,0,0,1|1,0,0]=3 809 B14R1.863 COC1=CC=CN=C1CNC(C)CF m_270004__10214060__18323684 [0,1,0,0,0,1|1,0,0]=3 810 B14R1.863 COC1=CC=CN=C1CNC(C)CO m_269862__10859216__15157990 [0,1,0,0,0,1|1,0,0]=3 811 B14R1.863 COC1=CC=CN=C1CN[C@H](C)CF m_270004__13811084__18323684 [0,1,0,0,0,1|1,0,0]=3 812 B14R1.863 COC1=CC=CN=C1CN[C@H](C)CN m_269982__22505378__15746996 [0,1,0,0,0,1|1,0,0]=3 813 B14R1.863 COC1=CC=CN=C1CN[C@H](C)CO m_2230__22399532__15746984 [0,1,0,0,0,1|1,0,0]=3 814 B14R1.863 COC1=CC=CN=C1CSC(C)CO m_7__6338928__15746968 [0,1,0,0,0,1|1,0,0]=3 815 B14R1.863 COC1=CC=CN=C1CS[C@@H](C)CN m_7__20871330__15746968 [0,1,0,0,0,1|1,0,0]=3 816 B14R1.863 COC1=CC=CN=C1NCC(C)C#N m_27__6283056__12218954 [0,1,0,0,0,1|1,0,1]=4 817 B14R1.863 COC1=CC=CN=C1NCC(C)CO m_27__1291346__12218954 [0,1,0,0,0,1|1,0,0]=3 818 B14R1.863 COC1=CC=CN=C1NCC(C)OC m_27__9164136__12218954 [0,1,0,0,0,1|1,0,0]=3 819 B14R1.863 COC1=CC=CN=C1NCC(F)CO m_27__17069708__12218954 [0,1,0,0,0,1|2,0,0]=4 820 B14R1.863 COC1=CC=CN=C1NCC(O)CF m_27__13905808__12218954 [0,1,0,0,0,1|2,0,0]=4 821 B14R1.863 COC1=CC=CN=C1NCC(O)CN m_270166__17563412__16819100 [0,1,0,0,0,1|2,0,0]=4 822 B14R1.863 COC1=CC=CN=C1NCC(O)CO m_27__7348072__12218954 [0,1,0,0,0,1|2,0,0]=4 823 B14R1.863 COC1=CC=CN=C1NC[C@@H](C)CN m_270166__16816856__16819100 [0,1,0,0,0,1|1,0,0]=3 824 B14R1.863 COC1=CC=CN=C1NC[C@H](N)CO m_270166__19037480__16819100 [0,1,0,0,0,1|2,0,0]=4 825 B14R1.863 COC1=CC=CN=C1SCC(C)C#N m_7__15368240__22787436 [0,1,0,0,0,1|1,0,1]=4 826 B14R1.863 COC1=CC=CN=C1SCC(C)CO m_7__15368240__7968760 [0,1,0,0,0,1|1,0,0]=3 827 B14R1.863 COC1=CC=CN=C1SCC(C)OC m_7__15368240__13594080 [0,1,0,0,0,1|1,0,0]=3 828 B14R1.863 COC1=CC=CN=C1SCC(O)CF m_63__15368242__13936424 [0,1,0,0,0,1|2,0,0]=4 829 B14R1.863 COC1=CC=CN=C1SCC(O)CO m_7__15368240__3173190 [0,1,0,0,0,1|2,0,0]=4 830 B14R1.863 COC1=CN=CN=C1NCC(C)CO m_27__1291346__20650720 [0,1,0,0,0,1|2,0,0]=4 831 B14R1.863 COC1=CN=CN=C1NCC(C)OC m_27__9164136__20650720 [0,1,0,0,0,1|2,0,0]=4 832 B14R1.863 COC1=NC=CC=C1CNC(C)CCl m_2230__22399894__9436012 [0,1,0,0,0,1|1,0,0]=3 833 B14R1.863 COC1=NC=CC=C1CNC(C)CF m_270004__10214060__11948388 [0,1,0,0,0,1|1,0,0]=3 834 B14R1.863 COC1=NC=CC=C1CN[C@H](C)CF m_207__13811060__11948386 [0,1,0,0,0,1|1,0,0]=3 835 B14R1.863 COC1=NC=CC=C1CN[C@H](C)CN m_269982__22505378__22498316 [0,1,0,0,0,1|1,0,0]=3 836 B14R1.863 COC1=NC=CC=C1CN[C@H](C)CO m_207__1299140__11948386 [0,1,0,0,0,1|1,0,0]=3 837 B14R1.863 COC1=NC=CC=C1CSC(C)CO m_7__6338928__6950566 [0,1,0,0,0,1|1,0,0]=3 838 B14R1.863 COC1=NC=CC=C1CS[C@@H](C)CN m_7__20871330__6950566 [0,1,0,0,0,1|1,0,0]=3 839 B14R1.863 COC1=NC=CC=C1OCC(C)C#N m_7__22984962__22787436 [0,1,0,0,0,1|1,0,1]=4 840 B14R1.863 COC1=NC=CC=C1OCC(C)CO m_7__22984962__7968760 [0,1,0,0,0,1|1,0,0]=3 841 B14R1.863 COC1=NC=CC=C1OCC(C)OC m_34__8616224__8635196 [0,1,0,0,0,1|1,0,0]=3 842 B14R1.863 COC1=NC=CC=C1OCC(O)CF m_7__22984962__13890448 [0,1,0,0,0,1|2,0,0]=4 843 B14R1.863 COC1=NC=CC=C1OCC(O)CO m_7__22984962__3173190 [0,1,0,0,0,1|2,0,0]=4 844 B14R1.863 COC1=NC=CC=C1SCC(C)C#N m_7__22987990__22787436 [0,1,0,0,0,1|1,0,1]=4 845 B14R1.863 COC1=NC=CC=C1SCC(C)CO m_7__22987990__7968760 [0,1,0,0,0,1|1,0,0]=3 846 B14R1.863 COC1=NC=CC=C1SCC(C)OC m_7__22987990__13594080 [0,1,0,0,0,1|1,0,0]=3 847 B14R1.863 COC1=NC=CC=C1SCC(O)CF m_7__22987990__13890448 [0,1,0,0,0,1|2,0,0]=4 848 B14R1.863 COC1=NC=CC=C1SCC(O)CO m_7__22987990__3173190 [0,1,0,0,0,1|2,0,0]=4 849 B14R1.863 COC1=NC=CN=C1CNC(C)CF m_270004__10214060__10427894 [0,1,0,0,0,1|0,0,0]=2 850 B14R1.863 COC1=NC=CN=C1CN[C@H](C)CF m_270004__13811084__10427894 [0,1,0,0,0,1|0,0,0]=2 851 B14R1.863 COC1=NC=CN=C1CN[C@H](C)CO m_207__1299140__10427880 [0,1,0,0,0,1|0,0,0]=2 852 B14R1.863 CSC(C)CNC1=NC=CN=C1C#N m_27__7689028__2745374 [0,1,0,0,0,1|2,0,0]=4 853 B14R1.863 C[C@@H](CN)CNC1=NC=CN=C1C#N m_270166__16816856__16817396 [0,1,0,0,0,1|2,0,0]=4 854 B14R1.1600 CC1=CN=C(C(=N1)C#N)NCC(C)C m_27__61318__17519954 [0,1,0,0,0,1|2,0,0]=4 855 B14R1.1600 CCC1=CC(=CN=C1NCC(C)C)Br m_270004__25290452__8127718 [0,1,0,0,0,1|2,0,0]=4 856 B14R1.1600 CCC1=CC(=CN=C1NCC(C)C)Cl m_270004__12331220__8127718 [0,1,0,0,0,1|2,0,0]=4 857 B14R1.1600 CCC1=NC(=CC=C1NCC(C)C)C m_270004__24794700__8127718 [0,1,0,0,0,1|2,0,0]=4 858 B14R1.1600 CCC1=NC(=CC=C1OCC(C)C)C m_34__9229018__6894142 [0,1,0,0,0,1|2,0,0]=4 859 B14R1.1600 COC1=CC(=CC=C1CNC(C)C)Br m_269862__14778958__7204804 [0,1,0,0,0,1|2,0,0]=4 860 B14R1.1600 COC1=CC(=CC=C1CNC(C)C)C m_269862__7199764__7204804 [0,1,0,0,0,1|2,0,0]=4 861 B14R1.1600 COC1=CC(=CC=C1CNC(C)C)Cl m_269862__24518882__7204804 [0,1,0,0,0,1|2,0,0]=4 862 B14R1.1600 COC1=CC(=CC=C1CNC(C)C)F m_269862__24460062__7204804 [0,1,0,0,0,1|2,0,0]=4 863 B14R1.1600 COC1=CC(=CC=C1CNC(C)C)O m_270004__23845338__24720104 [0,1,0,0,0,1|2,0,0]=4 864 B14R1.1600 COC1=CC(=CC=C1CSC(C)C)Br m_62__2390328__20273382 [0,1,0,0,0,1|2,0,0]=4 865 B14R1.1600 COC1=CC(=CC=C1CSC(C)C)Cl m_62__2390328__9582682 [0,1,0,0,0,1|2,0,0]=4 866 B14R1.1600 COC1=CC(=CC=C1NCC(C)C)Br m_207__12525472__121216 [0,1,0,0,0,1|2,0,0]=4 867 B14R1.1600 COC1=CC(=CC=C1NCC(C)C)C m_38__2069628__6579052 [0,1,0,0,0,1|2,0,0]=4 868 B14R1.1600 COC1=CC(=CC=C1NCC(C)C)Cl m_207__8990530__121216 [0,1,0,0,0,1|2,0,0]=4 869 B14R1.1600 COC1=CC(=CC=C1NCC(C)C)F m_207__1077872__121216 [0,1,0,0,0,1|2,0,0]=4 870 B14R1.1600 COC1=CC(=CC=C1NCC(C)C)I m_207__10644258__121216 [0,1,0,0,0,1|2,0,0]=4 871 B14R1.1600 COC1=CC(=CC=C1OCC(C)C)Br m_34__10228426__6894142 [0,1,0,0,0,1|2,0,0]=4 872 B14R1.1600 COC1=CC(=CC=C1OCC(C)C)C m_34__35383__6894142 [0,1,0,0,0,1|2,0,0]=4 873 B14R1.1600 COC1=CC(=CC=C1OCC(C)C)Cl m_34__11353930__6894142 [0,1,0,0,0,1|2,0,0]=4 874 B14R1.1600 COC1=CC(=CC=C1OCC(C)C)F m_34__16914006__6894142 [0,1,0,0,0,1|2,0,0]=4 875 B14R1.1600 COC1=CC(=CN=C1C=CC(C)C)Cl m_271570__17312298__15064140 [0,1,0,0,0,1|1,0,1]=4 876 B14R1.1600 COC1=CC(=CN=C1C=CC(C)C)N m_271570__17312298__15141686 [0,1,0,0,0,1|1,0,1]=4 877 B14R1.1600 COC1=CC(=CN=C1CNC(C)C)Br m_270004__23845338__24715448 [0,1,0,0,0,1|1,0,0]=3 878 B14R1.1600 COC1=CC(=CN=C1NCC(C)C)Br m_207__24409814__121216 [0,1,0,0,0,1|1,0,0]=3 879 B14R1.1600 COC1=CC(=CN=C1NCC(C)C)Cl m_27__61318__22153522 [0,1,0,0,0,1|1,0,0]=3 880 B14R1.1600 COC1=CC(=CN=C1NCC(C)F)Br m_27__13461110__22153524 [0,1,0,0,0,1|2,0,0]=4 881 B14R1.1600 COC1=CC(=CN=C1NCC(C)F)Cl m_27__13461110__22153522 [0,1,0,0,0,1|2,0,0]=4 882 B14R1.1600 COC1=CC(=CN=C1NCC(C)O)Br m_27__61393__22153524 [0,1,0,0,0,1|2,0,0]=4 883 B14R1.1600 COC1=CC(=CN=C1NCC(C)O)Cl m_27__61393__22153522 [0,1,0,0,0,1|2,0,0]=4 884 B14R1.1600 COC1=CC(=NN=C1NCC(C)C)Cl m_270004__25290202__8127718 [0,1,0,0,0,1|2,0,0]=4 885 B14R1.1600 COC1=NC(=CC=C1C=CC(C)C)N m_271570__17312298__21749422 [0,1,0,0,0,1|1,0,1]=4 886 B14R1.1600 COC1=NC(=CC=C1CNC(C)C)C m_269862__7196880__7204804 [0,1,0,0,0,1|1,0,0]=3 887 B14R1.1600 COC1=NC(=CC=C1NCC(C)C)Br m_207__9227820__121216 [0,1,0,0,0,1|1,0,0]=3 888 B14R1.1600 COC1=NC(=CC=C1NCC(C)C)Cl m_207__19888920__121216 [0,1,0,0,0,1|1,0,0]=3 889 B14R1.1600 COC1=NC(=CC=C1OCC(C)C)C m_34__12220114__6894142 [0,1,0,0,0,1|1,0,0]=3 890 B14R1.1600 COC1=NC(=CC=C1OCC(C)F)C m_34__12220114__16970748 [0,1,0,0,0,1|2,0,0]=4 891 B14R1.1600 COC1=NC(=CC=C1OCC(C)O)C m_7__22985622__10902704 [0,1,0,0,0,1|2,0,0]=4 892 B14R1.1600 COC1=NC(=CN=C1NCC(C)C)Br m_270004__25308494__8127718 [0,1,0,0,0,1|0,0,0]=2 893 B14R1.1600 COC1=NC(=CN=C1NCC(C)C)Cl m_270004__25308700__8127718 [0,1,0,0,0,1|0,0,0]=2 894 B14R1.1865 CCC1=CC=C(N=C1NCC(C)C)C m_270004__11964302__8127718 [0,1,0,0,0,1|2,0,0]=4 895 B14R1.1865 CCC1=NC=C(C=C1NCC(C)C)F m_207__13525794__121216 [0,1,0,0,0,1|2,0,0]=4 896 B14R1.1865 COC1=CC=C(C=C1CNC(C)C)Br m_269862__8259498__7204804 [0,1,0,0,0,1|2,0,0]=4 897 B14R1.1865 COC1=CC=C(C=C1CNC(C)C)C m_269862__8316286__7204804 [0,1,0,0,0,1|2,0,0]=4 898 B14R1.1865 COC1=CC=C(C=C1CNC(C)C)Cl m_269862__8257792__7204804 [0,1,0,0,0,1|2,0,0]=4 899 B14R1.1865 COC1=CC=C(C=C1CNC(C)C)F m_269862__15311906__7204804 [0,1,0,0,0,1|2,0,0]=4 900 B14R1.1865 COC1=CC=C(C=C1CSC(C)C)Br m_62__2390328__2161508 [0,1,0,0,0,1|2,0,0]=4 901 B14R1.1865 COC1=CC=C(C=C1CSC(C)C)C m_62__2390328__320452 [0,1,0,0,0,1|2,0,0]=4 902 B14R1.1865 COC1=CC=C(C=C1CSC(C)C)Cl m_62__2390328__134800 [0,1,0,0,0,1|2,0,0]=4 903 B14R1.1865 COC1=CC=C(C=C1CSC(C)C)F m_62__2390328__605946 [0,1,0,0,0,1|2,0,0]=4 904 B14R1.1865 COC1=CC=C(C=C1NCC(C)C)Br m_207__1161524__121216 [0,1,0,0,0,1|2,0,0]=4 905 B14R1.1865 COC1=CC=C(C=C1NCC(C)C)C m_38__56122__6579052 [0,1,0,0,0,1|2,0,0]=4 906 B14R1.1865 COC1=CC=C(C=C1NCC(C)C)Cl m_207__7457350__121216 [0,1,0,0,0,1|2,0,0]=4 907 B14R1.1865 COC1=CC=C(C=C1NCC(C)C)F m_207__8157912__121216 [0,1,0,0,0,1|2,0,0]=4 908 B14R1.1865 COC1=CC=C(C=C1NCC(C)C)I m_207__16898910__121216 [0,1,0,0,0,1|2,0,0]=4 909 B14R1.1865 COC1=CC=C(C=C1OCC(C)C)Br m_34__12156976__6894142 [0,1,0,0,0,1|2,0,0]=4 910 B14R1.1865 COC1=CC=C(C=C1OCC(C)C)C m_7__22985314__1010132 [0,1,0,0,0,1|2,0,0]=4 911 B14R1.1865 COC1=CC=C(C=C1OCC(C)C)Cl m_7__22985414__1010132 [0,1,0,0,0,1|2,0,0]=4 912 B14R1.1865 COC1=CC=C(C=C1OCC(C)C)F m_34__18313496__6894142 [0,1,0,0,0,1|2,0,0]=4 913 B14R1.1865 COC1=CC=C(C=C1SCC(C)C)Br m_7__5636490__1010132 [0,1,0,0,0,1|2,0,0]=4 914 B14R1.1865 COC1=CC=C(C=C1SCC(C)C)Cl m_7__22987924__1010132 [0,1,0,0,0,1|2,0,0]=4 915 B14R1.1865 COC1=CC=C(N=C1C=CC(C)C)C m_271570__17312298__14686358 [0,1,0,0,0,1|1,0,1]=4 916 B14R1.1865 COC1=CC=C(N=C1C=CC(C)C)F m_271570__17312298__21747956 [0,1,0,0,0,1|1,0,1]=4 917 B14R1.1865 COC1=CC=C(N=C1CNC(C)C)Br m_270004__23845338__14643886 [0,1,0,0,0,1|1,0,0]=3 918 B14R1.1865 COC1=CC=C(N=C1CSC(C)C)C m_62__2390328__15113214 [0,1,0,0,0,1|1,0,0]=3 919 B14R1.1865 COC1=CC=C(N=C1NCC(C)C)Br m_27__61318__22153526 [0,1,0,0,0,1|1,0,0]=3 920 B14R1.1865 COC1=CC=C(N=C1NCC(C)C)C m_270004__8298768__8127718 [0,1,0,0,0,1|1,0,0]=3 921 B14R1.1865 COC1=CC=C(N=C1NCC(C)F)Br m_27__13461110__22153526 [0,1,0,0,0,1|2,0,0]=4 922 B14R1.1865 COC1=CC=C(N=C1NCC(C)O)Br m_27__61393__22153526 [0,1,0,0,0,1|2,0,0]=4 923 B14R1.1865 COC1=CN=C(N=C1NCC(C)C)C m_270004__25071284__8127718 [0,1,0,0,0,1|2,0,0]=4 924 B14R1.1865 COC1=NC=C(C=C1C=CC(C)C)Cl m_271570__17312298__21751418 [0,1,0,0,0,1|1,0,1]=4 925 B14R1.1865 COC1=NC=C(C=C1C=CC(C)C)F m_271570__17312298__21751428 [0,1,0,0,0,1|1,0,1]=4 926 B14R1.1865 COC1=NC=C(C=C1C=CC(C)C)N m_271570__17312298__21751046 [0,1,0,0,0,1|1,0,1]=4 927 B14R1.1865 COC1=NC=C(C=C1C=CC(C)C)S m_271570__17312298__20004990 [0,1,0,0,0,1|1,0,1]=4 928 B14R1.1865 COC1=NC=C(C=C1CNC(C)C)Br m_269862__12221026__7204804 [0,1,0,0,0,1|1,0,0]=3 929 B14R1.1865 COC1=NC=C(C=C1CNC(C)C)C m_270004__23845338__24720404 [0,1,0,0,0,1|1,0,0]=3 930 B14R1.1865 COC1=NC=C(C=C1CNC(C)C)Cl m_270004__23845338__24714702 [0,1,0,0,0,1|1,0,0]=3 931 B14R1.1865 COC1=NC=C(C=C1CSC(C)C)Br m_62__2390328__12121658 [0,1,0,0,0,1|1,0,0]=3 932 B14R1.1865 COC1=NC=C(C=C1NCC(C)C)Br m_207__7592348__121216 [0,1,0,0,0,1|1,0,0]=3 933 B14R1.1865 COC1=NC=C(C=C1NCC(C)C)C m_270004__8299424__8127718 [0,1,0,0,0,1|1,0,0]=3 934 B14R1.1865 COC1=NC=C(C=C1SCC(C)C)Br m_7__20080774__1010132 [0,1,0,0,0,1|1,0,0]=3 935 B14R1.1865 COC1=NC=C(C=C1SCC(C)F)Br m_7__20080774__16970746 [0,1,0,0,0,1|2,0,0]=4 936 B14R1.1865 COC1=NC=C(C=C1SCC(C)O)Br m_7__20080774__10902704 [0,1,0,0,0,1|2,0,0]=4 937 B14R1.1865 COC1=NN=C(C=C1NCC(C)C)Cl m_270004__25290156__8127718 [0,1,0,0,0,1|2,0,0]=4 938 B14R1.2172 CCC1=NC=CC(=C1NCC(C)C)C m_270004__25070284__8127718 [0,1,0,0,0,1|2,0,0]=4 939 B14R1.2172 COC1=CC=CC(=C1CNC(C)C)Br m_270004__23845338__24715320 [0,1,0,0,0,1|2,0,0]=4 940 B14R1.2172 COC1=CC=CC(=C1CNC(C)C)Cl m_269862__9277762__7204804 [0,1,0,0,0,1|2,0,0]=4 941 B14R1.2172 COC1=CC=CC(=C1CNC(C)C)F m_269862__24564820__7204804 [0,1,0,0,0,1|2,0,0]=4 942 B14R1.2172 COC1=CC=CC(=C1CNC(C)C)I m_270004__23845338__24715534 [0,1,0,0,0,1|2,0,0]=4 943 B14R1.2172 COC1=CC=CC(=C1CNC(C)C)O m_270004__23845338__7548618 [0,1,0,0,0,1|2,0,0]=4 944 B14R1.2172 COC1=CC=CC(=C1CSC(C)C)F m_62__2390328__16613668 [0,1,0,0,0,1|2,0,0]=4 945 B14R1.2172 COC1=CC=CC(=C1NCC(C)C)Br m_38__24418010__6579052 [0,1,0,0,0,1|2,0,0]=4 946 B14R1.2172 COC1=CC=CC(=C1NCC(C)C)C m_38__9396902__6579052 [0,1,0,0,0,1|2,0,0]=4 947 B14R1.2172 COC1=CC=CC(=C1NCC(C)C)Cl m_38__12638802__6579052 [0,1,0,0,0,1|2,0,0]=4 948 B14R1.2172 COC1=CC=CC(=C1NCC(C)C)F m_38__8961924__6579052 [0,1,0,0,0,1|2,0,0]=4 949 B14R1.2172 COC1=CC=CC(=C1OCC(C)C)Br m_7__22849416__1010132 [0,1,0,0,0,1|2,0,0]=4 950 B14R1.2172 COC1=CC=CC(=C1OCC(C)C)C m_34__21432136__6894142 [0,1,0,0,0,1|2,0,0]=4 951 B14R1.2172 COC1=CC=CC(=C1OCC(C)C)Cl m_7__22849628__1010132 [0,1,0,0,0,1|2,0,0]=4 952 B14R1.2172 COC1=CC=CC(=C1OCC(C)C)F m_7__22849594__1010132 [0,1,0,0,0,1|2,0,0]=4 953 B14R1.2172 COC1=CC=CC(=C1SCC(C)C)Br m_7__16904098__1010132 [0,1,0,0,0,1|2,0,0]=4 954 B14R1.2172 COC1=CC=CC(=C1SCC(C)C)Cl m_7__16645968__1010132 [0,1,0,0,0,1|2,0,0]=4 955 B14R1.2172 COC1=CC=CC(=C1SCC(C)C)F m_7__22987646__1010132 [0,1,0,0,0,1|2,0,0]=4 956 B14R1.2172 COC1=NC=CC(=C1CNC(C)C)Br m_270004__23845338__14765766 [0,1,0,0,0,1|1,0,0]=3 957 B14R1.2172 COC1=NC=CC(=C1CNC(C)C)C m_269862__17598988__7204804 [0,1,0,0,0,1|1,0,0]=3 958 B14R1.2172 COC1=NC=CC(=C1NCC(C)C)C m_270004__25071004__8127718 [0,1,0,0,0,1|1,0,0]=3 959 B14R1.2172 COC1=NC=NC(=C1NCC(C)C)C m_270004__25113464__8127718 [0,1,0,0,0,1|2,0,0]=4 960 B14R1.3135 C#CC1=NC=CN=C1NC(C)C(C)C m_38__23815264__12110458 [0,1,0,0,0,1|1,0,1]=4 961 B14R1.3135 CC(C)C(C)SC1=NC=CN=C1C#N m_27__6286944__2745374 [0,1,0,0,0,1|2,0,0]=4 962 B14R1.3135 CCC1=CC=CN=C1CN(C)C(C)C m_270004__8128012__24720556 [0,1,0,0,0,1|2,0,0]=4 963 B14R1.3135 CCC1=NC=CC=C1CN(C)C(C)C m_270004__8128012__24720540 [0,1,0,0,0,1|2,0,0]=4 964 B14R1.3135 CCC1=NC=CC=C1NC(C)C(C)C m_270004__14060182__8334612 [0,1,0,0,0,1|2,0,0]=4 965 B14R1.3135 CNC1=NC=CC=C1CN(C)C(C)C m_270004__8128012__24721940 [0,1,0,0,0,1|2,0,0]=4 966 B14R1.3135 COC1=CC=CC=C1CN(C)C(C)C m_270004__8128012__7547528 [0,1,0,0,0,1|2,0,0]=4 967 B14R1.3135 COC1=CC=CC=C1NC(C)C(C)C m_269862__8315672__7200270 [0,1,0,0,0,1|2,0,0]=4 968 B14R1.3135 COC1=CC=CC=C1OC(C)C(C)C m_7__26874__9435972 [0,1,0,0,0,1|2,0,0]=4 969 B14R1.3135 COC1=CC=CC=C1SC(C)C(C)C m_7__2162778__9435972 [0,1,0,0,0,1|2,0,0]=4 970 B14R1.3135 COC1=CC=CN=C1CC(=O)N(C)C m_1626__24364878__22122982 [0,1,0,0,0,1|2,0,0]=4 971 B14R1.3135 COC1=CC=CN=C1CN(C)C(C)C m_270004__8128012__18323684 [0,1,0,0,0,1|1,0,0]=3 972 B14R1.3135 COC1=CC=CN=C1NC(=O)C(C)C m_270062__7609866__13861800 [0,1,0,0,0,1|1,0,1]=4 973 B14R1.3135 COC1=CC=CN=C1SC(C)C(C)C m_7__15368240__9435972 [0,1,0,0,0,1|1,0,0]=3 974 B14R1.3135 COC1=CC=CN=C1SC(C)C(C)O m_7__15368240__12202248 [0,1,0,0,0,1|2,0,0]=4 975 B14R1.3135 COC1=NC=CC=C1CC(=O)N(C)C m_1626__24364878__22130474 [0,1,0,0,0,1|2,0,0]=4 976 B14R1.3135 COC1=NC=CC=C1CN(C)C(C)C m_270004__8128012__11948388 [0,1,0,0,0,1|1,0,0]=3 977 B14R1.3135 COC1=NC=CC=C1NC(=O)C(C)C m_270062__7602436__13861800 [0,1,0,0,0,1|1,0,1]=4 978 B14R1.3135 COC1=NC=CC=C1NC(C)C(C)C m_270004__8299388__8334612 [0,1,0,0,0,1|1,0,0]=3 979 B14R1.3135 COC1=NC=CC=C1OC(=O)C(C)C m_276436__23172564__14088334 [0,1,0,0,0,1|1,0,1]=4 980 B14R1.3135 COC1=NC=CC=C1OC(C)C(C)C m_7__22984962__9435972 [0,1,0,0,0,1|1,0,0]=3 981 B14R1.3135 COC1=NC=CC=C1OC(C)C(C)O m_7__22984962__12202248 [0,1,0,0,0,1|2,0,0]=4 982 B14R1.3135 COC1=NC=CC=C1SC(C)C(C)C m_7__22987990__9435972 [0,1,0,0,0,1|1,0,0]=3 983 B14R1.3135 COC1=NC=CC=C1SC(C)C(C)O m_7__22987990__12202248 [0,1,0,0,0,1|2,0,0]=4 984 B14R1.3135 COC1=NC=CN=C1CN(C)C(C)C m_270004__8128012__10427894 [0,1,0,0,0,1|0,0,0]=2 985 B14R1.3135 COC1=NC=CN=C1NC(=O)C(C)C m_11__22176356__53470 [0,1,0,0,0,1|0,0,1]=3 986 B14R1.3135 COC1=NC=NC=C1NC(C)C(C)C m_270004__25069492__8334612 [0,1,0,0,0,1|2,0,0]=4 987 B14R1.3135 CSC1=NC=CC=C1NC(C)C(C)C m_270004__25071934__8334612 [0,1,0,0,0,1|1,1,0]=4 988 B14R1.4522 CC(=O)C1=CC=CN=C1NCC(C)C m_27__61318__22326974 [0,1,0,0,0,1|2,0,0]=4 989 B14R1.4522 CC(C)C=CC1=NC=CN=C1N(C)C m_271570__17312298__21546854 [0,1,0,0,0,1|1,0,1]=4 990 B14R1.4522 CC(C)CNC1=CC=CN=C1C(C)C m_207__12889160__121216 [0,1,0,0,0,1|2,0,0]=4 991 B14R1.4522 CC(C)CNC1=NC=CC=C1C(C)C m_270004__25069396__8127718 [0,1,0,0,0,1|2,0,0]=4 992 B14R1.4522 CC(C)CNC1=NC=CC=C1N(C)C m_270004__25069300__8127718 [0,1,0,0,0,1|2,0,0]=4 993 B14R1.4522 CC(C)CNC1=NC=CC=C1[C@@H](C)O m_27__61318__17781768 [0,1,0,0,0,1|2,0,0]=4 994 B14R1.4522 CC(C)CNC1=NC=CN=C1C(=O)O m_270344__11656092__13455290 [0,1,0,0,0,1|2,0,0]=4 995 B14R1.4522 CC(C)CNC1=NC=CN=C1C(C)C m_270004__25069352__8127718 [0,1,0,0,0,1|1,0,0]=3 996 B14R1.4522 CC(C)CNC1=NC=CN=C1N(C)C m_27__61318__8851590 [0,1,0,0,0,1|1,0,0]=3 997 B14R1.4522 CC(C)COC1=CC=CN=C1N(C)C m_7__22985854__1010132 [0,1,0,0,0,1|2,0,0]=4 998 B14R1.4522 CC(C)COC1=NC=CN=C1C(=O)N m_34__16604340__6894142 [0,1,0,0,0,1|2,0,0]=4 999 B14R1.4522 CC(C)CSC1=CC=CN=C1N(C)C m_7__22987992__1010132 [0,1,0,0,0,1|2,0,0]=4 1000 B14R1.4522 CC(C)NCC1=CC=CN=C1C(C)C m_270004__23845338__24720600 [0,1,0,0,0,1|2,0,0]=4 1001 B14R1.4522 CC(C)NCC1=CC=CN=C1N(C)C m_269862__24515420__7204804 [0,1,0,0,0,1|2,0,0]=4 1002 B14R1.4522 CC(F)CNC1=NC=CN=C1N(C)C m_27__13461110__8851590 [0,1,0,0,0,1|2,0,0]=4 1003 B14R1.4522 CC(O)CNC1=NC=CN=C1N(C)C m_27__61393__8851590 [0,1,0,0,0,1|2,0,0]=4 1004 B14R1.368 COC1=NC(=CC(=C1CN(C)C)C)C m_2230__12157286__2463448 [0,2,0,0,0,0|2,0,0]=4 1005 B14R1.1592 COC1=NC(=CN=C1C(=O)N(C)C)C m_22__387202__24537250 [0,2,0,0,0,0|1,0,1]=4 1006 B14R1.3417 CCC(C)OC1=CC=C(N=C1OC)C m_7__22985622__14247828 [0,2,0,0,0,0|2,0,0]=4 1007 B14R1.3417 CCN(C)CC1=CC=C(N=C1OC)Cl m_270004__24163902__24715004 [0,2,0,0,0,0|2,0,0]=4 1008 B14R1.3417 COC1=CC(=CN=C1NC(C)CO)Br m_27__308690__22153524 [0,2,0,0,0,0|2,0,0]=4 1009 B14R1.3417 COC1=CC(=CN=C1NC(C)CO)Cl m_27__308690__22153522 [0,2,0,0,0,0|2,0,0]=4 1010 B14R1.3417 COC1=NC(=CC=C1OC(C)CO)C m_7__22985622__17610454 [0,2,0,0,0,0|2,0,0]=4 1011 B14R1.95 CCN(C)C(=O)C1=NC=CN=C1OC m_1626__22018992__23857380 [0,2,0,0,0,0|1,0,1]=4 1012 B14R1.95 COC1=NC=CN=C1C(=O)N(C)OC m_22__300398__23857374 [0,2,0,0,0,0|1,0,1]=4 1013 B14R1.839 C=C(C1=CC=CN=C1OC)C(C)(C)C m_271570__20276026__18352954 [0,2,0,0,0,0|1,0,1]=4 1014 B14R1.839 C=C(C1=NC=CC=C1OC)C(C)(C)C m_271570__20276026__16463414 [0,2,0,0,0,0|1,0,1]=4 1015 B14R1.1711 COC1=CC=CN=C1S(=O)(=O)C(C)C m_2714__15368244__11944520 [0,2,0,0,0,0|2,0,0]=4 1016 B14R1.483 CCCC1=NC=CN=C1NC(C)CO m_27__308690__12130480 [0,2,0,0,0,0|2,0,0]=4 1017 B14R1.483 CCCC1=NC=CN=C1N[C@H](C)CN m_270166__16815602__16819124 [0,2,0,0,0,0|2,0,0]=4 1018 B14R1.483 CCNC1=NC=CN=C1NC(C)CO m_27__308690__9016274 [0,2,0,0,0,0|2,0,0]=4 1019 B14R1.483 CCNC1=NC=CN=C1OC(C)CC m_27__61262__12299182 [0,2,0,0,0,0|2,0,0]=4 1020 B14R1.483 CCOC1=NC=CN=C1NC(C)CO m_27__308690__8261144 [0,2,0,0,0,0|1,0,0]=3 1021 B14R1.483 CCOC1=NC=CN=C1N[C@H](C)CN m_270166__16815602__16817204 [0,2,0,0,0,0|1,0,0]=3 1022 B14R1.965 C#CCC(C)NC1=NC=CC=C1OC m_27__16647398__12218954 [0,2,0,0,0,0|2,0,0]=4 1023 B14R1.965 C#CCC(C)OC1=CC=CN=C1OC m_34__8616224__23842154 [0,2,0,0,0,0|2,0,0]=4 1024 B14R1.965 C#CCC(C)SC1=CC=CN=C1OC m_7__22987990__23842164 [0,2,0,0,0,0|2,0,0]=4 1025 B14R1.965 C#CCC(C)SC1=NC=CC=C1OC m_7__15368240__23842164 [0,2,0,0,0,0|2,0,0]=4 1026 B14R1.965 C=CCC(C)NC1=CC=CN=C1OC m_270004__8299388__24719128 [0,2,0,0,0,0|2,0,0]=4 1027 B14R1.965 C=CCC(C)OC1=CC=CN=C1OC m_7__22984962__12913704 [0,2,0,0,0,0|2,0,0]=4 1028 B14R1.965 C=CCC(C)SC1=CC=CN=C1OC m_7__22987990__12913704 [0,2,0,0,0,0|2,0,0]=4 1029 B14R1.965 C=CCC(C)SC1=NC=CC=C1OC m_7__15368240__12913704 [0,2,0,0,0,0|2,0,0]=4 1030 B14R1.965 C=CCN(C)CC1=CC=CN=C1OC m_2230__9044904__9436012 [0,2,0,0,0,0|2,0,0]=4 1031 B14R1.965 C=CCN(C)CC1=NC=CC=C1OC m_2230__9044904__15746984 [0,2,0,0,0,0|2,0,0]=4 1032 B14R1.965 C=CCN(C)CC1=NC=CN=C1OC m_270004__9044914__10427894 [0,2,0,0,0,0|1,0,0]=3 1033 B14R1.965 CC#CC(C)OC1=CC=CN=C1OC m_34__8616224__22381650 [0,2,0,0,0,0|2,0,0]=4 1034 B14R1.965 CC#CC(C)SC1=CC=CN=C1OC m_7__22987990__22381648 [0,2,0,0,0,0|2,0,0]=4 1035 B14R1.965 CC#CC(C)SC1=NC=CC=C1OC m_7__15368240__22381648 [0,2,0,0,0,0|2,0,0]=4 1036 B14R1.965 CCCC(C)OC1=CC=CN=C1OC m_7__22984962__6493860 [0,2,0,0,0,0|2,0,0]=4 1037 B14R1.965 CCCC(C)SC1=CC=CN=C1OC m_7__22987990__6493860 [0,2,0,0,0,0|2,0,0]=4 1038 B14R1.965 CCCC(C)SC1=NC=CC=C1OC m_7__15368240__6493860 [0,2,0,0,0,0|2,0,0]=4 1039 B14R1.965 CCCN(C)CC1=CC=CN=C1OC m_2230__2261920__9436012 [0,2,0,0,0,0|2,0,0]=4 1040 B14R1.965 CCCN(C)CC1=NC=CC=C1OC m_2230__2261920__15746984 [0,2,0,0,0,0|2,0,0]=4 1041 B14R1.965 CCCN(C)CC1=NC=CN=C1OC m_270004__8134916__10427894 [0,2,0,0,0,0|1,0,0]=3 1042 B14R1.965 CCNC(C)CC1=CC=CC=C1OC m_269862__7865270__7200422 [0,2,0,0,0,0|2,0,0]=4 1043 B14R1.965 CCN[C@@H](C)CC1=CC=CC=C1OC m_270004__9579724__24715004 [0,2,0,0,0,0|2,0,0]=4 1044 B14R1.965 CCOC(C)OC1=CC=CN=C1OC m_7__22984962__13420948 [0,2,0,0,0,0|2,0,0]=4 1045 B14R1.965 CCOC(C)SC1=CC=CN=C1OC m_7__22987990__13420948 [0,2,0,0,0,0|2,0,0]=4 1046 B14R1.965 CCOC(C)SC1=NC=CC=C1OC m_7__15368240__13420948 [0,2,0,0,0,0|2,0,0]=4 1047 B14R1.965 CNCC(C)NC1=NC=CC=C1OC m_270166__16815890__16819100 [0,2,0,0,0,0|2,0,0]=4 1048 B14R1.965 COC1=CC=CN=C1CN(C)CC#N m_2230__3014482__15746984 [0,2,0,0,0,0|2,0,0]=4 1049 B14R1.965 COC1=CC=CN=C1CN(C)CCN m_271302__10894794__18323692 [0,2,0,0,0,0|2,0,0]=4 1050 B14R1.965 COC1=CC=CN=C1CN(C)CCO m_2230__679202__15746984 [0,2,0,0,0,0|2,0,0]=4 1051 B14R1.965 COC1=CC=CN=C1NC(C)CCN m_270166__16815572__16819100 [0,2,0,0,0,0|2,0,0]=4 1052 B14R1.965 COC1=CC=CN=C1NC(C)CCO m_27__5349868__12218954 [0,2,0,0,0,0|2,0,0]=4 1053 B14R1.965 COC1=CC=CN=C1SC(C)CCO m_7__15368240__14772890 [0,2,0,0,0,0|2,0,0]=4 1054 B14R1.965 COC1=NC=CC=C1CN(C)CC#N m_2230__20764904__680932 [0,2,0,0,0,0|2,0,0]=4 1055 B14R1.965 COC1=NC=CC=C1CN(C)CCF m_2230__20764904__22320836 [0,2,0,0,0,0|2,0,0]=4 1056 B14R1.965 COC1=NC=CC=C1CN(C)CCN m_269982__22516734__14439794 [0,2,0,0,0,0|2,0,0]=4 1057 B14R1.965 COC1=NC=CC=C1CN(C)CCO m_2230__679202__9436012 [0,2,0,0,0,0|2,0,0]=4 1058 B14R1.965 COC1=NC=CC=C1NC(C)CCO m_270004__8299388__13397824 [0,2,0,0,0,0|2,0,0]=4 1059 B14R1.965 COC1=NC=CC=C1NC(C)CSC m_270004__8299388__15781876 [0,2,0,0,0,0|2,0,0]=4 1060 B14R1.965 COC1=NC=CC=C1OC(C)CCO m_7__22984962__14772890 [0,2,0,0,0,0|2,0,0]=4 1061 B14R1.965 COC1=NC=CC=C1SC(C)CCO m_7__22987990__14772890 [0,2,0,0,0,0|2,0,0]=4 1062 B14R1.965 COC1=NC=CN=C1CN(C)CCO m_270004__8127950__10427894 [0,2,0,0,0,0|1,0,0]=3 1063 B14R1.965 COCC(C)NC1=CC=CN=C1OC m_270004__8299388__8844972 [0,2,0,0,0,0|2,0,0]=4 1064 B14R1.965 COCC(C)OC1=CC=CN=C1OC m_7__22984962__6339266 [0,2,0,0,0,0|2,0,0]=4 1065 B14R1.965 COCC(C)SC1=CC=CN=C1OC m_7__22987990__6339266 [0,2,0,0,0,0|2,0,0]=4 1066 B14R1.965 COCC(C)SC1=NC=CC=C1OC m_7__15368240__6339266 [0,2,0,0,0,0|2,0,0]=4 1067 B14R1.2000 CNC(C)(C)CC1=CC=CC=C1OC m_2230__22393614__2463448 [0,2,0,0,0,0|2,0,0]=4 1068 B14R1.3136 CCC(CC)NC1=CC=CN=C1OC m_270004__8299388__8798310 [0,2,0,0,0,0|2,0,0]=4 1069 B14R1.3136 CCC(CC)NC1=NC=CC=C1OC m_27__61353__12218954 [0,2,0,0,0,0|2,0,0]=4 1070 B14R1.3136 CCC(CC)OC1=CC=CN=C1OC m_7__22984962__8740112 [0,2,0,0,0,0|2,0,0]=4 1071 B14R1.3136 CCC(CC)SC1=CC=CN=C1OC m_7__22987990__8740112 [0,2,0,0,0,0|2,0,0]=4 1072 B14R1.3136 CCC(CC)SC1=NC=CC=C1OC m_7__15368240__8740112 [0,2,0,0,0,0|2,0,0]=4 1073 B14R1.3136 CCC(CN)NC1=NC=CC=C1OC m_270166__21476924__16819100 [0,2,0,0,0,0|2,0,0]=4 1074 B14R1.3136 CCC(CO)OC1=CC=CN=C1OC m_7__22984962__12622184 [0,2,0,0,0,0|2,0,0]=4 1075 B14R1.3136 CCC(CO)SC1=CC=CN=C1OC m_7__22987990__12622184 [0,2,0,0,0,0|2,0,0]=4 1076 B14R1.3136 CCC(CO)SC1=NC=CC=C1OC m_7__15368240__12622184 [0,2,0,0,0,0|2,0,0]=4 1077 B14R1.3136 CCN(CC)CC1=CC=CN=C1OC m_2230__678602__9436012 [0,2,0,0,0,0|2,0,0]=4 1078 B14R1.3136 CCN(CC)CC1=NC=CC=C1OC m_2230__678602__15746984 [0,2,0,0,0,0|2,0,0]=4 1079 B14R1.3136 CCN(CC)CC1=NC=CN=C1OC m_270004__8127954__10427894 [0,2,0,0,0,0|1,0,0]=3 1080 B14R1.3136 CC[C@@H](CO)NC1=NC=CC=C1OC m_27__9108238__12218954 [0,2,0,0,0,0|2,0,0]=4 1081 B14R1.3136 COC1=CC=CN=C1SC(CF)CF m_7__15368240__17626614 [0,2,0,0,0,0|2,0,0]=4 1082 B14R1.3136 COC1=NC=CC=C1OC(CF)CF m_7__22984962__17626614 [0,2,0,0,0,0|2,0,0]=4 1083 B14R1.3136 COC1=NC=CC=C1SC(CF)CF m_7__22987990__17626614 [0,2,0,0,0,0|2,0,0]=4 1084 B14R1.3279 CCC(C)SC1=CC(=CN=C1OC)Br m_7__20080774__14247828 [0,2,0,0,0,0|2,0,0]=4 1085 B14R1.3279 COC1=CC=C(N=C1CN(C)OC)C m_2230__679026__22994170 [0,2,0,0,0,0|2,0,0]=4 1086 B14R1.3279 COC1=CC=C(N=C1NC(C)CO)Br m_27__308690__22153526 [0,2,0,0,0,0|2,0,0]=4 1087 B14R1.3279 COC1=NC=C(C=C1CN(C)OC)Br m_2230__679026__12121670 [0,2,0,0,0,0|2,0,0]=4 1088 B14R1.3279 COC1=NC=C(C=C1CN(C)OC)Cl m_2230__679026__22993868 [0,2,0,0,0,0|2,0,0]=4 1089 B14R1.3279 COC1=NC=C(C=C1SC(C)CO)Br m_7__20080774__17610454 [0,2,0,0,0,0|2,0,0]=4 1090 B14R1.3302 CC(CO)NC1=NC=CN=C1N(C)C m_27__308690__8851590 [0,2,0,0,0,0|2,0,0]=4 1091 B14R1.3995 COC1=C(C=CN=C1NC(C)CO)Br m_27__308690__13418004 [0,2,0,0,0,0|2,0,0]=4 1092 B14R1.262 CCOC1=CC=CN=C1OC(C)(C)C m_7__22984286__5047 [0,2,0,0,0,0|2,0,0]=4 1093 B14R1.744 C=C(CC)C1=CC=CN=C1CC(C)C m_271570__22840458__16969488 [0,2,0,0,0,0|2,0,0]=4 1094 B14R1.744 CC=C(C)C1=CC=CN=C1CC(C)C m_271570__17541496__16969488 [0,2,0,0,0,0|2,0,0]=4 1095 B14R1.744 COC(=O)C1=CC=CC=C1CC(C)C m_276436__14076652__14101378 [0,2,0,0,0,0|2,0,0]=4 1096 B14R1.744 COC(=O)C1=CC=CN=C1NC(C)C m_1458__5902210__483916 [0,2,0,0,0,0|2,0,0]=4 1097 B14R1.744 COC(=O)C1=CC=CN=C1OC(C)C m_276436__14076652__14102508 [0,2,0,0,0,0|2,0,0]=4 1098 B14R1.744 COC(=O)C1=CC=CN=C1SC(C)C m_7__291188__5048 [0,2,0,0,0,0|2,0,0]=4 1099 B14R1.744 COC(=O)C1=NC=CC=C1OC(C)C m_7__22986464__5048 [0,2,0,0,0,0|2,0,0]=4 1100 B14R1.744 COC(=O)C1=NC=CN=C1C=C(C)C m_271570__13019924__21463564 [0,2,0,0,0,0|0,0,2]=4 1101 B14R1.744 COC(=O)C1=NC=CN=C1NC(C)C m_27__3115962__11618550 [0,2,0,0,0,0|1,0,0]=3 1102 B14R1.744 CON(C)C1=NC=CN=C1OC(C)C m_27__62024__8370460 [0,2,0,0,0,0|1,0,0]=3 1103 B14R1.786 C#CCOC1=CC=CN=C1OC(C)C m_7__22985268__6266 [0,2,0,0,0,0|2,0,0]=4 1104 B14R1.786 C=CCNC1=NC=CN=C1OC(C)C m_27__61275__8370460 [0,2,0,0,0,0|2,0,0]=4 1105 B14R1.786 C=CCOC1=CC=CN=C1OC(C)C m_34__8627270__7343510 [0,2,0,0,0,0|2,0,0]=4 1106 B14R1.786 CC(C)CC1=NC=CC=C1C=CCO m_271570__22334694__16969488 [0,2,0,0,0,0|2,0,0]=4 1107 B14R1.786 CC(C)OC1=NC=CC=C1OCC#N m_7__22985268__5055 [0,2,0,0,0,0|2,0,0]=4 1108 B14R1.786 CC(C)OC1=NC=CC=C1OCCF m_34__8627270__22320830 [0,2,0,0,0,0|2,0,0]=4 1109 B14R1.786 CC(C)OC1=NC=CC=C1OCCO m_7__22985268__102708 [0,2,0,0,0,0|2,0,0]=4 1110 B14R1.786 CC(C)OC1=NC=CN=C1NCCN m_270166__16815364__16817250 [0,2,0,0,0,0|2,0,0]=4 1111 B14R1.786 CC(C)OC1=NC=CN=C1NCCO m_27__61206__8370460 [0,2,0,0,0,0|2,0,0]=4 1112 B14R1.786 CC(C)OC1=NC=CN=C1SCCN m_27__20871280__8370460 [0,2,0,0,0,0|1,1,0]=4 1113 B14R1.786 CCCOC1=CC=CN=C1OC(C)C m_34__8627270__13271108 [0,2,0,0,0,0|2,0,0]=4 1114 B14R1.786 COCOC1=CC=CN=C1OC(C)C m_7__22985268__6762 [0,2,0,0,0,0|2,0,0]=4 1115 B14R1.786 CON=CC1=CC=CC=C1CC(C)C m_4__461206__13946086 [0,2,0,0,0,0|2,0,0]=4 1116 B14R1.786 CSCOC1=CC=CN=C1OC(C)C m_7__22985268__10542644 [0,2,0,0,0,0|2,0,0]=4 1117 B14R1.814 CC(=CC1=CC=CN=C1CC(C)C)C m_271570__13019924__16969488 [0,2,0,0,0,0|2,0,0]=4 1118 B14R1.814 CC(=O)NC1=CC=CN=C1CC(C)C m_270062__16980940__15585492 [0,2,0,0,0,0|2,0,0]=4 1119 B14R1.814 CC(=O)NC1=NC=CN=C1OC(C)C m_270062__21870726__15585492 [0,2,0,0,0,0|2,0,0]=4 1120 B14R1.814 CC(C)NC1=NC=CN=C1OC(C)C m_27__3115962__8370460 [0,2,0,0,0,0|1,0,0]=3 1121 B14R1.814 CC(C)OC1=CC=CN=C1OC(C)C m_7__22985268__5048 [0,2,0,0,0,0|2,0,0]=4 1122 B14R1.2327 COC1=NC=C(C(=C1SC(C)C)C)Br m_7__20629136__5048 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.368 COC(=O)C1=NC=CN1C(C)C m_7__23726950__5048 [0,0,1,1,0,0|2,0,0]=4 1124 B12R1.255 CC(C)CON=CC1=COC=N1 m_4__7659376__10542452 [0,0,1,1,0,0|1,0,1]=4 1125 B12R2.24 CN1CCC2=NC=CN=C2C1 m_2230__24202658__2463448 [1,0,0,1,0,0|2,0,0]=4 1126 B12R2.315 COC1=CC=CC2=C1CCC2 m_34__11566052__7119626 [1,0,0,1,0,0|2,0,0]=4 1127 B12R2.2048 CCC1=CC=CN=C1C2CC2 m_271570__11830330__13419880 [1,0,0,1,0,0|2,0,0]=4 1128 B12R2.2048 COC1=CC=CN=C1C2CC2 m_271570__11830330__16463414 [1,0,0,1,0,0|1,0,0]=3 1129 B12R2.2048 COC1=NC=CC=C1C2CC2 m_271570__11830330__18352954 [1,0,0,1,0,0|1,0,0]=3 1130 B12R2.2048 COC1=NC=NC=C1C2CC2 m_271570__11830330__16463916 [1,0,0,1,0,0|2,0,0]=4 1131 B12R2.2048 CSC1=CC=CN=C1C2CC2 m_271570__11830330__21747776 [1,0,0,1,0,0|1,1,0]=4 1132 B12R2.2048 CSC1=NC=CC=C1C2CC2 m_271570__11830330__11944124 [1,0,0,1,0,0|1,1,0]=4 1133 B12R2.115 C=C1CC1C2=NC=CN=C2C m_271570__24797904__13972798 [1,0,0,1,0,0|0,0,2]=4 1134 B12R2.115 C=C1CC1C2=NC=CN=C2O m_271570__24797904__16969462 [1,0,0,1,0,0|0,0,2]=4 1135 B12R2.115 CC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11652070 [1,0,0,1,0,0|2,0,0]=4 1136 B12R2.115 CC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__11652192 [1,0,0,1,0,0|1,0,0]=3 1137 B12R2.115 CC1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__13358636 [1,0,0,1,0,0|1,0,0]=3 1138 B12R2.115 CC1=NC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__13972798 [1,0,0,1,0,0|0,0,0]=2 1139 B12R2.115 CC1=NC=NC=C1[C@@H]2C[C@H]2C m_271570__24798142__14032502 [1,0,0,1,0,0|2,0,0]=4 1140 B12R2.115 C[C@H]1C[C@@H]1C2=CC=CC=C2O m_271570__24798142__12089800 [1,0,0,1,0,0|2,0,0]=4 1141 B12R2.115 C[C@H]1C[C@@H]1C2=CC=CN=C2F m_271570__24798142__21750878 [1,0,0,1,0,0|2,0,0]=4 1142 B12R2.115 C[C@H]1C[C@@H]1C2=CC=CN=C2N m_271570__24798142__12089812 [1,0,0,1,0,0|2,0,0]=4 1143 B12R2.115 C[C@H]1C[C@@H]1C2=CN=CN=C2O m_271570__24798142__13837792 [1,0,0,1,0,0|2,0,0]=4 1144 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CC=C2Br m_271570__24798142__24880924 [1,0,0,1,0,0|2,0,0]=4 1145 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CC=C2Cl m_271570__24798142__13024052 [1,0,0,1,0,0|2,0,0]=4 1146 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CC=C2F m_271570__24798142__13358642 [1,0,0,1,0,0|2,0,0]=4 1147 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CC=C2N m_271570__24798142__21604526 [1,0,0,1,0,0|2,0,0]=4 1148 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CC=C2O m_271570__24798142__13967786 [1,0,0,1,0,0|1,0,0]=3 1149 B12R2.115 C[C@H]1C[C@@H]1C2=NC=CN=C2O m_271570__24798142__16969462 [1,0,0,1,0,0|0,0,0]=2 1150 B12R2.225 CC1=CC=CN=C1SC2CC2 m_7__10211412__16761930 [1,0,0,1,0,0|2,0,0]=4 1151 B12R2.225 CC1=NC=CC=C1OC2CC2 m_7__22985646__16761930 [1,0,0,1,0,0|2,0,0]=4 1152 B12R2.225 FC1=NC=CN=C1NC2CC2 m_88__23103788__23179394 [1,0,0,1,0,0|2,0,0]=4 1153 B12R2.225 NC1=NC=CN=C1SC2CC2 m_7__9358712__16761930 [1,0,0,1,0,0|2,0,0]=4 1154 B12R2.225 OC1=CC=CN=C1SC2CC2 m_7__13775788__16761930 [1,0,0,1,0,0|2,0,0]=4 1155 B12R2.2028 CC1CN(C2=CC=CN=C12)C m_2230__16913548__2463448 [0,0,0,1,1,0|2,0,0]=4 1156 B12R2.55 CCC1=C(N=CO1)[C@@H]2C[C@H]2C m_271570__24798142__21744050 [0,0,0,1,1,0|2,0,0]=4 1157 B12R2.55 CCC1=C(OC=N1)[C@@H]2C[C@H]2C m_271570__24798142__24859414 [0,0,0,1,1,0|2,0,0]=4 1158 B12R2.55 CCC1=C(SC=N1)[C@@H]2C[C@H]2C m_271570__24798142__15480368 [0,0,0,1,1,0|2,0,0]=4 1159 B12R2.55 CCN1C=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__16915716 [0,0,0,1,1,0|2,0,0]=4 1160 B12R2.55 CCN1N=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11651918 [0,0,0,1,1,0|2,0,0]=4 1161 B12R2.55 CCN1N=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__12621870 [0,0,0,1,1,0|2,0,0]=4 1162 B12R2.55 COC1=C(C=CS1)[C@@H]2C[C@H]2C m_271570__24798142__13286636 [0,0,0,1,1,0|1,0,0]=3 1163 B12R2.55 COC1=C(SC=C1)[C@@H]2C[C@H]2C m_271570__24798142__24860114 [0,0,0,1,1,0|1,0,0]=3 1164 B12R2.55 COC1=C(SC=N1)[C@@H]2C[C@H]2C m_271570__24798142__14571866 [0,0,0,1,1,0|1,0,0]=3 1165 B12R2.55 COC1=NNC=C1[C@@H]2C[C@H]2C m_271570__24798142__16711526 [0,0,0,1,1,0|1,0,0]=3 1166 B12R2.55 COC1=NSC=C1[C@@H]2C[C@H]2C m_271570__24798142__11651900 [0,0,0,1,1,0|1,0,0]=3 1167 B12R2.324 CCC1=NC=CN1CC2CC2 m_34__7912536__7141814 [0,0,0,1,1,0|2,0,0]=4 1168 B12R2.324 CSC1=NC=CN1CC2CC2 m_34__7103804__7141814 [0,0,0,1,1,0|1,1,0]=4 1169 B14R2.2 CC(C)CN1C=NC2=NC=CN=C12 m_7__12297288__1010132 [0,0,0,1,0,1|1,0,1]=4 1170 B14R2.2 CC(C)NC1CCC2=CC=CN=C12 m_2230__22399576__680832 [0,0,0,1,0,1|2,0,0]=4 1171 B14R2.2 CC(C)NC1COC2=CC=CC=C12 m_2230__22398882__680832 [0,0,0,1,0,1|2,0,0]=4 1172 B14R2.781 CC(C)N1CCC2=CC=CN=C2C1 m_2230__13022250__680832 [0,0,0,1,0,1|2,0,0]=4 1173 B14R2.781 CC(C)N1CCC2=NC=CC=C2C1 m_2230__10427518__680832 [0,0,0,1,0,1|2,0,0]=4 1174 B14R2.781 CC(C)N1CCC2=NC=CN=C2C1 m_2230__24202658__680832 [0,0,0,1,0,1|1,0,0]=3 1175 B14R2.1073 COC1=NC=CC2=C1CCN(C2)C m_2230__22406014__2463448 [0,0,0,1,0,1|2,0,0]=4 1176 B14R2.1145 CC1CC1NC2=NC=CN=C2C#N m_27__3048358__2745374 [0,0,0,1,0,1|2,0,0]=4 1177 B14R2.1145 COC1=CC=CN=C1NC2CC2C m_27__3048358__12218954 [0,0,0,1,0,1|1,0,0]=3 1178 B14R2.1145 COC1=CC=CN=C1N[C@@H]2C[C@H]2C m_27__12364690__12218954 [0,0,0,1,0,1|1,0,0]=3 1179 B14R2.1145 COC1=CC=CN=C1N[C@@H]2C[C@H]2N m_270166__16815740__16819100 [0,0,0,1,0,1|2,0,0]=4 1180 B14R2.1145 COC1=CN=CN=C1NC2CC2C m_27__3048358__20650720 [0,0,0,1,0,1|2,0,0]=4 1181 B14R2.1145 COC1=CN=CN=C1N[C@@H]2C[C@H]2C m_27__12364690__20650720 [0,0,0,1,0,1|2,0,0]=4 1182 B14R2.1145 C[C@@H]1C[C@H]1NC2=NC=CN=C2C#N m_27__12343830__2745374 [0,0,0,1,0,1|2,0,0]=4 1183 B14R2.1145 C[C@H]1C[C@@H]1NC2=NC=CN=C2C#N m_27__12364690__2745374 [0,0,0,1,0,1|2,0,0]=4 1184 B14R2.2967 CC1CN(C1)C2=NC=CN=C2C#N m_27__8845196__2745374 [0,0,0,1,0,1|2,0,0]=4 1185 B14R2.2967 COC1=CC=CN=C1N2CC(C2)N m_270166__18191350__16819100 [0,0,0,1,0,1|2,0,0]=4 1186 B14R2.2967 COC1=CC=CN=C1N2CC(C2)O m_27__2990580__12218954 [0,0,0,1,0,1|2,0,0]=4 1187 B14R2.3362 CCC1=CC=CN=C1C2CC2(C)C m_271570__17642324__13419880 [0,0,0,1,0,1|2,0,0]=4 1188 B14R2.3362 COC1=CC=CC=C1C2CC2(C)C m_271570__17642324__11652092 [0,0,0,1,0,1|2,0,0]=4 1189 B14R2.3362 COC1=CC=CN=C1C2CC2(C)C m_271570__17642324__16463414 [0,0,0,1,0,1|1,0,0]=3 1190 B14R2.3362 COC1=NC=CC=C1C2CC2(C)C m_271570__17642324__18352954 [0,0,0,1,0,1|1,0,0]=3 1191 B14R2.3362 COC1=NC=NC=C1C2CC2(C)C m_271570__17642324__16463916 [0,0,0,1,0,1|2,0,0]=4 1192 B14R2.3362 CSC1=CC=CN=C1C2CC2(C)C m_271570__17642324__21747776 [0,0,0,1,0,1|1,1,0]=4 1193 B14R2.3362 CSC1=NC=CC=C1C2CC2(C)C m_271570__17642324__11944124 [0,0,0,1,0,1|1,1,0]=4 1194 B14R2.11625 C#CC1=NC=CN=C1NCC2CC2 m_207__23815268__2989440 [0,0,0,1,0,1|1,0,1]=4 1195 B14R2.11625 CCC1=CC=CN=C1CSC2CC2 m_7__22987858__17854090 [0,0,0,1,0,1|2,0,0]=4 1196 B14R2.11625 CCC1=CC=CN=C1NCC2CC2 m_270004__8350426__7548776 [0,0,0,1,0,1|2,0,0]=4 1197 B14R2.11625 CCC1=NC=CC=C1NCC2CC2 m_207__14060174__2989440 [0,0,0,1,0,1|2,0,0]=4 1198 B14R2.11625 CCC1=NC=CN=C1CNC2CC2 m_2230__21223004__16761932 [0,0,0,1,0,1|1,0,0]=3 1199 B14R2.11625 CCC1=NN=CN=C1OCC2CC2 m_34__17665752__7141814 [0,0,0,1,0,1|2,0,0]=4 1200 B14R2.11625 COC1=CC=CC=C1CNC2CC2 m_207__109430__109763 [0,0,0,1,0,1|2,0,0]=4 1201 B14R2.11625 COC1=CC=CC=C1CSC2CC2 m_7__22987858__6352 [0,0,0,1,0,1|2,0,0]=4 1202 B14R2.11625 COC1=CC=CC=C1NCC2CC2 m_207__1077820__2989440 [0,0,0,1,0,1|2,0,0]=4 1203 B14R2.11625 COC1=CC=CC=C1OCC2CC2 m_34__34784__7141814 [0,0,0,1,0,1|2,0,0]=4 1204 B14R2.11625 COC1=CC=CC=C1SCC2CC2 m_7__2162778__7141812 [0,0,0,1,0,1|2,0,0]=4 1205 B14R2.11625 COC1=CC=CN=C1C=CC2CC2 m_271570__16463780__16463414 [0,0,0,1,0,1|1,0,1]=4 1206 B14R2.11625 COC1=CC=CN=C1CSC2CC2 m_7__22987858__15746968 [0,0,0,1,0,1|1,0,0]=3 1207 B14R2.11625 COC1=CC=CN=C1NCC2CC2 m_27__291574__12218954 [0,0,0,1,0,1|1,0,0]=3 1208 B14R2.11625 COC1=CC=CN=C1SCC2CC2 m_7__15368240__7141812 [0,0,0,1,0,1|1,0,0]=3 1209 B14R2.11625 COC1=CC=CN=C1SCC2CS2 m_7__15368240__22787476 [0,0,0,1,0,1|2,0,0]=4 1210 B14R2.11625 COC1=CC=NN=C1NCC2CC2 m_270004__25071242__7548776 [0,0,0,1,0,1|2,0,0]=4 1211 B14R2.11625 COC1=CN=CN=C1NCC2CC2 m_27__291574__20650720 [0,0,0,1,0,1|2,0,0]=4 1212 B14R2.11625 COC1=NC=CC=C1C=CC2CC2 m_271570__16463780__18352954 [0,0,0,1,0,1|1,0,1]=4 1213 B14R2.11625 COC1=NC=CC=C1CNC2CC2 m_207__109430__11948386 [0,0,0,1,0,1|1,0,0]=3 1214 B14R2.11625 COC1=NC=CC=C1CSC2CC2 m_7__22987858__6950566 [0,0,0,1,0,1|1,0,0]=3 1215 B14R2.11625 COC1=NC=CC=C1NCC2CC2 m_207__7592314__2989440 [0,0,0,1,0,1|1,0,0]=3 1216 B14R2.11625 COC1=NC=CC=C1OCC2CC2 m_34__8616224__7141814 [0,0,0,1,0,1|1,0,0]=3 1217 B14R2.11625 COC1=NC=CC=C1OCC2CS2 m_7__22984962__22787476 [0,0,0,1,0,1|2,0,0]=4 1218 B14R2.11625 COC1=NC=CC=C1SCC2CC2 m_7__22987990__7141812 [0,0,0,1,0,1|1,0,0]=3 1219 B14R2.11625 COC1=NC=CC=C1SCC2CS2 m_7__22987990__22787476 [0,0,0,1,0,1|2,0,0]=4 1220 B14R2.11625 COC1=NC=CN=C1CNC2CC2 m_207__109430__10427880 [0,0,0,1,0,1|0,0,0]=2 1221 B14R2.11625 COC1=NC=CN=C1NCC2CC2 m_270004__25069386__7548776 [0,0,0,1,0,1|0,0,0]=2 1222 B14R2.11625 COC1=NC=NC=C1NCC2CC2 m_270004__25069492__7548776 [0,0,0,1,0,1|2,0,0]=4 1223 B14R2.11625 COC1=NN=CC=C1NCC2CC2 m_270004__25070802__7548776 [0,0,0,1,0,1|2,0,0]=4 1224 B14R2.11625 CSC1=CC=CN=C1NCC2CC2 m_270004__11687508__7548776 [0,0,0,1,0,1|1,1,0]=4 1225 B14R2.11625 CSC1=NC=CC=C1NCC2CC2 m_270004__25071934__7548776 [0,0,0,1,0,1|1,1,0]=4 1226 B14R2.11625 N#CC1=NC=CN=C1NCC2CC2 m_27__291574__2745374 [0,0,0,1,0,1|2,0,0]=4 1227 B14R2.11625 N#CC1=NC=CN=C1SCC2CC2 m_7__22987412__7141812 [0,0,0,1,0,1|2,0,0]=4 1228 B14R2.117 COC1=NC(=CC=C1OC2CC2)C m_7__22985622__16761930 [0,1,0,1,0,0|2,0,0]=4 1229 B14R2.3166 CCC1=NC(=CC=C1[C@@H]2C[C@H]2C)N m_271570__24798142__21747726 [0,1,0,1,0,0|2,0,0]=4 1230 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)Br m_271570__24798142__24881132 [0,1,0,1,0,0|2,0,0]=4 1231 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)C m_271570__24798142__18716010 [0,1,0,1,0,0|2,0,0]=4 1232 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__19180080 [0,1,0,1,0,0|2,0,0]=4 1233 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)F m_271570__24798142__21751736 [0,1,0,1,0,0|2,0,0]=4 1234 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)N m_271570__24798142__11944018 [0,1,0,1,0,0|2,0,0]=4 1235 B14R2.3166 COC1=CC(=CC=C1[C@@H]2C[C@H]2C)O m_271570__24798142__21750740 [0,1,0,1,0,0|2,0,0]=4 1236 B14R2.3166 COC1=CC(=CN=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__15064140 [0,1,0,1,0,0|1,0,0]=3 1237 B14R2.3166 COC1=CC(=CN=C1[C@@H]2C[C@H]2C)N m_271570__24798142__15141686 [0,1,0,1,0,0|1,0,0]=3 1238 B14R2.3166 COC1=NC(=CC=C1[C@@H]2C[C@H]2C)N m_271570__24798142__21749422 [0,1,0,1,0,0|1,0,0]=3 1239 B14R2.3166 COC1=NC(=NC=C1[C@@H]2C[C@H]2C)C m_271570__24798142__21745846 [0,1,0,1,0,0|2,0,0]=4 1240 B14R2.95 CNC(C)C1COC2=CC=CC=C12 m_2230__8740552__2463448 [0,1,0,1,0,0|2,0,0]=4 1241 B14R2.143 CCN1CCOC2=CC=CN=C2C1 m_2230__12639582__22383854 [0,1,0,1,0,0|2,0,0]=4 1242 B14R2.1914 COC1=CC=CN=C1NC2CCC2 m_27__10892206__12218954 [0,1,0,1,0,0|2,0,0]=4 1243 B14R2.1914 COC1=CC=CN=C1SC2CCC2 m_7__15368240__13420952 [0,1,0,1,0,0|2,0,0]=4 1244 B14R2.1914 COC1=CC=CN=C1SC2COC2 m_7__15368240__10173692 [0,1,0,1,0,0|2,0,0]=4 1245 B14R2.1914 COC1=NC=CC=C1OC2CCC2 m_7__22984962__13420952 [0,1,0,1,0,0|2,0,0]=4 1246 B14R2.1914 COC1=NC=CC=C1OC2COC2 m_7__22984962__10173692 [0,1,0,1,0,0|2,0,0]=4 1247 B14R2.1914 COC1=NC=CC=C1SC2CCC2 m_7__22987990__13420952 [0,1,0,1,0,0|2,0,0]=4 1248 B14R2.1914 COC1=NC=CC=C1SC2COC2 m_7__22987990__10173692 [0,1,0,1,0,0|2,0,0]=4 1249 B14R2.2966 CCC1=CC=CN=C1[C@@H]2C[C@H]2CC m_271570__24798044__13419880 [0,1,0,1,0,0|2,0,0]=4 1250 B14R2.2966 CCC1=CC=CN=C1[C@@H]2C[C@H]2CO m_271570__24800714__13419880 [0,1,0,1,0,0|2,0,0]=4 1251 B14R2.2966 CC[C@H]1C[C@@H]1C2=CC=CC=C2OC m_271570__24798044__11652092 [0,1,0,1,0,0|2,0,0]=4 1252 B14R2.2966 CC[C@H]1C[C@@H]1C2=CC=CN=C2OC m_271570__24798044__18352954 [0,1,0,1,0,0|1,0,0]=3 1253 B14R2.2966 CC[C@H]1C[C@@H]1C2=CC=CN=C2SC m_271570__24798044__11944124 [0,1,0,1,0,0|1,1,0]=4 1254 B14R2.2966 CC[C@H]1C[C@@H]1C2=CN=CN=C2OC m_271570__24798044__16463916 [0,1,0,1,0,0|2,0,0]=4 1255 B14R2.2966 CC[C@H]1C[C@@H]1C2=NC=CC=C2OC m_271570__24798044__16463414 [0,1,0,1,0,0|1,0,0]=3 1256 B14R2.2966 CC[C@H]1C[C@@H]1C2=NC=CC=C2SC m_271570__24798044__21747776 [0,1,0,1,0,0|1,1,0]=4 1257 B14R2.2966 COC1=CC=CC=C1[C@@H]2C[C@H]2CO m_271570__24800714__11652092 [0,1,0,1,0,0|2,0,0]=4 1258 B14R2.2966 COC1=CC=CN=C1[C@@H]2C[C@H]2CO m_271570__24800714__16463414 [0,1,0,1,0,0|1,0,0]=3 1259 B14R2.2966 COC1=NC=CC=C1[C@@H]2C[C@H]2CO m_271570__24800714__18352954 [0,1,0,1,0,0|1,0,0]=3 1260 B14R2.2966 COC1=NC=NC=C1[C@@H]2C[C@H]2CO m_271570__24800714__16463916 [0,1,0,1,0,0|2,0,0]=4 1261 B14R2.2966 CSC1=CC=CN=C1[C@@H]2C[C@H]2CO m_271570__24800714__21747776 [0,1,0,1,0,0|1,1,0]=4 1262 B14R2.2966 CSC1=NC=CC=C1[C@@H]2C[C@H]2CO m_271570__24800714__11944124 [0,1,0,1,0,0|1,1,0]=4 1263 B14R2.3360 CCC1=CC=CN=C1C2[C@@H]([C@H]2C)C m_271570__18313416__13419880 [0,1,0,1,0,0|2,0,0]=4 1264 B14R2.3360 COC1=CC=CC=C1C2[C@@H]([C@H]2C)C m_271570__18313416__11652092 [0,1,0,1,0,0|2,0,0]=4 1265 B14R2.3360 COC1=CC=CN=C1C2[C@@H]([C@H]2C)C m_271570__18313416__16463414 [0,1,0,1,0,0|1,0,0]=3 1266 B14R2.3360 COC1=NC=CC=C1C2[C@@H]([C@H]2C)C m_271570__18313416__18352954 [0,1,0,1,0,0|1,0,0]=3 1267 B14R2.3360 COC1=NC=NC=C1C2[C@@H]([C@H]2C)C m_271570__18313416__16463916 [0,1,0,1,0,0|2,0,0]=4 1268 B14R2.3360 CSC1=CC=CN=C1C2[C@@H]([C@H]2C)C m_271570__18313416__21747776 [0,1,0,1,0,0|1,1,0]=4 1269 B14R2.3360 CSC1=NC=CC=C1C2[C@@H]([C@H]2C)C m_271570__18313416__11944124 [0,1,0,1,0,0|1,1,0]=4 1270 B14R2.11684 COC1=NC=CC2=C1CN(CC2)C m_2230__22406734__2463448 [0,1,0,1,0,0|2,0,0]=4 1271 B14R2.18614 COC1=C(C=CC=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__21748412 [0,1,0,1,0,0|2,0,0]=4 1272 B14R2.18614 COC1=C(C=CC=C1[C@@H]2C[C@H]2C)F m_271570__24798142__18051832 [0,1,0,1,0,0|2,0,0]=4 1273 B14R2.18614 COC1=C(C=CN=C1[C@@H]2C[C@H]2C)Br m_271570__24798142__22849102 [0,1,0,1,0,0|1,0,0]=3 1274 B14R2.499 CCNC1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__24879612 [0,1,0,1,0,0|2,0,0]=4 1275 B14R2.499 CCOC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11652494 [0,1,0,1,0,0|2,0,0]=4 1276 B14R2.499 CCOC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__16463442 [0,1,0,1,0,0|1,0,0]=3 1277 B14R2.499 COCC1=CC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__11652514 [0,1,0,1,0,0|2,0,0]=4 1278 B14R2.499 COCC1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__18726508 [0,1,0,1,0,0|1,0,0]=3 1279 B14R2.499 C[C@H]1C[C@@H]1C2=CC=CN=C2CCO m_271570__24798142__15539608 [0,1,0,1,0,0|2,0,0]=4 1280 B14R2.499 C[C@H]1C[C@@H]1C2=NC=CC=C2CCO m_271570__24798142__14772804 [0,1,0,1,0,0|2,0,0]=4 1281 B14R2.3102 CCOC1=CC=CC=C1CC2CC2 m_34__14686522__7791662 [0,1,0,1,0,0|2,0,0]=4 1282 B14R2.9577 CC(C)CC1=NC=CC=C1C2CC2 m_271570__11830330__16969488 [0,1,0,1,0,0|2,0,0]=4 1283 B14R2.365 CC(=O)C1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__21750568 [0,1,0,1,0,0|2,0,0]=4 1284 B14R2.365 CC(=O)C1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__21750332 [0,1,0,1,0,0|2,0,0]=4 1285 B14R2.365 CC(C)C1=CC=CN=C1[C@@H]2C[C@H]2C m_271570__24798142__21748916 [0,1,0,1,0,0|2,0,0]=4 1286 B14R2.365 C[C@@H](O)C1=NC=CC=C1[C@@H]2C[C@H]2C m_271570__24798142__21744120 [0,1,0,1,0,0|2,0,0]=4 1287 B14R2.365 C[C@H]1C[C@@H]1C2=NC=CN=C2N(C)C m_271570__24798142__21546854 [0,1,0,1,0,0|1,0,0]=3 1288 B14R2.390 CN1CCOC2=C(C1)C(=CC=N2)Cl m_2230__20767624__2463448 [0,1,0,1,0,0|2,0,0]=4 1289 B14R2.2187 COC1=CC=CC(=C1[C@@H]2C[C@H]2C)I m_271570__24798142__24880906 [0,1,0,1,0,0|2,0,0]=4 1290 B14R2.104 COC1=NC=C(C=C1SC2CC2)Br m_7__20080774__16761930 [0,1,0,1,0,0|2,0,0]=4 1291 B14R2.3072 COC1=CC=C(C=C1[C@@H]2C[C@H]2C)C m_271570__24798142__19493042 [0,1,0,1,0,0|2,0,0]=4 1292 B14R2.3072 COC1=CC=C(C=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__20581890 [0,1,0,1,0,0|2,0,0]=4 1293 B14R2.3072 COC1=CC=C(C=C1[C@@H]2C[C@H]2C)F m_271570__24798142__21751278 [0,1,0,1,0,0|2,0,0]=4 1294 B14R2.3072 COC1=CC=C(C=C1[C@@H]2C[C@H]2C)N m_271570__24798142__11944052 [0,1,0,1,0,0|2,0,0]=4 1295 B14R2.3072 COC1=CC=C(C=C1[C@@H]2C[C@H]2C)O m_271570__24798142__12531762 [0,1,0,1,0,0|2,0,0]=4 1296 B14R2.3072 COC1=CC=C(N=C1[C@@H]2C[C@H]2C)C m_271570__24798142__14686358 [0,1,0,1,0,0|1,0,0]=3 1297 B14R2.3072 COC1=CC=C(N=C1[C@@H]2C[C@H]2C)F m_271570__24798142__21747956 [0,1,0,1,0,0|1,0,0]=3 1298 B14R2.3072 COC1=NC=C(C=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__21751418 [0,1,0,1,0,0|1,0,0]=3 1299 B14R2.3072 COC1=NC=C(C=C1[C@@H]2C[C@H]2C)F m_271570__24798142__21751428 [0,1,0,1,0,0|1,0,0]=3 1300 B14R2.3072 COC1=NC=C(C=C1[C@@H]2C[C@H]2C)N m_271570__24798142__21751046 [0,1,0,1,0,0|1,0,0]=3 1301 B14R2.3072 COC1=NC=C(C=C1[C@@H]2C[C@H]2C)S m_271570__24798142__20004990 [0,1,0,1,0,0|1,0,0]=3 1302 B14R2.3072 COC1=NN=C(C=C1[C@@H]2C[C@H]2C)Cl m_271570__24798142__16913664 [0,1,0,1,0,0|2,0,0]=4 1303 B14R3.13924 CCC1=CC=CN=C1C23CC2C3 m_271570__24800892__13419880 [0,0,0,2,0,0|2,0,0]=4 1304 B14R3.13924 COC1=CC=CC=C1C23CC2C3 m_271570__24800892__11652092 [0,0,0,2,0,0|2,0,0]=4 1305 B14R3.13924 COC1=CC=CN=C1C23CC2C3 m_271570__24800892__16463414 [0,0,0,2,0,0|1,0,0]=3 1306 B14R3.13924 COC1=NC=CC=C1C23CC2C3 m_271570__24800892__18352954 [0,0,0,2,0,0|1,0,0]=3 1307 B14R3.13924 COC1=NC=NC=C1C23CC2C3 m_271570__24800892__16463916 [0,0,0,2,0,0|2,0,0]=4 1308 B14R3.13924 CSC1=CC=CN=C1C23CC2C3 m_271570__24800892__21747776 [0,0,0,2,0,0|1,1,0]=4 1309 B14R3.13924 CSC1=NC=CC=C1C23CC2C3 m_271570__24800892__11944124 [0,0,0,2,0,0|1,1,0]=4 1310 B10R1.5 CCCC1=NC=CN1CC m_34__7290638__7791662 [1,0,0,0,1,0|2,0,0]=4 1311 B10R1.5 CCCN1C=CN=C1CC m_34__7912536__13271108 [1,0,0,0,1,0|2,0,0]=4 1312 B10R1.5 CCCN1C=CN=C1SC m_34__7103804__13271108 [1,0,0,0,1,0|1,1,0]=4 1313 B10R1.5 CCNC1=CSN=C1OC m_270004__14430440__24715004 [1,0,0,0,1,0|2,0,0]=4 1314 B10R1.5 CNCC1=C(C=CS1)OC m_207__134027__7283318 [1,0,0,0,1,0|2,0,0]=4 1315 B10R1.5 CNCC1=C(SC=C1)OC m_207__134027__14190732 [1,0,0,0,1,0|2,0,0]=4 1316 B10R1.61 C=C(C)C1=NC=CN=C1C m_271570__19608422__13972798 [1,0,0,0,1,0|0,0,2]=4 1317 B10R1.61 C=C(C)C1=NC=CN=C1O m_271570__19608422__16969462 [1,0,0,0,1,0|0,0,2]=4 1318 B10R1.64 CC(C)CN1C=CN=C1Br m_7__24373642__1010132 [1,0,0,0,1,0|2,0,0]=4 1319 B10R1.64 CC(C)CN1C=CN=C1Cl m_34__14559790__6894142 [1,0,0,0,1,0|2,0,0]=4 1320 B10R1.64 CC(C)SC1=NC=CN1C m_7__27107__5048 [1,0,0,0,1,0|2,0,0]=4 1321 B10R1.64 CC(C)SC1=NC=NN1C m_7__8750426__5048 [1,0,0,0,1,0|2,0,0]=4 1322 B10R1.64 CC(O)CC1=NC=CN1C m_7__24547952__5046 [1,0,0,0,1,0|2,0,0]=4 1323 B10R1.64 CC1=C(C=CO1)CN(C)C m_2230__2028216__2463448 [1,0,0,0,1,0|2,0,0]=4 1324 B10R1.64 CC1=C(C=CO1)SC(C)C m_7__8592942__5048 [1,0,0,0,1,0|2,0,0]=4 1325 B10R1.64 CC1=C(C=CS1)OC(C)C m_7__22986706__5048 [1,0,0,0,1,0|2,0,0]=4 1326 B10R1.64 CC1=C(OC=C1)CN(C)C m_2230__10435220__2463448 [1,0,0,0,1,0|2,0,0]=4 1327 B10R1.64 CC1=C(OC=N1)CN(C)C m_2230__16914116__2463448 [1,0,0,0,1,0|2,0,0]=4 1328 B10R1.64 CC1=C(SC=C1)CN(C)C m_2230__678286__2463448 [1,0,0,0,1,0|2,0,0]=4 1329 B10R1.64 CC1=C(SC=C1)SC(C)C m_7__14781726__5048 [1,0,0,0,1,0|2,0,0]=4 1330 B10R1.64 CC1=C(SC=N1)CN(C)C m_2230__4357242__2463448 [1,0,0,0,1,0|2,0,0]=4 1331 B10R1.64 CC1=NC=CN1CC(C)C m_34__15541204__6894142 [1,0,0,0,1,0|1,0,0]=3 1332 B10R1.64 CC1=NC=CN1CC(C)F m_34__15541204__16970748 [1,0,0,0,1,0|2,0,0]=4 1333 B10R1.64 CC1=NC=CN1CC(C)O m_63__7825836__10903854 [1,0,0,0,1,0|2,0,0]=4 1334 B10R1.64 CC1=NNC=C1CN(C)C m_2230__12420568__2463448 [1,0,0,0,1,0|2,0,0]=4 1335 B10R1.64 CC1=NNC=C1SC(C)C m_7__23915254__5048 [1,0,0,0,1,0|2,0,0]=4 1336 B10R1.64 CC1=NSC=C1CN(C)C m_2230__22407600__2463448 [1,0,0,0,1,0|2,0,0]=4 1337 B10R1.64 CN(C)CC1=CC=NN1C m_2230__15162282__2463448 [1,0,0,0,1,0|2,0,0]=4 1338 B10R1.64 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m_62__1010136__17854098 [0,0,0,0,0,2|2,0,0]=4 1351 B14R1.96 CCC1=NC=CC=C1CNCC(C)C m_270004__8288546__24720540 [0,0,0,0,0,2|2,0,0]=4 1352 B14R1.96 CCC1=NC=CN=C1CNCC(C)C m_207__21222988__121216 [0,0,0,0,0,2|1,0,0]=3 1353 B14R1.96 CCC1=NC=CN=C1CNCC(C)F m_2230__21223004__16970752 [0,0,0,0,0,2|2,0,0]=4 1354 B14R1.96 CCC1=NC=CN=C1CNCC(C)O m_2230__21223004__9736146 [0,0,0,0,0,2|2,0,0]=4 1355 B14R1.96 CCC1=NN=CN=C1OCCC(C)C m_34__17665752__6894144 [0,0,0,0,0,2|2,0,0]=4 1356 B14R1.96 CNC1=NC=CC=C1CNCC(C)C m_270004__25344916__8127718 [0,0,0,0,0,2|2,0,0]=4 1357 B14R1.96 COC1=CC=CC=C1CCNC(C)C m_269862__7192812__7204804 [0,0,0,0,0,2|2,0,0]=4 1358 B14R1.96 COC1=CC=CC=C1CCSC(C)C m_62__2390328__14416298 [0,0,0,0,0,2|2,0,0]=4 1359 B14R1.96 COC1=CC=CC=C1CNCC(C)C m_207__109406__121216 [0,0,0,0,0,2|2,0,0]=4 1360 B14R1.96 COC1=CC=CC=C1CSCC(C)C m_62__1010136__81559 [0,0,0,0,0,2|2,0,0]=4 1361 B14R1.96 COC1=CC=CC=C1NCCC(C)C m_38__56055__6579034 [0,0,0,0,0,2|2,0,0]=4 1362 B14R1.96 COC1=CC=CC=C1OCCC(C)C m_34__34784__6894144 [0,0,0,0,0,2|2,0,0]=4 1363 B14R1.96 COC1=CC=CC=C1OCSC(C)C m_7__26874__12306378 [0,0,0,0,0,2|2,0,0]=4 1364 B14R1.96 COC1=CC=CC=C1SCCC(C)C m_7__2162778__102951 [0,0,0,0,0,2|2,0,0]=4 1365 B14R1.96 COC1=CC=CC=C1SCSC(C)C m_7__2162778__12306378 [0,0,0,0,0,2|2,0,0]=4 1366 B14R1.96 COC1=CC=CN=C1C=NOC(C)C m_4__10691394__18323674 [0,0,0,0,0,2|1,0,1]=4 1367 B14R1.96 COC1=CC=CN=C1CNCC(C)C m_270004__10859218__8127718 [0,0,0,0,0,2|1,0,0]=3 1368 B14R1.96 COC1=CC=CN=C1CNCC(C)F m_270004__13461138__18323684 [0,0,0,0,0,2|2,0,0]=4 1369 B14R1.96 COC1=CC=CN=C1CNCC(C)O m_273610__11530194__11516404 [0,0,0,0,0,2|2,0,0]=4 1370 B14R1.96 COC1=CC=CN=C1CSCC(C)C m_62__1010136__15746976 [0,0,0,0,0,2|1,0,0]=3 1371 B14R1.96 COC1=CC=CN=C1CSCC(C)F m_62__15746974__16913488 [0,0,0,0,0,2|2,0,0]=4 1372 B14R1.96 COC1=CC=CN=C1CSCC(C)O m_7__10953796__15746968 [0,0,0,0,0,2|2,0,0]=4 1373 B14R1.96 COC1=CC=CN=C1CSC[C@H](C)N m_7__20871336__15746968 [0,0,0,0,0,2|2,0,0]=4 1374 B14R1.96 COC1=CC=CN=C1NCC=C(C)C m_27__9277642__12218954 [0,0,0,0,0,2|1,0,1]=4 1375 B14R1.96 COC1=CC=CN=C1NCCC(C)C m_27__61251__12218954 [0,0,0,0,0,2|1,0,0]=3 1376 B14R1.96 COC1=CC=CN=C1NCCC(C)F m_27__10546014__12218954 [0,0,0,0,0,2|2,0,0]=4 1377 B14R1.96 COC1=CC=CN=C1NCCC(C)O m_27__4933438__12218954 [0,0,0,0,0,2|2,0,0]=4 1378 B14R1.96 COC1=CC=CN=C1NCCN(C)C m_27__61260__12218954 [0,0,0,0,0,2|2,0,0]=4 1379 B14R1.96 COC1=CC=CN=C1NCC[C@H](C)N m_270166__16815962__16819100 [0,0,0,0,0,2|2,0,0]=4 1380 B14R1.96 COC1=CC=CN=C1SCC=C(C)C m_7__15368240__10267514 [0,0,0,0,0,2|1,0,1]=4 1381 B14R1.96 COC1=CC=CN=C1SCCC(C)C m_7__15368240__102951 [0,0,0,0,0,2|1,0,0]=3 1382 B14R1.96 COC1=CC=CN=C1SCCC(C)F m_7__15368240__13165340 [0,0,0,0,0,2|2,0,0]=4 1383 B14R1.96 COC1=CC=CN=C1SCCC(C)O m_7__15368240__12057932 [0,0,0,0,0,2|2,0,0]=4 1384 B14R1.96 COC1=CC=CN=C1SCCN(C)C m_7__15368240__391100 [0,0,0,0,0,2|2,0,0]=4 1385 B14R1.96 COC1=CC=CN=C1SCSC(C)C m_7__15368240__12306378 [0,0,0,0,0,2|1,0,0]=3 1386 B14R1.96 COC1=CN=CN=C1NCCC(C)C m_27__61251__20650720 [0,0,0,0,0,2|2,0,0]=4 1387 B14R1.96 COC1=NC=CC=C1C=NOC(C)C m_4__10691394__11948378 [0,0,0,0,0,2|1,0,1]=4 1388 B14R1.96 COC1=NC=CC=C1CCNC(C)C m_269862__10345800__7204804 [0,0,0,0,0,2|1,0,0]=3 1389 B14R1.96 COC1=NC=CC=C1CNCC(C)C m_207__109450__11948386 [0,0,0,0,0,2|1,0,0]=3 1390 B14R1.96 COC1=NC=CC=C1CNCC(C)F m_270004__13461138__11948388 [0,0,0,0,0,2|2,0,0]=4 1391 B14R1.96 COC1=NC=CC=C1CNCC(C)O m_207__109407__11948386 [0,0,0,0,0,2|2,0,0]=4 1392 B14R1.96 COC1=NC=CC=C1CSCC(C)C m_7__27301__6950566 [0,0,0,0,0,2|1,0,0]=3 1393 B14R1.96 COC1=NC=CC=C1CSCC(C)O m_7__10953796__6950566 [0,0,0,0,0,2|2,0,0]=4 1394 B14R1.96 COC1=NC=CC=C1CSC[C@H](C)N m_7__20871336__6950566 [0,0,0,0,0,2|2,0,0]=4 1395 B14R1.96 COC1=NC=CC=C1OCC=C(C)C m_34__8616224__12201834 [0,0,0,0,0,2|1,0,1]=4 1396 B14R1.96 COC1=NC=CC=C1OCCC(C)C m_34__8616224__6894144 [0,0,0,0,0,2|1,0,0]=3 1397 B14R1.96 COC1=NC=CC=C1OCCC(C)F m_34__8616224__13165342 [0,0,0,0,0,2|2,0,0]=4 1398 B14R1.96 COC1=NC=CC=C1OCCC(C)O m_34__8616224__12057934 [0,0,0,0,0,2|2,0,0]=4 1399 B14R1.96 COC1=NC=CC=C1OCCN(C)C m_7__22984962__391100 [0,0,0,0,0,2|2,0,0]=4 1400 B14R1.96 COC1=NC=CC=C1OCSC(C)C m_7__22984962__12306378 [0,0,0,0,0,2|1,0,0]=3 1401 B14R1.96 COC1=NC=CC=C1SCC=C(C)C m_7__22987990__10267514 [0,0,0,0,0,2|1,0,1]=4 1402 B14R1.96 COC1=NC=CC=C1SCCC(C)C m_7__22987990__102951 [0,0,0,0,0,2|1,0,0]=3 1403 B14R1.96 COC1=NC=CC=C1SCCC(C)F m_7__22987990__13165340 [0,0,0,0,0,2|2,0,0]=4 1404 B14R1.96 COC1=NC=CC=C1SCCC(C)O m_7__22987990__12057932 [0,0,0,0,0,2|2,0,0]=4 1405 B14R1.96 COC1=NC=CC=C1SCCN(C)C m_7__22987990__391100 [0,0,0,0,0,2|2,0,0]=4 1406 B14R1.96 COC1=NC=CC=C1SCSC(C)C m_7__22987990__12306378 [0,0,0,0,0,2|1,0,0]=3 1407 B14R1.96 COC1=NC=CN=C1C=NOC(C)C m_4__10691394__10428162 [0,0,0,0,0,2|0,0,1]=3 1408 B14R1.96 COC1=NC=CN=C1CNCC(C)C m_207__109450__10427880 [0,0,0,0,0,2|0,0,0]=2 1409 B14R1.96 COC1=NC=CN=C1CNCC(C)F m_270004__13461138__10427894 [0,0,0,0,0,2|1,0,0]=3 1410 B14R1.96 COC1=NC=CN=C1CNCC(C)O m_207__109407__10427880 [0,0,0,0,0,2|1,0,0]=3 1411 B14R1.96 COC1=NC=CN=C1CNCC(F)Br m_270004__23851146__10427894 [0,0,0,0,0,2|2,0,0]=4 1412 B14R1.96 COC1=NC=CN=C1CNCC(F)Cl m_207__21631452__10427880 [0,0,0,0,0,2|2,0,0]=4 1413 B14R1.96 COC1=NC=CN=C1CNCC(F)F m_207__21586816__10427880 [0,0,0,0,0,2|2,0,0]=4