0 B10R1.15 CC(N[13CH3])c1ccccn1 2230a_100000181244_200025704644 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.15 CC(N[13CH3])c1cccnc1 2230a_100000195435_200025704644 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.15 CC(N[13CH3])c1ccncc1 2230a_100000181269_200025704644 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.15 CC(N[13CH3])c1ncccn1 2230a_100020641698_200025704644 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.15 CNC(=O)C1=CCCCC1 11a_106832991635_100000765259 [0,0,0,0,0,0|0,0,4]=4 19 B10R1.15 CNC(=O)C1=CCCCC1 1626a_100102657272_100000765259 [0,0,0,0,0,0|0,0,4]=4 20 B10R1.15 CNC(=O)C1=CCCCC1 240690a_100102657272_100000765259 [0,0,0,0,0,0|0,0,4]=4 21 B10R1.15 CNC(=O)C1=CCCCC1 527a_100102657272_100000765259 [0,0,0,0,0,0|0,0,4]=4 22 B10R1.15 CNC(=O)C1=CCCCO1 11a_106832991635_100000764163 [0,0,0,0,0,0|1,0,3]=4 23 B10R1.15 CNC(=O)C1=CCCCO1 1626a_100102657272_100000764163 [0,0,0,0,0,0|1,0,3]=4 24 B10R1.15 CNC(=O)C1=CCCCO1 240690a_100102657272_100000764163 [0,0,0,0,0,0|1,0,3]=4 25 B10R1.15 CNC(=O)C1=CCCCO1 527a_100102657272_100000764163 [0,0,0,0,0,0|1,0,3]=4 26 B10R1.15 CNC(=O)C1=COCCC1 1626a_100102657272_100000749935 [0,0,0,0,0,0|1,0,3]=4 27 B10R1.15 CNC(=O)C1=COCCC1 527a_100102657272_100000749935 [0,0,0,0,0,0|1,0,3]=4 28 B10R1.15 CNC(=O)C1=COCCO1 11a_106832991635_100000008702 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.15 CNC(=O)C1=COCCO1 1626a_100102657272_100000008702 [0,0,0,0,0,0|2,0,2]=4 30 B10R1.15 CNC(=O)C1=COCCO1 240690a_100102657272_100000008702 [0,0,0,0,0,0|2,0,2]=4 31 B10R1.15 CNC(=O)C1=COCCO1 527a_100102657272_100000008702 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.15 CNC(=O)N1CC=CCC1 2708a_100102657272_100000698166 [0,0,0,0,0,0|1,0,3]=4 33 B10R1.15 CNC(=O)N1CC=CCC1 273464a_100102657272_100000698166 [0,0,0,0,0,0|1,0,3]=4 34 B10R1.15 CNC(=O)[C@H]1CC=CCC1 11a_106832991635_100009820709 [0,0,0,0,0,0|0,0,4]=4 35 B10R1.15 CNC(=O)[C@H]1CC=CCC1 1626a_100102657272_100009820709 [0,0,0,0,0,0|0,0,4]=4 36 B10R1.15 CNC(=O)[C@H]1CC=CCC1 240690a_100102657272_100009820709 [0,0,0,0,0,0|0,0,4]=4 37 B10R1.15 CNC(=O)[C@H]1CC=CCC1 527a_100102657272_100009820709 [0,0,0,0,0,0|0,0,4]=4 38 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [0,0,0,0,0,0|0,0,0]=0 39 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [0,0,0,0,0,0|0,0,0]=0 40 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [0,0,0,0,0,0|0,0,0]=0 41 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [0,0,0,0,0,0|0,0,0]=0 42 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [0,0,0,0,0,0|1,0,1]=2 43 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [0,0,0,0,0,0|1,0,1]=2 44 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [0,0,0,0,0,0|1,0,1]=2 45 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [0,0,0,0,0,0|1,0,1]=2 46 B10R1.15 CNC(C)c1ccccn1 2230a_100000181244_200000210301 [0,0,0,0,0,0|2,0,1]=3 47 B10R1.15 CNC(C)c1ccccn1 269862a_106832991636_100000210467 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.15 CNC(C)c1cccnc1 2230a_100000195435_200000210301 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.15 CNC(C)c1cccnc1 269862a_106832991636_100000210468 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.15 CNC(C)c1cccnn1 269862a_106832991636_100009866853 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.15 CNC(C)c1ccncc1 2230a_100000181269_200000210301 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.15 CNC(C)c1ccncc1 269862a_106832991636_100000185792 [0,0,0,0,0,0|2,0,1]=3 53 B10R1.15 CNC(C)c1ccnnc1 269862a_106832991636_100012182992 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.15 CNC(C)c1cnccn1 2230a_106832991635_200000703233 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.15 CNC(C)c1cnccn1 269862a_106832991636_100000751083 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.15 CNC(C)c1cnccn1 7a_106832991635_200000703233 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.15 CNC(C)c1cncnc1 269862a_106832991636_100000757475 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.15 CNC(C)c1ncccn1 2230a_100020641698_200000210301 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.15 CNC(C)c1ncccn1 270004a_106832991635_100011350828 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [0,0,0,0,0,0|1,0,1]=2 61 B10R1.15 CN[C@H](C)c1cnccn1 2230a_100020589798_200000210301 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [0,0,0,0,0,0|2,0,1]=3 63 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [0,0,0,0,0,0|2,0,1]=3 64 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [0,0,0,0,0,0|2,0,1]=3 66 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [0,0,0,0,0,0|2,0,1]=3 67 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [0,0,0,0,0,0|1,0,1]=2 68 B10R1.15 C[C@@H](N[13CH3])c1cnccn1 2230a_100020589798_200025704644 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [0,0,0,0,0,0|2,0,1]=3 70 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [0,0,0,0,0,0|2,0,1]=3 71 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [0,0,0,0,0,0|2,0,0]=2 72 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,0,0|1,0,0]=2 73 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.6 C=C(C)c1cccnn1 271570a_100000694244_100016991348 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.6 C=C(C)c1ccncn1 271570a_100000694244_100000703185 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.6 C=C(C)c1ccnnc1 271570a_100000694244_100000732662 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 C=C(C)c1cncnc1 271570a_100000694244_100011206942 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.6 C=C(C)c1ncccn1 271570a_100000694244_100000211032 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,0,0|0,0,0]=1 83 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,0,0|0,0,0]=1 90 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,0,0,0,0|1,0,1]=3 91 B9R1.8 C=C=Cc1ccccn1 271570a_100015277604_100011216584 [1,0,0,0,0,0|2,0,1]=4 92 B9R1.8 C=C=Cc1cccnc1 271570a_100015277604_100000752921 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.8 C=C=Cc1ccncc1 271570a_100015277604_100000035832 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,0,0,0,0|1,0,0]=2 95 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.8 CC=Cc1cccnn1 271570a_100016259895_100016991348 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.8 CC=Cc1ccncn1 271570a_100016259895_100000703185 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.8 CC=Cc1ccnnc1 271570a_100016259895_100000732662 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.8 CC=Cc1cnccn1 271570a_100016259895_100000758340 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.8 CC=Cc1cncnc1 271570a_100016259895_100011206942 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.8 CC=Cc1ncccn1 271570a_100016259895_100000211032 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,0,0,0,0|0,0,1]=2 119 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,0,0,0,0|0,0,1]=2 120 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,0,0,0,0|0,0,1]=2 121 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,0,0,0,0|0,0,1]=2 122 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,0,0,0,0|0,0,1]=2 123 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,0,0,0,0|0,0,1]=2 124 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,0,0,0,0|0,0,1]=2 125 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [1,0,0,0,0,0|1,0,1]=3 126 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [1,0,0,0,0,0|1,0,1]=3 127 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [1,0,0,0,0,0|1,0,1]=3 128 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [1,0,0,0,0,0|1,0,1]=3 129 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [1,0,0,0,0,0|1,0,1]=3 130 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [1,0,0,0,0,0|1,0,1]=3 131 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [1,0,0,0,0,0|1,0,1]=3 132 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [1,0,0,0,0,0|1,0,1]=3 133 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [1,0,0,0,0,0|1,0,1]=3 134 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [1,0,0,0,0,0|1,0,1]=3 135 B9R1.8 CNCc1cccnn1 2230a_100159270163_200000210301 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.8 CNCc1cccnn1 2230a_106832991635_100016990269 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.8 CNCc1cccnn1 34a_100102657272_100016990269 [1,0,0,0,0,0|2,0,1]=4 138 B9R1.8 CNCc1cccnn1 7a_106832991635_100016990269 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [1,0,0,0,0,0|1,0,1]=3 140 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [1,0,0,0,0,0|1,0,1]=3 141 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [1,0,0,0,0,0|1,0,1]=3 142 B9R1.8 CNCc1ccnnc1 270004a_106832991635_100011934578 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.8 CNCc1cncnc1 2230a_100011243677_200000210301 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.8 CNCc1cncnc1 2230a_106832991635_100015196519 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.8 CNCc1cncnc1 270004a_106832991635_100000749868 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.8 CNCc1cncnc1 34a_100102657272_100015196519 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.8 CNCc1cncnc1 7a_106832991635_100015196519 [1,0,0,0,0,0|2,0,1]=4 152 B9R1.8 CNCc1ncccn1 2230a_106832991635_100000703007 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.8 CNCc1ncccn1 270004a_106832991635_100011532527 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.8 CNCc1ncccn1 34a_100102657272_100000703007 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.8 CNCc1ncccn1 7a_106832991635_100000703007 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,0,0,0,0|1,0,1]=3 157 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,0,0,0,0|1,0,1]=3 158 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,0,0,0,0|1,0,1]=3 159 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,0,0,0,0|1,0,1]=3 162 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,0,0,0,0|1,0,1]=3 163 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [1,0,0,0,0,0|2,0,1]=4 169 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,0,0,0,0|0,0,1]=2 175 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,0,0,0,0|0,0,1]=2 176 B9R1.8 [13CH3]NCc1cccnn1 2230a_100159270163_200025704644 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.8 [13CH3]NCc1cncnc1 2230a_100011243677_200025704644 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,0,0,0,0|1,0,1]=3 179 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,0,0,0,0|1,0,1]=3 180 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,0,0,0,0|1,0,1]=3 181 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,0,0,0,0|1,0,1]=3 182 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [1,0,0,0,0,0|2,0,1]=4 188 B11R1.7 CC(C)(N[13CH3])c1ccccc1 2230a_100011218174_200025704644 [0,1,0,0,0,0|1,0,1]=3 189 B11R1.7 CC(C)(N[13CH3])c1ccccn1 2230a_100011999416_200025704644 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.7 CC(C)(N[13CH3])c1cccnc1 2230a_100011376175_200025704644 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.7 CC(C)(O[13CH3])c1ccccc1 7a_100000694644_200025704644 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_100000034625_200025704644 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_200025704644_100000034625 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.7 CNC(C)(C)c1ccccc1 2230a_100011218174_200000210301 [0,1,0,0,0,0|1,0,1]=3 195 B11R1.7 CNC(C)(C)c1ccccc1 2230a_106832991635_100000034625 [0,1,0,0,0,0|1,0,1]=3 196 B11R1.7 CNC(C)(C)c1ccccn1 2230a_100011999416_200000210301 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.7 CNC(C)(C)c1cccnc1 2230a_100011376175_200000210301 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.7 CNC(F)(F)c1ccccc1 7a_106832991635_100000036403 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.7 CNS(=O)(=O)c1ccccc1 270084a_100102657272_100000210345 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.7 CNS(=O)(=O)c1ccccc1 274078a_100102657272_100000210345 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.7 CNS(=O)(=O)c1ccccc1 40a_100102657272_100000032697 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.7 CNS(=O)(=O)c1ccccn1 270084a_100102657272_100016994956 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.7 CNS(=O)(=O)c1ccccn1 274078a_100102657272_100016994956 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.7 CNS(=O)(=O)c1ccccn1 40a_100102657272_100000070048 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.7 CNS(=O)(=O)c1cccnc1 270084a_100102657272_100000736704 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.7 CNS(=O)(=O)c1cccnc1 274078a_100102657272_100000736704 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.7 COC(C)(C)c1ccccc1 7a_100000694644_200000210301 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.7 CSC(C)(C)c1ccccc1 62a_100000034625_200000210301 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.7 CSC(C)(C)c1ccccc1 62a_200000210301_100000034625 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.7 CSC(F)(F)c1ccccc1 62a_200000210301_100000036403 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.7 [13CH3]SC(F)(F)c1ccccc1 62a_200025704644_100000036403 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.12 C=CC(NC)c1ccccc1 2230a_106832991635_200000085779 [0,1,0,0,0,0|1,0,1]=3 217 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.12 C=CC(SC)c1ccccc1 62a_200000085779_200000210301 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.12 C=CC(SC)c1ccccc1 62a_200000210301_200000085779 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.12 C=CC(S[13CH3])c1ccccc1 62a_200000085779_200025704644 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.12 C=CC(S[13CH3])c1ccccc1 62a_200025704644_200000085779 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.12 CCC(NC)c1ccccc1 2230a_100000737752_200000210301 [0,1,0,0,0,0|1,0,1]=3 226 B11R1.12 CCC(NC)c1ccccc1 269862a_106832991636_100000210124 [0,1,0,0,0,0|1,0,1]=3 227 B11R1.12 CCC(NC)c1ccccn1 2230a_100015186561_200000210301 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.12 CCC(NC)c1ccccn1 269862a_106832991636_100000748178 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.12 CCC(NC)c1cccnc1 2230a_100000246009_200000210301 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.12 CCC(NC)c1cccnc1 269862a_106832991636_100011218761 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.12 CCC(NC)c1ccncc1 269862a_106832991636_100011216016 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.12 CCC(N[13CH3])c1ccccc1 2230a_100000737752_200025704644 [0,1,0,0,0,0|1,0,1]=3 233 B11R1.12 CCC(N[13CH3])c1ccccn1 2230a_100015186561_200025704644 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.12 CCC(N[13CH3])c1cccnc1 2230a_100000246009_200025704644 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [0,1,0,0,0,0|1,0,2]=4 236 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [0,1,0,0,0,0|1,0,2]=4 237 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [0,1,0,0,0,0|1,0,2]=4 238 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [0,1,0,0,0,0|1,0,2]=4 239 B11R1.12 CCN(CC)c1ccccc1 2230a_100000210013_100000210202 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.12 CCN(CC)c1ccccc1 269982a_100000210013_100000204670 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.12 CCN(CC)c1ccccc1 34a_100000210013_100000210202 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.12 CCN(CF)c1ccccc1 269982a_100000210013_100015361967 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.12 CCN(CF)c1ccccc1 34a_100000210013_100015361967 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.12 CNC(CO)c1ccccn1 2230a_100015196888_200000210301 [0,1,0,0,0,0|1,0,2]=4 245 B11R1.12 CN[C@H](CO)c1ccccc1 2230a_100000751927_200000210301 [0,1,0,0,0,0|0,0,2]=3 246 B11R1.12 CN[C@H](CO)c1ccccc1 34a_100000751927_200000210301 [0,1,0,0,0,0|0,0,2]=3 247 B11R1.12 CN[C@H](CO)c1ccncc1 2230a_100138412524_200000210301 [0,1,0,0,0,0|1,0,2]=4 248 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.12 [13CH3]NC(CO)c1ccccn1 2230a_100015196888_200025704644 [0,1,0,0,0,0|1,0,2]=4 254 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 2230a_100000751927_200025704644 [0,1,0,0,0,0|0,0,2]=3 255 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 34a_100000751927_200025704644 [0,1,0,0,0,0|0,0,2]=3 256 B11R1.12 [13CH3]N[C@H](CO)c1ccncc1 2230a_100138412524_200025704644 [0,1,0,0,0,0|1,0,2]=4 257 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [0,1,0,0,0,0|1,0,1]=3 263 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.16 CC(CN[13CH3])c1ccccc1 2230a_100000701038_200025704644 [0,1,0,0,0,0|1,0,1]=3 265 B11R1.16 CC(CN[13CH3])c1ccccc1 34a_100000701038_200025704644 [0,1,0,0,0,0|1,0,1]=3 266 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.16 CC(SCF)c1ccccc1 62a_100000230085_100015361967 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.16 CC(SCF)c1ccccc1 62a_100015361967_100000230085 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [0,1,0,0,0,0|1,0,0]=2 273 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [0,1,0,0,0,0|3,0,0]=4 276 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [0,1,0,0,0,0|0,0,0]=1 283 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [0,1,0,0,0,0|0,0,0]=1 284 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [0,1,0,0,0,0|0,0,0]=1 285 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [0,1,0,0,0,0|1,0,1]=3 286 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [0,1,0,0,0,0|1,0,1]=3 287 B11R1.16 CCNC(C)c1ccccn1 2230a_100000181244_100000210202 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.16 CCNC(C)c1ccccn1 269862a_100015525214_100000210467 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.16 CCNC(C)c1cccnc1 2230a_100000195435_100000210202 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.16 CCNC(C)c1cccnc1 269862a_100015525214_100000210468 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.16 CCNC(C)c1ccncc1 2230a_100000181269_100000210202 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.16 CCNC(C)c1ccncc1 269862a_100015525214_100000185792 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [0,1,0,0,0,0|1,0,1]=3 294 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.16 CN(CCF)c1ccccc1 2230a_100000210012_100011217306 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.16 CN(CCF)c1ccccc1 269982a_100000210012_100011217306 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.16 CN(CCF)c1ccccc1 34a_100000210012_100011217306 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.16 CN(CCO)c1ccccc1 2230a_100000210012_100000211926 [0,1,0,0,0,0|3,0,0]=4 303 B11R1.16 CN(CCO)c1ccccc1 2230a_100000211345_200000210301 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.16 CN(CCO)c1ccccc1 269982a_100000210012_100000211926 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.16 CN(CCO)c1ccccc1 269982a_100000211345_200000210301 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.16 CN(CCO)c1ccccc1 34a_100000210012_100000211926 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.16 CN(CCO)c1ccccc1 34a_100000211345_200000210301 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [0,1,0,0,0,0|0,0,0]=1 309 B11R1.16 CNCC(=O)c1ccccn1 34a_100102657272_100000027445 [0,1,0,0,0,0|1,0,0]=2 310 B11R1.16 CNCC(=O)c1ccccn1 7a_106832991635_100000027445 [0,1,0,0,0,0|1,0,0]=2 311 B11R1.16 CNCC(=O)c1ccncc1 7a_106832991635_100015248511 [0,1,0,0,0,0|1,0,0]=2 312 B11R1.16 CNCC(C)c1ccccc1 2230a_100000701038_200000210301 [0,1,0,0,0,0|1,0,1]=3 313 B11R1.16 CNCC(C)c1ccccc1 2230a_106832991635_100000756946 [0,1,0,0,0,0|1,0,1]=3 314 B11R1.16 CNCC(C)c1ccccc1 270004a_106832991635_100000212034 [0,1,0,0,0,0|1,0,1]=3 315 B11R1.16 CNCC(C)c1ccccc1 34a_100000701038_200000210301 [0,1,0,0,0,0|1,0,1]=3 316 B11R1.16 CNCC(C)c1ccccc1 34a_100102657272_100000756946 [0,1,0,0,0,0|1,0,1]=3 317 B11R1.16 CNCC(C)c1ccccc1 7a_106832991635_100000756946 [0,1,0,0,0,0|1,0,1]=3 318 B11R1.16 CNCC(O)c1ccccc1 2230a_100000210709_200000210301 [0,1,0,0,0,0|0,0,2]=3 319 B11R1.16 CNCC(O)c1ccccc1 2230a_106832991635_100000185958 [0,1,0,0,0,0|0,0,2]=3 320 B11R1.16 CNCC(O)c1ccccc1 34a_100102657272_100000185958 [0,1,0,0,0,0|0,0,2]=3 321 B11R1.16 CNCC(O)c1ccccc1 7a_106832991635_100000185958 [0,1,0,0,0,0|0,0,2]=3 322 B11R1.16 CNCC(O)c1ccccn1 2230a_100000691469_200000210301 [0,1,0,0,0,0|1,0,2]=4 323 B11R1.16 CNCC(O)c1cccnc1 2230a_100020605170_200000210301 [0,1,0,0,0,0|1,0,2]=4 324 B11R1.16 CNC[C@@H](O)c1ccccc1 2230a_106832991635_100011933945 [0,1,0,0,0,0|0,0,2]=3 325 B11R1.16 CNC[C@@H](O)c1ccccc1 34a_100102657272_100011933945 [0,1,0,0,0,0|0,0,2]=3 326 B11R1.16 CNC[C@@H](O)c1ccccc1 7a_106832991635_100011933945 [0,1,0,0,0,0|0,0,2]=3 327 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [0,1,0,0,0,0|0,0,0]=1 328 B11R1.16 COCC(=O)c1ccccn1 34a_100138415774_100000027445 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [0,1,0,0,0,0|1,0,2]=4 333 B11R1.16 COCN(C)c1ccccc1 2230a_100000210012_100000766300 [0,1,0,0,0,0|3,0,0]=4 334 B11R1.16 COCN(C)c1ccccc1 269982a_100000210012_100000766300 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [0,1,0,0,0,0|1,0,2]=4 337 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [0,1,0,0,0,0|1,0,0]=2 338 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [0,1,0,0,0,0|1,0,0]=2 339 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.16 CSCC(=O)c1ccncc1 62a_100000027454_200000210301 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.16 CSCC(=O)c1ccncc1 62a_200000210301_100000027454 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.16 CSCC(=O)c1ncccn1 62a_100020636365_200000210301 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.16 CSCC(=O)c1ncccn1 62a_200000210301_100020636365 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [0,1,0,0,0,0|1,0,2]=4 350 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [0,1,0,0,0,0|1,0,2]=4 351 B11R1.16 CSCN(C)c1ccccc1 2230a_100000210012_100011218213 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.16 CSCN(C)c1ccccc1 269982a_100000210012_100011218213 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.16 CSCN(C)c1ccccc1 34a_100000210012_100011218213 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [0,1,0,0,0,0|1,0,2]=4 356 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [0,1,0,0,0,0|1,0,2]=4 357 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [0,1,0,0,0,0|1,0,1]=3 360 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [0,1,0,0,0,0|1,0,0]=2 361 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [0,1,0,0,0,0|1,0,0]=2 362 B11R1.16 [13CH3]N(CCO)c1ccccc1 2230a_100000211345_200025704644 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.16 [13CH3]N(CCO)c1ccccc1 269982a_100000211345_200025704644 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.16 [13CH3]N(CCO)c1ccccc1 34a_100000211345_200025704644 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.16 [13CH3]NCC(O)c1ccccc1 2230a_100000210709_200025704644 [0,1,0,0,0,0|0,0,2]=3 366 B11R1.16 [13CH3]NCC(O)c1ccccn1 2230a_100000691469_200025704644 [0,1,0,0,0,0|1,0,2]=4 367 B11R1.16 [13CH3]NCC(O)c1cccnc1 2230a_100020605170_200025704644 [0,1,0,0,0,0|1,0,2]=4 368 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [0,1,0,0,0,0|2,0,1]=4 369 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [0,1,0,0,0,0|2,0,0]=3 374 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_100000027454_200025704644 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_200025704644_100000027454 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.16 [13CH3]SCC(=O)c1ncccn1 62a_100020636365_200025704644 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.16 [13CH3]SCC(=O)c1ncccn1 62a_200025704644_100020636365 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [0,1,0,0,0,0|1,0,2]=4 380 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [0,1,0,0,0,0|1,0,2]=4 381 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [0,1,0,0,0,0|1,0,2]=4 383 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [0,1,0,0,0,0|1,0,2]=4 384 B11R1.22 CC(N[13CH3])c1ccc(cn1)Br 2230a_100000723930_200025704644 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,1,0,0,0,0|2,0,1]=4 386 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,1,0,0,0,0|2,0,1]=4 388 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,1,0,0,0,0|2,0,1]=4 390 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,1,0,0,0,0|2,0,1]=4 391 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,1,0,0,0,0|2,0,1]=4 394 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,1,0,0,0,0|2,0,1]=4 396 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,0,0,0,0|1,0,0]=2 397 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,0,0,0,0|1,0,0]=2 398 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,0,0,0,0|1,0,0]=2 399 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,0,0,0,0|1,0,0]=2 400 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,0,0,0,0|1,0,0]=2 401 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,0,0,0,0|1,0,0]=2 402 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.22 CCC(=O)c1ncc(cn1)O 271570a_203496583355_200010116844 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,1,0,0,0,0|2,0,1]=4 406 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,1,0,0,0,0|1,0,2]=4 407 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,1,0,0,0,0|3,0,0]=4 410 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 411 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,1,0,0,0,0|3,0,0]=4 412 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,1,0,0,0,0|3,0,0]=4 414 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,1,0,0,0,0|3,0,0]=4 415 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,1,0,0,0,0|3,0,0]=4 416 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 420 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,1,0,0,0,0|3,0,0]=4 421 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,1,0,0,0,0|3,0,0]=4 425 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,1,0,0,0,0|3,0,0]=4 426 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,1,0,0,0,0|3,0,0]=4 432 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,1,0,0,0,0|3,0,0]=4 433 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,1,0,0,0,0|3,0,0]=4 434 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 437 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,1,0,0,0,0|3,0,0]=4 438 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 440 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 450 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,0,0,0,0|0,0,0]=1 456 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,0,0,0,0|0,0,0]=1 457 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,0,0,0,0|0,0,0]=1 458 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,0,0,0,0|0,0,0]=1 459 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,0,0,0,0|0,0,0]=1 460 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 461 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 462 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 463 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,0,0,0,0|0,0,0]=1 464 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,0,0,0,0|0,0,0]=1 465 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,0,0,0,0|0,0,0]=1 466 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,0,0,0,0|0,0,0]=1 467 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,0,0,0,0|0,0,0]=1 468 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,0,0,0,0|0,0,0]=1 469 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,0,0,0,0|0,0,0]=1 470 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,0,0,0,0|0,0,0]=1 471 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,0,0,0,0|0,0,0]=1 472 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,0,0,0,0|0,0,0]=1 473 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,0,0,0,0|0,0,0]=1 474 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,0,0,0,0|0,0,0]=1 475 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,0,0,0,0|0,0,0]=1 476 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,0,0,0,0|0,0,0]=1 477 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,0,0,0,0|0,0,0]=1 478 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,0,0,0,0|1,0,0]=2 480 B11R1.22 CNC(=O)c1ncc(cn1)O 271570a_203496583355_200010127873 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.22 CNC(C)c1cc[n+](cc1)[O-] 269862a_106832991636_100000076990 [0,1,0,0,0,0|2,0,1]=4 482 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,1,0,0,0,0|1,0,1]=3 483 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,1,0,0,0,0|1,0,1]=3 484 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,1,0,0,0,0|1,0,1]=3 485 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,1,0,0,0,0|1,0,1]=3 486 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,1,0,0,0,0|1,0,1]=3 487 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,1,0,0,0,0|1,0,1]=3 488 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,1,0,0,0,0|1,0,1]=3 489 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,1,0,0,0,0|1,0,1]=3 490 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,1,0,0,0,0|1,0,1]=3 491 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,1,0,0,0,0|1,0,1]=3 492 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,1,0,0,0,0|1,0,1]=3 493 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,1,0,0,0,0|1,0,1]=3 494 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,1,0,0,0,0|1,0,1]=3 495 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,1,0,0,0,0|1,0,1]=3 496 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,1,0,0,0,0|1,0,1]=3 497 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,1,0,0,0,0|1,0,1]=3 498 B11R1.22 CNC(C)c1ccc(cn1)Br 2230a_100000723930_200000210301 [0,1,0,0,0,0|2,0,1]=4 499 B11R1.22 CNC(C)c1ccc(cn1)Br 269862a_106832991636_100000686046 [0,1,0,0,0,0|2,0,1]=4 500 B11R1.22 CNC(C)c1ccc(cn1)Br 270004a_106832991635_100000686046 [0,1,0,0,0,0|2,0,1]=4 501 B11R1.22 CNC(C)c1ccc(cn1)C 269862a_106832991636_100000084104 [0,1,0,0,0,0|2,0,1]=4 502 B11R1.22 CNC(C)c1ccc(cn1)C 270004a_106832991635_100000084104 [0,1,0,0,0,0|2,0,1]=4 503 B11R1.22 CNC(C)c1ccc(cn1)Cl 269862a_106832991636_100000692432 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.22 CNC(C)c1ccc(cn1)Cl 270004a_106832991635_100000692432 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.22 CNC(C)c1ccc(cn1)F 269862a_106832991636_100102946652 [0,1,0,0,0,0|2,0,1]=4 506 B11R1.22 CNC(C)c1ccc(cn1)F 270004a_106832991635_100102946652 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.22 CNC(C)c1ccc(nc1)Br 269862a_106832991636_100000684857 [0,1,0,0,0,0|2,0,1]=4 508 B11R1.22 CNC(C)c1ccc(nc1)C 2230a_100011815741_200000210301 [0,1,0,0,0,0|2,0,1]=4 509 B11R1.22 CNC(C)c1ccc(nc1)C 269862a_106832991636_100011280547 [0,1,0,0,0,0|2,0,1]=4 510 B11R1.22 CNC(C)c1ccc(nc1)C 34a_100011815741_200000210301 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.22 CNC(C)c1ccc(nc1)Cl 269862a_106832991636_100000690552 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.22 CNC(C)c1ccc(nc1)F 269862a_106832991636_100000085738 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,1,0,0,0,0|1,0,1]=3 514 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,1,0,0,0,0|1,0,1]=3 515 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,1,0,0,0,0|1,0,1]=3 516 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,1,0,0,0,0|1,0,1]=3 517 B11R1.22 CN[C@@H](C)c1ccc(nc1)Br 2230a_100015387476_200000210301 [0,1,0,0,0,0|2,0,1]=4 518 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,1,0,0,0,0|1,0,1]=3 519 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,1,0,0,0,0|1,0,1]=3 520 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,1,0,0,0,0|1,0,1]=3 521 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,1,0,0,0,0|1,0,1]=3 522 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,1,0,0,0,0|1,0,1]=3 523 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,0,0,0,0|1,0,0]=2 524 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,0,0,0,0|2,0,0]=3 526 B11R1.22 COC(=O)c1ccc(nn1)O 271570a_203496583355_100009816182 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.22 COC(=O)c1cnc(cn1)O 271570a_203496583355_100010219404 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.22 COC(=O)c1cnc(nc1)O 271570a_203496583355_100000729365 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.22 COC(=O)c1ncc(cn1)O 271570a_203496583355_100000690087 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,1,0,0,0,0|2,0,1]=4 531 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,1,0,0,0,0|2,0,1]=4 532 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,1,0,0,0,0|2,0,1]=4 533 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,1,0,0,0,0|2,0,1]=4 538 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,1,0,0,0,0|2,0,1]=4 539 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,1,0,0,0,0|2,0,1]=4 541 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,1,0,0,0,0|2,0,1]=4 545 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,1,0,0,0,0|1,0,1]=3 552 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,1,0,0,0,0|1,0,1]=3 553 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,1,0,0,0,0|1,0,1]=3 554 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,1,0,0,0,0|1,0,1]=3 555 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,1,0,0,0,0|1,0,1]=3 556 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,1,0,0,0,0|1,0,1]=3 557 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,1,0,0,0,0|1,0,1]=3 558 B11R1.22 C[C@H](N[13CH3])c1ccc(nc1)Br 2230a_100015387476_200025704644 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,1,0,0,0,0|2,0,1]=4 560 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,0,0,0,0|2,0,0]=3 562 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,1,0,0,0,0|2,0,1]=4 564 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,1,0,0,0,0|1,0,1]=3 565 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,1,0,0,0,0|1,0,1]=3 566 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,1,0,0,0,0|2,0,1]=4 567 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,1,0,0,0,0|2,0,1]=4 568 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 2230a_100011815741_200025704644 [0,1,0,0,0,0|2,0,1]=4 569 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 34a_100011815741_200025704644 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,1,0,0,0,0|2,0,0]=3 571 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,1,0,0,0,0|1,0,0]=2 573 B11R1.22 NNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781063 [0,1,0,0,0,0|2,0,0]=3 574 B11R1.22 NNC(=O)c1ccc(nc1)O 271570a_203496583355_100000189807 [0,1,0,0,0,0|2,0,0]=3 575 B11R1.22 NNC(=O)c1cnc(cn1)O 271570a_203496583355_200012021860 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.22 NNC(=O)c1ncc(cn1)O 271570a_203496583355_100009996755 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,0,0,0,0|2,0,0]=3 578 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,0,0,0,0|2,0,0]=3 579 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,0,0,0,0|2,0,0]=3 580 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,0,0,0,0|2,0,0]=3 583 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,1,0,0,0,0|2,0,1]=4 585 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,1,0,0,0,0|2,0,1]=4 586 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,1,0,0,0,0|2,0,1]=4 587 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,1,0,0,0,0|2,0,1]=4 588 B11R1.23 CC(N[13CH3])c1cccc(c1)Br 2230a_100020642005_200025704644 [0,1,0,0,0,0|1,0,1]=3 589 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 2230a_100102723534_200025704644 [0,1,0,0,0,0|1,0,1]=3 590 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 34a_100102723534_200025704644 [0,1,0,0,0,0|1,0,1]=3 591 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [0,1,0,0,0,0|1,0,1]=3 592 B11R1.23 CC(N[13CH3])c1cccc(n1)Br 2230a_200010173468_200025704644 [0,1,0,0,0,0|2,0,1]=4 593 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [0,1,0,0,0,0|2,0,1]=4 595 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [0,1,0,0,0,0|2,0,1]=4 596 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [0,1,0,0,0,0|2,0,1]=4 597 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [0,1,0,0,0,0|2,0,1]=4 599 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [0,1,0,0,0,0|1,0,0]=2 603 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,1,0,0,0,0|1,0,0]=2 604 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [0,1,0,0,0,0|1,0,0]=2 605 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [0,1,0,0,0,0|1,0,0]=2 606 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [0,1,0,0,0,0|1,0,0]=2 607 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [0,1,0,0,0,0|1,0,0]=2 608 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [0,1,0,0,0,0|1,0,0]=2 609 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [0,1,0,0,0,0|2,0,0]=3 610 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [0,1,0,0,0,0|1,0,2]=4 611 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000219648_100000210202 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000219648_100000204670 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000219648_100000210202 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.23 CCN(C)c1cccc(c1)Cl 2230a_100000220044_100000210202 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.23 CCN(C)c1cccc(c1)Cl 269982a_100000220044_100000204670 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.23 CCN(C)c1cccc(c1)Cl 34a_100000220044_100000210202 [0,1,0,0,0,0|3,0,0]=4 627 B11R1.23 CCN(C)c1cccc(c1)F 2230a_100020633736_100000210202 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.23 CCN(C)c1cccc(c1)F 269982a_100020633736_100000204670 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.23 CCN(C)c1cccc(c1)F 34a_100020633736_100000210202 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.23 CCN(C)c1cccc(c1)I 2230a_100000221217_100000210202 [0,1,0,0,0,0|3,0,0]=4 631 B11R1.23 CCN(C)c1cccc(c1)I 269982a_100000221217_100000204670 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.23 CCN(C)c1cccc(c1)I 34a_100000221217_100000210202 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 638 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.23 CCN([13CH3])c1cccc(c1)Br 2230a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 640 B11R1.23 CCN([13CH3])c1cccc(c1)Br 269982a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.23 CCN([13CH3])c1cccc(c1)Br 34a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [0,1,0,0,0,0|3,0,0]=4 643 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [0,1,0,0,0,0|3,0,0]=4 644 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 647 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [0,1,0,0,0,0|1,0,0]=2 651 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [0,1,0,0,0,0|0,0,0]=1 652 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [0,1,0,0,0,0|0,0,0]=1 653 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [0,1,0,0,0,0|0,0,0]=1 654 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [0,1,0,0,0,0|0,0,0]=1 655 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [0,1,0,0,0,0|0,0,0]=1 656 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 657 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 658 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 659 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [0,1,0,0,0,0|0,0,0]=1 660 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [0,1,0,0,0,0|0,0,0]=1 661 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [0,1,0,0,0,0|0,0,0]=1 662 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [0,1,0,0,0,0|0,0,0]=1 663 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [0,1,0,0,0,0|0,0,0]=1 664 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [0,1,0,0,0,0|0,0,0]=1 665 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [0,1,0,0,0,0|0,0,0]=1 666 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [0,1,0,0,0,0|0,0,0]=1 667 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [0,1,0,0,0,0|0,0,0]=1 668 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [0,1,0,0,0,0|0,0,0]=1 669 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [0,1,0,0,0,0|0,0,0]=1 670 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [0,1,0,0,0,0|0,0,0]=1 671 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [0,1,0,0,0,0|0,0,0]=1 672 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [0,1,0,0,0,0|0,0,0]=1 673 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [0,1,0,0,0,0|0,0,0]=1 674 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [0,1,0,0,0,0|1,0,0]=2 675 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [0,1,0,0,0,0|1,0,0]=2 676 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [0,1,0,0,0,0|1,0,0]=2 677 B11R1.23 CNC(C)c1cc(ccn1)Br 269862a_106832991636_100000709912 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.23 CNC(C)c1cc(ccn1)Br 270004a_106832991635_100000709912 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.23 CNC(C)c1cc(ccn1)C 2230a_100011933787_200000210301 [0,1,0,0,0,0|2,0,1]=4 680 B11R1.23 CNC(C)c1cc(ccn1)C 269862a_106832991636_100000728896 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.23 CNC(C)c1cc(ccn1)C 270004a_106832991635_100000728896 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.23 CNC(C)c1cc(ccn1)Cl 269862a_106832991636_100000099826 [0,1,0,0,0,0|2,0,1]=4 683 B11R1.23 CNC(C)c1cc(ccn1)Cl 270004a_106832991635_100000099826 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.23 CNC(C)c1cccc(c1)Br 2230a_100020642005_200000210301 [0,1,0,0,0,0|1,0,1]=3 685 B11R1.23 CNC(C)c1cccc(c1)Br 269862a_106832991636_100000210093 [0,1,0,0,0,0|1,0,1]=3 686 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [0,1,0,0,0,0|1,0,1]=3 687 B11R1.23 CNC(C)c1cccc(c1)Cl 2230a_100102723534_200000210301 [0,1,0,0,0,0|1,0,1]=3 688 B11R1.23 CNC(C)c1cccc(c1)Cl 269862a_106832991636_200000210964 [0,1,0,0,0,0|1,0,1]=3 689 B11R1.23 CNC(C)c1cccc(c1)Cl 34a_100102723534_200000210301 [0,1,0,0,0,0|1,0,1]=3 690 B11R1.23 CNC(C)c1cccc(c1)F 269862a_106832991636_100000187083 [0,1,0,0,0,0|1,0,1]=3 691 B11R1.23 CNC(C)c1cccc(c1)I 269862a_106832991636_100011356966 [0,1,0,0,0,0|1,0,1]=3 692 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [0,1,0,0,0,0|1,0,1]=3 693 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [0,1,0,0,0,0|1,0,1]=3 694 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [0,1,0,0,0,0|1,0,1]=3 695 B11R1.23 CNC(C)c1cccc(n1)Br 2230a_200010173468_200000210301 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.23 CNC(C)c1cccc(n1)Br 269862a_106832991636_100009816502 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.23 CNC(C)c1cccc(n1)C 2230a_100011877385_200000210301 [0,1,0,0,0,0|2,0,1]=4 698 B11R1.23 CNC(C)c1cccc(n1)C 269862a_106832991636_100011877301 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.23 CNC(C)c1cccc(n1)Cl 269862a_106832991636_100000085735 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.23 CNC(C)c1cccc(n1)F 269862a_106832991636_100000092306 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.23 CNC(C)c1ccnc(c1)Br 269862a_106832991636_100010177706 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.23 CNC(C)c1ccnc(c1)C 269862a_106832991636_100011998260 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.23 CNC(C)c1ccnc(c1)Cl 269862a_106832991636_100000685609 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.23 CNC(C)c1cncc(c1)Br 269862a_106832991636_100011216243 [0,1,0,0,0,0|2,0,1]=4 705 B11R1.23 CNC(C)c1cncc(c1)C 269862a_106832991636_100000702010 [0,1,0,0,0,0|2,0,1]=4 706 B11R1.23 CNC(C)c1cncc(c1)F 269862a_106832991636_100000758212 [0,1,0,0,0,0|2,0,1]=4 707 B11R1.23 CN[C@@H](C)c1cccc(n1)F 2230a_100025709760_200000210301 [0,1,0,0,0,0|2,0,1]=4 708 B11R1.23 CN[C@@H](C)c1cccc(n1)F 34a_100025709760_200000210301 [0,1,0,0,0,0|2,0,1]=4 709 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [0,1,0,0,0,0|1,0,1]=3 710 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [0,1,0,0,0,0|1,0,1]=3 711 B11R1.23 CN[C@H](C)c1cccc(c1)F 2230a_100015193778_200000210301 [0,1,0,0,0,0|1,0,1]=3 712 B11R1.23 CN[C@H](C)c1cccc(c1)F 34a_100015193778_200000210301 [0,1,0,0,0,0|1,0,1]=3 713 B11R1.23 CN[C@H](C)c1cncc(c1)Br 2230a_100012350620_200000210301 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.23 COC(=O)c1cc(ncn1)O 271570a_203496583355_100000051410 [0,1,0,0,0,0|3,0,0]=4 716 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [0,1,0,0,0,0|1,0,0]=2 717 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [0,1,0,0,0,0|2,0,0]=3 718 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [0,1,0,0,0,0|2,0,0]=3 719 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [0,1,0,0,0,0|3,0,0]=4 720 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [0,1,0,0,0,0|2,0,0]=3 721 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.23 COC(=O)c1cnnc(c1)O 271570a_203496583355_100009862058 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [0,1,0,0,0,0|2,0,1]=4 724 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [0,1,0,0,0,0|2,0,1]=4 729 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [0,1,0,0,0,0|2,0,1]=4 730 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 2230a_100015193778_200025704644 [0,1,0,0,0,0|1,0,1]=3 736 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 34a_100015193778_200025704644 [0,1,0,0,0,0|1,0,1]=3 737 B11R1.23 C[C@@H](N[13CH3])c1cncc(c1)Br 2230a_100012350620_200025704644 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [0,1,0,0,0,0|2,0,1]=4 739 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [0,1,0,0,0,0|2,0,1]=4 740 B11R1.23 C[C@H](N[13CH3])c1cccc(n1)F 2230a_100025709760_200025704644 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.23 C[C@H](N[13CH3])c1cccc(n1)F 34a_100025709760_200025704644 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [0,1,0,0,0,0|2,0,0]=3 743 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [0,1,0,0,0,0|1,0,1]=3 746 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [0,1,0,0,0,0|1,0,1]=3 747 B11R1.23 Cc1cccc(n1)C(C)N[13CH3] 2230a_100011877385_200025704644 [0,1,0,0,0,0|2,0,1]=4 748 B11R1.23 Cc1ccnc(c1)C(C)N[13CH3] 2230a_100011933787_200025704644 [0,1,0,0,0,0|2,0,1]=4 749 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [0,1,0,0,0,0|2,0,0]=3 751 B11R1.23 NNC(=O)c1cc(ccn1)O 271570a_203496583355_100000017052 [0,1,0,0,0,0|2,0,0]=3 752 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [0,1,0,0,0,0|1,0,0]=2 753 B11R1.23 NNC(=O)c1cccc(n1)O 271570a_203496583355_100011631096 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.23 NNC(=O)c1ccnc(c1)O 271570a_203496583355_100000021280 [0,1,0,0,0,0|2,0,0]=3 755 B11R1.23 NNC(=O)c1cncc(c1)O 271570a_203496583355_100000189809 [0,1,0,0,0,0|2,0,0]=3 756 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [0,1,0,0,0,0|2,0,0]=3 757 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [0,1,0,0,0,0|2,0,0]=3 758 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [0,1,0,0,0,0|2,0,0]=3 759 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [0,1,0,0,0,0|2,0,0]=3 760 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [0,1,0,0,0,0|2,0,0]=3 761 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,1,0,0,0,0|2,0,0]=3 764 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.36 CC(=C(C)c1ccccn1)C 271570a_200000049429_100011216584 [0,1,0,0,0,0|3,0,0]=4 766 B11R1.36 CC(=C(C)c1cccnc1)C 271570a_200000049429_100000752921 [0,1,0,0,0,0|3,0,0]=4 767 B11R1.36 CC(=C(C)c1ccncc1)C 271570a_200000049429_100000035832 [0,1,0,0,0,0|3,0,0]=4 768 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [0,1,0,0,0,0|3,0,0]=4 773 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [0,1,0,0,0,0|2,0,1]=4 774 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [0,1,0,0,0,0|1,0,2]=4 775 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,1,0,0,0,0|1,0,0]=2 776 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [0,1,0,0,0,0|3,0,0]=4 779 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [0,1,0,0,0,0|1,0,1]=3 788 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [0,1,0,0,0,0|1,0,1]=3 789 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [0,1,0,0,0,0|1,0,1]=3 790 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [0,1,0,0,0,0|1,0,1]=3 791 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [0,1,0,0,0,0|1,0,1]=3 792 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [0,1,0,0,0,0|1,0,1]=3 793 B11R1.36 CC(c1ccccn1)N(C)C 2230a_100000231138_200000210301 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.36 CC(c1ccccn1)N(C)C 269982a_100000231138_200000210301 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 2230a_100000231138_200025704644 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 269982a_100000231138_200025704644 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.36 CC(c1cccnc1)N(C)C 2230a_100000232774_200000210301 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.36 CC(c1cccnc1)N(C)C 269982a_100000232774_200000210301 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 2230a_100000232774_200025704644 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 269982a_100000232774_200025704644 [0,1,0,0,0,0|2,0,1]=4 801 B11R1.36 CC(c1ccncc1)N(C)C 2230a_100000231139_200000210301 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.36 CC(c1ccncc1)N(C)C 269982a_100000231139_200000210301 [0,1,0,0,0,0|2,0,1]=4 803 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 2230a_100000231139_200025704644 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 269982a_100000231139_200025704644 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,1,0,0,0,0|0,0,0]=1 806 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,1,0,0,0,0|0,0,0]=1 807 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,1,0,0,0,0|0,0,0]=1 808 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,1,0,0,0,0|0,0,0]=1 809 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [0,1,0,0,0,0|1,0,2]=4 812 B11R1.222 CC(N[13CH3])c1ccccc1Br 2230a_100000181357_200025704644 [0,1,0,0,0,0|1,0,1]=3 813 B11R1.222 CC(N[13CH3])c1ccccc1Cl 2230a_100000174978_200025704644 [0,1,0,0,0,0|1,0,1]=3 814 B11R1.222 CC(N[13CH3])c1ccccc1Cl 34a_100000174978_200025704644 [0,1,0,0,0,0|1,0,1]=3 815 B11R1.222 CC(N[13CH3])c1ccccc1F 2230a_100000181408_200025704644 [0,1,0,0,0,0|1,0,1]=3 816 B11R1.222 CC(N[13CH3])c1ccccc1F 34a_100000181408_200025704644 [0,1,0,0,0,0|1,0,1]=3 817 B11R1.222 CC(N[13CH3])c1cccnc1O 2230a_100159269580_200025704644 [0,1,0,0,0,0|2,0,1]=4 818 B11R1.222 CC(N[13CH3])c1ncccc1Br 2230a_100159271932_200025704644 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [0,1,0,0,0,0|2,0,1]=4 823 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [0,1,0,0,0,0|2,0,1]=4 825 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [0,1,0,0,0,0|2,0,1]=4 826 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_100000181259_200025704644 [0,1,0,0,0,0|2,0,1]=4 827 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_200025704644_100000181259 [0,1,0,0,0,0|2,0,1]=4 828 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200000741388_200025704644 [0,1,0,0,0,0|2,0,1]=4 829 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200025704644_200000741388 [0,1,0,0,0,0|2,0,1]=4 830 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [0,1,0,0,0,0|1,0,0]=2 831 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [0,1,0,0,0,0|1,0,0]=2 832 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [0,1,0,0,0,0|1,0,0]=2 833 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [0,1,0,0,0,0|1,0,0]=2 834 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [0,1,0,0,0,0|1,0,0]=2 835 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [0,1,0,0,0,0|1,0,0]=2 836 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [0,1,0,0,0,0|1,0,0]=2 837 B11R1.222 CCN(C)c1ccccc1Br 2230a_100020606079_100000210202 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.222 CCN(C)c1ccccc1Br 2230a_114873767003_200000210301 [0,1,0,0,0,0|3,0,0]=4 839 B11R1.222 CCN(C)c1ccccc1Br 269982a_100020606079_100000204670 [0,1,0,0,0,0|3,0,0]=4 840 B11R1.222 CCN(C)c1ccccc1Br 269982a_114873767003_200000210301 [0,1,0,0,0,0|3,0,0]=4 841 B11R1.222 CCN(C)c1ccccc1Br 34a_100020606079_100000210202 [0,1,0,0,0,0|3,0,0]=4 842 B11R1.222 CCN(C)c1ccccc1Br 34a_114873767003_200000210301 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.222 CCN(C)c1ccccc1C 2230a_100000211084_200000210301 [0,1,0,0,0,0|3,0,0]=4 844 B11R1.222 CCN(C)c1ccccc1C 2230a_100000219699_100000210202 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.222 CCN(C)c1ccccc1C 269982a_100000211084_200000210301 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.222 CCN(C)c1ccccc1C 269982a_100000219699_100000204670 [0,1,0,0,0,0|3,0,0]=4 847 B11R1.222 CCN(C)c1ccccc1C 34a_100000211084_200000210301 [0,1,0,0,0,0|3,0,0]=4 848 B11R1.222 CCN(C)c1ccccc1C 34a_100000219699_100000210202 [0,1,0,0,0,0|3,0,0]=4 849 B11R1.222 CCN(C)c1ccccc1Cl 2230a_100000219374_100000210202 [0,1,0,0,0,0|3,0,0]=4 850 B11R1.222 CCN(C)c1ccccc1Cl 269982a_100000219374_100000204670 [0,1,0,0,0,0|3,0,0]=4 851 B11R1.222 CCN(C)c1ccccc1Cl 34a_100000219374_100000210202 [0,1,0,0,0,0|3,0,0]=4 852 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220357_100000210202 [0,1,0,0,0,0|3,0,0]=4 853 B11R1.222 CCN(C)c1ccccc1F 2230a_100000220365_200000210301 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220357_100000204670 [0,1,0,0,0,0|3,0,0]=4 855 B11R1.222 CCN(C)c1ccccc1F 269982a_100000220365_200000210301 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.222 CCN(C)c1ccccc1F 34a_100000220357_100000210202 [0,1,0,0,0,0|3,0,0]=4 857 B11R1.222 CCN(C)c1ccccc1F 34a_100000220365_200000210301 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.222 CCN(C)c1ccccc1F 38a_100000220357_100000204670 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.222 CCN([13CH3])c1ccccc1Br 2230a_114873767003_200025704644 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.222 CCN([13CH3])c1ccccc1Br 269982a_114873767003_200025704644 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.222 CCN([13CH3])c1ccccc1Br 34a_114873767003_200025704644 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.222 CCN([13CH3])c1ccccc1C 2230a_100000211084_200025704644 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.222 CCN([13CH3])c1ccccc1C 269982a_100000211084_200025704644 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.222 CCN([13CH3])c1ccccc1C 34a_100000211084_200025704644 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.222 CCN([13CH3])c1ccccc1F 2230a_100000220365_200025704644 [0,1,0,0,0,0|3,0,0]=4 868 B11R1.222 CCN([13CH3])c1ccccc1F 269982a_100000220365_200025704644 [0,1,0,0,0,0|3,0,0]=4 869 B11R1.222 CCN([13CH3])c1ccccc1F 34a_100000220365_200025704644 [0,1,0,0,0,0|3,0,0]=4 870 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [0,1,0,0,0,0|3,0,0]=4 871 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [0,1,0,0,0,0|0,0,0]=1 872 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [0,1,0,0,0,0|0,0,0]=1 873 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [0,1,0,0,0,0|0,0,0]=1 874 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [0,1,0,0,0,0|0,0,0]=1 875 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [0,1,0,0,0,0|0,0,0]=1 876 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [0,1,0,0,0,0|0,0,0]=1 877 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [0,1,0,0,0,0|0,0,0]=1 878 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [0,1,0,0,0,0|0,0,0]=1 879 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [0,1,0,0,0,0|0,0,0]=1 880 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [0,1,0,0,0,0|0,0,0]=1 881 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [0,1,0,0,0,0|0,0,0]=1 882 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [0,1,0,0,0,0|0,0,0]=1 883 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [0,1,0,0,0,0|0,0,0]=1 884 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [0,1,0,0,0,0|0,0,0]=1 885 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [0,1,0,0,0,0|0,0,0]=1 886 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [0,1,0,0,0,0|0,0,0]=1 887 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [0,1,0,0,0,0|0,0,0]=1 888 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [0,1,0,0,0,0|0,0,0]=1 889 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [0,1,0,0,0,0|0,0,0]=1 890 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [0,1,0,0,0,0|0,0,0]=1 891 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [0,1,0,0,0,0|0,0,0]=1 892 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [0,1,0,0,0,0|0,0,0]=1 893 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [0,1,0,0,0,0|0,0,0]=1 894 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [0,1,0,0,0,0|0,0,0]=1 895 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [0,1,0,0,0,0|0,0,0]=1 896 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [0,1,0,0,0,0|1,0,0]=2 897 B11R1.222 CNC(C)c1ccccc1Br 2230a_100000181357_200000210301 [0,1,0,0,0,0|1,0,1]=3 898 B11R1.222 CNC(C)c1ccccc1Br 269862a_106832991636_100000187085 [0,1,0,0,0,0|1,0,1]=3 899 B11R1.222 CNC(C)c1ccccc1C 2230a_100000181355_200000210301 [0,1,0,0,0,0|1,0,1]=3 900 B11R1.222 CNC(C)c1ccccc1C 269862a_106832991636_100000211656 [0,1,0,0,0,0|1,0,1]=3 901 B11R1.222 CNC(C)c1ccccc1C 34a_100000181355_200000210301 [0,1,0,0,0,0|1,0,1]=3 902 B11R1.222 CNC(C)c1ccccc1Cl 2230a_100000174978_200000210301 [0,1,0,0,0,0|1,0,1]=3 903 B11R1.222 CNC(C)c1ccccc1Cl 2230a_106832991635_100000181259 [0,1,0,0,0,0|1,0,1]=3 904 B11R1.222 CNC(C)c1ccccc1Cl 269862a_106832991636_100000210134 [0,1,0,0,0,0|1,0,1]=3 905 B11R1.222 CNC(C)c1ccccc1Cl 34a_100000174978_200000210301 [0,1,0,0,0,0|1,0,1]=3 906 B11R1.222 CNC(C)c1ccccc1Cl 7a_106832991635_100000181259 [0,1,0,0,0,0|1,0,1]=3 907 B11R1.222 CNC(C)c1ccccc1F 2230a_100000181408_200000210301 [0,1,0,0,0,0|1,0,1]=3 908 B11R1.222 CNC(C)c1ccccc1F 2230a_106832991635_200000741388 [0,1,0,0,0,0|1,0,1]=3 909 B11R1.222 CNC(C)c1ccccc1F 269862a_106832991636_100000210632 [0,1,0,0,0,0|1,0,1]=3 910 B11R1.222 CNC(C)c1ccccc1F 34a_100000181408_200000210301 [0,1,0,0,0,0|1,0,1]=3 911 B11R1.222 CNC(C)c1ccccc1F 34a_100102657272_200000741388 [0,1,0,0,0,0|1,0,1]=3 912 B11R1.222 CNC(C)c1ccccc1F 7a_106832991635_200000741388 [0,1,0,0,0,0|1,0,1]=3 913 B11R1.222 CNC(C)c1ccccc1I 269862a_106832991636_100000751169 [0,1,0,0,0,0|1,0,1]=3 914 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [0,1,0,0,0,0|1,0,1]=3 915 B11R1.222 CNC(C)c1cccnc1C 269862a_106832991636_100011995960 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.222 CNC(C)c1cccnc1O 2230a_100159269580_200000210301 [0,1,0,0,0,0|2,0,1]=4 917 B11R1.222 CNC(C)c1ccncc1Br 269862a_106832991636_100009993184 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.222 CNC(C)c1ccncc1Cl 269862a_106832991636_100012001414 [0,1,0,0,0,0|2,0,1]=4 919 B11R1.222 CNC(C)c1ccncc1F 269862a_106832991636_100000727669 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.222 CNC(C)c1cnccc1C 269862a_106832991636_100000693228 [0,1,0,0,0,0|2,0,1]=4 921 B11R1.222 CNC(C)c1cnccc1Cl 269862a_106832991636_100160469449 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.222 CNC(C)c1ncccc1Br 2230a_100159271932_200000210301 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.222 CNC(C)c1ncccc1Br 269862a_106832991636_100012348690 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.222 CNC(C)c1ncccc1C 2230a_100011536111_200000210301 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.222 CNC(C)c1ncccc1C 269862a_106832991636_100011536074 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.222 CNC(C)c1ncccc1Cl 269862a_106832991636_100015267551 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.222 CNC(C)c1ncccc1F 269862a_106832991636_100011997767 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.222 CNC(C)c1ncccc1I 269862a_106832991636_200015599370 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [0,1,0,0,0,0|1,0,1]=3 930 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [0,1,0,0,0,0|1,0,0]=2 931 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [0,1,0,0,0,0|2,0,0]=3 932 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.222 COC(=O)c1cncnc1O 271570a_203496583355_100000726419 [0,1,0,0,0,0|3,0,0]=4 935 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [0,1,0,0,0,0|2,0,0]=3 936 B11R1.222 COC(=O)c1nccnc1O 271570a_203496583355_100000688410 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.222 COC(=O)c1ncncc1O 271570a_203496583355_100012360100 [0,1,0,0,0,0|3,0,0]=4 938 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [0,1,0,0,0,0|2,0,1]=4 939 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [0,1,0,0,0,0|2,0,1]=4 940 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [0,1,0,0,0,0|2,0,1]=4 941 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [0,1,0,0,0,0|2,0,1]=4 942 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [0,1,0,0,0,0|2,0,1]=4 943 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.222 CSC(C)c1ccccc1Cl 62a_100000181259_200000210301 [0,1,0,0,0,0|2,0,1]=4 949 B11R1.222 CSC(C)c1ccccc1Cl 62a_200000210301_100000181259 [0,1,0,0,0,0|2,0,1]=4 950 B11R1.222 CSC(C)c1ccccc1F 62a_200000210301_200000741388 [0,1,0,0,0,0|2,0,1]=4 951 B11R1.222 CSC(C)c1ccccc1F 62a_200000741388_200000210301 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [0,1,0,0,0,0|1,0,1]=3 953 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [0,1,0,0,0,0|2,0,0]=3 954 B11R1.222 Cc1ccccc1C(C)N[13CH3] 2230a_100000181355_200025704644 [0,1,0,0,0,0|1,0,1]=3 955 B11R1.222 Cc1ccccc1C(C)N[13CH3] 34a_100000181355_200025704644 [0,1,0,0,0,0|1,0,1]=3 956 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [0,1,0,0,0,0|2,0,1]=4 958 B11R1.222 Cc1cccnc1C(C)N[13CH3] 2230a_100011536111_200025704644 [0,1,0,0,0,0|2,0,1]=4 959 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [0,1,0,0,0,0|1,0,0]=2 960 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [0,1,0,0,0,0|2,0,0]=3 961 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [0,1,0,0,0,0|2,0,0]=3 962 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [0,1,0,0,0,0|2,0,0]=3 963 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [0,1,0,0,0,0|2,0,0]=3 964 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [0,1,0,0,0,0|2,0,0]=3 965 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [0,1,0,0,0,0|2,0,0]=3 966 B9R0.8 C/C=C/CC(=O)C(=O)NC 1458a_100011218921_100102629194 [0,0,1,0,0,0|1,0,2]=4 967 B9R0.8 C=CCCC(=O)C(=O)NC 1458a_100011218921_100000754431 [0,0,1,0,0,0|1,0,2]=4 968 B9R0.8 C=CCNC(=O)C(=O)NC 1626a_100020586998_100011218921 [0,0,1,0,0,0|2,0,1]=4 969 B9R0.8 C=CCNC(=O)C(=O)NC 240690a_100020586998_100011218921 [0,0,1,0,0,0|2,0,1]=4 970 B9R0.8 C=CCNC(=O)C(=O)NC 527a_100020586998_100011218921 [0,0,1,0,0,0|2,0,1]=4 971 B9R0.8 CC=CCC(=O)C(=O)NC 1458a_100011218921_100000070051 [0,0,1,0,0,0|1,0,2]=4 972 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,1,0,0|2,0,1]=4 973 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,1,0,0|2,0,1]=4 974 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [0,0,0,1,0,0|1,0,2]=4 975 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [0,0,0,1,0,0|1,0,1]=3 976 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,0,0,1,0,0|2,0,1]=4 977 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,0,0,1,0,0|2,0,1]=4 978 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,0,0,1,0,0|2,0,1]=4 979 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,0,0,1,0,0|2,0,1]=4 980 B9R1.11 CC(N[13CH3])c1cccs1 2230a_100000703493_200025704644 [0,0,0,0,1,0|2,0,1]=4 981 B9R1.11 CC(N[13CH3])c1ccoc1 2230a_100000690049_200025704644 [0,0,0,0,1,0|2,0,1]=4 982 B9R1.11 CC(N[13CH3])c1ccsc1 2230a_100000748604_200025704644 [0,0,0,0,1,0|2,0,1]=4 983 B9R1.11 CNC(=O)C1=CCCC1 11a_106832991635_100000038896 [0,0,0,0,1,0|0,0,3]=4 984 B9R1.11 CNC(=O)C1=CCCC1 1626a_100102657272_100000038896 [0,0,0,0,1,0|0,0,3]=4 985 B9R1.11 CNC(=O)C1=CCCC1 240690a_100102657272_100000038896 [0,0,0,0,1,0|0,0,3]=4 986 B9R1.11 CNC(=O)C1=CCOC1 11a_106832991635_100000139269 [0,0,0,0,1,0|1,0,2]=4 987 B9R1.11 CNC(=O)C1=CCOC1 1626a_100102657272_100000139269 [0,0,0,0,1,0|1,0,2]=4 988 B9R1.11 CNC(=O)C1=CCOC1 240690a_100102657272_100000139269 [0,0,0,0,1,0|1,0,2]=4 989 B9R1.11 CNC(=O)C1=COCC1 1626a_100102657272_100000750620 [0,0,0,0,1,0|1,0,2]=4 990 B9R1.11 CNC(=O)C1=COCC1 240690a_100102657272_100000750620 [0,0,0,0,1,0|1,0,2]=4 991 B9R1.11 CNC(=O)C1CC=CC1 11a_106832991635_100000759439 [0,0,0,0,1,0|0,0,3]=4 992 B9R1.11 CNC(=O)C1CC=CC1 1626a_100102657272_100000759439 [0,0,0,0,1,0|0,0,3]=4 993 B9R1.11 CNC(=O)C1CC=CC1 240690a_100102657272_100000759439 [0,0,0,0,1,0|0,0,3]=4 994 B9R1.11 CNC(=O)C1CC=CC1 527a_100102657272_100000759439 [0,0,0,0,1,0|0,0,3]=4 995 B9R1.11 CNC(=O)N1CC=CC1 2708a_100102657272_100015195280 [0,0,0,0,1,0|1,0,2]=4 996 B9R1.11 CNC(=O)N1CC=CC1 273464a_100102657272_100015195280 [0,0,0,0,1,0|1,0,2]=4 997 B9R1.11 CNC(C)c1cc[nH]c1 269862a_106832991636_100000753940 [0,0,0,0,1,0|2,0,1]=4 998 B9R1.11 CNC(C)c1ccc[nH]1 269862a_106832991636_100000183661 [0,0,0,0,1,0|2,0,1]=4 999 B9R1.11 CNC(C)c1cccs1 2230a_100000703493_200000210301 [0,0,0,0,1,0|2,0,1]=4 1000 B9R1.11 CNC(C)c1cccs1 269862a_106832991636_100000185736 [0,0,0,0,1,0|2,0,1]=4 1001 B9R1.11 CNC(C)c1ccoc1 2230a_100000690049_200000210301 [0,0,0,0,1,0|2,0,1]=4 1002 B9R1.11 CNC(C)c1ccsc1 2230a_100000748604_200000210301 [0,0,0,0,1,0|2,0,1]=4 1003 B9R1.11 CNC(C)c1ccsc1 269862a_106832991636_100000747891 [0,0,0,0,1,0|2,0,1]=4 1004 B9R1.11 CN[C@H](C)c1ccco1 2230a_100160469435_200000210301 [0,0,0,0,1,0|2,0,1]=4 1005 B9R1.11 C[C@@H](N[13CH3])c1ccco1 2230a_100160469435_200025704644 [0,0,0,0,1,0|2,0,1]=4 1006 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [0,0,0,0,0,1|1,0,1]=3 1007 B11R1.40 C#CC(=O)Cc1ccccn1 1458a_100000211873_100000721315 [0,0,0,0,0,1|2,0,1]=4 1008 B11R1.40 C#CC(=O)Cc1cccnc1 1458a_100000211873_100000733263 [0,0,0,0,0,1|2,0,1]=4 1009 B11R1.40 C#CC(=O)Cc1ccncc1 1458a_100000211873_100000705612 [0,0,0,0,0,1|2,0,1]=4 1010 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,0,0,0,0,1|1,0,1]=3 1011 B11R1.40 C=CC(=O)Cc1ccccn1 1458a_100000185746_100000721315 [0,0,0,0,0,1|2,0,1]=4 1012 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [0,0,0,0,0,1|2,0,1]=4 1013 B11R1.40 C=CC(=O)Cc1ccncc1 1458a_100000185746_100000705612 [0,0,0,0,0,1|2,0,1]=4 1014 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,0,0,0,0,1|1,0,1]=3 1015 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,0,0,0,0,1|1,0,1]=3 1016 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [0,0,0,0,0,1|2,0,1]=4 1017 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [0,0,0,0,0,1|2,0,1]=4 1018 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200011218536_200025704644 [0,0,0,0,0,1|2,0,1]=4 1019 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200025704644_200011218536 [0,0,0,0,0,1|2,0,1]=4 1020 B11R1.40 CC(Cc1ccccn1)N[13CH3] 2230a_100000238496_200025704644 [0,0,0,0,0,1|2,0,1]=4 1021 B11R1.40 CC(Cc1cccnc1)N[13CH3] 2230a_100011207255_200025704644 [0,0,0,0,0,1|2,0,1]=4 1022 B11R1.40 CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210202 [0,0,0,0,0,1|2,0,0]=3 1023 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [0,0,0,0,0,1|1,0,0]=2 1024 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000210414_100000721315 [0,0,0,0,0,1|2,0,0]=3 1025 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000233486_100000210202 [0,0,0,0,0,1|2,0,0]=3 1026 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000210414_100000733263 [0,0,0,0,0,1|2,0,0]=3 1027 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000737805_100000210202 [0,0,0,0,0,1|2,0,0]=3 1028 B11R1.40 CCC(=O)Cc1cccnn1 1458a_100000210414_100016990269 [0,0,0,0,0,1|3,0,0]=4 1029 B11R1.40 CCC(=O)Cc1ccncc1 1458a_100000210414_100000705612 [0,0,0,0,0,1|2,0,0]=3 1030 B11R1.40 CCC(=O)Cc1cnccn1 1458a_100000210414_100016995436 [0,0,0,0,0,1|3,0,0]=4 1031 B11R1.40 CCC(=O)Cc1cncnc1 1458a_100000210414_100015196519 [0,0,0,0,0,1|3,0,0]=4 1032 B11R1.40 CCC(=O)Cc1cncnc1 1458a_100000721575_100000210202 [0,0,0,0,0,1|3,0,0]=4 1033 B11R1.40 CCC(=O)Cc1ncccn1 1458a_100000210414_100000703007 [0,0,0,0,0,1|3,0,0]=4 1034 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [0,0,0,0,0,1|1,0,0]=2 1035 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [0,0,0,0,0,1|1,0,0]=2 1036 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [0,0,0,0,0,1|1,0,0]=2 1037 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [0,0,0,0,0,1|1,0,0]=2 1038 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [0,0,0,0,0,1|2,0,1]=4 1039 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [0,0,0,0,0,1|2,0,1]=4 1040 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [0,0,0,0,0,1|2,0,1]=4 1041 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [0,0,0,0,0,1|2,0,1]=4 1042 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [0,0,0,0,0,1|2,0,1]=4 1043 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186898_100000210202 [0,0,0,0,0,1|3,0,0]=4 1044 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186914_200000210301 [0,0,0,0,0,1|3,0,0]=4 1045 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000225621_100015291786 [0,0,0,0,0,1|3,0,0]=4 1046 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186898_100000204670 [0,0,0,0,0,1|3,0,0]=4 1047 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186914_200000210301 [0,0,0,0,0,1|3,0,0]=4 1048 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000225621_100000211182 [0,0,0,0,0,1|3,0,0]=4 1049 B11R1.40 CCN([13CH3])Cc1ccccc1 2230a_100000186914_200025704644 [0,0,0,0,0,1|3,0,0]=4 1050 B11R1.40 CCN([13CH3])Cc1ccccc1 269982a_100000186914_200025704644 [0,0,0,0,0,1|3,0,0]=4 1051 B11R1.40 CNC(=O)C[n+]1ccccc1 11a_106832991635_200000086051 [0,0,0,0,0,1|1,0,0]=2 1052 B11R1.40 CNC(=O)C[n+]1ccccc1 240690a_100102657272_200000086051 [0,0,0,0,0,1|1,0,0]=2 1053 B11R1.40 CNC(=O)C[n+]1ccccc1 527a_100102657272_200000086051 [0,0,0,0,0,1|1,0,0]=2 1054 B11R1.40 CNC(=O)Cc1ccccn1 11a_106832991635_100000233486 [0,0,0,0,0,1|1,0,0]=2 1055 B11R1.40 CNC(=O)Cc1cccnc1 11a_106832991635_100000737805 [0,0,0,0,0,1|1,0,0]=2 1056 B11R1.40 CNC(=O)Cc1cccnc1 240690a_100102657272_100000737805 [0,0,0,0,0,1|1,0,0]=2 1057 B11R1.40 CNC(=O)Cc1cccnc1 527a_100102657272_100000737805 [0,0,0,0,0,1|1,0,0]=2 1058 B11R1.40 CNC(=O)Cc1ccncc1 11a_106832991635_100011201483 [0,0,0,0,0,1|1,0,0]=2 1059 B11R1.40 CNC(=O)Cc1ccncc1 240690a_100102657272_100011201483 [0,0,0,0,0,1|1,0,0]=2 1060 B11R1.40 CNC(=O)Cc1cnccn1 11a_106832991635_100000726051 [0,0,0,0,0,1|2,0,0]=3 1061 B11R1.40 CNC(=O)Cc1cnccn1 240690a_100102657272_100000726051 [0,0,0,0,0,1|2,0,0]=3 1062 B11R1.40 CNC(=O)Cc1cnccn1 527a_100102657272_100000726051 [0,0,0,0,0,1|2,0,0]=3 1063 B11R1.40 CNC(=O)Cc1cncnc1 11a_106832991635_100000721575 [0,0,0,0,0,1|2,0,0]=3 1064 B11R1.40 CNC(=O)Cc1cncnc1 240690a_100102657272_100000721575 [0,0,0,0,0,1|2,0,0]=3 1065 B11R1.40 CNC(=O)Cc1cncnc1 527a_100102657272_100000721575 [0,0,0,0,0,1|2,0,0]=3 1066 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [0,0,0,0,0,1|0,0,0]=1 1067 B11R1.40 CNC(C)C[n+]1ccccc1 270004a_106832991635_100000034229 [0,0,0,0,0,1|2,0,1]=4 1068 B11R1.40 CNC(C)Cc1ccccc1 34a_100102657272_200011218536 [0,0,0,0,0,1|1,0,1]=3 1069 B11R1.40 CNC(C)Cc1ccccc1 7a_106832991635_200011218536 [0,0,0,0,0,1|1,0,1]=3 1070 B11R1.40 CNC(C)Cc1ccccn1 2230a_100000238496_200000210301 [0,0,0,0,0,1|2,0,1]=4 1071 B11R1.40 CNC(C)Cc1cccnc1 2230a_100011207255_200000210301 [0,0,0,0,0,1|2,0,1]=4 1072 B11R1.40 CNC(C)Cc1cccnc1 270004a_106832991635_100015187140 [0,0,0,0,0,1|2,0,1]=4 1073 B11R1.40 CNC(C)Cc1ccncc1 270004a_106832991635_100000238508 [0,0,0,0,0,1|2,0,1]=4 1074 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [0,0,0,0,0,1|2,0,1]=4 1075 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [0,0,0,0,0,1|2,0,1]=4 1076 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [0,0,0,0,0,1|2,0,1]=4 1077 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [0,0,0,0,0,1|2,0,1]=4 1078 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [0,0,0,0,0,1|2,0,1]=4 1079 B11R1.40 CSC(C)Cc1ccccc1 62a_200000210301_200011218536 [0,0,0,0,0,1|2,0,1]=4 1080 B11R1.40 CSC(C)Cc1ccccc1 62a_200011218536_200000210301 [0,0,0,0,0,1|2,0,1]=4 1081 B11R1.40 O=C(CF)C[n+]1ccccc1 1458a_200000086051_100015361967 [0,0,0,0,0,1|3,0,0]=4 1082 B11R1.40 O=C(CF)Cc1ccccn1 1458a_100000233486_100015361967 [0,0,0,0,0,1|3,0,0]=4 1083 B11R1.40 O=C(CF)Cc1cccnc1 1458a_100000737805_100015361967 [0,0,0,0,0,1|3,0,0]=4 1084 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [0,0,0,0,0,1|2,0,0]=3 1085 B11R1.40 O=C(CO)Cc1ccccn1 1458a_100000210174_100000721315 [0,0,0,0,0,1|3,0,0]=4 1086 B11R1.40 O=C(CO)Cc1cccnc1 1458a_100000210174_100000733263 [0,0,0,0,0,1|3,0,0]=4 1087 B11R1.40 O=C(CO)Cc1ccncc1 1458a_100000210174_100000705612 [0,0,0,0,0,1|3,0,0]=4 1088 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [0,0,0,0,0,1|2,0,0]=3 1089 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [0,0,0,0,0,1|2,0,0]=3 1090 B8R0.1 C=CC=CC(=O)NNC 22a_100016993582_100016291481 [1,0,1,0,0,0|2,0,0]=4 1091 B8R0.3 C=CCC(=O)C(=O)NC 1458a_100011218921_100000210623 [1,0,1,0,0,0|1,0,1]=4 1092 B8R0.6 C/C=C/C=CC(=O)CC 1458a_100000185730_100000210202 [1,0,1,0,0,0|1,0,1]=4 1093 B8R0.6 C/C=C/C=CC(=O)NC 11a_106832991635_100000185730 [1,0,1,0,0,0|0,0,1]=3 1094 B8R0.6 C/C=C/C=CC(=O)NC 1626a_100102657272_100000185730 [1,0,1,0,0,0|0,0,1]=3 1095 B8R0.6 C/C=C/C=CC(=O)NC 240690a_100102657272_100000185730 [1,0,1,0,0,0|0,0,1]=3 1096 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,1]=3 1097 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|1,0,1]=4 1098 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|1,0,1]=4 1099 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|1,0,1]=4 1100 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|0,0,0]=2 1101 B8R1.2 CNc1cccnn1 27a_100102657272_100016991348 [2,0,0,0,0,0|2,0,0]=4 1102 B8R1.2 CNc1ccncn1 27a_100102657272_100000703185 [2,0,0,0,0,0|2,0,0]=4 1103 B8R1.2 CNc1cnccn1 27a_100102657272_100000211759 [2,0,0,0,0,0|2,0,0]=4 1104 B8R1.2 CNc1ncccn1 27a_100102657272_100000211032 [2,0,0,0,0,0|2,0,0]=4 1105 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1106 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1107 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1108 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1109 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 1110 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 1111 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 1112 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 1113 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 1114 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 1115 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 1116 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 1117 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 1118 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|0,0,0]=2 1119 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1120 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1121 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1122 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1123 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 1124 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 1125 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 1126 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 1127 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 1128 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 1129 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 1130 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 1131 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 1132 B10R0.73 C=CCN(CC=C)C(=O)NC 2708a_100102657272_100000210471 [0,1,1,0,0,0|1,0,1]=4 1133 B10R0.73 C=CCN(CC=C)C(=O)NC 273464a_100102657272_100000210471 [0,1,1,0,0,0|1,0,1]=4 1134 B10R0.18 C=CC=CC(=O)CC(=O)CC 1458a_100016291481_100000747405 [0,1,1,0,0,0|1,0,1]=4 1135 B10R0.18 C=CC=CC(=O)CC(=O)NC 1458a_100016291481_100000183359 [0,1,1,0,0,0|0,0,1]=3 1136 B10R0.18 C=CC=CC(=O)CC(=O)OC 1458a_100016291481_100000747449 [0,1,1,0,0,0|1,0,1]=4 1137 B10R0.74 CCC/C=C/C=CC(=O)NC 11a_106832991635_200016258893 [0,1,1,0,0,0|0,0,2]=4 1138 B10R0.74 CCC/C=C/C=CC(=O)NC 1626a_100102657272_200016258893 [0,1,1,0,0,0|0,0,2]=4 1139 B10R0.74 CCC/C=C/C=CC(=O)NC 240690a_100102657272_200016258893 [0,1,1,0,0,0|0,0,2]=4 1140 B10R0.108 C=CCC(=O)C=CC(=O)NC 1458a_100016259477_100000210623 [0,1,1,0,0,0|0,0,1]=3 1141 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [1,1,0,0,0,0|2,0,0]=4 1142 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [1,1,0,0,0,0|2,0,0]=4 1143 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,1,0,0,0,0|1,0,0]=3 1144 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,1,0,0,0,0|1,0,0]=3 1145 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,1,0,0,0,0|1,0,0]=3 1146 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,1,0,0,0,0|1,0,0]=3 1147 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,1,0,0,0,0|1,0,0]=3 1148 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,1,0,0,0,0|1,0,0]=3 1149 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,1,0,0,0,0|1,0,0]=3 1150 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [1,1,0,0,0,0|2,0,0]=4 1151 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [1,1,0,0,0,0|2,0,0]=4 1152 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [1,1,0,0,0,0|2,0,0]=4 1153 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [1,1,0,0,0,0|2,0,0]=4 1154 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [1,1,0,0,0,0|2,0,0]=4 1155 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,1,0,0,0,0|2,0,0]=4 1156 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [1,1,0,0,0,0|2,0,0]=4 1157 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [1,1,0,0,0,0|2,0,0]=4 1159 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [1,1,0,0,0,0|2,0,0]=4 1160 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [1,1,0,0,0,0|2,0,0]=4 1161 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,1,0,0,0,0|0,0,0]=2 1162 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,1,0,0,0,0|0,0,0]=2 1163 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,1,0,0,0,0|0,0,0]=2 1164 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,1,0,0,0,0|0,0,0]=2 1165 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,1,0,0,0,0|0,0,0]=2 1166 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,1,0,0,0,0|0,0,0]=2 1167 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,1,0,0,0,0|0,0,0]=2 1168 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,1,0,0,0,0|1,0,0]=3 1169 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,1,0,0,0,0|1,0,0]=3 1170 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [1,1,0,0,0,0|2,0,0]=4 1171 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [1,1,0,0,0,0|2,0,0]=4 1172 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [1,1,0,0,0,0|2,0,0]=4 1173 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,1,0,0,0,0|1,0,1]=4 1174 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,1,0,0,0,0|0,0,2]=4 1175 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 1176 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 1177 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 1178 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 1179 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 1180 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 1181 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 1182 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 1183 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 1184 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 1185 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 1186 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 1187 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,1,0,0,0,0|2,0,0]=4 1188 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,1,0,0,0,0|2,0,0]=4 1189 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,1,0,0,0,0|2,0,0]=4 1190 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 1191 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 1192 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 1193 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 1194 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 1195 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 1196 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 1197 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 1198 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 1199 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 1200 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 1201 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 1202 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,1,0,0,0,0|2,0,0]=4 1203 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,1,0,0,0,0|2,0,0]=4 1204 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,1,0,0,0,0|1,0,0]=3 1205 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,1,0,0,0,0|1,0,1]=4 1206 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,1,0,0,0,0|1,0,1]=4 1207 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,1,0,0,0,0|0,0,0]=2 1208 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 1209 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 1210 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 1211 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 1212 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 1213 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 1214 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,1,0,0,0,0|0,0,0]=2 1215 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,1,0,0,0,0|1,0,0]=3 1216 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,1,0,0,0,0|1,0,0]=3 1217 B10R1.13 NC(=O)c1ccc(nn1)O 271570a_203496583355_100000761398 [1,1,0,0,0,0|2,0,0]=4 1218 B10R1.13 NC(=O)c1cnc(cn1)O 271570a_203496583355_100000738300 [1,1,0,0,0,0|2,0,0]=4 1219 B10R1.13 NC(=O)c1ncc(cn1)O 271570a_203496583355_100009996756 [1,1,0,0,0,0|2,0,0]=4 1220 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,1,0,0,0,0|0,0,0]=2 1221 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,1,0,0,0,0|0,0,0]=2 1222 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,1,0,0,0,0|0,0,0]=2 1223 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,1,0,0,0,0|0,0,0]=2 1224 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,1,0,0,0,0|0,0,0]=2 1225 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [1,1,0,0,0,0|2,0,0]=4 1226 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [1,1,0,0,0,0|2,0,0]=4 1227 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [1,1,0,0,0,0|2,0,0]=4 1228 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [1,1,0,0,0,0|2,0,0]=4 1229 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [1,1,0,0,0,0|2,0,0]=4 1230 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,0]=3 1231 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,0]=3 1232 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,0]=3 1233 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,0]=3 1234 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,0]=3 1235 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|1,0,0]=3 1236 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,1,0,0,0,0|2,0,0]=4 1237 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,1,0,0,0,0|2,0,0]=4 1238 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,1,0,0,0,0|2,0,0]=4 1239 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,1,0,0,0,0|2,0,0]=4 1240 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,1,0,0,0,0|2,0,0]=4 1241 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [1,1,0,0,0,0|2,0,0]=4 1242 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [1,1,0,0,0,0|2,0,0]=4 1243 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [1,1,0,0,0,0|2,0,0]=4 1244 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [1,1,0,0,0,0|2,0,0]=4 1245 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,1,0,0,0,0|2,0,0]=4 1246 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|2,0,0]=4 1247 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [1,1,0,0,0,0|2,0,0]=4 1248 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [1,1,0,0,0,0|2,0,0]=4 1249 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [1,1,0,0,0,0|2,0,0]=4 1250 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [1,1,0,0,0,0|2,0,0]=4 1251 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,1,0,0,0,0|2,0,0]=4 1252 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,1,0,0,0,0|2,0,0]=4 1253 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,1,0,0,0,0|2,0,0]=4 1254 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,1,0,0,0,0|2,0,0]=4 1255 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,1,0,0,0,0|2,0,0]=4 1256 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,1,0,0,0,0|2,0,0]=4 1257 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|2,0,0]=4 1258 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|0,0,0]=2 1259 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|0,0,0]=2 1260 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|0,0,0]=2 1261 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|0,0,0]=2 1262 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|0,0,0]=2 1263 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,0]=2 1264 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,0]=2 1265 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,0]=2 1266 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,0]=3 1267 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,0]=3 1268 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,0]=3 1269 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,0]=3 1270 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,1,0,0,0,0|2,0,0]=4 1271 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|1,0,1]=4 1272 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|1,0,1]=4 1273 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,2]=4 1274 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 1275 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 1276 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 1277 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 1278 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 1279 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 1280 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 1281 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 1282 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 1283 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 1284 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|2,0,0]=4 1285 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|2,0,0]=4 1286 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 1287 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 1288 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 1289 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 1290 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 1291 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 1292 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 1293 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 1294 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 1295 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 1296 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|2,0,0]=4 1297 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,0]=3 1298 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|0,0,0]=2 1299 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 1300 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 1301 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 1302 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 1303 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 1304 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 1305 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|0,0,0]=2 1306 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,1,0,0,0,0|1,0,0]=3 1307 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,1,0,0,0,0|1,0,0]=3 1308 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,1,0,0,0,0|1,0,0]=3 1309 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,1,0,0,0,0|1,0,0]=3 1310 B10R1.61 NC(=O)c1nccnc1O 271570a_203496583355_100000094861 [1,1,0,0,0,0|2,0,0]=4 1311 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|0,0,0]=2 1312 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|0,0,0]=2 1313 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|0,0,0]=2 1314 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|0,0,0]=2 1315 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,0]=2 1316 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,0]=2 1317 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [1,1,0,0,0,0|2,0,0]=4 1318 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [1,1,0,0,0,0|2,0,0]=4 1319 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [1,1,0,0,0,0|2,0,0]=4 1320 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [1,1,0,0,0,0|2,0,0]=4 1321 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [1,1,0,0,0,0|2,0,0]=4 1322 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [1,1,0,0,0,0|2,0,0]=4 1323 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [1,1,0,0,0,0|2,0,0]=4 1324 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [1,1,0,0,0,0|2,0,0]=4 1325 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [1,1,0,0,0,0|2,0,0]=4 1326 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,1,0,0,0,0|1,0,0]=3 1327 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,1,0,0,0,0|1,0,0]=3 1328 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,1,0,0,0,0|1,0,0]=3 1329 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,1,0,0,0,0|1,0,0]=3 1330 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,1,0,0,0,0|1,0,0]=3 1331 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,1,0,0,0,0|1,0,0]=3 1332 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,1,0,0,0,0|1,0,0]=3 1333 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,1,0,0,0,0|1,0,0]=3 1334 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [1,1,0,0,0,0|2,0,0]=4 1335 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [1,1,0,0,0,0|2,0,0]=4 1336 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [1,1,0,0,0,0|2,0,0]=4 1337 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [1,1,0,0,0,0|2,0,0]=4 1338 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [1,1,0,0,0,0|2,0,0]=4 1339 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [1,1,0,0,0,0|2,0,0]=4 1340 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [1,1,0,0,0,0|2,0,0]=4 1341 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [1,1,0,0,0,0|2,0,0]=4 1342 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [1,1,0,0,0,0|2,0,0]=4 1343 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [1,1,0,0,0,0|2,0,0]=4 1344 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [1,1,0,0,0,0|2,0,0]=4 1345 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [1,1,0,0,0,0|2,0,0]=4 1346 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [1,1,0,0,0,0|2,0,0]=4 1347 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [1,1,0,0,0,0|2,0,0]=4 1348 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [1,1,0,0,0,0|2,0,0]=4 1349 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [1,1,0,0,0,0|2,0,0]=4 1350 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [1,1,0,0,0,0|1,0,0]=3 1351 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,1,0,0,0,0|0,0,0]=2 1352 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,1,0,0,0,0|0,0,0]=2 1353 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,1,0,0,0,0|0,0,0]=2 1354 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,1,0,0,0,0|0,0,0]=2 1355 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,1,0,0,0,0|0,0,0]=2 1356 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,1,0,0,0,0|0,0,0]=2 1357 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,1,0,0,0,0|0,0,0]=2 1358 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [1,1,0,0,0,0|1,0,0]=3 1359 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,1,0,0,0,0|1,0,0]=3 1360 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [1,1,0,0,0,0|2,0,0]=4 1361 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [1,1,0,0,0,0|1,0,0]=3 1362 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,1,0,0,0,0|1,0,1]=4 1363 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,1,0,0,0,0|1,0,1]=4 1364 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,1,0,0,0,0|0,0,2]=4 1365 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 1366 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 1367 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 1368 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 1369 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 1370 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 1371 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 1372 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 1373 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 1374 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 1375 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 1376 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 1377 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 1378 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 1379 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,1,0,0,0,0|2,0,0]=4 1380 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 1381 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 1382 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 1383 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 1384 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 1385 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 1386 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 1387 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 1388 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 1389 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 1390 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 1391 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 1392 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 1393 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 1394 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 1395 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 1396 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,1,0,0,0,0|1,0,0]=3 1397 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,1,0,0,0,0|0,0,0]=2 1398 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 1399 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 1400 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 1401 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 1402 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 1403 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 1404 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [1,1,0,0,0,0|1,0,0]=3 1405 B10R1.113 NC(=O)c1cc(ncn1)O 271570a_203496583355_100000725265 [1,1,0,0,0,0|2,0,0]=4 1406 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,1,0,0,0,0|0,0,0]=2 1407 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [1,1,0,0,0,0|1,0,0]=3 1408 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,1,0,0,0,0|1,0,0]=3 1409 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [1,1,0,0,0,0|2,0,0]=4 1410 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [1,1,0,0,0,0|1,0,0]=3 1411 B10R1.113 NC(=O)c1cncc(n1)O 271570a_203496583355_100000764846 [1,1,0,0,0,0|2,0,0]=4 1412 B10R1.113 NC(=O)c1cnnc(c1)O 271570a_203496583355_100015785749 [1,1,0,0,0,0|2,0,0]=4 1413 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,1,0,0,0,0|0,0,0]=2 1414 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,1,0,0,0,0|0,0,0]=2 1415 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,1,0,0,0,0|0,0,0]=2 1416 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,1,0,0,0,0|0,0,0]=2 1417 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,1,0,0,0,0|0,0,0]=2 1418 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|1,0,0]=3 1419 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,1,0,0,0,0|1,0,1]=4 1420 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,1,0,0,0,0|1,0,1]=4 1421 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,1,0,0,0,0|1,0,1]=4 1422 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,1,0,0,0,0|1,0,1]=4 1423 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,1,0,0,0,0|1,0,1]=4 1424 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|1,0,1]=4 1425 B10R1.1 CC=Cc1cc[n+](cc1)[O-] 271570a_100016259895_100000039755 [1,1,0,0,0,0|2,0,0]=4 1426 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [1,1,0,0,0,0|2,0,0]=4 1427 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|1,0,0]=3 1428 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|1,0,0]=3 1429 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|1,0,0]=3 1430 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|1,0,0]=3 1431 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|1,0,0]=3 1432 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|1,0,0]=3 1433 B10R1.1 CC=Cc1ccc(cn1)Br 271570a_100016259895_100000686858 [1,1,0,0,0,0|2,0,0]=4 1434 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,1,0,0,0,0|2,0,0]=4 1435 B10R1.1 CC=Cc1ccc(cn1)Cl 271570a_100016259895_100011356976 [1,1,0,0,0,0|2,0,0]=4 1436 B10R1.1 CC=Cc1ccc(cn1)F 271570a_100016259895_100000744514 [1,1,0,0,0,0|2,0,0]=4 1437 B10R1.1 CC=Cc1ccc(cn1)N 271570a_100016259895_100000744251 [1,1,0,0,0,0|2,0,0]=4 1438 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [1,1,0,0,0,0|2,0,0]=4 1439 B10R1.1 CC=Cc1ccc(nc1)Br 271570a_100016259895_100009814638 [1,1,0,0,0,0|2,0,0]=4 1440 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,1,0,0,0,0|2,0,0]=4 1441 B10R1.1 CC=Cc1ccc(nc1)Cl 271570a_100016259895_100000034144 [1,1,0,0,0,0|2,0,0]=4 1442 B10R1.1 CC=Cc1ccc(nc1)F 271570a_100016259895_100000748661 [1,1,0,0,0,0|2,0,0]=4 1443 B10R1.1 CC=Cc1ccc(nc1)N 271570a_100016259895_100000187370 [1,1,0,0,0,0|2,0,0]=4 1444 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|1,0,1]=4 1445 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,1,0,0,0,0|2,0,0]=4 1446 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,1,0,0,0,0|2,0,0]=4 1447 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|2,0,0]=4 1448 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,1,0,0,0,0|2,0,0]=4 1449 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,1,0,0,0,0|2,0,0]=4 1450 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,1,0,0,0,0|2,0,0]=4 1451 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,1,0,0,0,0|2,0,0]=4 1452 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,1,0,0,0,0|2,0,0]=4 1453 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,1,0,0,0,0|2,0,0]=4 1454 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,1,0,0,0,0|2,0,0]=4 1455 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,1,0,0,0,0|2,0,0]=4 1456 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1457 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1458 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,1,0,0,0,0|2,0,0]=4 1459 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,1,0,0,0,0|2,0,0]=4 1460 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,1,0,0,0,0|2,0,0]=4 1461 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,1,0,0,0,0|2,0,0]=4 1462 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,1,0,0,0,0|2,0,0]=4 1463 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,1,0,0,0,0|2,0,0]=4 1464 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,1,0,0,0,0|2,0,0]=4 1465 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,1,0,0,0,0|2,0,0]=4 1466 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,1,0,0,0,0|2,0,0]=4 1467 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|2,0,0]=4 1468 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|2,0,0]=4 1469 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,1,0,0,0,0|2,0,0]=4 1470 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,1,0,0,0,0|2,0,0]=4 1471 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,1,0,0,0,0|2,0,0]=4 1472 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,1,0,0,0,0|2,0,0]=4 1473 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,1,0,0,0,0|2,0,0]=4 1474 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,1,0,0,0,0|2,0,0]=4 1475 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,1,0,0,0,0|2,0,0]=4 1476 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,1,0,0,0,0|2,0,0]=4 1477 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|0,0,1]=3 1478 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|0,0,1]=3 1479 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|0,0,1]=3 1480 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|0,0,1]=3 1481 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|0,0,1]=3 1482 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|0,0,1]=3 1483 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|0,0,1]=3 1484 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|0,0,1]=3 1485 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|0,0,1]=3 1486 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|0,0,1]=3 1487 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|0,0,1]=3 1488 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|0,0,1]=3 1489 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|0,0,1]=3 1490 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|0,0,1]=3 1491 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|0,0,1]=3 1492 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|0,0,1]=3 1493 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|0,0,1]=3 1494 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|0,0,1]=3 1495 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|0,0,1]=3 1496 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|0,0,1]=3 1497 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|0,0,1]=3 1498 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|0,0,1]=3 1499 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|0,0,1]=3 1500 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|0,0,1]=3 1501 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|0,0,1]=3 1502 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|0,0,1]=3 1503 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|0,0,1]=3 1504 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|0,0,1]=3 1505 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|0,0,1]=3 1506 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|0,0,1]=3 1507 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|0,0,1]=3 1508 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|0,0,1]=3 1509 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|0,0,1]=3 1510 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|0,0,1]=3 1511 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|0,0,1]=3 1512 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|0,0,1]=3 1513 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|0,0,1]=3 1514 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|0,0,1]=3 1515 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [1,1,0,0,0,0|1,0,1]=4 1516 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [1,1,0,0,0,0|1,0,1]=4 1517 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [1,1,0,0,0,0|1,0,1]=4 1518 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [1,1,0,0,0,0|1,0,1]=4 1519 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [1,1,0,0,0,0|1,0,1]=4 1520 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [1,1,0,0,0,0|1,0,1]=4 1521 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [1,1,0,0,0,0|1,0,1]=4 1522 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [1,1,0,0,0,0|1,0,1]=4 1523 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [1,1,0,0,0,0|1,0,1]=4 1524 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [1,1,0,0,0,0|1,0,1]=4 1525 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [1,1,0,0,0,0|1,0,1]=4 1526 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [1,1,0,0,0,0|1,0,1]=4 1527 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [1,1,0,0,0,0|1,0,1]=4 1528 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [1,1,0,0,0,0|1,0,1]=4 1529 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [1,1,0,0,0,0|1,0,1]=4 1530 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [1,1,0,0,0,0|1,0,1]=4 1531 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [1,1,0,0,0,0|1,0,1]=4 1532 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [1,1,0,0,0,0|1,0,1]=4 1533 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [1,1,0,0,0,0|1,0,1]=4 1534 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [1,1,0,0,0,0|1,0,1]=4 1535 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [1,1,0,0,0,0|1,0,1]=4 1536 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [1,1,0,0,0,0|1,0,1]=4 1537 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [1,1,0,0,0,0|1,0,1]=4 1538 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [1,1,0,0,0,0|1,0,1]=4 1539 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [1,1,0,0,0,0|1,0,1]=4 1540 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [1,1,0,0,0,0|1,0,1]=4 1541 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [1,1,0,0,0,0|1,0,1]=4 1542 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [1,1,0,0,0,0|1,0,1]=4 1543 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [1,1,0,0,0,0|1,0,1]=4 1544 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|1,0,1]=4 1545 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|1,0,1]=4 1546 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|1,0,1]=4 1547 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|1,0,1]=4 1548 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|1,0,1]=4 1549 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [1,1,0,0,0,0|1,0,1]=4 1550 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [1,1,0,0,0,0|1,0,1]=4 1551 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [1,1,0,0,0,0|1,0,1]=4 1552 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [1,1,0,0,0,0|1,0,1]=4 1553 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [1,1,0,0,0,0|1,0,1]=4 1554 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [1,1,0,0,0,0|1,0,1]=4 1555 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [1,1,0,0,0,0|1,0,1]=4 1556 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [1,1,0,0,0,0|1,0,1]=4 1557 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [1,1,0,0,0,0|1,0,1]=4 1558 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [1,1,0,0,0,0|1,0,1]=4 1559 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,1,0,0,0,0|1,0,1]=4 1560 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,1,0,0,0,0|1,0,1]=4 1561 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,1,0,0,0,0|1,0,1]=4 1562 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|1,0,1]=4 1563 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|1,0,1]=4 1564 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|1,0,1]=4 1565 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|1,0,1]=4 1566 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|1,0,1]=4 1567 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 1568 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|1,0,1]=4 1569 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 1570 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 1571 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|1,0,1]=4 1572 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 1573 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 1574 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|1,0,1]=4 1575 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 1576 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,1]=4 1577 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,1]=4 1578 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|1,0,1]=4 1579 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|1,0,1]=4 1580 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|1,0,1]=4 1581 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|1,0,1]=4 1582 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|1,0,1]=4 1583 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|1,0,1]=4 1584 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|1,0,1]=4 1585 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|1,0,1]=4 1586 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|1,0,1]=4 1587 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|1,0,1]=4 1588 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|0,0,1]=3 1589 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|0,0,1]=3 1590 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|1,0,1]=4 1591 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|1,0,1]=4 1592 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|1,0,1]=4 1593 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|1,0,1]=4 1594 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|1,0,1]=4 1595 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [1,1,0,0,0,0|1,0,1]=4 1596 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,1,0,0,0,0|1,0,1]=4 1597 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|2,0,0]=4 1598 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|0,0,1]=3 1599 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|0,0,1]=3 1600 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|0,0,1]=3 1601 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|0,0,1]=3 1602 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|0,0,1]=3 1603 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|0,0,1]=3 1604 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|0,0,1]=3 1605 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|0,0,1]=3 1606 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|0,0,1]=3 1607 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [1,1,0,0,0,0|1,0,1]=4 1608 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [1,1,0,0,0,0|1,0,1]=4 1609 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [1,1,0,0,0,0|1,0,1]=4 1610 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [1,1,0,0,0,0|1,0,1]=4 1611 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [1,1,0,0,0,0|1,0,1]=4 1612 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [1,1,0,0,0,0|1,0,1]=4 1613 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [1,1,0,0,0,0|1,0,1]=4 1614 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [1,1,0,0,0,0|1,0,1]=4 1615 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [1,1,0,0,0,0|1,0,1]=4 1616 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,1,0,0,0,0|1,0,1]=4 1617 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|1,0,1]=4 1618 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 1619 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 1620 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 1621 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 1622 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 1623 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 1624 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,1]=4 1625 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|1,0,1]=4 1626 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|1,0,1]=4 1627 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|1,0,1]=4 1628 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|1,0,1]=4 1629 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|1,0,1]=4 1630 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|1,0,1]=4 1631 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|1,0,1]=4 1632 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|1,0,1]=4 1633 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,1,0,0,0,0|1,0,1]=4 1634 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,1,0,0,0,0|1,0,1]=4 1635 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,1,0,0,0,0|1,0,1]=4 1636 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,1,0,0,0,0|1,0,1]=4 1637 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,1,0,0,0,0|1,0,1]=4 1638 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,1,0,0,0,0|1,0,1]=4 1639 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [1,1,0,0,0,0|2,0,0]=4 1640 B10R1.4 CC=Cc1c[nH]ccc1=S 271570a_100016259895_200012280681 [1,1,0,0,0,0|2,0,0]=4 1641 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [1,1,0,0,0,0|2,0,0]=4 1642 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [1,1,0,0,0,0|2,0,0]=4 1643 B10R1.4 CC=Cc1cccc[n+]1[O-] 271570a_100016259895_200000042595 [1,1,0,0,0,0|2,0,0]=4 1644 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,1,0,0,0,0|1,0,0]=3 1645 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,1,0,0,0,0|1,0,0]=3 1646 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,1,0,0,0,0|1,0,0]=3 1647 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,1,0,0,0,0|1,0,0]=3 1648 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,1,0,0,0,0|1,0,0]=3 1649 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,1,0,0,0,0|1,0,0]=3 1650 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [1,1,0,0,0,0|2,0,0]=4 1651 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [1,1,0,0,0,0|2,0,0]=4 1652 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [1,1,0,0,0,0|2,0,0]=4 1653 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [1,1,0,0,0,0|2,0,0]=4 1654 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [1,1,0,0,0,0|2,0,0]=4 1655 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [1,1,0,0,0,0|2,0,0]=4 1656 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [1,1,0,0,0,0|2,0,0]=4 1657 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [1,1,0,0,0,0|2,0,0]=4 1658 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [1,1,0,0,0,0|2,0,0]=4 1659 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [1,1,0,0,0,0|2,0,0]=4 1660 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [1,1,0,0,0,0|2,0,0]=4 1661 B10R1.4 CC=Cc1cnccc1Br 271570a_100016259895_100010138639 [1,1,0,0,0,0|2,0,0]=4 1662 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [1,1,0,0,0,0|2,0,0]=4 1663 B10R1.4 CC=Cc1cnccc1Cl 271570a_100016259895_100009995489 [1,1,0,0,0,0|2,0,0]=4 1664 B10R1.4 CC=Cc1cnccc1F 271570a_100016259895_100009820683 [1,1,0,0,0,0|2,0,0]=4 1665 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [1,1,0,0,0,0|2,0,0]=4 1666 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [1,1,0,0,0,0|2,0,0]=4 1667 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [1,1,0,0,0,0|2,0,0]=4 1668 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [1,1,0,0,0,0|2,0,0]=4 1669 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [1,1,0,0,0,0|2,0,0]=4 1670 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [1,1,0,0,0,0|2,0,0]=4 1671 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,1,0,0,0,0|2,0,0]=4 1672 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [1,1,0,0,0,0|2,0,0]=4 1673 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [1,1,0,0,0,0|2,0,0]=4 1674 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [1,1,0,0,0,0|2,0,0]=4 1675 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [1,1,0,0,0,0|2,0,0]=4 1676 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [1,1,0,0,0,0|2,0,0]=4 1677 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [1,1,0,0,0,0|2,0,0]=4 1678 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [1,1,0,0,0,0|2,0,0]=4 1679 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [1,1,0,0,0,0|2,0,0]=4 1680 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [1,1,0,0,0,0|2,0,0]=4 1681 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [1,1,0,0,0,0|2,0,0]=4 1682 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [1,1,0,0,0,0|2,0,0]=4 1683 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [1,1,0,0,0,0|2,0,0]=4 1684 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [1,1,0,0,0,0|2,0,0]=4 1685 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [1,1,0,0,0,0|2,0,0]=4 1686 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [1,1,0,0,0,0|2,0,0]=4 1687 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [1,1,0,0,0,0|2,0,0]=4 1688 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [1,1,0,0,0,0|2,0,0]=4 1689 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [1,1,0,0,0,0|2,0,0]=4 1690 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [1,1,0,0,0,0|2,0,0]=4 1691 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [1,1,0,0,0,0|2,0,0]=4 1692 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [1,1,0,0,0,0|2,0,0]=4 1693 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [1,1,0,0,0,0|2,0,0]=4 1694 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [1,1,0,0,0,0|2,0,0]=4 1695 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [1,1,0,0,0,0|2,0,0]=4 1696 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [1,1,0,0,0,0|2,0,0]=4 1697 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [1,1,0,0,0,0|2,0,0]=4 1698 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [1,1,0,0,0,0|2,0,0]=4 1699 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [1,1,0,0,0,0|2,0,0]=4 1700 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [1,1,0,0,0,0|2,0,0]=4 1701 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [1,1,0,0,0,0|2,0,0]=4 1702 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [1,1,0,0,0,0|2,0,0]=4 1703 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [1,1,0,0,0,0|2,0,0]=4 1704 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [1,1,0,0,0,0|2,0,0]=4 1705 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [1,1,0,0,0,0|0,0,1]=3 1706 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [1,1,0,0,0,0|0,0,1]=3 1707 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [1,1,0,0,0,0|0,0,1]=3 1708 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [1,1,0,0,0,0|0,0,1]=3 1709 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [1,1,0,0,0,0|0,0,1]=3 1710 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [1,1,0,0,0,0|0,0,1]=3 1711 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [1,1,0,0,0,0|0,0,1]=3 1712 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [1,1,0,0,0,0|0,0,1]=3 1713 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [1,1,0,0,0,0|0,0,1]=3 1714 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [1,1,0,0,0,0|0,0,1]=3 1715 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [1,1,0,0,0,0|0,0,1]=3 1716 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [1,1,0,0,0,0|0,0,1]=3 1717 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [1,1,0,0,0,0|0,0,1]=3 1718 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [1,1,0,0,0,0|0,0,1]=3 1719 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [1,1,0,0,0,0|0,0,1]=3 1720 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [1,1,0,0,0,0|0,0,1]=3 1721 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [1,1,0,0,0,0|0,0,1]=3 1722 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [1,1,0,0,0,0|0,0,1]=3 1723 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [1,1,0,0,0,0|0,0,1]=3 1724 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [1,1,0,0,0,0|0,0,1]=3 1725 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [1,1,0,0,0,0|0,0,1]=3 1726 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [1,1,0,0,0,0|0,0,1]=3 1727 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [1,1,0,0,0,0|0,0,1]=3 1728 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [1,1,0,0,0,0|0,0,1]=3 1729 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [1,1,0,0,0,0|0,0,1]=3 1730 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [1,1,0,0,0,0|0,0,1]=3 1731 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [1,1,0,0,0,0|0,0,1]=3 1732 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [1,1,0,0,0,0|0,0,1]=3 1733 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [1,1,0,0,0,0|0,0,1]=3 1734 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [1,1,0,0,0,0|0,0,1]=3 1735 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [1,1,0,0,0,0|0,0,1]=3 1736 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [1,1,0,0,0,0|0,0,1]=3 1737 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [1,1,0,0,0,0|0,0,1]=3 1738 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [1,1,0,0,0,0|0,0,1]=3 1739 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [1,1,0,0,0,0|0,0,1]=3 1740 B10R1.4 CNCc1cccnc1Br 2230a_100009818023_200000210301 [1,1,0,0,0,0|1,0,1]=4 1741 B10R1.4 CNCc1cccnc1Br 2230a_106832991635_100010140945 [1,1,0,0,0,0|1,0,1]=4 1742 B10R1.4 CNCc1cccnc1Br 34a_100009818023_200000210301 [1,1,0,0,0,0|1,0,1]=4 1743 B10R1.4 CNCc1cccnc1Br 34a_100102657272_100010140945 [1,1,0,0,0,0|1,0,1]=4 1744 B10R1.4 CNCc1cccnc1Br 7a_106832991635_100010140945 [1,1,0,0,0,0|1,0,1]=4 1745 B10R1.4 CNCc1cccnc1C 207a_100102657272_100000751968 [1,1,0,0,0,0|1,0,1]=4 1746 B10R1.4 CNCc1cccnc1C 2230a_106832991635_100000732876 [1,1,0,0,0,0|1,0,1]=4 1747 B10R1.4 CNCc1cccnc1C 270004a_106832991635_100000751968 [1,1,0,0,0,0|1,0,1]=4 1748 B10R1.4 CNCc1cccnc1C 34a_100102657272_100000732876 [1,1,0,0,0,0|1,0,1]=4 1749 B10R1.4 CNCc1cccnc1C 7a_106832991635_100000732876 [1,1,0,0,0,0|1,0,1]=4 1750 B10R1.4 CNCc1cccnc1Cl 2230a_100015189234_200000210301 [1,1,0,0,0,0|1,0,1]=4 1751 B10R1.4 CNCc1cccnc1Cl 2230a_106832991635_100000045678 [1,1,0,0,0,0|1,0,1]=4 1752 B10R1.4 CNCc1cccnc1Cl 34a_100015189234_200000210301 [1,1,0,0,0,0|1,0,1]=4 1753 B10R1.4 CNCc1cccnc1Cl 34a_100102657272_100000045678 [1,1,0,0,0,0|1,0,1]=4 1754 B10R1.4 CNCc1cccnc1Cl 7a_106832991635_100000045678 [1,1,0,0,0,0|1,0,1]=4 1755 B10R1.4 CNCc1cccnc1F 2230a_106832991635_100000099810 [1,1,0,0,0,0|1,0,1]=4 1756 B10R1.4 CNCc1cccnc1F 34a_100000724633_200000210301 [1,1,0,0,0,0|1,0,1]=4 1757 B10R1.4 CNCc1cccnc1F 34a_100102657272_100000099810 [1,1,0,0,0,0|1,0,1]=4 1758 B10R1.4 CNCc1cccnc1F 7a_106832991635_100000099810 [1,1,0,0,0,0|1,0,1]=4 1759 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [1,1,0,0,0,0|1,0,1]=4 1760 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [1,1,0,0,0,0|1,0,1]=4 1761 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [1,1,0,0,0,0|1,0,1]=4 1762 B10R1.4 CNCc1ccncc1Br 270004a_106832991635_100000755692 [1,1,0,0,0,0|1,0,1]=4 1763 B10R1.4 CNCc1ccncc1C 2230a_106832991635_100020672808 [1,1,0,0,0,0|1,0,1]=4 1764 B10R1.4 CNCc1ccncc1C 34a_100102657272_100020672809 [1,1,0,0,0,0|1,0,1]=4 1765 B10R1.4 CNCc1ccncc1C 7a_106832991635_100020672808 [1,1,0,0,0,0|1,0,1]=4 1766 B10R1.4 CNCc1ccncc1Cl 207a_100102657272_100011934409 [1,1,0,0,0,0|1,0,1]=4 1767 B10R1.4 CNCc1ccncc1Cl 2230a_106832991635_100000763264 [1,1,0,0,0,0|1,0,1]=4 1768 B10R1.4 CNCc1ccncc1Cl 270004a_106832991635_100011934409 [1,1,0,0,0,0|1,0,1]=4 1769 B10R1.4 CNCc1ccncc1Cl 7a_106832991635_100000763264 [1,1,0,0,0,0|1,0,1]=4 1770 B10R1.4 CNCc1ccncc1F 34a_100011935246_200000210301 [1,1,0,0,0,0|1,0,1]=4 1771 B10R1.4 CNCc1cnccc1Br 270004a_106832991635_100009816821 [1,1,0,0,0,0|1,0,1]=4 1772 B10R1.4 CNCc1cnccc1C 207a_100102657272_100000685662 [1,1,0,0,0,0|1,0,1]=4 1773 B10R1.4 CNCc1cnccc1C 2230a_106832991635_100000690890 [1,1,0,0,0,0|1,0,1]=4 1774 B10R1.4 CNCc1cnccc1C 270004a_106832991635_100000685662 [1,1,0,0,0,0|1,0,1]=4 1775 B10R1.4 CNCc1cnccc1C 34a_100102657272_100000690890 [1,1,0,0,0,0|1,0,1]=4 1776 B10R1.4 CNCc1cnccc1C 7a_106832991635_100000690890 [1,1,0,0,0,0|1,0,1]=4 1777 B10R1.4 CNCc1cnccc1Cl 270004a_106832991635_100000050567 [1,1,0,0,0,0|1,0,1]=4 1778 B10R1.4 CNCc1ncccc1Br 207a_100102657272_100011934733 [1,1,0,0,0,0|1,0,1]=4 1779 B10R1.4 CNCc1ncccc1Br 2230a_106832991635_100025702911 [1,1,0,0,0,0|1,0,1]=4 1780 B10R1.4 CNCc1ncccc1Br 270004a_106832991635_100011934733 [1,1,0,0,0,0|1,0,1]=4 1781 B10R1.4 CNCc1ncccc1Br 34a_100102657272_100025702911 [1,1,0,0,0,0|1,0,1]=4 1782 B10R1.4 CNCc1ncccc1Br 7a_106832991635_100025702911 [1,1,0,0,0,0|1,0,1]=4 1783 B10R1.4 CNCc1ncccc1C 207a_100102657272_100000698913 [1,1,0,0,0,0|1,0,1]=4 1784 B10R1.4 CNCc1ncccc1C 2230a_106832991635_100000696600 [1,1,0,0,0,0|1,0,1]=4 1785 B10R1.4 CNCc1ncccc1C 270004a_106832991635_100000698913 [1,1,0,0,0,0|1,0,1]=4 1786 B10R1.4 CNCc1ncccc1C 34a_100011223789_200000210301 [1,1,0,0,0,0|1,0,1]=4 1787 B10R1.4 CNCc1ncccc1C 34a_100102657272_100000696600 [1,1,0,0,0,0|1,0,1]=4 1788 B10R1.4 CNCc1ncccc1C 7a_106832991635_100000696600 [1,1,0,0,0,0|1,0,1]=4 1789 B10R1.4 CNCc1ncccc1Cl 207a_100102657272_100012001307 [1,1,0,0,0,0|1,0,1]=4 1790 B10R1.4 CNCc1ncccc1Cl 2230a_100015189233_200000210301 [1,1,0,0,0,0|1,0,1]=4 1791 B10R1.4 CNCc1ncccc1Cl 2230a_106832991635_100000099807 [1,1,0,0,0,0|1,0,1]=4 1792 B10R1.4 CNCc1ncccc1Cl 270004a_106832991635_100012001307 [1,1,0,0,0,0|1,0,1]=4 1793 B10R1.4 CNCc1ncccc1Cl 7a_106832991635_100000099807 [1,1,0,0,0,0|1,0,1]=4 1794 B10R1.4 CNCc1ncccc1F 207a_100102657272_100011934734 [1,1,0,0,0,0|1,0,1]=4 1795 B10R1.4 CNCc1ncccc1F 2230a_106832991635_100000104219 [1,1,0,0,0,0|1,0,1]=4 1796 B10R1.4 CNCc1ncccc1F 270004a_106832991635_100011934734 [1,1,0,0,0,0|1,0,1]=4 1797 B10R1.4 CNCc1ncccc1F 34a_100000690088_200000210301 [1,1,0,0,0,0|1,0,1]=4 1798 B10R1.4 CNCc1ncccc1F 34a_100102657272_100000104219 [1,1,0,0,0,0|1,0,1]=4 1799 B10R1.4 CNCc1ncccc1F 7a_106832991635_100000104219 [1,1,0,0,0,0|1,0,1]=4 1800 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [1,1,0,0,0,0|1,0,1]=4 1801 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [1,1,0,0,0,0|1,0,1]=4 1802 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [1,1,0,0,0,0|1,0,1]=4 1803 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [1,1,0,0,0,0|1,0,1]=4 1804 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [1,1,0,0,0,0|1,0,1]=4 1805 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [1,1,0,0,0,0|1,0,1]=4 1806 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [1,1,0,0,0,0|1,0,1]=4 1807 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [1,1,0,0,0,0|1,0,1]=4 1808 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [1,1,0,0,0,0|1,0,1]=4 1809 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [1,1,0,0,0,0|1,0,1]=4 1810 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [1,1,0,0,0,0|1,0,1]=4 1811 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [1,1,0,0,0,0|1,0,1]=4 1812 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [1,1,0,0,0,0|1,0,1]=4 1813 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [1,1,0,0,0,0|1,0,1]=4 1814 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [1,1,0,0,0,0|1,0,1]=4 1815 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [1,1,0,0,0,0|1,0,1]=4 1816 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [1,1,0,0,0,0|1,0,1]=4 1817 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [1,1,0,0,0,0|1,0,1]=4 1818 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [1,1,0,0,0,0|1,0,1]=4 1819 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [1,1,0,0,0,0|1,0,1]=4 1820 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [1,1,0,0,0,0|1,0,1]=4 1821 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [1,1,0,0,0,0|1,0,1]=4 1822 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [1,1,0,0,0,0|1,0,1]=4 1823 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [1,1,0,0,0,0|1,0,1]=4 1824 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [1,1,0,0,0,0|1,0,1]=4 1825 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [1,1,0,0,0,0|1,0,1]=4 1826 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [1,1,0,0,0,0|1,0,1]=4 1827 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [1,1,0,0,0,0|1,0,1]=4 1828 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [1,1,0,0,0,0|1,0,1]=4 1829 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [1,1,0,0,0,0|1,0,1]=4 1830 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [1,1,0,0,0,0|0,0,1]=3 1831 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [1,1,0,0,0,0|1,0,1]=4 1832 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [1,1,0,0,0,0|1,0,1]=4 1833 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [1,1,0,0,0,0|1,0,1]=4 1834 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [1,1,0,0,0,0|1,0,1]=4 1835 B10R1.4 Cc1cccnc1CN[13CH3] 34a_100011223789_200025704644 [1,1,0,0,0,0|1,0,1]=4 1836 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [1,1,0,0,0,0|1,0,1]=4 1837 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [1,1,0,0,0,0|0,0,1]=3 1838 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [1,1,0,0,0,0|0,0,1]=3 1839 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [1,1,0,0,0,0|0,0,1]=3 1840 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [1,1,0,0,0,0|0,0,1]=3 1841 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [1,1,0,0,0,0|0,0,1]=3 1842 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [1,1,0,0,0,0|0,0,1]=3 1843 B10R1.4 [13CH3]NCc1cccnc1Br 2230a_100009818023_200025704644 [1,1,0,0,0,0|1,0,1]=4 1844 B10R1.4 [13CH3]NCc1cccnc1Br 34a_100009818023_200025704644 [1,1,0,0,0,0|1,0,1]=4 1845 B10R1.4 [13CH3]NCc1cccnc1Cl 2230a_100015189234_200025704644 [1,1,0,0,0,0|1,0,1]=4 1846 B10R1.4 [13CH3]NCc1cccnc1Cl 34a_100015189234_200025704644 [1,1,0,0,0,0|1,0,1]=4 1847 B10R1.4 [13CH3]NCc1cccnc1F 34a_100000724633_200025704644 [1,1,0,0,0,0|1,0,1]=4 1848 B10R1.4 [13CH3]NCc1ccncc1F 34a_100011935246_200025704644 [1,1,0,0,0,0|1,0,1]=4 1849 B10R1.4 [13CH3]NCc1ncccc1Cl 2230a_100015189233_200025704644 [1,1,0,0,0,0|1,0,1]=4 1850 B10R1.4 [13CH3]NCc1ncccc1F 34a_100000690088_200025704644 [1,1,0,0,0,0|1,0,1]=4 1851 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [1,1,0,0,0,0|1,0,1]=4 1852 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [1,1,0,0,0,0|1,0,1]=4 1853 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [1,1,0,0,0,0|1,0,1]=4 1854 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [1,1,0,0,0,0|1,0,1]=4 1855 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [1,1,0,0,0,0|1,0,1]=4 1856 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [1,1,0,0,0,0|1,0,1]=4 1857 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [1,1,0,0,0,0|1,0,1]=4 1858 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [1,1,0,0,0,0|1,0,1]=4 1859 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [1,1,0,0,0,0|1,0,1]=4 1860 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [1,1,0,0,0,0|1,0,1]=4 1861 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [1,1,0,0,0,0|1,0,1]=4 1862 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [1,1,0,0,0,0|1,0,1]=4 1863 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [1,1,0,0,0,0|1,0,1]=4 1864 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [1,1,0,0,0,0|1,0,1]=4 1865 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [1,1,0,0,0,0|1,0,1]=4 1866 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [1,1,0,0,0,0|1,0,1]=4 1867 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [1,1,0,0,0,0|1,0,1]=4 1868 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,1,0,0,0,0|1,0,1]=4 1869 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,1,0,0,0,0|1,0,1]=4 1870 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,1,0,0,0,0|1,0,1]=4 1871 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,1,0,0,0,0|1,0,1]=4 1872 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,1,0,0,0,0|1,0,1]=4 1873 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,1,0,0,0,0|1,0,1]=4 1874 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,1,0,0,0,0|1,0,1]=4 1875 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,1,0,0,0,0|1,0,1]=4 1876 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,1,0,0,0,0|2,0,0]=4 1877 B10R1.10 CC=Cc1cc(ccn1)Cl 271570a_100016259895_100010167805 [1,1,0,0,0,0|2,0,0]=4 1878 B10R1.10 CC=Cc1cc(ccn1)F 271570a_100016259895_100009817058 [1,1,0,0,0,0|2,0,0]=4 1879 B10R1.10 CC=Cc1cc(ccn1)N 271570a_100016259895_100009814236 [1,1,0,0,0,0|2,0,0]=4 1880 B10R1.10 CC=Cc1cc(ccn1)O 271570a_100016259895_100000762945 [1,1,0,0,0,0|2,0,0]=4 1881 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [1,1,0,0,0,0|2,0,0]=4 1882 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,1,0,0,0,0|2,0,0]=4 1883 B10R1.10 CC=Cc1ccc[n+](c1)[O-] 271570a_100016259895_100009815978 [1,1,0,0,0,0|2,0,0]=4 1884 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [1,1,0,0,0,0|2,0,0]=4 1885 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|1,0,0]=3 1886 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|1,0,0]=3 1887 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|1,0,0]=3 1888 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|1,0,0]=3 1889 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|1,0,0]=3 1890 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|1,0,0]=3 1891 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|1,0,0]=3 1892 B10R1.10 CC=Cc1cccc(n1)Br 271570a_100016259895_100000684672 [1,1,0,0,0,0|2,0,0]=4 1893 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,1,0,0,0,0|2,0,0]=4 1894 B10R1.10 CC=Cc1cccc(n1)F 271570a_100016259895_100009815982 [1,1,0,0,0,0|2,0,0]=4 1895 B10R1.10 CC=Cc1cccc(n1)N 271570a_100016259895_100000740741 [1,1,0,0,0,0|2,0,0]=4 1896 B10R1.10 CC=Cc1ccnc(c1)Br 271570a_100016259895_100009814637 [1,1,0,0,0,0|2,0,0]=4 1897 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,1,0,0,0,0|2,0,0]=4 1898 B10R1.10 CC=Cc1ccnc(c1)Cl 271570a_100016259895_100000035001 [1,1,0,0,0,0|2,0,0]=4 1899 B10R1.10 CC=Cc1ccnc(c1)F 271570a_100016259895_100009816116 [1,1,0,0,0,0|2,0,0]=4 1900 B10R1.10 CC=Cc1ccnc(c1)N 271570a_100016259895_100000744379 [1,1,0,0,0,0|2,0,0]=4 1901 B10R1.10 CC=Cc1cncc(c1)Br 271570a_100016259895_100000728054 [1,1,0,0,0,0|2,0,0]=4 1902 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,1,0,0,0,0|2,0,0]=4 1903 B10R1.10 CC=Cc1cncc(c1)Cl 271570a_100016259895_100000049639 [1,1,0,0,0,0|2,0,0]=4 1904 B10R1.10 CC=Cc1cncc(c1)F 271570a_100016259895_100000744099 [1,1,0,0,0,0|2,0,0]=4 1905 B10R1.10 CC=Cc1cncc(c1)N 271570a_100016259895_100000687067 [1,1,0,0,0,0|2,0,0]=4 1906 B10R1.10 CC=Cc1cncc(c1)O 271570a_100016259895_100000754920 [1,1,0,0,0,0|2,0,0]=4 1907 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|1,0,1]=4 1908 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,1,0,0,0,0|2,0,0]=4 1909 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,1,0,0,0,0|2,0,0]=4 1910 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,1,0,0,0,0|2,0,0]=4 1911 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,1,0,0,0,0|2,0,0]=4 1912 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,1,0,0,0,0|2,0,0]=4 1913 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,1,0,0,0,0|2,0,0]=4 1914 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,1,0,0,0,0|2,0,0]=4 1915 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,1,0,0,0,0|2,0,0]=4 1916 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,1,0,0,0,0|2,0,0]=4 1917 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,1,0,0,0,0|2,0,0]=4 1918 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,1,0,0,0,0|2,0,0]=4 1919 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,1,0,0,0,0|2,0,0]=4 1920 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,1,0,0,0,0|2,0,0]=4 1921 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,1,0,0,0,0|2,0,0]=4 1922 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,1,0,0,0,0|2,0,0]=4 1923 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,1,0,0,0,0|2,0,0]=4 1924 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,1,0,0,0,0|2,0,0]=4 1925 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,1,0,0,0,0|2,0,0]=4 1926 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,1,0,0,0,0|2,0,0]=4 1927 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,1,0,0,0,0|2,0,0]=4 1928 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,1,0,0,0,0|2,0,0]=4 1929 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,1,0,0,0,0|2,0,0]=4 1930 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,1,0,0,0,0|2,0,0]=4 1931 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,1,0,0,0,0|2,0,0]=4 1932 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,1,0,0,0,0|2,0,0]=4 1933 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,1,0,0,0,0|2,0,0]=4 1934 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,1,0,0,0,0|2,0,0]=4 1935 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,1,0,0,0,0|2,0,0]=4 1936 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,1,0,0,0,0|2,0,0]=4 1937 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,1,0,0,0,0|2,0,0]=4 1938 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,1,0,0,0,0|2,0,0]=4 1939 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,1,0,0,0,0|2,0,0]=4 1940 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,1,0,0,0,0|2,0,0]=4 1941 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,1,0,0,0,0|2,0,0]=4 1942 B10R1.10 CNCc1cc(ccn1)Br 2230a_106832991635_100010173614 [1,1,0,0,0,0|1,0,1]=4 1943 B10R1.10 CNCc1cc(ccn1)Br 270004a_106832991635_100009818557 [1,1,0,0,0,0|1,0,1]=4 1944 B10R1.10 CNCc1cc(ccn1)Br 34a_100102657272_100010173614 [1,1,0,0,0,0|1,0,1]=4 1945 B10R1.10 CNCc1cc(ccn1)Br 7a_106832991635_100010173614 [1,1,0,0,0,0|1,0,1]=4 1946 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [1,1,0,0,0,0|1,0,1]=4 1947 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [1,1,0,0,0,0|1,0,1]=4 1948 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [1,1,0,0,0,0|1,0,1]=4 1949 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [1,1,0,0,0,0|1,0,1]=4 1950 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [1,1,0,0,0,0|1,0,1]=4 1951 B10R1.10 CNCc1cc(ccn1)Cl 2230a_106832991635_100016988179 [1,1,0,0,0,0|1,0,1]=4 1952 B10R1.10 CNCc1cc(ccn1)Cl 270004a_106832991635_100011998288 [1,1,0,0,0,0|1,0,1]=4 1953 B10R1.10 CNCc1cc(ccn1)Cl 34a_100102657272_100016988179 [1,1,0,0,0,0|1,0,1]=4 1954 B10R1.10 CNCc1cc(ccn1)Cl 7a_106832991635_100016988179 [1,1,0,0,0,0|1,0,1]=4 1955 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [1,1,0,0,0,0|1,0,1]=4 1956 B10R1.10 CNCc1cccc(=O)[nH]1 207a_100102657272_100011935257 [1,1,0,0,0,0|1,0,1]=4 1957 B10R1.10 CNCc1cccc(=O)[nH]1 2230a_100000696482_200000210301 [1,1,0,0,0,0|1,0,1]=4 1958 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|0,0,1]=3 1959 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|0,0,1]=3 1960 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|0,0,1]=3 1961 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|0,0,1]=3 1962 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|0,0,1]=3 1963 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|0,0,1]=3 1964 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|0,0,1]=3 1965 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|0,0,1]=3 1966 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|0,0,1]=3 1967 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|0,0,1]=3 1968 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|0,0,1]=3 1969 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|0,0,1]=3 1970 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|0,0,1]=3 1971 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|0,0,1]=3 1972 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|0,0,1]=3 1973 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|0,0,1]=3 1974 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|0,0,1]=3 1975 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|0,0,1]=3 1976 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|0,0,1]=3 1977 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|0,0,1]=3 1978 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|0,0,1]=3 1979 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|0,0,1]=3 1980 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|0,0,1]=3 1981 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|0,0,1]=3 1982 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|0,0,1]=3 1983 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|0,0,1]=3 1984 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|0,0,1]=3 1985 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|0,0,1]=3 1986 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|0,0,1]=3 1987 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|0,0,1]=3 1988 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|0,0,1]=3 1989 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|0,0,1]=3 1990 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|0,0,1]=3 1991 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|0,0,1]=3 1992 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|0,0,1]=3 1993 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|0,0,1]=3 1994 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|0,0,1]=3 1995 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|0,0,1]=3 1996 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|0,0,1]=3 1997 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|0,0,1]=3 1998 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|0,0,1]=3 1999 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|0,0,1]=3 2000 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|0,0,1]=3 2001 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|0,0,1]=3 2002 B10R1.10 CNCc1cccc(n1)Br 2230a_100016987751_200000210301 [1,1,0,0,0,0|1,0,1]=4 2003 B10R1.10 CNCc1cccc(n1)Br 2230a_106832991635_100009889011 [1,1,0,0,0,0|1,0,1]=4 2004 B10R1.10 CNCc1cccc(n1)Br 270004a_106832991635_100000688028 [1,1,0,0,0,0|1,0,1]=4 2005 B10R1.10 CNCc1cccc(n1)Br 34a_100102657272_100009889011 [1,1,0,0,0,0|1,0,1]=4 2006 B10R1.10 CNCc1cccc(n1)Br 7a_106832991635_100009889011 [1,1,0,0,0,0|1,0,1]=4 2007 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [1,1,0,0,0,0|1,0,1]=4 2008 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [1,1,0,0,0,0|1,0,1]=4 2009 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [1,1,0,0,0,0|1,0,1]=4 2010 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [1,1,0,0,0,0|1,0,1]=4 2011 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [1,1,0,0,0,0|1,0,1]=4 2012 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [1,1,0,0,0,0|1,0,1]=4 2013 B10R1.10 CNCc1cccc(n1)Cl 2230a_100016990191_200000210301 [1,1,0,0,0,0|1,0,1]=4 2014 B10R1.10 CNCc1cccc(n1)Cl 2230a_106832991635_100000086093 [1,1,0,0,0,0|1,0,1]=4 2015 B10R1.10 CNCc1cccc(n1)Cl 270004a_106832991635_100011361687 [1,1,0,0,0,0|1,0,1]=4 2016 B10R1.10 CNCc1cccc(n1)Cl 34a_100102657272_100000086093 [1,1,0,0,0,0|1,0,1]=4 2017 B10R1.10 CNCc1cccc(n1)Cl 7a_106832991635_100000086093 [1,1,0,0,0,0|1,0,1]=4 2018 B10R1.10 CNCc1cccc(n1)F 2230a_100015188798_200000210301 [1,1,0,0,0,0|1,0,1]=4 2019 B10R1.10 CNCc1cccc(n1)F 2230a_106832991635_100009819644 [1,1,0,0,0,0|1,0,1]=4 2020 B10R1.10 CNCc1cccc(n1)F 270004a_106832991635_100000050434 [1,1,0,0,0,0|1,0,1]=4 2021 B10R1.10 CNCc1cccc(n1)F 34a_100015188798_200000210301 [1,1,0,0,0,0|1,0,1]=4 2022 B10R1.10 CNCc1cccc(n1)F 34a_100102657272_100009819644 [1,1,0,0,0,0|1,0,1]=4 2023 B10R1.10 CNCc1cccc(n1)F 7a_106832991635_100009819644 [1,1,0,0,0,0|1,0,1]=4 2024 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [1,1,0,0,0,0|1,0,1]=4 2025 B10R1.10 CNCc1ccnc(c1)Br 2230a_100025757509_200000210301 [1,1,0,0,0,0|1,0,1]=4 2026 B10R1.10 CNCc1ccnc(c1)Br 2230a_106832991635_100010243470 [1,1,0,0,0,0|1,0,1]=4 2027 B10R1.10 CNCc1ccnc(c1)Br 270004a_106832991635_100009814634 [1,1,0,0,0,0|1,0,1]=4 2028 B10R1.10 CNCc1ccnc(c1)Br 34a_100025757509_200000210301 [1,1,0,0,0,0|1,0,1]=4 2029 B10R1.10 CNCc1ccnc(c1)Br 34a_100102657272_100010243470 [1,1,0,0,0,0|1,0,1]=4 2030 B10R1.10 CNCc1ccnc(c1)Br 7a_106832991635_100010254460 [1,1,0,0,0,0|1,0,1]=4 2031 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [1,1,0,0,0,0|1,0,1]=4 2032 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [1,1,0,0,0,0|1,0,1]=4 2033 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [1,1,0,0,0,0|1,0,1]=4 2034 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [1,1,0,0,0,0|1,0,1]=4 2035 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [1,1,0,0,0,0|1,0,1]=4 2036 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [1,1,0,0,0,0|1,0,1]=4 2037 B10R1.10 CNCc1ccnc(c1)Cl 2230a_100015205668_200000210301 [1,1,0,0,0,0|1,0,1]=4 2038 B10R1.10 CNCc1ccnc(c1)Cl 2230a_106832991635_100000764220 [1,1,0,0,0,0|1,0,1]=4 2039 B10R1.10 CNCc1ccnc(c1)Cl 270004a_106832991635_100011290808 [1,1,0,0,0,0|1,0,1]=4 2040 B10R1.10 CNCc1ccnc(c1)Cl 34a_100015205668_200000210301 [1,1,0,0,0,0|1,0,1]=4 2041 B10R1.10 CNCc1ccnc(c1)Cl 34a_100102657272_100000764220 [1,1,0,0,0,0|1,0,1]=4 2042 B10R1.10 CNCc1ccnc(c1)Cl 7a_106832991635_100000764220 [1,1,0,0,0,0|1,0,1]=4 2043 B10R1.10 CNCc1ccnc(c1)F 2230a_100015188774_200000210301 [1,1,0,0,0,0|1,0,1]=4 2044 B10R1.10 CNCc1ccnc(c1)F 270004a_106832991635_100000068331 [1,1,0,0,0,0|1,0,1]=4 2045 B10R1.10 CNCc1ccnc(c1)F 34a_100015188774_200000210301 [1,1,0,0,0,0|1,0,1]=4 2046 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [1,1,0,0,0,0|1,0,1]=4 2047 B10R1.10 CNCc1cncc(c1)Br 207a_100102657272_100000687066 [1,1,0,0,0,0|1,0,1]=4 2048 B10R1.10 CNCc1cncc(c1)Br 2230a_106832991635_100000738771 [1,1,0,0,0,0|1,0,1]=4 2049 B10R1.10 CNCc1cncc(c1)Br 270004a_106832991635_100000687066 [1,1,0,0,0,0|1,0,1]=4 2050 B10R1.10 CNCc1cncc(c1)Br 34a_100102657272_100000738771 [1,1,0,0,0,0|1,0,1]=4 2051 B10R1.10 CNCc1cncc(c1)Br 7a_106832991635_100000738771 [1,1,0,0,0,0|1,0,1]=4 2052 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [1,1,0,0,0,0|1,0,1]=4 2053 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [1,1,0,0,0,0|1,0,1]=4 2054 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [1,1,0,0,0,0|1,0,1]=4 2055 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [1,1,0,0,0,0|1,0,1]=4 2056 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [1,1,0,0,0,0|1,0,1]=4 2057 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [1,1,0,0,0,0|1,0,1]=4 2058 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [1,1,0,0,0,0|1,0,1]=4 2059 B10R1.10 CNCc1cncc(c1)Cl 207a_100102657272_100000088910 [1,1,0,0,0,0|1,0,1]=4 2060 B10R1.10 CNCc1cncc(c1)Cl 2230a_106832991635_100016992070 [1,1,0,0,0,0|1,0,1]=4 2061 B10R1.10 CNCc1cncc(c1)Cl 2230a_200020614424_200000210301 [1,1,0,0,0,0|1,0,1]=4 2062 B10R1.10 CNCc1cncc(c1)Cl 270004a_106832991635_100000088910 [1,1,0,0,0,0|1,0,1]=4 2063 B10R1.10 CNCc1cncc(c1)Cl 34a_100102657272_100016992070 [1,1,0,0,0,0|1,0,1]=4 2064 B10R1.10 CNCc1cncc(c1)Cl 7a_106832991635_100016992070 [1,1,0,0,0,0|1,0,1]=4 2065 B10R1.10 CNCc1cncc(c1)F 207a_100102657272_100011361476 [1,1,0,0,0,0|1,0,1]=4 2066 B10R1.10 CNCc1cncc(c1)F 2230a_100011962886_200000210301 [1,1,0,0,0,0|1,0,1]=4 2067 B10R1.10 CNCc1cncc(c1)F 2230a_106832991635_100000725299 [1,1,0,0,0,0|1,0,1]=4 2068 B10R1.10 CNCc1cncc(c1)F 270004a_106832991635_100011361476 [1,1,0,0,0,0|1,0,1]=4 2069 B10R1.10 CNCc1cncc(c1)F 34a_100011962886_200000210301 [1,1,0,0,0,0|1,0,1]=4 2070 B10R1.10 CNCc1cncc(c1)F 34a_100102657272_100000725299 [1,1,0,0,0,0|1,0,1]=4 2071 B10R1.10 CNCc1cncc(c1)F 7a_106832991635_100000725299 [1,1,0,0,0,0|1,0,1]=4 2072 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [1,1,0,0,0,0|1,0,1]=4 2073 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [1,1,0,0,0,0|1,0,1]=4 2074 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [1,1,0,0,0,0|1,0,1]=4 2075 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 2076 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|1,0,1]=4 2077 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 2078 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|1,0,1]=4 2079 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|1,0,1]=4 2080 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|1,0,1]=4 2081 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 2082 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|1,0,1]=4 2083 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 2084 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 2085 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|1,0,1]=4 2086 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 2087 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 2088 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|1,0,1]=4 2089 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 2090 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,1]=4 2091 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|1,0,1]=4 2092 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|1,0,1]=4 2093 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|1,0,1]=4 2094 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|1,0,1]=4 2095 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|1,0,1]=4 2096 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|1,0,1]=4 2097 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|1,0,1]=4 2098 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|1,0,1]=4 2099 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|1,0,1]=4 2100 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|1,0,1]=4 2101 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|1,0,1]=4 2102 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|1,0,1]=4 2103 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|1,0,1]=4 2104 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|1,0,1]=4 2105 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [1,1,0,0,0,0|1,0,1]=4 2106 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|0,0,1]=3 2107 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|0,0,1]=3 2108 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|1,0,1]=4 2109 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|1,0,1]=4 2110 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|1,0,1]=4 2111 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|1,0,1]=4 2112 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [1,1,0,0,0,0|1,0,1]=4 2113 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [1,1,0,0,0,0|1,0,1]=4 2114 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [1,1,0,0,0,0|1,0,1]=4 2115 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,1,0,0,0,0|1,0,1]=4 2116 B10R1.10 [13CH3]NCc1cccc(=O)[nH]1 2230a_100000696482_200025704644 [1,1,0,0,0,0|1,0,1]=4 2117 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|0,0,1]=3 2118 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|0,0,1]=3 2119 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|0,0,1]=3 2120 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|0,0,1]=3 2121 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|0,0,1]=3 2122 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|0,0,1]=3 2123 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|0,0,1]=3 2124 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|0,0,1]=3 2125 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|0,0,1]=3 2126 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|0,0,1]=3 2127 B10R1.10 [13CH3]NCc1cccc(n1)Br 2230a_100016987751_200025704644 [1,1,0,0,0,0|1,0,1]=4 2128 B10R1.10 [13CH3]NCc1cccc(n1)Cl 2230a_100016990191_200025704644 [1,1,0,0,0,0|1,0,1]=4 2129 B10R1.10 [13CH3]NCc1cccc(n1)F 2230a_100015188798_200025704644 [1,1,0,0,0,0|1,0,1]=4 2130 B10R1.10 [13CH3]NCc1cccc(n1)F 34a_100015188798_200025704644 [1,1,0,0,0,0|1,0,1]=4 2131 B10R1.10 [13CH3]NCc1ccnc(c1)Br 2230a_100025757509_200025704644 [1,1,0,0,0,0|1,0,1]=4 2132 B10R1.10 [13CH3]NCc1ccnc(c1)Br 34a_100025757509_200025704644 [1,1,0,0,0,0|1,0,1]=4 2133 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 2230a_100015205668_200025704644 [1,1,0,0,0,0|1,0,1]=4 2134 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 34a_100015205668_200025704644 [1,1,0,0,0,0|1,0,1]=4 2135 B10R1.10 [13CH3]NCc1ccnc(c1)F 2230a_100015188774_200025704644 [1,1,0,0,0,0|1,0,1]=4 2136 B10R1.10 [13CH3]NCc1ccnc(c1)F 34a_100015188774_200025704644 [1,1,0,0,0,0|1,0,1]=4 2137 B10R1.10 [13CH3]NCc1cncc(c1)Cl 2230a_200020614424_200025704644 [1,1,0,0,0,0|1,0,1]=4 2138 B10R1.10 [13CH3]NCc1cncc(c1)F 2230a_100011962886_200025704644 [1,1,0,0,0,0|1,0,1]=4 2139 B10R1.10 [13CH3]NCc1cncc(c1)F 34a_100011962886_200025704644 [1,1,0,0,0,0|1,0,1]=4 2140 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 2141 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 2142 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 2143 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 2144 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 2145 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 2146 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 2147 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 2148 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,1]=4 2149 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|1,0,1]=4 2150 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|1,0,1]=4 2151 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|1,0,1]=4 2152 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|1,0,1]=4 2153 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|1,0,1]=4 2154 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|1,0,1]=4 2155 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|1,0,1]=4 2156 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|1,0,1]=4 2157 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|1,0,1]=4 2158 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|1,0,1]=4 2159 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,1,0,0,0,0|1,0,1]=4 2160 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [1,1,0,0,0,0|1,0,1]=4 2161 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [1,1,0,0,0,0|1,0,1]=4 2162 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [1,1,0,0,0,0|1,0,1]=4 2163 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [1,1,0,0,0,0|1,0,1]=4 2164 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [1,1,0,0,0,0|1,0,1]=4 2165 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [1,1,0,0,0,0|1,0,1]=4 2166 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [1,1,0,0,0,0|0,0,1]=3 2167 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [1,1,0,0,0,0|0,0,1]=3 2168 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [1,1,0,0,0,0|0,0,1]=3 2169 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [1,1,0,0,0,0|0,0,1]=3 2170 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [1,1,0,0,0,0|0,0,1]=3 2171 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [1,1,0,0,0,0|1,0,1]=4 2172 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [1,1,0,0,0,0|1,0,1]=4 2173 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [1,1,0,0,0,0|1,0,1]=4 2174 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [1,1,0,0,0,0|1,0,1]=4 2175 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [1,1,0,0,0,0|1,0,1]=4 2176 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [1,1,0,0,0,0|1,0,1]=4 2177 B10R1.17 CCNCc1ccncc1 207a_100015525214_100000186114 [1,1,0,0,0,0|1,0,1]=4 2178 B10R1.17 CCNCc1ccncc1 2230a_100015525214_100015193705 [1,1,0,0,0,0|1,0,1]=4 2179 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [1,1,0,0,0,0|1,0,1]=4 2180 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [1,1,0,0,0,0|1,0,1]=4 2181 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [1,1,0,0,0,0|1,0,1]=4 2182 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [1,1,0,0,0,0|1,0,1]=4 2183 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [1,1,0,0,0,0|1,0,1]=4 2184 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [1,1,0,0,0,0|0,0,1]=3 2185 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [1,1,0,0,0,0|0,0,1]=3 2186 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [1,1,0,0,0,0|0,0,1]=3 2187 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [1,1,0,0,0,0|0,0,1]=3 2188 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [1,1,0,0,0,0|0,0,1]=3 2189 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [1,1,0,0,0,0|1,0,1]=4 2190 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [1,1,0,0,0,0|1,0,1]=4 2191 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [1,1,0,0,0,0|1,0,1]=4 2192 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [1,1,0,0,0,0|1,0,1]=4 2193 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [1,1,0,0,0,0|1,0,1]=4 2194 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [1,1,0,0,0,0|1,0,1]=4 2195 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [1,1,0,0,0,0|1,0,1]=4 2196 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [1,1,0,0,0,0|0,0,1]=3 2197 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [1,1,0,0,0,0|1,0,1]=4 2198 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [1,1,0,0,0,0|1,0,1]=4 2199 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [1,1,0,0,0,0|1,0,1]=4 2200 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [1,1,0,0,0,0|1,0,1]=4 2201 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [1,1,0,0,0,0|1,0,1]=4 2202 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [1,1,0,0,0,0|1,0,1]=4 2203 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [1,1,0,0,0,0|1,0,1]=4 2204 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [1,1,0,0,0,0|1,0,1]=4 2205 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [1,1,0,0,0,0|1,0,1]=4 2206 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [1,1,0,0,0,0|1,0,1]=4 2207 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [1,1,0,0,0,0|1,0,1]=4 2208 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [1,1,0,0,0,0|1,0,1]=4 2209 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [1,1,0,0,0,0|1,0,1]=4 2210 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [1,1,0,0,0,0|2,0,0]=4 2211 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [1,1,0,0,0,0|2,0,0]=4 2212 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [1,1,0,0,0,0|2,0,0]=4 2213 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [1,1,0,0,0,0|2,0,0]=4 2214 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [1,1,0,0,0,0|2,0,0]=4 2215 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [1,1,0,0,0,0|0,0,1]=3 2216 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [1,1,0,0,0,0|1,0,1]=4 2217 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [1,1,0,0,0,0|1,0,1]=4 2218 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [1,1,0,0,0,0|1,0,1]=4 2219 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [1,1,0,0,0,0|1,0,1]=4 2220 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [1,1,0,0,0,0|2,0,0]=4 2221 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [1,1,0,0,0,0|2,0,0]=4 2222 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [1,1,0,0,0,0|2,0,0]=4 2223 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [1,1,0,0,0,0|0,0,1]=3 2226 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [1,1,0,0,0,0|0,0,1]=3 2227 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [1,1,0,0,0,0|1,0,1]=4 2228 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [1,1,0,0,0,0|1,0,1]=4 2229 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [1,1,0,0,0,0|1,0,1]=4 2230 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [1,1,0,0,0,0|1,0,1]=4 2231 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [1,1,0,0,0,0|1,0,1]=4 2232 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [1,1,0,0,0,0|1,0,1]=4 2233 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [1,1,0,0,0,0|1,0,1]=4 2234 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,1,0,0,0,0|1,0,0]=3 2235 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,1,0,0,0,0|2,0,0]=4 2236 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,1,0,0,0,0|2,0,0]=4 2237 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,1,0,0,0,0|2,0,0]=4 2238 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,1,0,0,0,0|1,0,1]=4 2239 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,1,0,0,0,0|2,0,0]=4 2240 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,1,0,0,0,0|2,0,0]=4 2241 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,1,0,0,0,0|2,0,0]=4 2242 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,1,0,0,0,0|2,0,0]=4 2243 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,1,0,0,0,0|2,0,0]=4 2244 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,1,0,0,0,0|2,0,0]=4 2245 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,1,0,0,0,0|2,0,0]=4 2246 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,1,0,0,0,0|2,0,0]=4 2247 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,1,0,0,0,0|2,0,0]=4 2248 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,1,0,0,0,0|0,0,1]=3 2249 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,1,0,0,0,0|0,0,1]=3 2250 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,1,0,0,0,0|0,0,1]=3 2251 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,1,0,0,0,0|0,0,1]=3 2252 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,1,0,0,0,0|0,0,1]=3 2253 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [1,1,0,0,0,0|1,0,1]=4 2254 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [1,1,0,0,0,0|1,0,1]=4 2255 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [1,1,0,0,0,0|1,0,1]=4 2256 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [1,1,0,0,0,0|1,0,1]=4 2257 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [1,1,0,0,0,0|1,0,1]=4 2258 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [1,1,0,0,0,0|1,0,1]=4 2259 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [1,1,0,0,0,0|1,0,1]=4 2260 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [1,1,0,0,0,0|1,0,1]=4 2261 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [1,1,0,0,0,0|1,0,1]=4 2262 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [1,1,0,0,0,0|1,0,1]=4 2263 B10R1.18 CN(C)Cc1ccncc1 2230a_100000187231_200000210301 [1,1,0,0,0,0|1,0,1]=4 2264 B10R1.18 CN(C)Cc1ccncc1 2230a_100102631434_100015193705 [1,1,0,0,0,0|1,0,1]=4 2265 B10R1.18 CN(C)Cc1ccncc1 269982a_100000187231_200000210301 [1,1,0,0,0,0|1,0,1]=4 2266 B10R1.18 CN(C)Cc1ccncc1 269982a_100102631434_100015193705 [1,1,0,0,0,0|1,0,1]=4 2267 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,1,0,0,0,0|0,0,1]=3 2268 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,1,0,0,0,0|0,0,1]=3 2269 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [1,1,0,0,0,0|1,0,1]=4 2270 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [1,1,0,0,0,0|1,0,1]=4 2271 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [1,1,0,0,0,0|1,0,1]=4 2272 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [1,1,0,0,0,0|1,0,1]=4 2273 B10R1.18 CN([13CH3])Cc1ccncc1 2230a_100000187231_200025704644 [1,1,0,0,0,0|1,0,1]=4 2274 B10R1.18 CN([13CH3])Cc1ccncc1 269982a_100000187231_200025704644 [1,1,0,0,0,0|1,0,1]=4 2275 B10R1.6 CNS(=O)(=O)c1ccco1 270084a_100102657272_200000702926 [0,1,0,0,1,0|2,0,0]=4 2276 B10R1.6 CNS(=O)(=O)c1ccco1 274078a_100102657272_200000702926 [0,1,0,0,1,0|2,0,0]=4 2277 B10R1.6 CNS(=O)(=O)c1cccs1 270084a_100102657272_100000205146 [0,1,0,0,1,0|2,0,0]=4 2278 B10R1.6 CNS(=O)(=O)c1cccs1 274078a_100102657272_100000205146 [0,1,0,0,1,0|2,0,0]=4 2279 B10R1.6 CNS(=O)(=O)c1cccs1 40a_100102657272_200000102146 [0,1,0,0,1,0|2,0,0]=4 2280 B10R1.6 CNS(=O)(=O)c1ccsc1 270084a_100102657272_100000756429 [0,1,0,0,1,0|2,0,0]=4 2281 B10R1.6 CNS(=O)(=O)c1ccsc1 274078a_100102657272_100000756429 [0,1,0,0,1,0|2,0,0]=4 2282 B10R1.11 CNCC(=O)c1ccc[nH]1 7a_106832991635_200011262396 [0,1,0,0,1,0|1,0,0]=3 2283 B10R1.11 CNCC(=O)c1ccco1 7a_106832991635_100000211439 [0,1,0,0,1,0|1,0,0]=3 2284 B10R1.11 CNCC(=O)c1cccs1 2230a_106832991635_100000211436 [0,1,0,0,1,0|1,0,0]=3 2285 B10R1.11 CNCC(=O)c1cccs1 7a_106832991635_100000211436 [0,1,0,0,1,0|1,0,0]=3 2286 B10R1.11 CNCC(=O)c1ccsc1 2230a_106832991635_100011219462 [0,1,0,0,1,0|1,0,0]=3 2287 B10R1.11 CNCC(=O)c1ccsc1 34a_100102657272_100011219462 [0,1,0,0,1,0|1,0,0]=3 2288 B10R1.11 CNCC(=O)c1ccsc1 7a_106832991635_100011219462 [0,1,0,0,1,0|1,0,0]=3 2289 B10R1.11 CNCC(=O)c1nccs1 7a_106832991635_100000718653 [0,1,0,0,1,0|2,0,0]=4 2290 B10R1.11 CNCC(=O)n1cccn1 2230a_106832991635_100000077511 [0,1,0,0,1,0|2,0,0]=4 2291 B10R1.11 CNCC(=O)n1cccn1 7a_106832991635_100000077511 [0,1,0,0,1,0|2,0,0]=4 2292 B10R1.11 COCC(=O)c1ccsc1 34a_100138415774_100011219462 [0,1,0,0,1,0|2,0,0]=4 2293 B10R1.11 CSCC(=O)c1ccc[nH]1 62a_200000210301_200011262396 [0,1,0,0,1,0|2,0,0]=4 2294 B10R1.11 CSCC(=O)c1ccc[nH]1 62a_200011262396_200000210301 [0,1,0,0,1,0|2,0,0]=4 2295 B10R1.11 CSCC(=O)c1ccco1 62a_100000211439_200000210301 [0,1,0,0,1,0|2,0,0]=4 2296 B10R1.11 CSCC(=O)c1ccco1 62a_200000210301_100000211439 [0,1,0,0,1,0|2,0,0]=4 2297 B10R1.11 CSCC(=O)c1cccs1 62a_100000211436_200000210301 [0,1,0,0,1,0|2,0,0]=4 2298 B10R1.11 CSCC(=O)c1cccs1 62a_200000210301_100000211436 [0,1,0,0,1,0|2,0,0]=4 2299 B10R1.11 CSCC(=O)c1ccsc1 62a_100011219462_200000210301 [0,1,0,0,1,0|2,0,0]=4 2300 B10R1.11 CSCC(=O)c1ccsc1 62a_200000210301_100011219462 [0,1,0,0,1,0|2,0,0]=4 2301 B10R1.11 [13CH3]SCC(=O)c1ccc[nH]1 62a_200011262396_200025704644 [0,1,0,0,1,0|2,0,0]=4 2302 B10R1.11 [13CH3]SCC(=O)c1ccc[nH]1 62a_200025704644_200011262396 [0,1,0,0,1,0|2,0,0]=4 2303 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_100000211439_200025704644 [0,1,0,0,1,0|2,0,0]=4 2304 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_200025704644_100000211439 [0,1,0,0,1,0|2,0,0]=4 2305 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_100000211436_200025704644 [0,1,0,0,1,0|2,0,0]=4 2306 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_200025704644_100000211436 [0,1,0,0,1,0|2,0,0]=4 2307 B10R1.11 [13CH3]SCC(=O)c1ccsc1 62a_100011219462_200025704644 [0,1,0,0,1,0|2,0,0]=4 2308 B10R1.11 [13CH3]SCC(=O)c1ccsc1 62a_200025704644_100011219462 [0,1,0,0,1,0|2,0,0]=4 2309 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,1,0,0,1,0|2,0,0]=4 2310 B10R1.14 CNC(=O)c1ccc(o1)O 271570a_203496583355_100000159859 [0,1,0,0,1,0|1,0,0]=3 2311 B10R1.14 CNC(=O)c1ccc(s1)O 271570a_203496583355_200000155069 [0,1,0,0,1,0|1,0,0]=3 2312 B10R1.14 CNC(=O)c1csc(n1)O 271570a_203496583355_100010260535 [0,1,0,0,1,0|2,0,0]=4 2313 B10R1.14 COC(=O)c1c[nH]c(c1)O 271570a_203496583355_100009840242 [0,1,0,0,1,0|2,0,0]=4 2314 B10R1.14 COC(=O)c1cc(co1)O 271570a_203496583355_100009992624 [0,1,0,0,1,0|2,0,0]=4 2315 B10R1.14 COC(=O)c1cc(cs1)O 271570a_203496583355_100009815473 [0,1,0,0,1,0|2,0,0]=4 2316 B10R1.14 COC(=O)c1ccc([nH]1)O 271570a_203496583355_100000687774 [0,1,0,0,1,0|2,0,0]=4 2317 B10R1.14 COC(=O)c1ccc(o1)O 271570a_203496583355_100000148852 [0,1,0,0,1,0|2,0,0]=4 2318 B10R1.14 COC(=O)c1ccc(s1)O 271570a_203496583355_100000148107 [0,1,0,0,1,0|2,0,0]=4 2319 B10R1.14 COC(=O)c1csc(c1)O 271570a_203496583355_100000692058 [0,1,0,0,1,0|2,0,0]=4 2320 B10R1.14 NNC(=O)c1ccc(o1)O 271570a_203496583355_100000186364 [0,1,0,0,1,0|2,0,0]=4 2321 B10R1.14 NNC(=O)c1ccc(s1)O 271570a_203496583355_100000180196 [0,1,0,0,1,0|2,0,0]=4 2322 B10R1.149 COC(=O)c1[nH]ccc1O 271570a_203496583355_100102525103 [0,1,0,0,1,0|2,0,0]=4 2323 B10R1.149 COC(=O)c1ccoc1O 271570a_203496583355_100011935261 [0,1,0,0,1,0|2,0,0]=4 2324 B10R1.149 COC(=O)c1ccsc1O 271570a_203496583355_100009822520 [0,1,0,0,1,0|2,0,0]=4 2325 B10R1.149 COC(=O)c1cscc1O 271570a_203496583355_100012351140 [0,1,0,0,1,0|2,0,0]=4 2326 B10R1.149 COC(=O)c1occc1O 271570a_203496583355_100012676306 [0,1,0,0,1,0|2,0,0]=4 2327 B10R1.149 COC(=O)c1sccc1O 271570a_203496583355_100000730364 [0,1,0,0,1,0|2,0,0]=4 2328 B12R1.32 C#CCC(=O)Cc1ccccc1 1458a_100011220946_100015291786 [0,1,0,0,0,1|1,0,1]=4 2329 B12R1.32 C#CCC(=O)Nc1ccccc1 1626a_100000106764_100011220946 [0,1,0,0,0,1|1,0,1]=4 2330 B12R1.32 C#CCC(=O)Nc1ccccc1 527a_100000106764_100011220946 [0,1,0,0,0,1|1,0,1]=4 2331 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 34a_200025717232_200025704644 [0,1,0,0,0,1|2,0,0]=4 2332 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 7a_200025717232_200025704644 [0,1,0,0,0,1|2,0,0]=4 2333 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [0,1,0,0,0,1|1,0,1]=4 2334 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [0,1,0,0,0,1|1,0,1]=4 2335 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [0,1,0,0,0,1|1,0,1]=4 2336 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [0,1,0,0,0,1|1,0,1]=4 2337 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [0,1,0,0,0,1|1,0,1]=4 2338 B12R1.32 CC#CC(=O)Cc1ccccc1 1458a_100000763181_100015291786 [0,1,0,0,0,1|1,0,0]=3 2339 B12R1.32 CC#CC(=O)Cc1ccccn1 1458a_100000763181_100000721315 [0,1,0,0,0,1|2,0,0]=4 2340 B12R1.32 CC#CC(=O)Cc1cccnc1 1458a_100000763181_100000733263 [0,1,0,0,0,1|2,0,0]=4 2341 B12R1.32 CC#CC(=O)Cc1ccncc1 1458a_100000763181_100000705612 [0,1,0,0,0,1|2,0,0]=4 2342 B12R1.32 CC#CC(=O)Nc1ccccc1 22a_100000106764_100000763181 [0,1,0,0,0,1|1,0,0]=3 2343 B12R1.32 CC(CN[13CH3])Oc1ccccc1 2230a_100000755676_200025704644 [0,1,0,0,0,1|1,0,1]=4 2344 B12R1.32 CC(CN[13CH3])Oc1ccccc1 34a_100000755676_200025704644 [0,1,0,0,0,1|1,0,1]=4 2345 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [0,1,0,0,0,1|1,0,0]=3 2346 B12R1.32 CC=CC(=O)Cc1ccccn1 1458a_100000210699_100000721315 [0,1,0,0,0,1|2,0,0]=4 2347 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,1,0,0,0,1|2,0,0]=4 2348 B12R1.32 CC=CC(=O)Cc1ccncc1 1458a_100000210699_100000705612 [0,1,0,0,0,1|2,0,0]=4 2349 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [0,1,0,0,0,1|1,0,0]=3 2350 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [0,1,0,0,0,1|1,0,0]=3 2351 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [0,1,0,0,0,1|1,0,0]=3 2352 B12R1.32 CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210303 [0,1,0,0,0,1|2,0,0]=4 2353 B12R1.32 CCCC(=O)Cc1ccccc1 1458a_100000211992_100015291786 [0,1,0,0,0,1|1,0,0]=3 2354 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000211992_100000721315 [0,1,0,0,0,1|2,0,0]=4 2355 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000233486_100000210303 [0,1,0,0,0,1|2,0,0]=4 2356 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000211992_100000733263 [0,1,0,0,0,1|2,0,0]=4 2357 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000737805_100000210303 [0,1,0,0,0,1|2,0,0]=4 2358 B12R1.32 CCCC(=O)Cc1ccncc1 1458a_100000211992_100000705612 [0,1,0,0,0,1|2,0,0]=4 2359 B12R1.32 CCCC(=O)Nc1ccccc1 11a_100000106764_100000211992 [0,1,0,0,0,1|1,0,0]=3 2360 B12R1.32 CCCC(=O)Nc1ccccc1 1626a_100000106764_100000211992 [0,1,0,0,0,1|1,0,0]=3 2361 B12R1.32 CCCC(=O)Nc1ccccc1 22a_100000106764_100000211992 [0,1,0,0,0,1|1,0,0]=3 2362 B12R1.32 CCCC(=O)Nc1ccccc1 527a_100000106764_100000211992 [0,1,0,0,0,1|1,0,0]=3 2363 B12R1.32 CCNC(=O)C[n+]1ccccc1 11a_100015525214_200000086051 [0,1,0,0,0,1|1,0,0]=3 2364 B12R1.32 CCNC(=O)C[n+]1ccccc1 240690a_100015525214_200000086051 [0,1,0,0,0,1|1,0,0]=3 2365 B12R1.32 CCNC(=O)C[n+]1ccccc1 527a_100015525214_200000086051 [0,1,0,0,0,1|1,0,0]=3 2366 B12R1.32 CCNC(=O)Cc1ccccn1 11a_100015525214_100000233486 [0,1,0,0,0,1|1,0,0]=3 2367 B12R1.32 CCNC(=O)Cc1cccnc1 11a_100015525214_100000737805 [0,1,0,0,0,1|1,0,0]=3 2368 B12R1.32 CCNC(=O)Cc1cccnc1 240690a_100015525214_100000737805 [0,1,0,0,0,1|1,0,0]=3 2369 B12R1.32 CCNC(=O)Cc1cccnc1 527a_100015525214_100000737805 [0,1,0,0,0,1|1,0,0]=3 2370 B12R1.32 CCNC(=O)Cc1ccncc1 11a_100015525214_100011201483 [0,1,0,0,0,1|1,0,0]=3 2371 B12R1.32 CCNC(=O)Cc1ccncc1 240690a_100015525214_100011201483 [0,1,0,0,0,1|1,0,0]=3 2372 B12R1.32 CCNC(=O)Cc1cnccn1 11a_100015525214_100000726051 [0,1,0,0,0,1|2,0,0]=4 2373 B12R1.32 CCNC(=O)Cc1cnccn1 240690a_100015525214_100000726051 [0,1,0,0,0,1|2,0,0]=4 2374 B12R1.32 CCNC(=O)Cc1cnccn1 527a_100015525214_100000726051 [0,1,0,0,0,1|2,0,0]=4 2375 B12R1.32 CCNC(=O)Cc1cncnc1 11a_100015525214_100000721575 [0,1,0,0,0,1|2,0,0]=4 2376 B12R1.32 CCNC(=O)Cc1cncnc1 240690a_100015525214_100000721575 [0,1,0,0,0,1|2,0,0]=4 2377 B12R1.32 CCNC(=O)Cc1cncnc1 527a_100015525214_100000721575 [0,1,0,0,0,1|2,0,0]=4 2378 B12R1.32 CCNC(=O)Nc1ccccc1 2430a_100000106764_100015525214 [0,1,0,0,0,1|0,0,0]=2 2379 B12R1.32 CNCC(=O)Cc1ccccc1 2230a_106832991635_100000233483 [0,1,0,0,0,1|0,0,0]=2 2380 B12R1.32 CNCC(=O)Cc1ccccc1 7a_106832991635_100000233483 [0,1,0,0,0,1|0,0,0]=2 2381 B12R1.32 CNCC(=O)Nc1ccccc1 2230a_106832991635_100000182850 [0,1,0,0,0,1|0,0,0]=2 2382 B12R1.32 CNCC(=O)Nc1ccccc1 34a_100102657272_100000182850 [0,1,0,0,0,1|0,0,0]=2 2383 B12R1.32 CNCC(=O)Nc1ccccc1 7a_106832991635_100000182850 [0,1,0,0,0,1|0,0,0]=2 2384 B12R1.32 CNCC(=O)Nc1ccccn1 2230a_106832991635_100020662008 [0,1,0,0,0,1|1,0,0]=3 2385 B12R1.32 CNCC(=O)Nc1ccccn1 7a_106832991635_100020662008 [0,1,0,0,0,1|1,0,0]=3 2386 B12R1.32 CNCC(=O)Nc1ccncc1 2230a_106832991635_100000754145 [0,1,0,0,0,1|1,0,0]=3 2387 B12R1.32 CNCC(=O)Nc1ccncc1 7a_106832991635_100000754145 [0,1,0,0,0,1|1,0,0]=3 2388 B12R1.32 CNCC(=O)Nc1ncccn1 7a_106832991635_100000183248 [0,1,0,0,0,1|2,0,0]=4 2389 B12R1.32 CNCC(=O)Oc1ccccc1 2230a_106832991635_100009813826 [0,1,0,0,0,1|0,0,0]=2 2390 B12R1.32 CNCC(=O)Oc1ccccc1 34a_100102657272_100009813826 [0,1,0,0,0,1|0,0,0]=2 2391 B12R1.32 CNCC(=O)Oc1ccccc1 7a_106832991635_100009813826 [0,1,0,0,0,1|0,0,0]=2 2392 B12R1.32 CNCC(C)Oc1ccccc1 2230a_100000755676_200000210301 [0,1,0,0,0,1|1,0,1]=4 2393 B12R1.32 CNCC(C)Oc1ccccc1 34a_100000755676_200000210301 [0,1,0,0,0,1|1,0,1]=4 2394 B12R1.32 CNCC(O)Cc1ccccc1 2230a_100000752270_200000210301 [0,1,0,0,0,1|0,0,2]=4 2395 B12R1.32 CNC[C@@H](O)Cc1ccccc1 2230a_106832991635_100000729385 [0,1,0,0,0,1|0,0,2]=4 2396 B12R1.32 CNC[C@@H](O)Cc1ccccc1 34a_100102657272_100000729385 [0,1,0,0,0,1|0,0,2]=4 2397 B12R1.32 CNC[C@@H](O)Cc1ccccc1 7a_106832991635_100000729385 [0,1,0,0,0,1|0,0,2]=4 2398 B12R1.32 CNNC(=O)C[n+]1ccccc1 22a_100016993582_200000086051 [0,1,0,0,0,1|1,0,0]=3 2399 B12R1.32 CNNC(=O)Cc1ccccn1 22a_100016993582_100000233486 [0,1,0,0,0,1|1,0,0]=3 2400 B12R1.32 CNNC(=O)Cc1cccnc1 22a_100016993582_100000737805 [0,1,0,0,0,1|1,0,0]=3 2401 B12R1.32 CNNC(=O)Cc1ccncc1 22a_100016993582_100011201483 [0,1,0,0,0,1|1,0,0]=3 2402 B12R1.32 CNNC(=O)Cc1cnccn1 22a_100016993582_100000726051 [0,1,0,0,0,1|2,0,0]=4 2403 B12R1.32 CNNC(=O)Cc1cncnc1 22a_100016993582_100000721575 [0,1,0,0,0,1|2,0,0]=4 2404 B12R1.32 COC/C(=C/c1ccccc1)/C 34a_200025717232_200000210301 [0,1,0,0,0,1|2,0,0]=4 2405 B12R1.32 COC/C(=C/c1ccccc1)/C 7a_200025717232_200000210301 [0,1,0,0,0,1|2,0,0]=4 2406 B12R1.32 COCC(=O)Cc1ccccc1 1458a_100000210968_100015291786 [0,1,0,0,0,1|1,0,0]=3 2407 B12R1.32 COCC(=O)Cc1ccccn1 1458a_100000210968_100000721315 [0,1,0,0,0,1|2,0,0]=4 2408 B12R1.32 COCC(=O)Cc1cccnc1 1458a_100000210968_100000733263 [0,1,0,0,0,1|2,0,0]=4 2409 B12R1.32 COCC(=O)Cc1ccncc1 1458a_100000210968_100000705612 [0,1,0,0,0,1|2,0,0]=4 2410 B12R1.32 COCC(=O)Nc1ccccc1 11a_100000106764_100000210968 [0,1,0,0,0,1|1,0,0]=3 2411 B12R1.32 COCC(=O)Nc1ccccc1 1626a_100000106764_100000210968 [0,1,0,0,0,1|1,0,0]=3 2412 B12R1.32 COCC(=O)Nc1ccccc1 22a_100000106764_100000210968 [0,1,0,0,0,1|1,0,0]=3 2413 B12R1.32 COCC(=O)Nc1ccccc1 34a_100000246334_200000210301 [0,1,0,0,0,1|1,0,0]=3 2414 B12R1.32 COCC(=O)Nc1ccccc1 34a_100138415774_100000182850 [0,1,0,0,0,1|1,0,0]=3 2415 B12R1.32 COCC(=O)Nc1ccccc1 527a_100000106764_100000210968 [0,1,0,0,0,1|1,0,0]=3 2416 B12R1.32 COCC(=O)Oc1ccccc1 34a_100138415774_100009813826 [0,1,0,0,0,1|1,0,0]=3 2417 B12R1.32 CSCC(=O)Cc1ccccc1 1458a_100000184570_100015291786 [0,1,0,0,0,1|1,0,0]=3 2418 B12R1.32 CSCC(=O)Cc1ccccc1 62a_100000233483_200000210301 [0,1,0,0,0,1|1,0,0]=3 2419 B12R1.32 CSCC(=O)Cc1ccccc1 62a_200000210301_100000233483 [0,1,0,0,0,1|1,0,0]=3 2420 B12R1.32 CSCC(=O)Cc1ccccn1 1458a_100000184570_100000721315 [0,1,0,0,0,1|2,0,0]=4 2421 B12R1.32 CSCC(=O)Cc1cccnc1 1458a_100000184570_100000733263 [0,1,0,0,0,1|2,0,0]=4 2422 B12R1.32 CSCC(=O)Cc1ccncc1 1458a_100000184570_100000705612 [0,1,0,0,0,1|2,0,0]=4 2423 B12R1.32 CSCC(=O)Nc1ccccc1 11a_100000106764_100000184570 [0,1,0,0,0,1|1,0,0]=3 2424 B12R1.32 CSCC(=O)Nc1ccccc1 1626a_100000106764_100000184570 [0,1,0,0,0,1|1,0,0]=3 2425 B12R1.32 CSCC(=O)Nc1ccccc1 22a_100000106764_100000184570 [0,1,0,0,0,1|1,0,0]=3 2426 B12R1.32 CSCC(=O)Nc1ccccc1 527a_100000106764_100000184570 [0,1,0,0,0,1|1,0,0]=3 2427 B12R1.32 CSCC(=O)Nc1ccccc1 62a_100012148978_200000210301 [0,1,0,0,0,1|1,0,0]=3 2428 B12R1.32 CSCC(=O)Nc1ccccc1 62a_200000210301_100000182850 [0,1,0,0,0,1|1,0,0]=3 2429 B12R1.32 CSCC(=O)Nc1ccccn1 62a_100020662008_200000210301 [0,1,0,0,0,1|2,0,0]=4 2430 B12R1.32 CSCC(=O)Nc1ccccn1 62a_200000210301_100020662008 [0,1,0,0,0,1|2,0,0]=4 2431 B12R1.32 CSCC(=O)Nc1ccncc1 62a_200000210301_100000754145 [0,1,0,0,0,1|2,0,0]=4 2432 B12R1.32 CSCC(=O)Oc1ccccc1 62a_100009813826_200000210301 [0,1,0,0,0,1|1,0,0]=3 2433 B12R1.32 CSCC(=O)Oc1ccccc1 62a_200000210301_100009813826 [0,1,0,0,0,1|1,0,0]=3 2434 B12R1.32 N#CCC(=O)Cc1ccccc1 1458a_100051588842_100015291786 [0,1,0,0,0,1|1,0,1]=4 2435 B12R1.32 N#CCC(=O)Nc1ccccc1 1626a_100000106764_100051588842 [0,1,0,0,0,1|1,0,1]=4 2436 B12R1.32 N#CCC(=O)Nc1ccccc1 22a_100000106764_100051588842 [0,1,0,0,0,1|1,0,1]=4 2437 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [0,1,0,0,0,1|1,0,1]=4 2438 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [0,1,0,0,0,1|1,0,1]=4 2439 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [0,1,0,0,0,1|1,0,1]=4 2440 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [0,1,0,0,0,1|1,0,1]=4 2441 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [0,1,0,0,0,1|1,0,1]=4 2442 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [0,1,0,0,0,1|1,0,1]=4 2443 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [0,1,0,0,0,1|1,0,1]=4 2444 B12R1.32 O=C(CCF)C[n+]1ccccc1 1458a_200000086051_100011217306 [0,1,0,0,0,1|2,0,0]=4 2445 B12R1.32 O=C(CCF)Cc1ccccn1 1458a_100000233486_100011217306 [0,1,0,0,0,1|2,0,0]=4 2446 B12R1.32 O=C(CCF)Cc1cccnc1 1458a_100000737805_100011217306 [0,1,0,0,0,1|2,0,0]=4 2447 B12R1.32 O=C(CCO)C[n+]1ccccc1 1458a_200000086051_100000211926 [0,1,0,0,0,1|2,0,0]=4 2448 B12R1.32 O=C(CCO)Cc1ccccc1 1458a_100011216618_100015291786 [0,1,0,0,0,1|1,0,0]=3 2449 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100000233486_100000211926 [0,1,0,0,0,1|2,0,0]=4 2450 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100011216618_100000721315 [0,1,0,0,0,1|2,0,0]=4 2451 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100000737805_100000211926 [0,1,0,0,0,1|2,0,0]=4 2452 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100011216618_100000733263 [0,1,0,0,0,1|2,0,0]=4 2453 B12R1.32 O=C(CCO)Cc1ccncc1 1458a_100011216618_100000705612 [0,1,0,0,0,1|2,0,0]=4 2454 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [0,1,0,0,0,1|1,0,0]=3 2455 B12R1.32 [13CH3]NCC(O)Cc1ccccc1 2230a_100000752270_200025704644 [0,1,0,0,0,1|0,0,2]=4 2456 B12R1.32 [13CH3]OCC(=O)Nc1ccccc1 34a_100000246334_200025704644 [0,1,0,0,0,1|1,0,0]=3 2457 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_100000233483_200025704644 [0,1,0,0,0,1|1,0,0]=3 2458 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_200025704644_100000233483 [0,1,0,0,0,1|1,0,0]=3 2459 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_100012148978_200025704644 [0,1,0,0,0,1|1,0,0]=3 2460 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_200025704644_100000182850 [0,1,0,0,0,1|1,0,0]=3 2461 B12R1.32 [13CH3]SCC(=O)Nc1ccccn1 62a_100020662008_200025704644 [0,1,0,0,0,1|2,0,0]=4 2462 B12R1.32 [13CH3]SCC(=O)Nc1ccccn1 62a_200025704644_100020662008 [0,1,0,0,0,1|2,0,0]=4 2463 B12R1.32 [13CH3]SCC(=O)Nc1ccncc1 62a_200025704644_100000754145 [0,1,0,0,0,1|2,0,0]=4 2464 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_100009813826_200025704644 [0,1,0,0,0,1|1,0,0]=3 2465 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_200025704644_100009813826 [0,1,0,0,0,1|1,0,0]=3 2466 B12R1.34 C#CC(=O)C(C)c1ccccc1 1458a_100000211873_100000230085 [0,1,0,0,0,1|1,0,1]=4 2467 B12R1.34 C=C(C(=O)CC)c1ccccc1 1458a_100000065200_100000210202 [0,1,0,0,0,1|1,0,0]=3 2468 B12R1.34 C=C(C(=O)CF)c1ccccc1 1458a_100000065200_100015361967 [0,1,0,0,0,1|2,0,0]=4 2469 B12R1.34 C=C(C(=O)NC)c1ccccc1 1626a_100102657272_100000065200 [0,1,0,0,0,1|0,0,0]=2 2470 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [0,1,0,0,0,1|1,0,1]=4 2471 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [0,1,0,0,0,1|1,0,1]=4 2472 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [0,1,0,0,0,1|1,0,1]=4 2473 B12R1.34 CC(C(=O)CO)c1ccccc1 1458a_100000210174_100000230085 [0,1,0,0,0,1|2,0,0]=4 2474 B12R1.34 CCC(=O)C(C)c1ccccc1 1458a_100000210414_100000230085 [0,1,0,0,0,1|1,0,0]=3 2475 B12R1.34 CCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210202 [0,1,0,0,0,1|2,0,0]=4 2476 B12R1.34 CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210202 [0,1,0,0,0,1|1,0,0]=3 2477 B12R1.34 CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210414 [0,1,0,0,0,1|1,0,0]=3 2478 B12R1.34 CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210414 [0,1,0,0,0,1|1,0,0]=3 2479 B12R1.34 CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210414 [0,1,0,0,0,1|1,0,0]=3 2480 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210202 [0,1,0,0,0,1|1,0,0]=3 2481 B12R1.34 CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210202 [0,1,0,0,0,1|1,0,0]=3 2482 B12R1.34 CN(C(=O)CO)c1ccccc1 22a_100000210012_100000210174 [0,1,0,0,0,1|2,0,0]=4 2483 B12R1.34 CNC(=O)C(C)c1ccccn1 11a_106832991635_100000722050 [0,1,0,0,0,1|1,0,0]=3 2484 B12R1.34 CNC(=O)C(C)c1ccccn1 1626a_100102657272_100000722050 [0,1,0,0,0,1|1,0,0]=3 2485 B12R1.34 CNC(=O)C(C)c1ccccn1 240690a_100102657272_100000722050 [0,1,0,0,0,1|1,0,0]=3 2486 B12R1.34 CNC(=O)C(C)c1ccccn1 527a_100102657272_100000722050 [0,1,0,0,0,1|1,0,0]=3 2487 B12R1.34 CNC(=O)C(C)c1ncccn1 11a_106832991635_100011934538 [0,1,0,0,0,1|2,0,0]=4 2488 B12R1.34 CNC(=O)C(C)c1ncccn1 240690a_100102657272_100011934538 [0,1,0,0,0,1|2,0,0]=4 2489 B12R1.34 CNC(=O)C(C)c1ncccn1 527a_100102657272_100011934538 [0,1,0,0,0,1|2,0,0]=4 2490 B12R1.34 CNC(=O)C(F)c1ccccc1 11a_106832991635_100000698975 [0,1,0,0,0,1|0,0,0]=2 2491 B12R1.34 CNC(=O)C(F)c1ccccc1 1626a_100102657272_100000698975 [0,1,0,0,0,1|0,0,0]=2 2492 B12R1.34 CNC(=O)C(F)c1ccccc1 240690a_100102657272_100000698975 [0,1,0,0,0,1|0,0,0]=2 2493 B12R1.34 CNC(=O)C(F)c1ccccc1 527a_100102657272_100000698975 [0,1,0,0,0,1|0,0,0]=2 2494 B12R1.34 CNC(=O)N(C)c1ccccc1 512a_106832991638_100000210012 [0,1,0,0,0,1|0,0,0]=2 2495 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 11a_106832991635_100000751047 [0,1,0,0,0,1|0,0,0]=2 2496 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 1626a_100102657272_100000751047 [0,1,0,0,0,1|0,0,0]=2 2497 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 240690a_100102657272_100000751047 [0,1,0,0,0,1|0,0,0]=2 2498 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 527a_100102657272_100000751047 [0,1,0,0,0,1|0,0,0]=2 2499 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 240690a_100102657272_100000684486 [0,1,0,0,0,1|0,0,0]=2 2500 B12R1.34 CNC(C)C(=O)c1ccccc1 2230a_106832991635_100000239700 [0,1,0,0,0,1|1,0,1]=4 2501 B12R1.34 CNC(C)C(=O)c1ccccc1 7a_106832991635_100000239700 [0,1,0,0,0,1|1,0,1]=4 2502 B12R1.34 C[C@H](C(=O)CF)c1ccccc1 1458a_100000751047_100015361967 [0,1,0,0,0,1|2,0,0]=4 2503 B12R1.34 O=C(CF)C(F)c1ccccc1 1458a_100000698975_100015361967 [0,1,0,0,0,1|2,0,0]=4 2504 B12R1.34 O=C(CF)[C@H](O)c1ccccc1 1458a_100000684486_100015361967 [0,1,0,0,0,1|2,0,0]=4 2505 B12R1.43 C/C(=C\c1ccccc1)/C(=O)[13CH3] 1458a_100016990649_200025704644 [0,1,0,0,0,1|2,0,0]=4 2506 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [0,1,0,0,0,1|1,0,1]=4 2507 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [0,1,0,0,0,1|1,0,1]=4 2508 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [0,1,0,0,0,1|1,0,0]=3 2509 B12R1.43 C=C(C)C(=O)Cc1ccccn1 1458a_100000185857_100000721315 [0,1,0,0,0,1|2,0,0]=4 2510 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [0,1,0,0,0,1|2,0,0]=4 2511 B12R1.43 C=C(C)C(=O)Cc1ccncc1 1458a_100000185857_100000705612 [0,1,0,0,0,1|2,0,0]=4 2512 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [0,1,0,0,0,1|1,0,0]=3 2513 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [0,1,0,0,0,1|1,0,0]=3 2514 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [0,1,0,0,0,1|1,0,0]=3 2515 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 2516 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 2517 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 2518 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 2519 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 2520 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 2521 B12R1.43 CC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_200000210301 [0,1,0,0,0,1|2,0,0]=4 2522 B12R1.43 CC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200000210301 [0,1,0,0,0,1|2,0,0]=4 2523 B12R1.43 CC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200000210301 [0,1,0,0,0,1|2,0,0]=4 2524 B12R1.43 CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_200000210301 [0,1,0,0,0,1|1,0,0]=3 2525 B12R1.43 CC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_100000210206 [0,1,0,0,0,1|2,0,0]=4 2526 B12R1.43 CC(C)C(=O)Cc1ccccc1 1458a_100000210198_100015291786 [0,1,0,0,0,1|1,0,0]=3 2527 B12R1.43 CC(C)C(=O)Cc1ccccn1 1458a_100000210198_100000721315 [0,1,0,0,0,1|2,0,0]=4 2528 B12R1.43 CC(C)C(=O)Cc1ccccn1 1458a_100000233486_100000210206 [0,1,0,0,0,1|2,0,0]=4 2529 B12R1.43 CC(C)C(=O)Cc1cccnc1 1458a_100000210198_100000733263 [0,1,0,0,0,1|2,0,0]=4 2530 B12R1.43 CC(C)C(=O)Cc1cccnc1 1458a_100000737805_100000210206 [0,1,0,0,0,1|2,0,0]=4 2531 B12R1.43 CC(C)C(=O)Cc1ccncc1 1458a_100000210198_100000705612 [0,1,0,0,0,1|2,0,0]=4 2532 B12R1.43 CC(C)C(=O)Nc1ccccc1 11a_100000106764_100000210198 [0,1,0,0,0,1|1,0,0]=3 2533 B12R1.43 CC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000210198 [0,1,0,0,0,1|1,0,0]=3 2534 B12R1.43 CC(C)C(=O)Nc1ccccc1 22a_100000106764_100000210198 [0,1,0,0,0,1|1,0,0]=3 2535 B12R1.43 CC(C)C(=O)Nc1ccccc1 527a_100000106764_100000210198 [0,1,0,0,0,1|1,0,0]=3 2536 B12R1.43 CC(Cc1ccccc1)N(C)C 269982a_100102631434_200011218536 [0,1,0,0,0,1|1,0,1]=4 2537 B12R1.43 CC(F)C(=O)Cc1ccccc1 1458a_100000062450_100015291786 [0,1,0,0,0,1|1,0,0]=3 2538 B12R1.43 CC(F)C(=O)Cc1ccccn1 1458a_100000062450_100000721315 [0,1,0,0,0,1|2,0,0]=4 2539 B12R1.43 CC(F)C(=O)Cc1cccnc1 1458a_100000062450_100000733263 [0,1,0,0,0,1|2,0,0]=4 2540 B12R1.43 CC(F)C(=O)Cc1ccncc1 1458a_100000062450_100000705612 [0,1,0,0,0,1|2,0,0]=4 2541 B12R1.43 CC(F)C(=O)Nc1ccccc1 11a_100000106764_100000062450 [0,1,0,0,0,1|1,0,0]=3 2542 B12R1.43 CC(F)C(=O)Nc1ccccc1 1626a_100000106764_100000062450 [0,1,0,0,0,1|1,0,0]=3 2543 B12R1.43 CC(F)C(=O)Nc1ccccc1 22a_100000106764_100000062450 [0,1,0,0,0,1|1,0,0]=3 2544 B12R1.43 CC(F)C(=O)Nc1ccccc1 527a_100000106764_100000062450 [0,1,0,0,0,1|1,0,0]=3 2545 B12R1.43 CN(C)C(=O)C[n+]1ccccc1 11a_100102631434_200000086051 [0,1,0,0,0,1|1,0,0]=3 2546 B12R1.43 CN(C)C(=O)C[n+]1ccccc1 240690a_100102631434_200000086051 [0,1,0,0,0,1|1,0,0]=3 2547 B12R1.43 CN(C)C(=O)C[n+]1ccccc1 527a_100102631434_200000086051 [0,1,0,0,0,1|1,0,0]=3 2548 B12R1.43 CN(C)C(=O)Cc1ccccn1 11a_100102631434_100000233486 [0,1,0,0,0,1|1,0,0]=3 2549 B12R1.43 CN(C)C(=O)Cc1cccnc1 11a_100102631434_100000737805 [0,1,0,0,0,1|1,0,0]=3 2550 B12R1.43 CN(C)C(=O)Cc1cccnc1 240690a_100102631434_100000737805 [0,1,0,0,0,1|1,0,0]=3 2551 B12R1.43 CN(C)C(=O)Cc1cccnc1 527a_100102631434_100000737805 [0,1,0,0,0,1|1,0,0]=3 2552 B12R1.43 CN(C)C(=O)Cc1ccncc1 11a_100102631434_100011201483 [0,1,0,0,0,1|1,0,0]=3 2553 B12R1.43 CN(C)C(=O)Cc1ccncc1 240690a_100102631434_100011201483 [0,1,0,0,0,1|1,0,0]=3 2554 B12R1.43 CN(C)C(=O)Cc1cnccn1 11a_100102631434_100000726051 [0,1,0,0,0,1|2,0,0]=4 2555 B12R1.43 CN(C)C(=O)Cc1cnccn1 240690a_100102631434_100000726051 [0,1,0,0,0,1|2,0,0]=4 2556 B12R1.43 CN(C)C(=O)Cc1cnccn1 527a_100102631434_100000726051 [0,1,0,0,0,1|2,0,0]=4 2557 B12R1.43 CN(C)C(=O)Cc1cncnc1 11a_100102631434_100000721575 [0,1,0,0,0,1|2,0,0]=4 2558 B12R1.43 CN(C)C(=O)Cc1cncnc1 240690a_100102631434_100000721575 [0,1,0,0,0,1|2,0,0]=4 2559 B12R1.43 CN(C)C(=O)Cc1cncnc1 527a_100102631434_100000721575 [0,1,0,0,0,1|2,0,0]=4 2560 B12R1.43 CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100102631434 [0,1,0,0,0,1|0,0,0]=2 2561 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 1458a_100000717761_100015291786 [0,1,0,0,0,1|1,0,0]=3 2562 B12R1.43 C[C@@H](O)C(=O)Cc1ccccn1 1458a_100000717761_100000721315 [0,1,0,0,0,1|2,0,0]=4 2563 B12R1.43 C[C@@H](O)C(=O)Cc1cccnc1 1458a_100000717761_100000733263 [0,1,0,0,0,1|2,0,0]=4 2564 B12R1.43 C[C@@H](O)C(=O)Cc1ccncc1 1458a_100000717761_100000705612 [0,1,0,0,0,1|2,0,0]=4 2565 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 22a_100000106764_100000717761 [0,1,0,0,0,1|1,0,0]=3 2566 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 1458a_217856618621_100015291786 [0,1,0,0,0,1|1,0,0]=3 2567 B12R1.43 C[C@H](O)C(=O)Cc1ccccn1 1458a_217856618621_100000721315 [0,1,0,0,0,1|2,0,0]=4 2568 B12R1.43 C[C@H](O)C(=O)Cc1cccnc1 1458a_217856618621_100000733263 [0,1,0,0,0,1|2,0,0]=4 2569 B12R1.43 C[C@H](O)C(=O)Cc1ccncc1 1458a_217856618621_100000705612 [0,1,0,0,0,1|2,0,0]=4 2570 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 1626a_100000106764_217856618621 [0,1,0,0,0,1|1,0,0]=3 2571 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_217856618621 [0,1,0,0,0,1|1,0,0]=3 2572 B12R1.43 NC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011215815 [0,1,0,0,0,1|2,0,0]=4 2573 B12R1.43 O=C(Cc1ccccc1)C(O)O 1458a_100000233687_100015291786 [0,1,0,0,0,1|2,0,0]=4 2574 B12R1.43 O=C(Nc1ccccc1)C(F)F 11a_100000106764_100000210393 [0,1,0,0,0,1|2,0,0]=4 2575 B12R1.43 O=C(Nc1ccccc1)C(F)F 1626a_100000106764_100000210393 [0,1,0,0,0,1|2,0,0]=4 2576 B12R1.43 O=C(Nc1ccccc1)C(F)F 22a_100000106764_100000210393 [0,1,0,0,0,1|2,0,0]=4 2577 B12R1.43 O=C(Nc1ccccc1)C(F)F 527a_100000106764_100000210393 [0,1,0,0,0,1|2,0,0]=4 2578 B12R1.43 O=C(Nc1ccccc1)C(O)O 22a_100000106764_100000233687 [0,1,0,0,0,1|2,0,0]=4 2579 B12R1.43 [13CH3]C(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200025704644 [0,1,0,0,0,1|2,0,0]=4 2580 B12R1.43 [13CH3]C(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200025704644 [0,1,0,0,0,1|2,0,0]=4 2581 B12R1.43 [13CH3]C(=O)C(=O)Nc1ccccc1 1458a_100000738435_200025704644 [0,1,0,0,0,1|1,0,0]=3 2582 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [0,1,0,0,0,1|1,0,1]=4 2583 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [0,1,0,0,0,1|1,0,1]=4 2584 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [0,1,0,0,0,1|1,0,1]=4 2585 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [0,1,0,0,0,1|1,0,1]=4 2586 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [0,1,0,0,0,1|1,0,1]=4 2587 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [0,1,0,0,0,1|1,0,1]=4 2588 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [0,1,0,0,0,1|1,0,1]=4 2589 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [0,1,0,0,0,1|1,0,1]=4 2590 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [0,1,0,0,0,1|1,0,1]=4 2591 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [0,1,0,0,0,1|1,0,1]=4 2592 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [0,1,0,0,0,1|1,0,1]=4 2593 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [0,1,0,0,0,1|1,0,1]=4 2594 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [0,1,0,0,0,1|1,0,1]=4 2595 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [0,1,0,0,0,1|1,0,1]=4 2596 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [0,1,0,0,0,1|1,0,1]=4 2597 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [0,1,0,0,0,1|1,0,1]=4 2598 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [0,1,0,0,0,1|1,0,1]=4 2599 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [0,1,0,0,0,1|1,0,1]=4 2600 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [0,1,0,0,0,1|1,0,1]=4 2601 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [0,1,0,0,0,1|1,0,1]=4 2602 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [0,1,0,0,0,1|1,0,1]=4 2603 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,1,0,0,0,1|1,0,1]=4 2604 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,1,0,0,0,1|1,0,1]=4 2605 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [0,1,0,0,0,1|1,0,0]=3 2606 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [0,1,0,0,0,1|1,0,0]=3 2607 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [0,1,0,0,0,1|1,0,0]=3 2608 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [0,1,0,0,0,1|1,0,0]=3 2609 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [0,1,0,0,0,1|1,0,0]=3 2610 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [0,1,0,0,0,1|1,0,0]=3 2611 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [0,1,0,0,0,1|1,0,0]=3 2612 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [0,1,0,0,0,1|1,0,0]=3 2613 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [0,1,0,0,0,1|1,0,0]=3 2614 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [0,1,0,0,0,1|1,0,0]=3 2615 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,1,0,0,0,1|1,0,0]=3 2616 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100000210414_100000702658 [0,1,0,0,0,1|2,0,0]=4 2617 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210202 [0,1,0,0,0,1|2,0,0]=4 2618 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100000210414_100000691093 [0,1,0,0,0,1|2,0,0]=4 2619 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210202 [0,1,0,0,0,1|2,0,0]=4 2620 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000210414_100012066911 [0,1,0,0,0,1|2,0,0]=4 2621 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210202 [0,1,0,0,0,1|2,0,0]=4 2622 B12R1.49 CCC(=O)Cc1ccc(cn1)F 1458a_100000210414_100000703193 [0,1,0,0,0,1|2,0,0]=4 2623 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100000210414_100009831999 [0,1,0,0,0,1|2,0,0]=4 2624 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210202 [0,1,0,0,0,1|2,0,0]=4 2625 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000210414_100016987292 [0,1,0,0,0,1|2,0,0]=4 2626 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210202 [0,1,0,0,0,1|2,0,0]=4 2627 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210202 [0,1,0,0,0,1|2,0,0]=4 2628 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000210414_100000735431 [0,1,0,0,0,1|2,0,0]=4 2629 B12R1.49 CCC(=O)Cc1ccc(nc1)F 1458a_100000210414_100009820150 [0,1,0,0,0,1|2,0,0]=4 2630 B12R1.49 CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210202 [0,1,0,0,0,1|2,0,0]=4 2631 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 2632 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 2633 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 2634 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 2635 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [0,1,0,0,0,1|1,0,0]=3 2636 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [0,1,0,0,0,1|1,0,0]=3 2637 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [0,1,0,0,0,1|1,0,0]=3 2638 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [0,1,0,0,0,1|1,0,0]=3 2639 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 2640 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 2641 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 2642 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 2643 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 2644 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 2645 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 2646 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 2647 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 2648 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 2649 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 2650 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 2651 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,1,0,0,0,1|1,0,0]=3 2652 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,1,0,0,0,1|1,0,0]=3 2653 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [0,1,0,0,0,1|0,0,0]=2 2654 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [0,1,0,0,0,1|0,0,0]=2 2655 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [0,1,0,0,0,1|0,0,0]=2 2656 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [0,1,0,0,0,1|0,0,0]=2 2657 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [0,1,0,0,0,1|0,0,0]=2 2658 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [0,1,0,0,0,1|0,0,0]=2 2659 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [0,1,0,0,0,1|0,0,0]=2 2660 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [0,1,0,0,0,1|0,0,0]=2 2661 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [0,1,0,0,0,1|0,0,0]=2 2662 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [0,1,0,0,0,1|0,0,0]=2 2663 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [0,1,0,0,0,1|0,0,0]=2 2664 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [0,1,0,0,0,1|0,0,0]=2 2665 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [0,1,0,0,0,1|0,0,0]=2 2666 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [0,1,0,0,0,1|0,0,0]=2 2667 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [0,1,0,0,0,1|0,0,0]=2 2668 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [0,1,0,0,0,1|0,0,0]=2 2669 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [0,1,0,0,0,1|0,0,0]=2 2670 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,1,0,0,0,1|0,0,0]=2 2671 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,1,0,0,0,1|0,0,0]=2 2672 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,1,0,0,0,1|0,0,0]=2 2673 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,1,0,0,0,1|0,0,0]=2 2674 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 11a_106832991635_100020629044 [0,1,0,0,0,1|1,0,0]=3 2675 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 240690a_100102657272_100020629044 [0,1,0,0,0,1|1,0,0]=3 2676 B12R1.49 CNC(=O)Cc1ccc(cn1)C 11a_106832991635_100025705728 [0,1,0,0,0,1|1,0,0]=3 2677 B12R1.49 CNC(=O)Cc1ccc(cn1)C 1626a_100102657272_100025705728 [0,1,0,0,0,1|1,0,0]=3 2678 B12R1.49 CNC(=O)Cc1ccc(cn1)C 240690a_100102657272_100025705728 [0,1,0,0,0,1|1,0,0]=3 2679 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 11a_106832991635_100000728320 [0,1,0,0,0,1|1,0,0]=3 2680 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 1626a_100102657272_100000728320 [0,1,0,0,0,1|1,0,0]=3 2681 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 240690a_100102657272_100000728320 [0,1,0,0,0,1|1,0,0]=3 2682 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 527a_100102657272_100000728320 [0,1,0,0,0,1|1,0,0]=3 2683 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 11a_106832991635_100010067268 [0,1,0,0,0,1|1,0,0]=3 2684 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 240690a_100102657272_100010067268 [0,1,0,0,0,1|1,0,0]=3 2685 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 527a_100102657272_100010067268 [0,1,0,0,0,1|1,0,0]=3 2686 B12R1.49 CNC(=O)Cc1ccc(nc1)C 11a_106832991635_100000740413 [0,1,0,0,0,1|1,0,0]=3 2687 B12R1.49 CNC(=O)Cc1ccc(nc1)C 1626a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 2688 B12R1.49 CNC(=O)Cc1ccc(nc1)C 240690a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 2689 B12R1.49 CNC(=O)Cc1ccc(nc1)C 527a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 2690 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 11a_106832991635_100000061944 [0,1,0,0,0,1|1,0,0]=3 2691 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 1626a_100102657272_100000061944 [0,1,0,0,0,1|1,0,0]=3 2692 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 240690a_100102657272_100000061944 [0,1,0,0,0,1|1,0,0]=3 2693 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 527a_100102657272_100000061944 [0,1,0,0,0,1|1,0,0]=3 2694 B12R1.49 CNC(=O)Cc1ncc(cn1)Br 240690a_100102657272_100012357043 [0,1,0,0,0,1|2,0,0]=4 2695 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 11a_106832991635_200000238563 [0,1,0,0,0,1|1,0,0]=3 2696 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 1626a_100102657272_200000238563 [0,1,0,0,0,1|1,0,0]=3 2697 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 240690a_100102657272_200000238563 [0,1,0,0,0,1|1,0,0]=3 2698 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 527a_100102657272_200000238563 [0,1,0,0,0,1|1,0,0]=3 2699 B12R1.49 CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102657272 [0,1,0,0,0,1|0,0,0]=2 2700 B12R1.49 CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100102657272 [0,1,0,0,0,1|0,0,0]=2 2701 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102657272 [0,1,0,0,0,1|0,0,0]=2 2702 B12R1.49 CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102657272 [0,1,0,0,0,1|0,0,0]=2 2703 B12R1.49 CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102657272 [0,1,0,0,0,1|0,0,0]=2 2704 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,1,0,0,0,1|0,0,0]=2 2705 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [0,1,0,0,0,1|1,0,1]=4 2706 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [0,1,0,0,0,1|1,0,1]=4 2707 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [0,1,0,0,0,1|1,0,1]=4 2708 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [0,1,0,0,0,1|1,0,1]=4 2709 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,1,0,0,0,1|1,0,1]=4 2710 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,1,0,0,0,1|1,0,1]=4 2711 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,1,0,0,0,1|1,0,1]=4 2712 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,1,0,0,0,1|1,0,0]=3 2713 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [0,1,0,0,0,1|2,0,0]=4 2714 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [0,1,0,0,0,1|2,0,0]=4 2715 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,1,0,0,0,1|1,0,0]=3 2716 B12R1.49 COC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000188976 [0,1,0,0,0,1|2,0,0]=4 2717 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [0,1,0,0,0,1|2,0,0]=4 2718 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [0,1,0,0,0,1|2,0,0]=4 2719 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [0,1,0,0,0,1|2,0,0]=4 2720 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [0,1,0,0,0,1|2,0,0]=4 2721 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [0,1,0,0,0,1|2,0,0]=4 2722 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [0,1,0,0,0,1|2,0,0]=4 2723 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [0,1,0,0,0,1|2,0,0]=4 2724 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [0,1,0,0,0,1|2,0,0]=4 2725 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,1,0,0,0,1|2,0,0]=4 2726 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [0,1,0,0,0,1|2,0,0]=4 2727 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [0,1,0,0,0,1|2,0,0]=4 2728 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [0,1,0,0,0,1|2,0,0]=4 2729 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [0,1,0,0,0,1|2,0,0]=4 2730 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [0,1,0,0,0,1|2,0,0]=4 2731 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [0,1,0,0,0,1|2,0,0]=4 2732 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [0,1,0,0,0,1|2,0,0]=4 2733 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [0,1,0,0,0,1|2,0,0]=4 2734 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [0,1,0,0,0,1|2,0,0]=4 2735 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [0,1,0,0,0,1|2,0,0]=4 2736 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [0,1,0,0,0,1|2,0,0]=4 2737 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [0,1,0,0,0,1|2,0,0]=4 2738 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,1,0,0,0,1|2,0,0]=4 2739 B12R1.50 C#CC(=O)Cc1cccc(c1)Br 1458a_100000211873_100000211773 [0,1,0,0,0,1|1,0,1]=4 2740 B12R1.50 C#CC(=O)Cc1cccc(c1)C 1458a_100000211873_100000211840 [0,1,0,0,0,1|1,0,1]=4 2741 B12R1.50 C#CC(=O)Cc1cccc(c1)Cl 1458a_100000211873_100000181238 [0,1,0,0,0,1|1,0,1]=4 2742 B12R1.50 C#CC(=O)Cc1cccc(c1)F 1458a_100000211873_100000230114 [0,1,0,0,0,1|1,0,1]=4 2743 B12R1.50 C#CC(=O)Cc1cccc(c1)I 1458a_100000211873_100011218688 [0,1,0,0,0,1|1,0,1]=4 2744 B12R1.50 C#CC(=O)Cc1cccc(c1)O 1458a_100000211873_100011660834 [0,1,0,0,0,1|1,0,1]=4 2745 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [0,1,0,0,0,1|1,0,1]=4 2746 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,1,0,0,0,1|1,0,1]=4 2747 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [0,1,0,0,0,1|1,0,1]=4 2748 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [0,1,0,0,0,1|1,0,1]=4 2749 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [0,1,0,0,0,1|1,0,1]=4 2750 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [0,1,0,0,0,1|1,0,1]=4 2751 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [0,1,0,0,0,1|1,0,1]=4 2752 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [0,1,0,0,0,1|1,0,1]=4 2753 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,1,0,0,0,1|1,0,1]=4 2754 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,1,0,0,0,1|1,0,1]=4 2755 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [0,1,0,0,0,1|1,0,1]=4 2756 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [0,1,0,0,0,1|1,0,1]=4 2757 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [0,1,0,0,0,1|1,0,1]=4 2758 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [0,1,0,0,0,1|1,0,1]=4 2759 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [0,1,0,0,0,1|1,0,1]=4 2760 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [0,1,0,0,0,1|1,0,1]=4 2761 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [0,1,0,0,0,1|1,0,1]=4 2762 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [0,1,0,0,0,1|1,0,1]=4 2763 B12R1.50 CCC(=O)Cc1cc(ccn1)Br 1458a_100000210414_100010173614 [0,1,0,0,0,1|2,0,0]=4 2764 B12R1.50 CCC(=O)Cc1cc(ccn1)C 1458a_100000210414_100000718516 [0,1,0,0,0,1|2,0,0]=4 2765 B12R1.50 CCC(=O)Cc1cc(ccn1)Cl 1458a_100000210414_100016988179 [0,1,0,0,0,1|2,0,0]=4 2766 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000210414_100000211773 [0,1,0,0,0,1|1,0,0]=3 2767 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210202 [0,1,0,0,0,1|1,0,0]=3 2768 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100000210414_100000211840 [0,1,0,0,0,1|1,0,0]=3 2769 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210202 [0,1,0,0,0,1|1,0,0]=3 2770 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000210414_100000181238 [0,1,0,0,0,1|1,0,0]=3 2771 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210202 [0,1,0,0,0,1|1,0,0]=3 2772 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000210414_100000230114 [0,1,0,0,0,1|1,0,0]=3 2773 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210202 [0,1,0,0,0,1|1,0,0]=3 2774 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000210414_100011218688 [0,1,0,0,0,1|1,0,0]=3 2775 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210202 [0,1,0,0,0,1|1,0,0]=3 2776 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [0,1,0,0,0,1|1,0,0]=3 2777 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [0,1,0,0,0,1|1,0,0]=3 2778 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100000210414_100009889011 [0,1,0,0,0,1|2,0,0]=4 2779 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210202 [0,1,0,0,0,1|2,0,0]=4 2780 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100000210414_100000757606 [0,1,0,0,0,1|2,0,0]=4 2781 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210202 [0,1,0,0,0,1|2,0,0]=4 2782 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210202 [0,1,0,0,0,1|2,0,0]=4 2783 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000210414_100000086093 [0,1,0,0,0,1|2,0,0]=4 2784 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210202 [0,1,0,0,0,1|2,0,0]=4 2785 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000210414_100009819644 [0,1,0,0,0,1|2,0,0]=4 2786 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100000210414_100010243470 [0,1,0,0,0,1|2,0,0]=4 2787 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210202 [0,1,0,0,0,1|2,0,0]=4 2788 B12R1.50 CCC(=O)Cc1ccnc(c1)C 1458a_100000210414_200020672517 [0,1,0,0,0,1|2,0,0]=4 2789 B12R1.50 CCC(=O)Cc1ccnc(c1)Cl 1458a_100000210414_100000764220 [0,1,0,0,0,1|2,0,0]=4 2790 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000210414_100011740620 [0,1,0,0,0,1|2,0,0]=4 2791 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210202 [0,1,0,0,0,1|2,0,0]=4 2792 B12R1.50 CCC(=O)Cc1cncc(c1)C 1458a_100000210414_100000716715 [0,1,0,0,0,1|2,0,0]=4 2793 B12R1.50 CCC(=O)Cc1cncc(c1)Cl 1458a_100000210414_100016992070 [0,1,0,0,0,1|2,0,0]=4 2794 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100000210414_100000725299 [0,1,0,0,0,1|2,0,0]=4 2795 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210202 [0,1,0,0,0,1|2,0,0]=4 2796 B12R1.50 CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 2797 B12R1.50 CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 2798 B12R1.50 CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 2799 B12R1.50 CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 2800 B12R1.50 CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210414 [0,1,0,0,0,1|1,0,0]=3 2801 B12R1.50 CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210414 [0,1,0,0,0,1|1,0,0]=3 2802 B12R1.50 CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210414 [0,1,0,0,0,1|1,0,0]=3 2803 B12R1.50 CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210414 [0,1,0,0,0,1|1,0,0]=3 2804 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 2805 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 2806 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 2807 B12R1.50 CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 2808 B12R1.50 CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 2809 B12R1.50 CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 2810 B12R1.50 CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 2811 B12R1.50 CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 2812 B12R1.50 CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 2813 B12R1.50 CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 2814 B12R1.50 CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 2815 B12R1.50 CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 2816 B12R1.50 CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 2817 B12R1.50 CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 2818 B12R1.50 CNC(=O)Cc1cccc(c1)Br 11a_106832991635_100000747190 [0,1,0,0,0,1|0,0,0]=2 2819 B12R1.50 CNC(=O)Cc1cccc(c1)Br 240690a_100102657272_100000747190 [0,1,0,0,0,1|0,0,0]=2 2820 B12R1.50 CNC(=O)Cc1cccc(c1)Br 527a_100102657272_100000747190 [0,1,0,0,0,1|0,0,0]=2 2821 B12R1.50 CNC(=O)Cc1cccc(c1)C 11a_106832991635_100011206899 [0,1,0,0,0,1|0,0,0]=2 2822 B12R1.50 CNC(=O)Cc1cccc(c1)C 1626a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 2823 B12R1.50 CNC(=O)Cc1cccc(c1)C 240690a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 2824 B12R1.50 CNC(=O)Cc1cccc(c1)C 527a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 2825 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 11a_106832991635_100000749307 [0,1,0,0,0,1|0,0,0]=2 2826 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 1626a_100102657272_100000749307 [0,1,0,0,0,1|0,0,0]=2 2827 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 240690a_100102657272_100000749307 [0,1,0,0,0,1|0,0,0]=2 2828 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 527a_100102657272_100000749307 [0,1,0,0,0,1|0,0,0]=2 2829 B12R1.50 CNC(=O)Cc1cccc(c1)F 11a_106832991635_100000211661 [0,1,0,0,0,1|0,0,0]=2 2830 B12R1.50 CNC(=O)Cc1cccc(c1)F 1626a_100102657272_100000211661 [0,1,0,0,0,1|0,0,0]=2 2831 B12R1.50 CNC(=O)Cc1cccc(c1)F 240690a_100102657272_100000211661 [0,1,0,0,0,1|0,0,0]=2 2832 B12R1.50 CNC(=O)Cc1cccc(c1)F 527a_100102657272_100000211661 [0,1,0,0,0,1|0,0,0]=2 2833 B12R1.50 CNC(=O)Cc1cccc(c1)I 11a_106832991635_100000238430 [0,1,0,0,0,1|0,0,0]=2 2834 B12R1.50 CNC(=O)Cc1cccc(c1)I 1626a_100102657272_100000238430 [0,1,0,0,0,1|0,0,0]=2 2835 B12R1.50 CNC(=O)Cc1cccc(c1)I 240690a_100102657272_100000238430 [0,1,0,0,0,1|0,0,0]=2 2836 B12R1.50 CNC(=O)Cc1cccc(c1)I 527a_100102657272_100000238430 [0,1,0,0,0,1|0,0,0]=2 2837 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [0,1,0,0,0,1|0,0,0]=2 2838 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [0,1,0,0,0,1|0,0,0]=2 2839 B12R1.50 CNC(=O)Cc1cccc(n1)Br 11a_106832991635_100010201708 [0,1,0,0,0,1|1,0,0]=3 2840 B12R1.50 CNC(=O)Cc1cccc(n1)Br 240690a_100102657272_100010201708 [0,1,0,0,0,1|1,0,0]=3 2841 B12R1.50 CNC(=O)Cc1cccc(n1)Br 527a_100102657272_100010201708 [0,1,0,0,0,1|1,0,0]=3 2842 B12R1.50 CNC(=O)Cc1cccc(n1)C 11a_106832991635_100012001110 [0,1,0,0,0,1|1,0,0]=3 2843 B12R1.50 CNC(=O)Cc1cccc(n1)C 1626a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 2844 B12R1.50 CNC(=O)Cc1cccc(n1)C 240690a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 2845 B12R1.50 CNC(=O)Cc1cccc(n1)C 527a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 2846 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 11a_106832991635_100000090259 [0,1,0,0,0,1|1,0,0]=3 2847 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 1626a_100102657272_100000090259 [0,1,0,0,0,1|1,0,0]=3 2848 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 240690a_100102657272_100000090259 [0,1,0,0,0,1|1,0,0]=3 2849 B12R1.50 CNC(=O)Cc1cccc(n1)F 11a_106832991635_100000096803 [0,1,0,0,0,1|1,0,0]=3 2850 B12R1.50 CNC(=O)Cc1cccc(n1)F 1626a_100102657272_100000096803 [0,1,0,0,0,1|1,0,0]=3 2851 B12R1.50 CNC(=O)Cc1cccc(n1)F 240690a_100102657272_100000096803 [0,1,0,0,0,1|1,0,0]=3 2852 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 11a_106832991635_100010126891 [0,1,0,0,0,1|1,0,0]=3 2853 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 240690a_100102657272_100010126891 [0,1,0,0,0,1|1,0,0]=3 2854 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 527a_100102657272_100010126891 [0,1,0,0,0,1|1,0,0]=3 2855 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 11a_106832991635_100000085289 [0,1,0,0,0,1|1,0,0]=3 2856 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 1626a_100102657272_100000085289 [0,1,0,0,0,1|1,0,0]=3 2857 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 240690a_100102657272_100000085289 [0,1,0,0,0,1|1,0,0]=3 2858 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 527a_100102657272_100000085289 [0,1,0,0,0,1|1,0,0]=3 2859 B12R1.50 CNC(=O)Cc1cncc(c1)Br 11a_106832991635_100000239331 [0,1,0,0,0,1|1,0,0]=3 2860 B12R1.50 CNC(=O)Cc1cncc(c1)Br 240690a_100102657272_100000239331 [0,1,0,0,0,1|1,0,0]=3 2861 B12R1.50 CNC(=O)Cc1cncc(c1)Br 527a_100102657272_100000239331 [0,1,0,0,0,1|1,0,0]=3 2862 B12R1.50 CNC(=O)Cc1cncc(c1)F 11a_106832991635_100011667516 [0,1,0,0,0,1|1,0,0]=3 2863 B12R1.50 CNC(=O)Cc1cncc(c1)F 240690a_100102657272_100011667516 [0,1,0,0,0,1|1,0,0]=3 2864 B12R1.50 CNC(=O)Cc1cncc(c1)F 527a_100102657272_100011667516 [0,1,0,0,0,1|1,0,0]=3 2865 B12R1.50 CNC(=O)Cc1cncc(n1)Cl 11a_106832991635_100000095580 [0,1,0,0,0,1|2,0,0]=4 2866 B12R1.50 CNC(=O)Cc1cncc(n1)Cl 1626a_100102657272_100000095580 [0,1,0,0,0,1|2,0,0]=4 2867 B12R1.50 CNC(=O)Cc1cncc(n1)Cl 240690a_100102657272_100000095580 [0,1,0,0,0,1|2,0,0]=4 2868 B12R1.50 CNC(=O)Cc1cncc(n1)Cl 527a_100102657272_100000095580 [0,1,0,0,0,1|2,0,0]=4 2869 B12R1.50 CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100102657272 [0,1,0,0,0,1|0,0,0]=2 2870 B12R1.50 CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100102657272 [0,1,0,0,0,1|0,0,0]=2 2871 B12R1.50 CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100102657272 [0,1,0,0,0,1|0,0,0]=2 2872 B12R1.50 CNC(=O)Nc1cccc(c1)C 512a_100000188690_100102657272 [0,1,0,0,0,1|0,0,0]=2 2873 B12R1.50 CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100102657272 [0,1,0,0,0,1|0,0,0]=2 2874 B12R1.50 CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100102657272 [0,1,0,0,0,1|0,0,0]=2 2875 B12R1.50 CNC(=O)Nc1cccc(c1)F 512a_100000210047_100102657272 [0,1,0,0,0,1|0,0,0]=2 2876 B12R1.50 CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100102657272 [0,1,0,0,0,1|0,0,0]=2 2877 B12R1.50 CNC(=O)Nc1cccc(c1)I 512a_100000211102_100102657272 [0,1,0,0,0,1|0,0,0]=2 2878 B12R1.50 CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100102657272 [0,1,0,0,0,1|0,0,0]=2 2879 B12R1.50 CNC(=O)Nc1cccc(c1)O 512a_100000210217_100102657272 [0,1,0,0,0,1|0,0,0]=2 2880 B12R1.50 CNC(C)Cc1cccc(c1)Br 270004a_106832991635_100000689217 [0,1,0,0,0,1|1,0,1]=4 2881 B12R1.50 CNC(C)Cc1cccc(c1)Cl 270004a_106832991635_100000727212 [0,1,0,0,0,1|1,0,1]=4 2882 B12R1.50 CNC(C)Cc1cccc(c1)F 270004a_106832991635_100000687711 [0,1,0,0,0,1|1,0,1]=4 2883 B12R1.50 COC(=O)Cc1cc(ccn1)O 271570a_203496583355_100010275543 [0,1,0,0,0,1|2,0,0]=4 2884 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [0,1,0,0,0,1|1,0,0]=3 2885 B12R1.50 COC(=O)Cc1cccc(n1)O 271570a_203496583355_100000094215 [0,1,0,0,0,1|2,0,0]=4 2886 B12R1.50 COC(=O)Cc1ccnc(c1)O 271570a_203496583355_100010135589 [0,1,0,0,0,1|2,0,0]=4 2887 B12R1.50 Cc1cccc(c1)CC(=O)CF 1458a_100011206899_100015361967 [0,1,0,0,0,1|2,0,0]=4 2888 B12R1.50 Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211840 [0,1,0,0,0,1|2,0,0]=4 2889 B12R1.50 Cc1cccc(c1)NC(=O)CO 22a_100000188690_100000210174 [0,1,0,0,0,1|2,0,0]=4 2890 B12R1.50 Cc1cccc(c1)NC(=O)CO 527a_100000188690_100000210174 [0,1,0,0,0,1|2,0,0]=4 2891 B12R1.50 O=C(CF)Cc1cccc(c1)Br 1458a_100000747190_100015361967 [0,1,0,0,0,1|2,0,0]=4 2892 B12R1.50 O=C(CF)Cc1cccc(c1)Cl 1458a_100000749307_100015361967 [0,1,0,0,0,1|2,0,0]=4 2893 B12R1.50 O=C(CF)Cc1cccc(c1)F 1458a_100000211661_100015361967 [0,1,0,0,0,1|2,0,0]=4 2894 B12R1.50 O=C(CF)Cc1cccc(c1)I 1458a_100000238430_100015361967 [0,1,0,0,0,1|2,0,0]=4 2895 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [0,1,0,0,0,1|2,0,0]=4 2896 B12R1.50 O=C(CO)Cc1cccc(c1)Br 1458a_100000210174_100000211773 [0,1,0,0,0,1|2,0,0]=4 2897 B12R1.50 O=C(CO)Cc1cccc(c1)Cl 1458a_100000210174_100000181238 [0,1,0,0,0,1|2,0,0]=4 2898 B12R1.50 O=C(CO)Cc1cccc(c1)F 1458a_100000210174_100000230114 [0,1,0,0,0,1|2,0,0]=4 2899 B12R1.50 O=C(CO)Cc1cccc(c1)I 1458a_100000210174_100011218688 [0,1,0,0,0,1|2,0,0]=4 2900 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [0,1,0,0,0,1|2,0,0]=4 2901 B12R1.50 O=C(CO)Nc1cccc(c1)Br 22a_100000210019_100000210174 [0,1,0,0,0,1|2,0,0]=4 2902 B12R1.50 O=C(CO)Nc1cccc(c1)Br 527a_100000210019_100000210174 [0,1,0,0,0,1|2,0,0]=4 2903 B12R1.50 O=C(CO)Nc1cccc(c1)Cl 22a_100000185859_100000210174 [0,1,0,0,0,1|2,0,0]=4 2904 B12R1.50 O=C(CO)Nc1cccc(c1)F 22a_100000210047_100000210174 [0,1,0,0,0,1|2,0,0]=4 2905 B12R1.50 O=C(CO)Nc1cccc(c1)F 527a_100000210047_100000210174 [0,1,0,0,0,1|2,0,0]=4 2906 B12R1.50 O=C(CO)Nc1cccc(c1)I 22a_100000211102_100000210174 [0,1,0,0,0,1|2,0,0]=4 2907 B12R1.50 O=C(CO)Nc1cccc(c1)I 527a_100000211102_100000210174 [0,1,0,0,0,1|2,0,0]=4 2908 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [0,1,0,0,0,1|2,0,0]=4 2909 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [0,1,0,0,0,1|2,0,0]=4 2910 B12R1.118 CCC(Cc1ccccc1)NC 270004a_106832991635_100000212045 [0,1,0,0,0,1|1,0,1]=4 2911 B12R1.118 CNC(C#N)Cc1ccccc1 2230a_100000746547_200000210301 [0,1,0,0,0,1|1,0,1]=4 2912 B12R1.118 CNC(C#N)Cc1ccccc1 7a_106832991635_100000183401 [0,1,0,0,0,1|1,0,1]=4 2913 B12R1.118 CNC(CO)Cc1ccccc1 2230a_100000739027_200000210301 [0,1,0,0,0,1|0,0,2]=4 2914 B12R1.118 [13CH3]NC(C#N)Cc1ccccc1 2230a_100000746547_200025704644 [0,1,0,0,0,1|1,0,1]=4 2915 B12R1.118 [13CH3]NC(CO)Cc1ccccc1 2230a_100000739027_200025704644 [0,1,0,0,0,1|0,0,2]=4 2916 B12R1.194 CCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000211323 [0,1,0,0,0,1|2,0,0]=4 2917 B12R1.194 CNC(F)(F)Oc1ccccc1 7a_106832991635_200000057402 [0,1,0,0,0,1|1,0,1]=4 2918 B12R1.194 CNS(=O)(=O)Cc1ccccc1 270084a_100102657272_100000211737 [0,1,0,0,0,1|1,0,0]=3 2919 B12R1.194 CNS(=O)(=O)Cc1ccccc1 274078a_100102657272_100000211737 [0,1,0,0,0,1|1,0,0]=3 2920 B12R1.194 CNS(=O)(=O)Cc1ccccc1 40a_100102657272_100000235865 [0,1,0,0,0,1|1,0,0]=3 2921 B12R1.371 C#CC(=O)Cc1ccccc1Br 1458a_100000211873_100000184730 [0,1,0,0,0,1|1,0,1]=4 2922 B12R1.371 C#CC(=O)Cc1ccccc1C 1458a_100000211873_100000211839 [0,1,0,0,0,1|1,0,1]=4 2923 B12R1.371 C#CC(=O)Cc1ccccc1Cl 1458a_100000211873_100000187162 [0,1,0,0,0,1|1,0,1]=4 2924 B12R1.371 C#CC(=O)Cc1ccccc1F 1458a_100000211873_100000187165 [0,1,0,0,0,1|1,0,1]=4 2925 B12R1.371 C#CC(=O)Cc1ccccc1I 1458a_100000211873_100011216222 [0,1,0,0,0,1|1,0,1]=4 2926 B12R1.371 C=CC(=O)Cc1ccccc1Br 1458a_100000185746_100000184730 [0,1,0,0,0,1|1,0,1]=4 2927 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [0,1,0,0,0,1|1,0,1]=4 2928 B12R1.371 C=CC(=O)Cc1ccccc1Cl 1458a_100000185746_100000187162 [0,1,0,0,0,1|1,0,1]=4 2929 B12R1.371 C=CC(=O)Cc1ccccc1F 1458a_100000185746_100000187165 [0,1,0,0,0,1|1,0,1]=4 2930 B12R1.371 C=CC(=O)Cc1ccccc1I 1458a_100000185746_100011216222 [0,1,0,0,0,1|1,0,1]=4 2931 B12R1.371 C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000185746 [0,1,0,0,0,1|1,0,1]=4 2932 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [0,1,0,0,0,1|1,0,1]=4 2933 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [0,1,0,0,0,1|1,0,1]=4 2934 B12R1.371 C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000185746 [0,1,0,0,0,1|1,0,1]=4 2935 B12R1.371 C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000185746 [0,1,0,0,0,1|1,0,1]=4 2936 B12R1.371 C=CC(=O)Nc1ccccc1F 1626a_100000210422_100000185746 [0,1,0,0,0,1|1,0,1]=4 2937 B12R1.371 C=CC(=O)Nc1ccccc1F 22a_100000210422_100000185746 [0,1,0,0,0,1|1,0,1]=4 2938 B12R1.371 C=CC(=O)Nc1ccccc1I 1626a_100000210053_100000185746 [0,1,0,0,0,1|1,0,1]=4 2939 B12R1.371 C=CC(=O)Nc1ccccc1O 22a_100000185747_100000185746 [0,1,0,0,0,1|1,0,1]=4 2940 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000210414_100000184730 [0,1,0,0,0,1|1,0,0]=3 2941 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210202 [0,1,0,0,0,1|1,0,0]=3 2942 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000210414_100000211839 [0,1,0,0,0,1|1,0,0]=3 2943 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000212180_100000210202 [0,1,0,0,0,1|1,0,0]=3 2944 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210202 [0,1,0,0,0,1|1,0,0]=3 2945 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000210414_100000187162 [0,1,0,0,0,1|1,0,0]=3 2946 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000210414_100000187165 [0,1,0,0,0,1|1,0,0]=3 2947 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210202 [0,1,0,0,0,1|1,0,0]=3 2948 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210202 [0,1,0,0,0,1|1,0,0]=3 2949 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000210414_100011216222 [0,1,0,0,0,1|1,0,0]=3 2950 B12R1.371 CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210202 [0,1,0,0,0,1|1,0,0]=3 2951 B12R1.371 CCC(=O)Cc1cccnc1Br 1458a_100000210414_100010140945 [0,1,0,0,0,1|2,0,0]=4 2952 B12R1.371 CCC(=O)Cc1cccnc1C 1458a_100000210414_100000732876 [0,1,0,0,0,1|2,0,0]=4 2953 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210202 [0,1,0,0,0,1|2,0,0]=4 2954 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000210414_100000045678 [0,1,0,0,0,1|2,0,0]=4 2955 B12R1.371 CCC(=O)Cc1cccnc1F 1458a_100000210414_100000099810 [0,1,0,0,0,1|2,0,0]=4 2956 B12R1.371 CCC(=O)Cc1ccncc1C 1458a_100000210414_100020672808 [0,1,0,0,0,1|2,0,0]=4 2957 B12R1.371 CCC(=O)Cc1ccncc1Cl 1458a_100000210414_100000763264 [0,1,0,0,0,1|2,0,0]=4 2958 B12R1.371 CCC(=O)Cc1cnccc1C 1458a_100000210414_100000690890 [0,1,0,0,0,1|2,0,0]=4 2959 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_100000210414_100025702911 [0,1,0,0,0,1|2,0,0]=4 2960 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210202 [0,1,0,0,0,1|2,0,0]=4 2961 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_100000210414_100000696600 [0,1,0,0,0,1|2,0,0]=4 2962 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_200000722269_100000210202 [0,1,0,0,0,1|2,0,0]=4 2963 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100000210414_100000099807 [0,1,0,0,0,1|2,0,0]=4 2964 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210202 [0,1,0,0,0,1|2,0,0]=4 2965 B12R1.371 CCC(=O)Cc1ncccc1F 1458a_100000210414_100000104219 [0,1,0,0,0,1|2,0,0]=4 2966 B12R1.371 CCC(=O)Cc1ncccc1O 1458a_100000210414_200020655725 [0,1,0,0,0,1|2,0,0]=4 2967 B12R1.371 CCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210202 [0,1,0,0,0,1|2,0,0]=4 2968 B12R1.371 CCC(=O)Nc1ccccc1Br 11a_100000210017_100000210414 [0,1,0,0,0,1|1,0,0]=3 2969 B12R1.371 CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210414 [0,1,0,0,0,1|1,0,0]=3 2970 B12R1.371 CCC(=O)Nc1ccccc1C 11a_100015192222_100000210414 [0,1,0,0,0,1|1,0,0]=3 2971 B12R1.371 CCC(=O)Nc1ccccc1C 1626a_100015192222_100000210414 [0,1,0,0,0,1|1,0,0]=3 2972 B12R1.371 CCC(=O)Nc1ccccc1C 22a_100015192222_100000210414 [0,1,0,0,0,1|1,0,0]=3 2973 B12R1.371 CCC(=O)Nc1ccccc1C 527a_100015192222_100000210414 [0,1,0,0,0,1|1,0,0]=3 2974 B12R1.371 CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210414 [0,1,0,0,0,1|1,0,0]=3 2975 B12R1.371 CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210414 [0,1,0,0,0,1|1,0,0]=3 2976 B12R1.371 CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210414 [0,1,0,0,0,1|1,0,0]=3 2977 B12R1.371 CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210414 [0,1,0,0,0,1|1,0,0]=3 2978 B12R1.371 CCC(=O)Nc1ccccc1F 11a_100000210422_100000210414 [0,1,0,0,0,1|1,0,0]=3 2979 B12R1.371 CCC(=O)Nc1ccccc1F 1626a_100000210422_100000210414 [0,1,0,0,0,1|1,0,0]=3 2980 B12R1.371 CCC(=O)Nc1ccccc1F 22a_100000210422_100000210414 [0,1,0,0,0,1|1,0,0]=3 2981 B12R1.371 CCC(=O)Nc1ccccc1F 527a_100000210422_100000210414 [0,1,0,0,0,1|1,0,0]=3 2982 B12R1.371 CCC(=O)Nc1ccccc1I 11a_100000210053_100000210414 [0,1,0,0,0,1|1,0,0]=3 2983 B12R1.371 CCC(=O)Nc1ccccc1I 1626a_100000210053_100000210414 [0,1,0,0,0,1|1,0,0]=3 2984 B12R1.371 CCC(=O)Nc1ccccc1O 22a_100000185747_100000210414 [0,1,0,0,0,1|1,0,0]=3 2985 B12R1.371 CCC(=O)Nc1ccccc1O 271570a_203496583355_100000153536 [0,1,0,0,0,1|1,0,0]=3 2986 B12R1.371 CCC(=O)Nc1ccccc1O 527a_100000185747_100000210414 [0,1,0,0,0,1|1,0,0]=3 2987 B12R1.371 CNC(=O)Cc1ccccc1Br 11a_106832991635_100000751119 [0,1,0,0,0,1|0,0,0]=2 2988 B12R1.371 CNC(=O)Cc1ccccc1Br 240690a_100102657272_100000751119 [0,1,0,0,0,1|0,0,0]=2 2989 B12R1.371 CNC(=O)Cc1ccccc1Br 527a_100102657272_100000751119 [0,1,0,0,0,1|0,0,0]=2 2990 B12R1.371 CNC(=O)Cc1ccccc1C 11a_106832991635_100000212180 [0,1,0,0,0,1|0,0,0]=2 2991 B12R1.371 CNC(=O)Cc1ccccc1C 1626a_100102657272_100000212180 [0,1,0,0,0,1|0,0,0]=2 2992 B12R1.371 CNC(=O)Cc1ccccc1C 240690a_100102657272_100000212180 [0,1,0,0,0,1|0,0,0]=2 2993 B12R1.371 CNC(=O)Cc1ccccc1C 527a_100102657272_100000212180 [0,1,0,0,0,1|0,0,0]=2 2994 B12R1.371 CNC(=O)Cc1ccccc1Cl 11a_106832991635_100000183793 [0,1,0,0,0,1|0,0,0]=2 2995 B12R1.371 CNC(=O)Cc1ccccc1Cl 1626a_100102657272_100000183793 [0,1,0,0,0,1|0,0,0]=2 2996 B12R1.371 CNC(=O)Cc1ccccc1Cl 240690a_100102657272_100000183793 [0,1,0,0,0,1|0,0,0]=2 2997 B12R1.371 CNC(=O)Cc1ccccc1Cl 527a_100102657272_100000183793 [0,1,0,0,0,1|0,0,0]=2 2998 B12R1.371 CNC(=O)Cc1ccccc1F 11a_106832991635_100000212012 [0,1,0,0,0,1|0,0,0]=2 2999 B12R1.371 CNC(=O)Cc1ccccc1F 1626a_100102657272_100000212012 [0,1,0,0,0,1|0,0,0]=2 3000 B12R1.371 CNC(=O)Cc1ccccc1F 240690a_100102657272_100000212012 [0,1,0,0,0,1|0,0,0]=2 3001 B12R1.371 CNC(=O)Cc1ccccc1F 527a_100102657272_100000212012 [0,1,0,0,0,1|0,0,0]=2 3002 B12R1.371 CNC(=O)Cc1ccccc1I 11a_106832991635_100000036491 [0,1,0,0,0,1|0,0,0]=2 3003 B12R1.371 CNC(=O)Cc1ccccc1I 1626a_100102657272_100000036491 [0,1,0,0,0,1|0,0,0]=2 3004 B12R1.371 CNC(=O)Cc1ccccc1I 240690a_100102657272_100000036491 [0,1,0,0,0,1|0,0,0]=2 3005 B12R1.371 CNC(=O)Cc1ccccc1I 527a_100102657272_100000036491 [0,1,0,0,0,1|0,0,0]=2 3006 B12R1.371 CNC(=O)Cc1ccccc1O 240690a_100102657272_100000743006 [0,1,0,0,0,1|0,0,0]=2 3007 B12R1.371 CNC(=O)Cc1ccccc1O 271570a_203496583355_200009816160 [0,1,0,0,0,1|0,0,0]=2 3008 B12R1.371 CNC(=O)Cc1ccccc1O 527a_100102657272_100000743006 [0,1,0,0,0,1|0,0,0]=2 3009 B12R1.371 CNC(=O)Cc1cccnc1Cl 11a_106832991635_100000093521 [0,1,0,0,0,1|1,0,0]=3 3010 B12R1.371 CNC(=O)Cc1cccnc1Cl 1626a_100102657272_100000093521 [0,1,0,0,0,1|1,0,0]=3 3011 B12R1.371 CNC(=O)Cc1cccnc1Cl 240690a_100102657272_100000093521 [0,1,0,0,0,1|1,0,0]=3 3012 B12R1.371 CNC(=O)Cc1cccnc1Cl 527a_100102657272_100000093521 [0,1,0,0,0,1|1,0,0]=3 3013 B12R1.371 CNC(=O)Cc1ncccc1Br 11a_106832991635_200012357574 [0,1,0,0,0,1|1,0,0]=3 3014 B12R1.371 CNC(=O)Cc1ncccc1Br 240690a_100102657272_200012357574 [0,1,0,0,0,1|1,0,0]=3 3015 B12R1.371 CNC(=O)Cc1ncccc1C 11a_106832991635_200000722269 [0,1,0,0,0,1|1,0,0]=3 3016 B12R1.371 CNC(=O)Cc1ncccc1C 1626a_100102657272_200000722269 [0,1,0,0,0,1|1,0,0]=3 3017 B12R1.371 CNC(=O)Cc1ncccc1C 240690a_100102657272_200000722269 [0,1,0,0,0,1|1,0,0]=3 3018 B12R1.371 CNC(=O)Cc1ncccc1Cl 11a_106832991635_100011998755 [0,1,0,0,0,1|1,0,0]=3 3019 B12R1.371 CNC(=O)Cc1ncccc1Cl 240690a_100102657272_100011998755 [0,1,0,0,0,1|1,0,0]=3 3020 B12R1.371 CNC(=O)Cc1ncccc1Cl 527a_100102657272_100011998755 [0,1,0,0,0,1|1,0,0]=3 3021 B12R1.371 CNC(=O)Cn1ccccc1=O 1626a_100102657272_100000189665 [0,1,0,0,0,1|1,0,0]=3 3022 B12R1.371 CNC(=O)Cn1ccccc1=O 240690a_100102657272_100000189665 [0,1,0,0,0,1|1,0,0]=3 3023 B12R1.371 CNC(=O)Cn1ccccc1=O 527a_100102657272_100000189665 [0,1,0,0,0,1|1,0,0]=3 3024 B12R1.371 CNC(=O)Cn1cccnc1=O 1626a_100102657272_100000738077 [0,1,0,0,0,1|2,0,0]=4 3025 B12R1.371 CNC(=O)Cn1cccnc1=O 240690a_100102657272_100000738077 [0,1,0,0,0,1|2,0,0]=4 3026 B12R1.371 CNC(=O)Cn1ncccc1=O 11a_106832991635_100000238584 [0,1,0,0,0,1|2,0,0]=4 3027 B12R1.371 CNC(=O)Cn1ncccc1=O 1626a_100102657272_100000238584 [0,1,0,0,0,1|2,0,0]=4 3028 B12R1.371 CNC(=O)Cn1ncccc1=O 240690a_100102657272_100000238584 [0,1,0,0,0,1|2,0,0]=4 3029 B12R1.371 CNC(=O)Cn1ncccc1=O 527a_100102657272_100000238584 [0,1,0,0,0,1|2,0,0]=4 3030 B12R1.371 CNC(=O)Nc1ccccc1Br 2430a_100000210017_100102657272 [0,1,0,0,0,1|0,0,0]=2 3031 B12R1.371 CNC(=O)Nc1ccccc1C 2430a_100015192222_100102657272 [0,1,0,0,0,1|0,0,0]=2 3032 B12R1.371 CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100102657272 [0,1,0,0,0,1|0,0,0]=2 3033 B12R1.371 CNC(=O)Nc1ccccc1F 2430a_100000210422_100102657272 [0,1,0,0,0,1|0,0,0]=2 3034 B12R1.371 CNC(=O)Nc1ccccc1I 2430a_100000210053_100102657272 [0,1,0,0,0,1|0,0,0]=2 3035 B12R1.371 CNC(=O)Nc1ccccc1O 2430a_100000185747_100102657272 [0,1,0,0,0,1|0,0,0]=2 3036 B12R1.371 CNC(C)Cc1ccccc1Br 270004a_106832991635_100011350739 [0,1,0,0,0,1|1,0,1]=4 3037 B12R1.371 CNC(C)Cc1ccccc1C 270004a_106832991635_200000764500 [0,1,0,0,0,1|1,0,1]=4 3038 B12R1.371 CNC(C)Cc1ccccc1Cl 270004a_106832991635_100000758791 [0,1,0,0,0,1|1,0,1]=4 3039 B12R1.371 CNC(C)Cc1ccccc1F 270004a_106832991635_100000709178 [0,1,0,0,0,1|1,0,1]=4 3040 B12R1.371 COC(=O)Cc1ccccc1O 271570a_203496583355_100000699816 [0,1,0,0,0,1|1,0,0]=3 3041 B12R1.371 COC(=O)Cc1cccnc1O 271570a_203496583355_100010293180 [0,1,0,0,0,1|2,0,0]=4 3042 B12R1.371 COC(=O)Cc1ncccc1O 271570a_203496583355_100012347948 [0,1,0,0,0,1|2,0,0]=4 3043 B12R1.371 COC(=O)Nc1ccccc1O 271570a_203496583355_100000216184 [0,1,0,0,0,1|1,0,0]=3 3044 B12R1.371 Cc1ccccc1CC(=O)CF 1458a_100000212180_100015361967 [0,1,0,0,0,1|2,0,0]=4 3045 B12R1.371 Cc1ccccc1CC(=O)CO 1458a_100000210174_100000211839 [0,1,0,0,0,1|2,0,0]=4 3046 B12R1.371 Cc1ccccc1NC(=O)CO 22a_100015192222_100000210174 [0,1,0,0,0,1|2,0,0]=4 3047 B12R1.371 Cc1ccccc1NC(=O)CO 527a_100015192222_100000210174 [0,1,0,0,0,1|2,0,0]=4 3048 B12R1.371 NNC(=O)Cc1ccccc1O 271570a_203496583355_200010210069 [0,1,0,0,0,1|1,0,0]=3 3049 B12R1.371 O=C(CF)Cc1ccccc1Br 1458a_100000751119_100015361967 [0,1,0,0,0,1|2,0,0]=4 3050 B12R1.371 O=C(CF)Cc1ccccc1Cl 1458a_100000183793_100015361967 [0,1,0,0,0,1|2,0,0]=4 3051 B12R1.371 O=C(CF)Cc1ccccc1F 1458a_100000212012_100015361967 [0,1,0,0,0,1|2,0,0]=4 3052 B12R1.371 O=C(CF)Cc1ccccc1I 1458a_100000036491_100015361967 [0,1,0,0,0,1|2,0,0]=4 3053 B12R1.371 O=C(CF)Cc1ccccc1O 1458a_100000743006_100015361967 [0,1,0,0,0,1|2,0,0]=4 3054 B12R1.371 O=C(CO)Cc1ccccc1Br 1458a_100000210174_100000184730 [0,1,0,0,0,1|2,0,0]=4 3055 B12R1.371 O=C(CO)Cc1ccccc1Cl 1458a_100000210174_100000187162 [0,1,0,0,0,1|2,0,0]=4 3056 B12R1.371 O=C(CO)Cc1ccccc1F 1458a_100000210174_100000187165 [0,1,0,0,0,1|2,0,0]=4 3057 B12R1.371 O=C(CO)Cc1ccccc1I 1458a_100000210174_100011216222 [0,1,0,0,0,1|2,0,0]=4 3058 B12R1.371 O=C(CO)Nc1ccccc1Cl 22a_100000185783_100000210174 [0,1,0,0,0,1|2,0,0]=4 3059 B12R1.371 O=C(CO)Nc1ccccc1Cl 527a_100000185783_100000210174 [0,1,0,0,0,1|2,0,0]=4 3060 B12R1.371 O=C(CO)Nc1ccccc1F 22a_100000210422_100000210174 [0,1,0,0,0,1|2,0,0]=4 3061 B12R1.371 O=C(CO)Nc1ccccc1F 527a_100000210422_100000210174 [0,1,0,0,0,1|2,0,0]=4 3062 B12R1.371 O=C(CO)Nc1ccccc1O 22a_100000185747_100000210174 [0,1,0,0,0,1|2,0,0]=4 3063 B12R1.371 O=C(CO)Nc1ccccc1O 527a_100000185747_100000210174 [0,1,0,0,0,1|2,0,0]=4 3064 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)Br 2230a_100000739617_200025704644 [0,2,0,0,0,0|1,0,1]=4 3065 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)Cl 2230a_100000750703_200025704644 [0,2,0,0,0,0|1,0,1]=4 3066 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)F 2230a_100015193028_200025704644 [0,2,0,0,0,0|1,0,1]=4 3067 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)F 34a_100015193028_200025704644 [0,2,0,0,0,0|1,0,1]=4 3068 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,2,0,0,0,0|2,0,0]=4 3069 B12R1.9 CNC(C)(C)c1ccc(cc1)Br 2230a_100000739617_200000210301 [0,2,0,0,0,0|1,0,1]=4 3070 B12R1.9 CNC(C)(C)c1ccc(cc1)C 2230a_200011345931_200000210301 [0,2,0,0,0,0|1,0,1]=4 3071 B12R1.9 CNC(C)(C)c1ccc(cc1)C 34a_200011345931_200000210301 [0,2,0,0,0,0|1,0,1]=4 3072 B12R1.9 CNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_200000210301 [0,2,0,0,0,0|1,0,1]=4 3073 B12R1.9 CNC(C)(C)c1ccc(cc1)F 2230a_100015193028_200000210301 [0,2,0,0,0,0|1,0,1]=4 3074 B12R1.9 CNC(C)(C)c1ccc(cc1)F 34a_100015193028_200000210301 [0,2,0,0,0,0|1,0,1]=4 3075 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 270084a_100102657272_100000182491 [0,2,0,0,0,0|1,0,0]=3 3076 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 274078a_100102657272_100000182491 [0,2,0,0,0,0|1,0,0]=3 3077 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 40a_100102657272_100010306709 [0,2,0,0,0,0|1,0,0]=3 3078 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 270084a_100102657272_100000211267 [0,2,0,0,0,0|1,0,0]=3 3079 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 274078a_100102657272_100000211267 [0,2,0,0,0,0|1,0,0]=3 3080 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 40a_100102657272_100000039673 [0,2,0,0,0,0|1,0,0]=3 3081 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100102657272_100000209962 [0,2,0,0,0,0|1,0,0]=3 3082 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100102657272_100000209962 [0,2,0,0,0,0|1,0,0]=3 3083 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 40a_100102657272_100000077732 [0,2,0,0,0,0|1,0,0]=3 3084 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 270084a_100102657272_100000184267 [0,2,0,0,0,0|1,0,0]=3 3085 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 274078a_100102657272_100000184267 [0,2,0,0,0,0|1,0,0]=3 3086 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 40a_100102657272_100000081159 [0,2,0,0,0,0|1,0,0]=3 3087 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 270084a_100102657272_100011205396 [0,2,0,0,0,0|1,0,0]=3 3088 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 274078a_100102657272_100011205396 [0,2,0,0,0,0|1,0,0]=3 3089 B12R1.9 CNS(=O)(=O)c1ccc(cc1)N 40a_100102657272_100000054796 [0,2,0,0,0,0|1,0,0]=3 3090 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,2,0,0,0,0|1,0,0]=3 3091 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,2,0,0,0,0|1,0,0]=3 3092 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,2,0,0,0,0|1,0,0]=3 3093 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Br 270084a_100102657272_100011361808 [0,2,0,0,0,0|2,0,0]=4 3094 B12R1.9 CNS(=O)(=O)c1ccc(cn1)Br 274078a_100102657272_100011361808 [0,2,0,0,0,0|2,0,0]=4 3095 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C 270084a_100102657272_100000719016 [0,2,0,0,0,0|2,0,0]=4 3096 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C 274078a_100102657272_100000719016 [0,2,0,0,0,0|2,0,0]=4 3097 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl 270084a_100102657272_100000184283 [0,2,0,0,0,0|2,0,0]=4 3098 B12R1.9 CNS(=O)(=O)c1ccc(nc1)Cl 274078a_100102657272_100000184283 [0,2,0,0,0,0|2,0,0]=4 3099 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,2,0,0,0,0|2,0,0]=4 3100 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 2230a_200011345931_200025704644 [0,2,0,0,0,0|1,0,1]=4 3101 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 34a_200011345931_200025704644 [0,2,0,0,0,0|1,0,1]=4 3102 B12R1.9 NNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000183514 [0,2,0,0,0,0|2,0,0]=4 3103 B12R1.10 CC(C)(N[13CH3])c1cccc(c1)Br 2230a_100016995529_200025704644 [0,2,0,0,0,0|1,0,1]=4 3104 B12R1.10 CC(C)(N[13CH3])c1cccc(c1)Cl 2230a_100020605014_200025704644 [0,2,0,0,0,0|1,0,1]=4 3105 B12R1.10 CC(C)(N[13CH3])c1cccc(c1)F 2230a_100016993694_200025704644 [0,2,0,0,0,0|1,0,1]=4 3106 B12R1.10 CC(C)(N[13CH3])c1cccc(c1)F 34a_100016993694_200025704644 [0,2,0,0,0,0|1,0,1]=4 3107 B12R1.10 CCS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815775 [0,2,0,0,0,0|2,0,0]=4 3108 B12R1.10 CNC(C)(C)c1cccc(c1)Br 2230a_100016995529_200000210301 [0,2,0,0,0,0|1,0,1]=4 3109 B12R1.10 CNC(C)(C)c1cccc(c1)Cl 2230a_100020605014_200000210301 [0,2,0,0,0,0|1,0,1]=4 3110 B12R1.10 CNC(C)(C)c1cccc(c1)F 2230a_100016993694_200000210301 [0,2,0,0,0,0|1,0,1]=4 3111 B12R1.10 CNC(C)(C)c1cccc(c1)F 34a_100016993694_200000210301 [0,2,0,0,0,0|1,0,1]=4 3112 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 270084a_100102657272_100000184224 [0,2,0,0,0,0|1,0,0]=3 3113 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 274078a_100102657272_100000184224 [0,2,0,0,0,0|1,0,0]=3 3114 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 40a_100102657272_100010340488 [0,2,0,0,0,0|1,0,0]=3 3115 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 270084a_100102657272_100000182797 [0,2,0,0,0,0|1,0,0]=3 3116 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 274078a_100102657272_100000182797 [0,2,0,0,0,0|1,0,0]=3 3117 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 40a_100102657272_100010983817 [0,2,0,0,0,0|1,0,0]=3 3118 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 270084a_100102657272_100000182923 [0,2,0,0,0,0|1,0,0]=3 3119 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 274078a_100102657272_100000182923 [0,2,0,0,0,0|1,0,0]=3 3120 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 270084a_100102657272_100000184201 [0,2,0,0,0,0|1,0,0]=3 3121 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 274078a_100102657272_100000184201 [0,2,0,0,0,0|1,0,0]=3 3122 B12R1.10 CNS(=O)(=O)c1cccc(c1)N 40a_100102657272_100000034547 [0,2,0,0,0,0|1,0,0]=3 3123 B12R1.10 CNS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000165148 [0,2,0,0,0,0|1,0,0]=3 3124 B12R1.10 CNS(=O)(=O)c1cccc(n1)Br 270084a_100102657272_100010247296 [0,2,0,0,0,0|2,0,0]=4 3125 B12R1.10 CNS(=O)(=O)c1cccc(n1)Br 274078a_100102657272_100010247296 [0,2,0,0,0,0|2,0,0]=4 3126 B12R1.10 CNS(=O)(=O)c1cccc(n1)Cl 270084a_100102657272_100000071421 [0,2,0,0,0,0|2,0,0]=4 3127 B12R1.10 CNS(=O)(=O)c1cccc(n1)Cl 274078a_100102657272_100000071421 [0,2,0,0,0,0|2,0,0]=4 3128 B12R1.10 CNS(=O)(=O)c1cccc(n1)F 274078a_100102657272_100000099853 [0,2,0,0,0,0|2,0,0]=4 3129 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br 270084a_100102657272_100000745557 [0,2,0,0,0,0|2,0,0]=4 3130 B12R1.10 CNS(=O)(=O)c1cncc(c1)Br 274078a_100102657272_100000745557 [0,2,0,0,0,0|2,0,0]=4 3131 B12R1.10 CNS(=O)(=O)c1cncc(c1)O 271570a_203496583355_200011549042 [0,2,0,0,0,0|2,0,0]=4 3132 B12R1.39 CC(C)(CN[13CH3])c1ccccc1 2230a_100011211644_200025704644 [0,2,0,0,0,0|1,0,1]=4 3133 B12R1.39 CC(O)(CN[13CH3])c1ccccc1 2230a_100011660926_200025704644 [0,2,0,0,0,0|0,0,2]=4 3134 B12R1.39 CCNC(C)(C)c1ccccc1 2230a_100011218174_100000210202 [0,2,0,0,0,0|1,0,1]=4 3135 B12R1.39 CCNC(C)(C)c1ccccc1 2230a_100015525214_100000034625 [0,2,0,0,0,0|1,0,1]=4 3136 B12R1.39 CCNS(=O)(=O)c1ccccc1 270084a_100015525214_100000210345 [0,2,0,0,0,0|1,0,0]=3 3137 B12R1.39 CCNS(=O)(=O)c1ccccc1 274078a_100015525214_100000210345 [0,2,0,0,0,0|1,0,0]=3 3138 B12R1.39 CCNS(=O)(=O)c1ccccc1 40a_100015525214_100000032697 [0,2,0,0,0,0|1,0,0]=3 3139 B12R1.39 CCNS(=O)(=O)c1ccccn1 270084a_100015525214_100016994956 [0,2,0,0,0,0|2,0,0]=4 3140 B12R1.39 CCNS(=O)(=O)c1ccccn1 274078a_100015525214_100016994956 [0,2,0,0,0,0|2,0,0]=4 3141 B12R1.39 CCNS(=O)(=O)c1ccccn1 40a_100015525214_100000070048 [0,2,0,0,0,0|2,0,0]=4 3142 B12R1.39 CCNS(=O)(=O)c1cccnc1 270084a_100015525214_100000736704 [0,2,0,0,0,0|2,0,0]=4 3143 B12R1.39 CCNS(=O)(=O)c1cccnc1 274078a_100015525214_100000736704 [0,2,0,0,0,0|2,0,0]=4 3144 B12R1.39 CNCC(C)(C)c1ccccc1 2230a_100011211644_200000210301 [0,2,0,0,0,0|1,0,1]=4 3145 B12R1.39 CNCC(C)(O)c1ccccc1 2230a_100011660926_200000210301 [0,2,0,0,0,0|0,0,2]=4 3146 B12R1.39 CNCC(F)(F)c1ccccc1 34a_100000717977_200000210301 [0,2,0,0,0,0|1,0,1]=4 3147 B12R1.39 CNCC(F)(F)c1ccccc1 34a_100102657272_100009875531 [0,2,0,0,0,0|1,0,1]=4 3148 B12R1.39 CNCS(=O)(=O)c1ccccc1 34a_100102657272_200009813291 [0,2,0,0,0,0|1,0,0]=3 3149 B12R1.39 CNC[Si](C)(C)c1ccccc1 2230a_106832991635_100000038972 [0,2,0,0,0,0|1,1,0]=4 3150 B12R1.39 CNC[Si](C)(C)c1ccccc1 7a_106832991635_100000038972 [0,2,0,0,0,0|1,1,0]=4 3151 B12R1.39 CNNS(=O)(=O)c1ccccc1 40a_100016993582_100000032697 [0,2,0,0,0,0|1,0,0]=3 3152 B12R1.39 CNNS(=O)(=O)c1ccccn1 40a_100016993582_100000070048 [0,2,0,0,0,0|2,0,0]=4 3153 B12R1.39 COCS(=O)(=O)c1ccccc1 34a_100138415774_200009813291 [0,2,0,0,0,0|2,0,0]=4 3154 B12R1.39 CSCS(=O)(=O)c1ccccc1 62a_100000240042_200000210301 [0,2,0,0,0,0|2,0,0]=4 3155 B12R1.39 CSCS(=O)(=O)c1ccccc1 62a_200000210301_100000240042 [0,2,0,0,0,0|2,0,0]=4 3156 B12R1.39 [13CH3]NCC(F)(F)c1ccccc1 34a_100000717977_200025704644 [0,2,0,0,0,0|1,0,1]=4 3157 B12R1.39 [13CH3]SCS(=O)(=O)c1ccccc1 62a_100000240042_200025704644 [0,2,0,0,0,0|2,0,0]=4 3158 B12R1.39 [13CH3]SCS(=O)(=O)c1ccccc1 62a_200025704644_100000240042 [0,2,0,0,0,0|2,0,0]=4 3159 B12R1.195 CC(C)(N[13CH3])c1ccccc1Br 2230a_100020606264_200025704644 [0,2,0,0,0,0|1,0,1]=4 3160 B12R1.195 CC(C)(N[13CH3])c1ccccc1Cl 2230a_100020606166_200025704644 [0,2,0,0,0,0|1,0,1]=4 3161 B12R1.195 CC(C)(N[13CH3])c1ccccc1Cl 34a_100020606166_200025704644 [0,2,0,0,0,0|1,0,1]=4 3162 B12R1.195 CC(C)(N[13CH3])c1ccccc1F 2230a_100000734538_200025704644 [0,2,0,0,0,0|1,0,1]=4 3163 B12R1.195 CC(C)(N[13CH3])c1ccccc1F 34a_100000734538_200025704644 [0,2,0,0,0,0|1,0,1]=4 3164 B12R1.195 CNC(C)(C)c1ccccc1Br 2230a_100020606264_200000210301 [0,2,0,0,0,0|1,0,1]=4 3165 B12R1.195 CNC(C)(C)c1ccccc1Cl 2230a_100020606166_200000210301 [0,2,0,0,0,0|1,0,1]=4 3166 B12R1.195 CNC(C)(C)c1ccccc1Cl 34a_100020606166_200000210301 [0,2,0,0,0,0|1,0,1]=4 3167 B12R1.195 CNC(C)(C)c1ccccc1F 2230a_100000734538_200000210301 [0,2,0,0,0,0|1,0,1]=4 3168 B12R1.195 CNC(C)(C)c1ccccc1F 34a_100000734538_200000210301 [0,2,0,0,0,0|1,0,1]=4 3169 B12R1.195 CNC(F)(F)c1ccccc1F 2230a_106832991635_100000070671 [0,2,0,0,0,0|1,0,1]=4 3170 B12R1.195 CNC(F)(F)c1ccccc1F 34a_100102657272_100000070671 [0,2,0,0,0,0|1,0,1]=4 3171 B12R1.195 CNC(F)(F)c1ccccc1F 7a_106832991635_100000070671 [0,2,0,0,0,0|1,0,1]=4 3172 B12R1.195 CNS(=O)(=O)c1ccccc1Br 270084a_100102657272_100000184729 [0,2,0,0,0,0|1,0,0]=3 3173 B12R1.195 CNS(=O)(=O)c1ccccc1Br 274078a_100102657272_100000184729 [0,2,0,0,0,0|1,0,0]=3 3174 B12R1.195 CNS(=O)(=O)c1ccccc1Br 40a_100102657272_100010380725 [0,2,0,0,0,0|1,0,0]=3 3175 B12R1.195 CNS(=O)(=O)c1ccccc1C 270084a_100102657272_100000750907 [0,2,0,0,0,0|1,0,0]=3 3176 B12R1.195 CNS(=O)(=O)c1ccccc1C 274078a_100102657272_100000750907 [0,2,0,0,0,0|1,0,0]=3 3177 B12R1.195 CNS(=O)(=O)c1ccccc1C 40a_100102657272_100010269479 [0,2,0,0,0,0|1,0,0]=3 3178 B12R1.195 CNS(=O)(=O)c1ccccc1Cl 270084a_100102657272_100000184199 [0,2,0,0,0,0|1,0,0]=3 3179 B12R1.195 CNS(=O)(=O)c1ccccc1Cl 274078a_100102657272_100000184199 [0,2,0,0,0,0|1,0,0]=3 3180 B12R1.195 CNS(=O)(=O)c1ccccc1F 270084a_100102657272_100000184916 [0,2,0,0,0,0|1,0,0]=3 3181 B12R1.195 CNS(=O)(=O)c1ccccc1F 274078a_100102657272_100000184916 [0,2,0,0,0,0|1,0,0]=3 3182 B12R1.195 CNS(=O)(=O)c1ccccc1I 270084a_100102657272_100011191325 [0,2,0,0,0,0|1,0,0]=3 3183 B12R1.195 CNS(=O)(=O)c1ccccc1I 274078a_100102657272_100011191325 [0,2,0,0,0,0|1,0,0]=3 3184 B12R1.195 CNS(=O)(=O)c1ccccc1N 40a_100102657272_100000703237 [0,2,0,0,0,0|1,0,0]=3 3185 B12R1.195 CNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165157 [0,2,0,0,0,0|1,0,0]=3 3186 B12R1.195 CNS(=O)(=O)c1cccnc1Cl 270084a_100102657272_100000737393 [0,2,0,0,0,0|2,0,0]=4 3187 B12R1.195 CNS(=O)(=O)c1cccnc1Cl 274078a_100102657272_100000737393 [0,2,0,0,0,0|2,0,0]=4 3188 B12R1.195 CNS(=O)(=O)c1cccnc1F 274078a_100102657272_100000103413 [0,2,0,0,0,0|2,0,0]=4 3189 B12R1.195 CNS(=O)(=O)c1cnccc1Cl 270084a_100102657272_200000749572 [0,2,0,0,0,0|2,0,0]=4 3190 B12R1.195 CNS(=O)(=O)c1cnccc1Cl 274078a_100102657272_200000749572 [0,2,0,0,0,0|2,0,0]=4 3191 B12R1.195 NNS(=O)(=O)c1ccccc1O 271570a_203496583355_200011248379 [0,2,0,0,0,0|2,0,0]=4 3192 B12R1.253 CN(C)C(C)(C)c1ccccc1 2230a_100102631434_100000034625 [0,2,0,0,0,0|1,0,1]=4 3193 B12R1.253 CN(C)C(C)(C)c1ccccc1 269982a_100102631434_100000034625 [0,2,0,0,0,0|1,0,1]=4 3194 B12R1.253 CN(C)C(F)(F)c1ccccc1 269982a_100102631434_100000036403 [0,2,0,0,0,0|1,0,1]=4 3195 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 270084a_100102631434_100000210345 [0,2,0,0,0,0|1,0,0]=3 3196 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 274078a_100102631434_100000210345 [0,2,0,0,0,0|1,0,0]=3 3197 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 40a_100102631434_100000032697 [0,2,0,0,0,0|1,0,0]=3 3198 B12R1.253 CN(C)S(=O)(=O)c1ccccn1 270084a_100102631434_100016994956 [0,2,0,0,0,0|2,0,0]=4 3199 B12R1.253 CN(C)S(=O)(=O)c1ccccn1 274078a_100102631434_100016994956 [0,2,0,0,0,0|2,0,0]=4 3200 B12R1.253 CN(C)S(=O)(=O)c1ccccn1 40a_100102631434_100000070048 [0,2,0,0,0,0|2,0,0]=4 3201 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 270084a_100102631434_100000736704 [0,2,0,0,0,0|2,0,0]=4 3202 B12R1.253 CN(C)S(=O)(=O)c1cccnc1 274078a_100102631434_100000736704 [0,2,0,0,0,0|2,0,0]=4 3203 B12R1.3 C=CC(NCC)c1ccccc1 2230a_100015525214_200000085779 [0,2,0,0,0,0|1,0,1]=4 3204 B12R1.3 CCC(CNC)c1ccccc1 270004a_106832991635_100000753018 [0,2,0,0,0,0|1,0,1]=4 3205 B12R1.3 CCCC(NC)c1ccccc1 2230a_100000189686_200000210301 [0,2,0,0,0,0|1,0,1]=4 3206 B12R1.3 CCCC(NC)c1ccccc1 269862a_106832991636_100000211045 [0,2,0,0,0,0|1,0,1]=4 3207 B12R1.3 CCCC(NC)c1ccccc1 34a_100000189686_200000210301 [0,2,0,0,0,0|1,0,1]=4 3208 B12R1.3 CCCC(N[13CH3])c1ccccc1 2230a_100000189686_200025704644 [0,2,0,0,0,0|1,0,1]=4 3209 B12R1.3 CCCC(N[13CH3])c1ccccc1 34a_100000189686_200025704644 [0,2,0,0,0,0|1,0,1]=4 3210 B12R1.3 CCN(CC=O)c1ccccc1 2230a_100000210013_200015260668 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.3 CCN(CC=O)c1ccccc1 269982a_100000210013_200015260668 [0,2,0,0,0,0|2,0,0]=4 3212 B12R1.3 CCN(CC=O)c1ccccc1 34a_100000210013_200009817547 [0,2,0,0,0,0|2,0,0]=4 3213 B12R1.3 CCNC(CC)c1ccccc1 2230a_100000737752_100000210202 [0,2,0,0,0,0|1,0,1]=4 3214 B12R1.3 CCNC(CC)c1ccccc1 269862a_100015525214_100000210124 [0,2,0,0,0,0|1,0,1]=4 3215 B12R1.3 CCN[C@H](CO)c1ccccc1 2230a_100000751927_100000210202 [0,2,0,0,0,0|0,0,2]=4 3216 B12R1.3 CCN[C@H](CO)c1ccccc1 34a_100000751927_100000210202 [0,2,0,0,0,0|0,0,2]=4 3217 B12R1.3 CNC(CCCl)c1ccccc1 2230a_106832991635_200010132975 [0,2,0,0,0,0|1,0,1]=4 3218 B12R1.3 CNC(CCCl)c1ccccc1 7a_106832991635_200010132975 [0,2,0,0,0,0|1,0,1]=4 3219 B12R1.3 CNC(COC)c1ccccc1 269862a_106832991636_100000765260 [0,2,0,0,0,0|0,0,2]=4 3220 B12R1.3 CN[C@@H](CCO)c1ccccc1 2230a_100025705951_200000210301 [0,2,0,0,0,0|0,0,2]=4 3221 B12R1.3 CN[C@H](COC)c1ccccc1 2230a_103619048568_200000210301 [0,2,0,0,0,0|0,0,2]=4 3222 B12R1.3 CN[C@H](COC)c1ccccc1 34a_103619048568_200000210301 [0,2,0,0,0,0|0,0,2]=4 3223 B12R1.3 COC[C@@H](N[13CH3])c1ccccc1 2230a_103619048568_200025704644 [0,2,0,0,0,0|0,0,2]=4 3224 B12R1.3 COC[C@@H](N[13CH3])c1ccccc1 34a_103619048568_200025704644 [0,2,0,0,0,0|0,0,2]=4 3225 B12R1.3 OC[C@@H](NCF)c1ccccc1 34a_100000751927_100015361967 [0,2,0,0,0,0|0,0,2]=4 3226 B12R1.3 [13CH3]N[C@@H](CCO)c1ccccc1 2230a_100025705951_200025704644 [0,2,0,0,0,0|0,0,2]=4 3227 B12R1.12 CCC(NC)c1ccc(cc1)Br 269862a_106832991636_100000211647 [0,2,0,0,0,0|1,0,1]=4 3228 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [0,2,0,0,0,0|1,0,1]=4 3229 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [0,2,0,0,0,0|1,0,1]=4 3230 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [0,2,0,0,0,0|1,0,1]=4 3231 B12R1.12 CCC(NC)c1ccc(cc1)Cl 269862a_106832991636_100000210983 [0,2,0,0,0,0|1,0,1]=4 3232 B12R1.12 CCC(NC)c1ccc(cc1)F 2230a_100011191751_200000210301 [0,2,0,0,0,0|1,0,1]=4 3233 B12R1.12 CCC(NC)c1ccc(cc1)F 269862a_106832991636_100000211089 [0,2,0,0,0,0|1,0,1]=4 3234 B12R1.12 CCC(NC)c1ccc(cc1)F 34a_100011191751_200000210301 [0,2,0,0,0,0|1,0,1]=4 3235 B12R1.12 CCC(NC)c1ccc(cc1)I 269862a_106832991636_100000763097 [0,2,0,0,0,0|1,0,1]=4 3236 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [0,2,0,0,0,0|1,0,1]=4 3237 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [0,2,0,0,0,0|1,0,1]=4 3238 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [0,2,0,0,0,0|1,0,1]=4 3239 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [0,2,0,0,0,0|1,0,1]=4 3240 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 2230a_100011191751_200025704644 [0,2,0,0,0,0|1,0,1]=4 3241 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 34a_100011191751_200025704644 [0,2,0,0,0,0|1,0,1]=4 3242 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [0,2,0,0,0,0|1,0,1]=4 3243 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 2230a_100025736560_200000210301 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 34a_100025736560_200000210301 [0,2,0,0,0,0|1,0,1]=4 3245 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 2230a_100015186824_200000210301 [0,2,0,0,0,0|1,0,1]=4 3246 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 34a_100015186824_200000210301 [0,2,0,0,0,0|1,0,1]=4 3247 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100025736560_200025704644 [0,2,0,0,0,0|1,0,1]=4 3248 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 34a_100025736560_200025704644 [0,2,0,0,0,0|1,0,1]=4 3249 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015186824_200025704644 [0,2,0,0,0,0|1,0,1]=4 3250 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 34a_100015186824_200025704644 [0,2,0,0,0,0|1,0,1]=4 3251 B12R1.12 CNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_200000210301 [0,2,0,0,0,0|1,0,1]=4 3252 B12R1.12 CNC(C#N)c1ccc(cc1)F 2230a_100020612109_200000210301 [0,2,0,0,0,0|1,0,1]=4 3253 B12R1.12 CNC(C#N)c1ccc(cc1)F 34a_100020612109_200000210301 [0,2,0,0,0,0|1,0,1]=4 3254 B12R1.12 CNC(CO)c1ccc(cc1)Br 2230a_100000734186_200000210301 [0,2,0,0,0,0|0,0,2]=4 3255 B12R1.12 CNC(CO)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,2,0,0,0,0|0,0,2]=4 3256 B12R1.12 CNC(CO)c1ccc(cc1)F 2230a_100000705410_200000210301 [0,2,0,0,0,0|0,0,2]=4 3257 B12R1.12 CNC(CO)c1ccc(cc1)F 34a_100000705410_200000210301 [0,2,0,0,0,0|0,0,2]=4 3258 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_200000210301 [0,2,0,0,0,0|0,0,2]=4 3259 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_200000210301 [0,2,0,0,0,0|0,0,2]=4 3260 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200000210301 [0,2,0,0,0,0|0,0,2]=4 3261 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,2,0,0,0,0|0,0,2]=4 3262 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 2230a_100009818840_200025704644 [0,2,0,0,0,0|0,0,2]=4 3263 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 34a_100009818840_200025704644 [0,2,0,0,0,0|0,0,2]=4 3264 B12R1.12 [13CH3]NC(C#N)c1ccc(cc1)Cl 2230a_100000747793_200025704644 [0,2,0,0,0,0|1,0,1]=4 3265 B12R1.12 [13CH3]NC(C#N)c1ccc(cc1)F 2230a_100020612109_200025704644 [0,2,0,0,0,0|1,0,1]=4 3266 B12R1.12 [13CH3]NC(C#N)c1ccc(cc1)F 34a_100020612109_200025704644 [0,2,0,0,0,0|1,0,1]=4 3267 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 2230a_100000734186_200025704644 [0,2,0,0,0,0|0,0,2]=4 3268 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,2,0,0,0,0|0,0,2]=4 3269 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 2230a_100000705410_200025704644 [0,2,0,0,0,0|0,0,2]=4 3270 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 34a_100000705410_200025704644 [0,2,0,0,0,0|0,0,2]=4 3271 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200025704644 [0,2,0,0,0,0|0,0,2]=4 3272 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,2,0,0,0,0|0,0,2]=4 3273 B12R1.13 CCC(NC)c1cccc(c1)Br 269862a_106832991636_100000211677 [0,2,0,0,0,0|1,0,1]=4 3274 B12R1.13 CCC(NC)c1cccc(c1)C 269862a_106832991636_100000730664 [0,2,0,0,0,0|1,0,1]=4 3275 B12R1.13 CCC(NC)c1cccc(c1)Cl 2230a_100000737531_200000210301 [0,2,0,0,0,0|1,0,1]=4 3276 B12R1.13 CCC(NC)c1cccc(c1)Cl 269862a_106832991636_100000211052 [0,2,0,0,0,0|1,0,1]=4 3277 B12R1.13 CCC(NC)c1cccc(c1)Cl 34a_100000737531_200000210301 [0,2,0,0,0,0|1,0,1]=4 3278 B12R1.13 CCC(NC)c1cccc(c1)F 2230a_100159265421_200000210301 [0,2,0,0,0,0|1,0,1]=4 3279 B12R1.13 CCC(NC)c1cccc(c1)F 269862a_106832991636_100000687998 [0,2,0,0,0,0|1,0,1]=4 3280 B12R1.13 CCC(NC)c1cccc(c1)F 34a_100159265421_200000210301 [0,2,0,0,0,0|1,0,1]=4 3281 B12R1.13 CCC(NC)c1cccc(c1)O 2230a_100159312145_200000210301 [0,2,0,0,0,0|1,0,1]=4 3282 B12R1.13 CCC(NC)c1cccc(c1)O 269862a_106832991636_100011996911 [0,2,0,0,0,0|1,0,1]=4 3283 B12R1.13 CCC(NC)c1cccc(c1)O 34a_100159312145_200000210301 [0,2,0,0,0,0|1,0,1]=4 3284 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 2230a_100000737531_200025704644 [0,2,0,0,0,0|1,0,1]=4 3285 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 34a_100000737531_200025704644 [0,2,0,0,0,0|1,0,1]=4 3286 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 2230a_100159265421_200025704644 [0,2,0,0,0,0|1,0,1]=4 3287 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 34a_100159265421_200025704644 [0,2,0,0,0,0|1,0,1]=4 3288 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 2230a_100159312145_200025704644 [0,2,0,0,0,0|1,0,1]=4 3289 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 34a_100159312145_200025704644 [0,2,0,0,0,0|1,0,1]=4 3290 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 2230a_200016991486_200000210301 [0,2,0,0,0,0|1,0,1]=4 3291 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 34a_200016991486_200000210301 [0,2,0,0,0,0|1,0,1]=4 3292 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 2230a_200016991486_200025704644 [0,2,0,0,0,0|1,0,1]=4 3293 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 34a_200016991486_200025704644 [0,2,0,0,0,0|1,0,1]=4 3294 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 2230a_100102422761_200000210301 [0,2,0,0,0,0|1,0,1]=4 3295 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 34a_100102422761_200000210301 [0,2,0,0,0,0|1,0,1]=4 3296 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 2230a_100102422761_200025704644 [0,2,0,0,0,0|1,0,1]=4 3297 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 34a_100102422761_200025704644 [0,2,0,0,0,0|1,0,1]=4 3298 B12R1.13 CNC(CO)c1cccc(c1)Br 2230a_100000690078_200000210301 [0,2,0,0,0,0|0,0,2]=4 3299 B12R1.13 CNC(CO)c1cccc(c1)Br 34a_100000690078_200000210301 [0,2,0,0,0,0|0,0,2]=4 3300 B12R1.13 CNC(CO)c1cccc(c1)O 2230a_100025717460_200000210301 [0,2,0,0,0,0|0,0,2]=4 3301 B12R1.13 CNC(CO)c1cccc(c1)O 34a_100025717460_200000210301 [0,2,0,0,0,0|0,0,2]=4 3302 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200000210301 [0,2,0,0,0,0|0,0,2]=4 3303 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200000210301 [0,2,0,0,0,0|0,0,2]=4 3304 B12R1.13 CN[C@H](CO)c1cccc(c1)C 2230a_100009818812_200000210301 [0,2,0,0,0,0|0,0,2]=4 3305 B12R1.13 CN[C@H](CO)c1cccc(c1)C 34a_100009818812_200000210301 [0,2,0,0,0,0|0,0,2]=4 3306 B12R1.13 CN[C@H](CO)c1cccc(c1)F 2230a_100020641251_200000210301 [0,2,0,0,0,0|0,0,2]=4 3307 B12R1.13 CN[C@H](CO)c1cccc(c1)F 34a_100020641251_200000210301 [0,2,0,0,0,0|0,0,2]=4 3308 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 2230a_100009818812_200025704644 [0,2,0,0,0,0|0,0,2]=4 3309 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 34a_100009818812_200025704644 [0,2,0,0,0,0|0,0,2]=4 3310 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 2230a_100000690078_200025704644 [0,2,0,0,0,0|0,0,2]=4 3311 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 34a_100000690078_200025704644 [0,2,0,0,0,0|0,0,2]=4 3312 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 2230a_100025717460_200025704644 [0,2,0,0,0,0|0,0,2]=4 3313 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 34a_100025717460_200025704644 [0,2,0,0,0,0|0,0,2]=4 3314 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200025704644 [0,2,0,0,0,0|0,0,2]=4 3315 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200025704644 [0,2,0,0,0,0|0,0,2]=4 3316 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 2230a_100020641251_200025704644 [0,2,0,0,0,0|0,0,2]=4 3317 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 34a_100020641251_200025704644 [0,2,0,0,0,0|0,0,2]=4 3318 B12R1.243 CCC(NC)c1ccccc1C 269862a_106832991636_100011350723 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.243 CCC(NC)c1ccccc1Cl 269862a_106832991636_100011400563 [0,2,0,0,0,0|1,0,1]=4 3320 B12R1.243 CCC(NC)c1ccccc1F 269862a_106832991636_100000686739 [0,2,0,0,0,0|1,0,1]=4 3321 B12R1.243 CC[C@H](NC)c1ccccc1Cl 2230a_200016987949_200000210301 [0,2,0,0,0,0|1,0,1]=4 3322 B12R1.243 CC[C@H](NC)c1ccccc1Cl 34a_200016987949_200000210301 [0,2,0,0,0,0|1,0,1]=4 3323 B12R1.243 CC[C@H](NC)c1ccccc1F 2230a_100015190424_200000210301 [0,2,0,0,0,0|1,0,1]=4 3324 B12R1.243 CC[C@H](NC)c1ccccc1F 34a_100015190424_200000210301 [0,2,0,0,0,0|1,0,1]=4 3325 B12R1.243 CC[C@H](N[13CH3])c1ccccc1Cl 2230a_200016987949_200025704644 [0,2,0,0,0,0|1,0,1]=4 3326 B12R1.243 CC[C@H](N[13CH3])c1ccccc1Cl 34a_200016987949_200025704644 [0,2,0,0,0,0|1,0,1]=4 3327 B12R1.243 CC[C@H](N[13CH3])c1ccccc1F 2230a_100015190424_200025704644 [0,2,0,0,0,0|1,0,1]=4 3328 B12R1.243 CC[C@H](N[13CH3])c1ccccc1F 34a_100015190424_200025704644 [0,2,0,0,0,0|1,0,1]=4 3329 B12R1.243 CNC(C#N)c1ccccc1C 2230a_102495364774_200000210301 [0,2,0,0,0,0|1,0,1]=4 3330 B12R1.243 CNC(CO)c1ccccc1Cl 2230a_100138412506_200000210301 [0,2,0,0,0,0|0,0,2]=4 3331 B12R1.243 CNC(CO)c1ccccc1Cl 34a_100138412506_200000210301 [0,2,0,0,0,0|0,0,2]=4 3332 B12R1.243 CN[C@@H](CO)c1ccccc1F 2230a_100009818778_200000210301 [0,2,0,0,0,0|0,0,2]=4 3333 B12R1.243 CN[C@@H](CO)c1ccccc1F 34a_100009818778_200000210301 [0,2,0,0,0,0|0,0,2]=4 3334 B12R1.243 CN[C@H](CO)c1ccccc1Br 2230a_100161155918_200000210301 [0,2,0,0,0,0|0,0,2]=4 3335 B12R1.243 CN[C@H](CO)c1ccccc1Br 34a_100161155918_200000210301 [0,2,0,0,0,0|0,0,2]=4 3336 B12R1.243 Cc1ccccc1C(C#N)N[13CH3] 2230a_102495364774_200025704644 [0,2,0,0,0,0|1,0,1]=4 3337 B12R1.243 [13CH3]NC(CO)c1ccccc1Cl 2230a_100138412506_200025704644 [0,2,0,0,0,0|0,0,2]=4 3338 B12R1.243 [13CH3]NC(CO)c1ccccc1Cl 34a_100138412506_200025704644 [0,2,0,0,0,0|0,0,2]=4 3339 B12R1.243 [13CH3]N[C@@H](CO)c1ccccc1F 2230a_100009818778_200025704644 [0,2,0,0,0,0|0,0,2]=4 3340 B12R1.243 [13CH3]N[C@@H](CO)c1ccccc1F 34a_100009818778_200025704644 [0,2,0,0,0,0|0,0,2]=4 3341 B12R1.243 [13CH3]N[C@H](CO)c1ccccc1Br 2230a_100161155918_200025704644 [0,2,0,0,0,0|0,0,2]=4 3342 B12R1.243 [13CH3]N[C@H](CO)c1ccccc1Br 34a_100161155918_200025704644 [0,2,0,0,0,0|0,0,2]=4 3343 B12R1.478 C=CC(c1ccccc1)N(C)C 2230a_100102631434_200000085779 [0,2,0,0,0,0|1,0,1]=4 3344 B12R1.478 C=CC(c1ccccc1)N(C)C 269982a_100102631434_200000085779 [0,2,0,0,0,0|1,0,1]=4 3345 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_100009888967_200025704644 [0,2,0,0,0,0|1,0,1]=4 3346 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_200025704644_100009888967 [0,2,0,0,0,0|1,0,1]=4 3347 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 2230a_100015186014_200025704644 [0,2,0,0,0,0|1,0,1]=4 3348 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 34a_100015186014_200025704644 [0,2,0,0,0,0|1,0,1]=4 3349 B12R1.478 CCC(C(=O)C)c1ccccc1 1458a_100000211302_200000210301 [0,2,0,0,0,0|1,0,1]=4 3350 B12R1.478 CCC(C(=O)[13CH3])c1ccccc1 1458a_100000211302_200025704644 [0,2,0,0,0,0|1,0,1]=4 3351 B12R1.478 CCC(c1ccccc1)N(C)C 2230a_100000737544_200000210301 [0,2,0,0,0,0|1,0,1]=4 3352 B12R1.478 CCC(c1ccccc1)N(C)C 269982a_100000737544_200000210301 [0,2,0,0,0,0|1,0,1]=4 3353 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 2230a_100000737544_200025704644 [0,2,0,0,0,0|1,0,1]=4 3354 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 269982a_100000737544_200025704644 [0,2,0,0,0,0|1,0,1]=4 3355 B12R1.478 CCN(C(=O)C)c1ccccc1 11a_100000210013_100015343762 [0,2,0,0,0,0|2,0,0]=4 3356 B12R1.478 CCN(C(=O)C)c1ccccc1 1626a_100000210013_100015343762 [0,2,0,0,0,0|2,0,0]=4 3357 B12R1.478 CCN(C(=O)C)c1ccccc1 22a_100000210013_100000070787 [0,2,0,0,0,0|2,0,0]=4 3358 B12R1.478 CNC(C(=O)C)c1ccccc1 2230a_106832991635_100009888967 [0,2,0,0,0,0|0,0,1]=3 3359 B12R1.478 CNC(C(=O)C)c1ccccc1 7a_106832991635_100009888967 [0,2,0,0,0,0|0,0,1]=3 3360 B12R1.478 CNC(C(=O)N)c1ccccc1 2230a_106832991635_100000188848 [0,2,0,0,0,0|0,0,1]=3 3361 B12R1.478 CNC(C(=O)N)c1ccccc1 7a_106832991635_100000188848 [0,2,0,0,0,0|0,0,1]=3 3362 B12R1.478 CNC(C(=O)O)c1ccccc1 269956a_100000230147_200000210301 [0,2,0,0,0,0|0,0,1]=3 3363 B12R1.478 CNC(C(=O)O)c1ccccn1 269956a_200016167988_200000210301 [0,2,0,0,0,0|1,0,1]=4 3364 B12R1.478 CN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200000210301 [0,2,0,0,0,0|0,0,1]=3 3365 B12R1.478 CN[C@@H](c1ccccc1)[C@H](C)O 2230a_100134616770_200000210301 [0,2,0,0,0,0|0,0,2]=4 3366 B12R1.478 CN[C@H](c1ccccc1)C(C)C 2230a_100015186014_200000210301 [0,2,0,0,0,0|1,0,1]=4 3367 B12R1.478 CN[C@H](c1ccccc1)C(C)C 34a_100015186014_200000210301 [0,2,0,0,0,0|1,0,1]=4 3368 B12R1.478 COC(C(=O)N)c1ccccc1 34a_100011200849_200000210301 [0,2,0,0,0,0|1,0,1]=4 3369 B12R1.478 COC(C(=O)N)c1ccccc1 7a_100011200849_200000210301 [0,2,0,0,0,0|1,0,1]=4 3370 B12R1.478 CO[C@@H](C(=O)C)c1ccccc1 1458a_100000698336_200000210301 [0,2,0,0,0,0|1,0,1]=4 3371 B12R1.478 CO[C@@H](C(=O)[13CH3])c1ccccc1 1458a_100000698336_200025704644 [0,2,0,0,0,0|1,0,1]=4 3372 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_100009888967_200000210301 [0,2,0,0,0,0|1,0,1]=4 3373 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_200000210301_100009888967 [0,2,0,0,0,0|1,0,1]=4 3374 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_100000188848_200000210301 [0,2,0,0,0,0|1,0,1]=4 3375 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_200000210301_100000188848 [0,2,0,0,0,0|1,0,1]=4 3376 B12R1.478 C[C@H](O)[C@@H](N[13CH3])c1ccccc1 2230a_100134616770_200025704644 [0,2,0,0,0,0|0,0,2]=4 3377 B12R1.478 [13CH3]NC(C(=O)O)c1ccccc1 269956a_100000230147_200025704644 [0,2,0,0,0,0|0,0,1]=3 3378 B12R1.478 [13CH3]NC(C(=O)O)c1ccccn1 269956a_200016167988_200025704644 [0,2,0,0,0,0|1,0,1]=4 3379 B12R1.478 [13CH3]N[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200025704644 [0,2,0,0,0,0|0,0,1]=3 3380 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 34a_100011200849_200025704644 [0,2,0,0,0,0|1,0,1]=4 3381 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 7a_100011200849_200025704644 [0,2,0,0,0,0|1,0,1]=4 3382 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_100000188848_200025704644 [0,2,0,0,0,0|1,0,1]=4 3383 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_200025704644_100000188848 [0,2,0,0,0,0|1,0,1]=4 3384 B12R1.16 C#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000184674 [0,2,0,0,0,0|1,0,1]=4 3385 B12R1.16 C#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000184674 [0,2,0,0,0,0|1,0,1]=4 3386 B12R1.16 C#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000184674 [0,2,0,0,0,0|1,0,1]=4 3387 B12R1.16 C#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000184674 [0,2,0,0,0,0|1,0,1]=4 3388 B12R1.16 C#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000184674 [0,2,0,0,0,0|1,0,1]=4 3389 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,2,0,0,0,0|1,0,1]=4 3390 B12R1.16 C=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210623 [0,2,0,0,0,0|1,0,1]=4 3391 B12R1.16 C=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210623 [0,2,0,0,0,0|1,0,1]=4 3392 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210623 [0,2,0,0,0,0|1,0,1]=4 3393 B12R1.16 C=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210623 [0,2,0,0,0,0|1,0,1]=4 3394 B12R1.16 C=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210623 [0,2,0,0,0,0|1,0,1]=4 3395 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,2,0,0,0,0|1,0,1]=4 3396 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [0,2,0,0,0,0|1,0,0]=3 3397 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [0,2,0,0,0,0|1,0,1]=4 3398 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [0,2,0,0,0,0|1,0,0]=3 3399 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [0,2,0,0,0,0|1,0,0]=3 3400 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [0,2,0,0,0,0|1,0,0]=3 3401 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [0,2,0,0,0,0|1,0,0]=3 3402 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [0,2,0,0,0,0|1,0,0]=3 3403 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,2,0,0,0,0|1,0,0]=3 3404 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,2,0,0,0,0|1,0,0]=3 3405 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [0,2,0,0,0,0|2,0,0]=4 3406 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [0,2,0,0,0,0|0,0,0]=2 3407 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [0,2,0,0,0,0|0,0,0]=2 3408 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [0,2,0,0,0,0|0,0,0]=2 3409 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 3410 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 3411 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 3412 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [0,2,0,0,0,0|0,0,0]=2 3413 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [0,2,0,0,0,0|0,0,0]=2 3414 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [0,2,0,0,0,0|0,0,0]=2 3415 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [0,2,0,0,0,0|0,0,0]=2 3416 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [0,2,0,0,0,0|0,0,0]=2 3417 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [0,2,0,0,0,0|0,0,0]=2 3418 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [0,2,0,0,0,0|0,0,0]=2 3419 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [0,2,0,0,0,0|0,0,0]=2 3420 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [0,2,0,0,0,0|0,0,0]=2 3421 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,2,0,0,0,0|0,0,0]=2 3422 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,2,0,0,0,0|0,0,0]=2 3423 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,2,0,0,0,0|0,0,0]=2 3424 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [0,2,0,0,0,0|1,0,0]=3 3425 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [0,2,0,0,0,0|1,0,0]=3 3426 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [0,2,0,0,0,0|1,0,1]=4 3427 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [0,2,0,0,0,0|1,0,1]=4 3428 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,2,0,0,0,0|1,0,1]=4 3429 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,2,0,0,0,0|1,0,1]=4 3430 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [0,2,0,0,0,0|1,0,1]=4 3431 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [0,2,0,0,0,0|1,0,1]=4 3432 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [0,2,0,0,0,0|1,0,1]=4 3433 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [0,2,0,0,0,0|1,0,1]=4 3434 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [0,2,0,0,0,0|1,0,1]=4 3435 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [0,2,0,0,0,0|1,0,1]=4 3436 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [0,2,0,0,0,0|1,0,1]=4 3437 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [0,2,0,0,0,0|1,0,1]=4 3438 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [0,2,0,0,0,0|1,0,1]=4 3439 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [0,2,0,0,0,0|1,0,1]=4 3440 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,2,0,0,0,0|1,0,1]=4 3441 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,2,0,0,0,0|1,0,1]=4 3442 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [0,2,0,0,0,0|1,0,1]=4 3443 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [0,2,0,0,0,0|1,0,1]=4 3444 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,2,0,0,0,0|1,0,0]=3 3445 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [0,2,0,0,0,0|2,0,0]=4 3446 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [0,2,0,0,0,0|2,0,0]=4 3447 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [0,2,0,0,0,0|0,0,0]=2 3448 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [0,2,0,0,0,0|0,0,0]=2 3449 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [0,2,0,0,0,0|0,0,0]=2 3450 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [0,2,0,0,0,0|0,0,0]=2 3451 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [0,2,0,0,0,0|0,0,0]=2 3452 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [0,2,0,0,0,0|0,0,0]=2 3453 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [0,2,0,0,0,0|0,0,0]=2 3454 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [0,2,0,0,0,0|0,0,0]=2 3455 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [0,2,0,0,0,0|0,0,0]=2 3456 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,2,0,0,0,0|0,0,0]=2 3457 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,2,0,0,0,0|0,0,0]=2 3458 B12R1.16 CNCC(=O)c1ccc(cn1)Cl 7a_106832991635_100016989621 [0,2,0,0,0,0|1,0,0]=3 3459 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [0,2,0,0,0,0|1,0,1]=4 3460 B12R1.16 CNCC(O)c1ccc(cc1)Br 2230a_100020626992_200000210301 [0,2,0,0,0,0|0,0,2]=4 3461 B12R1.16 CNCC(O)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,2,0,0,0,0|0,0,2]=4 3462 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [0,2,0,0,0,0|0,0,2]=4 3463 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [0,2,0,0,0,0|0,0,2]=4 3464 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_200000210301 [0,2,0,0,0,0|0,0,2]=4 3465 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_106832991635_200011996143 [0,2,0,0,0,0|0,0,2]=4 3466 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,2,0,0,0,0|0,0,2]=4 3467 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100102657272_200011996143 [0,2,0,0,0,0|0,0,2]=4 3468 B12R1.16 CNCC(O)c1ccc(cc1)Cl 7a_106832991635_200011996143 [0,2,0,0,0,0|0,0,2]=4 3469 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [0,2,0,0,0,0|0,0,2]=4 3470 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 2230a_106832991635_100000720402 [0,2,0,0,0,0|0,0,2]=4 3471 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 34a_100102657272_100000720402 [0,2,0,0,0,0|0,0,2]=4 3472 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 7a_106832991635_100000720402 [0,2,0,0,0,0|0,0,2]=4 3473 B12R1.16 CNNC(=O)c1ccc(cc1)Br 22a_100016993582_100000185839 [0,2,0,0,0,0|0,0,0]=2 3474 B12R1.16 CNNC(=O)c1ccc(cc1)C 22a_100016993582_100000188618 [0,2,0,0,0,0|0,0,0]=2 3475 B12R1.16 CNNC(=O)c1ccc(cc1)Cl 22a_100016993582_100000210187 [0,2,0,0,0,0|0,0,0]=2 3476 B12R1.16 CNNC(=O)c1ccc(cc1)F 22a_100016993582_100000187176 [0,2,0,0,0,0|0,0,0]=2 3477 B12R1.16 CNNC(=O)c1ccc(cc1)I 22a_100016993582_100000187904 [0,2,0,0,0,0|0,0,0]=2 3478 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,2,0,0,0,0|0,0,0]=2 3479 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [0,2,0,0,0,0|1,0,0]=3 3480 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [0,2,0,0,0,0|1,0,0]=3 3481 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [0,2,0,0,0,0|1,0,0]=3 3482 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [0,2,0,0,0,0|1,0,0]=3 3483 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,2,0,0,0,0|1,0,0]=3 3484 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,2,0,0,0,0|1,0,0]=3 3485 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [0,2,0,0,0,0|1,0,0]=3 3486 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [0,2,0,0,0,0|1,0,0]=3 3487 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [0,2,0,0,0,0|1,0,0]=3 3488 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [0,2,0,0,0,0|1,0,0]=3 3489 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [0,2,0,0,0,0|1,0,0]=3 3490 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [0,2,0,0,0,0|1,0,0]=3 3491 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [0,2,0,0,0,0|1,0,0]=3 3492 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [0,2,0,0,0,0|1,0,0]=3 3493 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [0,2,0,0,0,0|1,0,0]=3 3494 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,2,0,0,0,0|1,0,0]=3 3495 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,2,0,0,0,0|1,0,0]=3 3496 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_200000210301 [0,2,0,0,0,0|2,0,0]=4 3497 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_200000210301_100016989621 [0,2,0,0,0,0|2,0,0]=4 3498 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_100012027583_200000210301 [0,2,0,0,0,0|2,0,0]=4 3499 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_200000210301_100012027583 [0,2,0,0,0,0|2,0,0]=4 3500 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_200000210301 [0,2,0,0,0,0|2,0,0]=4 3501 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_200000210301_100009864725 [0,2,0,0,0,0|2,0,0]=4 3502 B12R1.16 C[C@@H](NCF)c1ccc(cc1)Cl 34a_100015205461_100015361967 [0,2,0,0,0,0|1,0,1]=4 3503 B12R1.16 C[C@H](NCF)c1ccc(cc1)F 34a_100025705893_100015361967 [0,2,0,0,0,0|1,0,1]=4 3504 B12R1.16 Cc1ccc(cc1)C(=O)CC#N 1458a_100000188618_100011214920 [0,2,0,0,0,0|1,0,1]=4 3505 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [0,2,0,0,0,0|1,0,0]=3 3506 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [0,2,0,0,0,0|1,0,0]=3 3507 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [0,2,0,0,0,0|1,0,0]=3 3508 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [0,2,0,0,0,0|1,0,0]=3 3509 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [0,2,0,0,0,0|0,0,2]=4 3510 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [0,2,0,0,0,0|0,0,2]=4 3511 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCF 34a_100016988085_100015361967 [0,2,0,0,0,0|1,0,1]=4 3512 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_100012027583_200025704644 [0,2,0,0,0,0|2,0,0]=4 3513 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_200025704644_100012027583 [0,2,0,0,0,0|2,0,0]=4 3514 B12R1.16 N#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011214920 [0,2,0,0,0,0|1,0,1]=4 3515 B12R1.16 N#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214920 [0,2,0,0,0,0|1,0,1]=4 3516 B12R1.16 N#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100011214920 [0,2,0,0,0,0|1,0,1]=4 3517 B12R1.16 N#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100011214920 [0,2,0,0,0,0|1,0,1]=4 3518 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,2,0,0,0,0|1,0,1]=4 3519 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,2,0,0,0,0|1,0,1]=4 3520 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [0,2,0,0,0,0|1,0,0]=3 3521 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [0,2,0,0,0,0|1,0,0]=3 3522 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [0,2,0,0,0,0|1,0,0]=3 3523 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [0,2,0,0,0,0|1,0,0]=3 3524 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,2,0,0,0,0|1,0,0]=3 3525 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [0,2,0,0,0,0|1,0,0]=3 3526 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [0,2,0,0,0,0|1,0,0]=3 3527 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [0,2,0,0,0,0|1,0,0]=3 3528 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [0,2,0,0,0,0|1,0,0]=3 3529 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,2,0,0,0,0|1,0,0]=3 3530 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 2230a_100020626992_200025704644 [0,2,0,0,0,0|0,0,2]=4 3531 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,2,0,0,0,0|0,0,2]=4 3532 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 2230a_100000736658_200025704644 [0,2,0,0,0,0|0,0,2]=4 3533 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,2,0,0,0,0|0,0,2]=4 3534 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [0,2,0,0,0,0|0,0,2]=4 3535 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [0,2,0,0,0,0|1,0,0]=3 3536 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [0,2,0,0,0,0|1,0,0]=3 3537 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [0,2,0,0,0,0|1,0,0]=3 3538 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [0,2,0,0,0,0|1,0,0]=3 3539 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [0,2,0,0,0,0|1,0,0]=3 3540 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [0,2,0,0,0,0|1,0,0]=3 3541 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [0,2,0,0,0,0|1,0,0]=3 3542 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [0,2,0,0,0,0|1,0,0]=3 3543 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,2,0,0,0,0|1,0,0]=3 3544 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,2,0,0,0,0|1,0,0]=3 3545 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_100016989621_200025704644 [0,2,0,0,0,0|2,0,0]=4 3546 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_200025704644_100016989621 [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_100009864725_200025704644 [0,2,0,0,0,0|2,0,0]=4 3548 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_200025704644_100009864725 [0,2,0,0,0,0|2,0,0]=4 3549 B12R1.17 C#CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000184674 [0,2,0,0,0,0|1,0,1]=4 3550 B12R1.17 C#CCC(=O)c1cccc(c1)C 1458a_100000189346_100000184674 [0,2,0,0,0,0|1,0,1]=4 3551 B12R1.17 C#CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000184674 [0,2,0,0,0,0|1,0,1]=4 3552 B12R1.17 C#CCC(=O)c1cccc(c1)F 1458a_100000210950_100000184674 [0,2,0,0,0,0|1,0,1]=4 3553 B12R1.17 C#CCC(=O)c1cccc(c1)I 1458a_100000184098_100000184674 [0,2,0,0,0,0|1,0,1]=4 3554 B12R1.17 C#CCC(=O)c1cccc(c1)O 1458a_100000183914_100000184674 [0,2,0,0,0,0|1,0,1]=4 3555 B12R1.17 C=CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210623 [0,2,0,0,0,0|1,0,1]=4 3556 B12R1.17 C=CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210623 [0,2,0,0,0,0|1,0,1]=4 3557 B12R1.17 C=CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210623 [0,2,0,0,0,0|1,0,1]=4 3558 B12R1.17 C=CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210623 [0,2,0,0,0,0|1,0,1]=4 3559 B12R1.17 C=CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210623 [0,2,0,0,0,0|1,0,1]=4 3560 B12R1.17 C=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210623 [0,2,0,0,0,0|1,0,1]=4 3561 B12R1.17 CC(NCF)c1cccc(c1)Cl 34a_100102723534_100015361967 [0,2,0,0,0,0|1,0,1]=4 3562 B12R1.17 CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210303 [0,2,0,0,0,0|1,0,0]=3 3563 B12R1.17 CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210303 [0,2,0,0,0,0|1,0,0]=3 3564 B12R1.17 CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210303 [0,2,0,0,0,0|1,0,0]=3 3565 B12R1.17 CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210303 [0,2,0,0,0,0|1,0,0]=3 3566 B12R1.17 CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210303 [0,2,0,0,0,0|1,0,0]=3 3567 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [0,2,0,0,0,0|1,0,0]=3 3568 B12R1.17 CCNC(=O)c1cc(ccn1)O 271570a_203496583355_100000194128 [0,2,0,0,0,0|1,0,0]=3 3569 B12R1.17 CCNC(=O)c1cccc(c1)Br 11a_100015525214_100000210664 [0,2,0,0,0,0|0,0,0]=2 3570 B12R1.17 CCNC(=O)c1cccc(c1)Br 240690a_100015525214_100000210664 [0,2,0,0,0,0|0,0,0]=2 3571 B12R1.17 CCNC(=O)c1cccc(c1)Br 527a_100015525214_100000210664 [0,2,0,0,0,0|0,0,0]=2 3572 B12R1.17 CCNC(=O)c1cccc(c1)C 11a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 3573 B12R1.17 CCNC(=O)c1cccc(c1)C 240690a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 3574 B12R1.17 CCNC(=O)c1cccc(c1)C 527a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 3575 B12R1.17 CCNC(=O)c1cccc(c1)Cl 11a_100015525214_100000210390 [0,2,0,0,0,0|0,0,0]=2 3576 B12R1.17 CCNC(=O)c1cccc(c1)Cl 240690a_100015525214_100000210390 [0,2,0,0,0,0|0,0,0]=2 3577 B12R1.17 CCNC(=O)c1cccc(c1)Cl 527a_100015525214_100000210390 [0,2,0,0,0,0|0,0,0]=2 3578 B12R1.17 CCNC(=O)c1cccc(c1)F 11a_100015525214_100000210950 [0,2,0,0,0,0|0,0,0]=2 3579 B12R1.17 CCNC(=O)c1cccc(c1)F 240690a_100015525214_100000210950 [0,2,0,0,0,0|0,0,0]=2 3580 B12R1.17 CCNC(=O)c1cccc(c1)F 527a_100015525214_100000210950 [0,2,0,0,0,0|0,0,0]=2 3581 B12R1.17 CCNC(=O)c1cccc(c1)I 11a_100015525214_100000184098 [0,2,0,0,0,0|0,0,0]=2 3582 B12R1.17 CCNC(=O)c1cccc(c1)I 240690a_100015525214_100000184098 [0,2,0,0,0,0|0,0,0]=2 3583 B12R1.17 CCNC(=O)c1cccc(c1)I 527a_100015525214_100000184098 [0,2,0,0,0,0|0,0,0]=2 3584 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [0,2,0,0,0,0|0,0,0]=2 3585 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [0,2,0,0,0,0|0,0,0]=2 3586 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [0,2,0,0,0,0|0,0,0]=2 3587 B12R1.17 CCNC(=O)c1ccnc(c1)O 271570a_203496583355_100000229823 [0,2,0,0,0,0|1,0,0]=3 3588 B12R1.17 CCNC(=O)c1cncc(c1)O 271570a_203496583355_200000155184 [0,2,0,0,0,0|1,0,0]=3 3589 B12R1.17 CCNC(C)c1cccc(c1)Br 2230a_100020642005_100000210202 [0,2,0,0,0,0|1,0,1]=4 3590 B12R1.17 CCNC(C)c1cccc(c1)Br 269862a_100015525214_100000210093 [0,2,0,0,0,0|1,0,1]=4 3591 B12R1.17 CCNC(C)c1cccc(c1)C 269862a_100015525214_100000211476 [0,2,0,0,0,0|1,0,1]=4 3592 B12R1.17 CCNC(C)c1cccc(c1)Cl 2230a_100102723534_100000210202 [0,2,0,0,0,0|1,0,1]=4 3593 B12R1.17 CCNC(C)c1cccc(c1)Cl 269862a_100015525214_200000210964 [0,2,0,0,0,0|1,0,1]=4 3594 B12R1.17 CCNC(C)c1cccc(c1)Cl 34a_100102723534_100000210202 [0,2,0,0,0,0|1,0,1]=4 3595 B12R1.17 CCNC(C)c1cccc(c1)F 269862a_100015525214_100000187083 [0,2,0,0,0,0|1,0,1]=4 3596 B12R1.17 CCNC(C)c1cccc(c1)I 269862a_100015525214_100011356966 [0,2,0,0,0,0|1,0,1]=4 3597 B12R1.17 CCNC(C)c1cccc(c1)O 2230a_100000740644_100000210202 [0,2,0,0,0,0|1,0,1]=4 3598 B12R1.17 CCNC(C)c1cccc(c1)O 269862a_100015525214_100000211620 [0,2,0,0,0,0|1,0,1]=4 3599 B12R1.17 CCN[C@H](C)c1cccc(c1)C 2230a_100000698126_100000210202 [0,2,0,0,0,0|1,0,1]=4 3600 B12R1.17 CCN[C@H](C)c1cccc(c1)C 34a_100000698126_100000210202 [0,2,0,0,0,0|1,0,1]=4 3601 B12R1.17 CCN[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210202 [0,2,0,0,0,0|1,0,1]=4 3602 B12R1.17 CCN[C@H](C)c1cccc(c1)F 34a_100015193778_100000210202 [0,2,0,0,0,0|1,0,1]=4 3603 B12R1.17 CCOC(=O)c1cc(ccn1)O 271570a_203496583355_100010210110 [0,2,0,0,0,0|2,0,0]=4 3604 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [0,2,0,0,0,0|1,0,0]=3 3605 B12R1.17 CCOC(=O)c1cccc(n1)O 271570a_203496583355_100000695914 [0,2,0,0,0,0|2,0,0]=4 3606 B12R1.17 CCOC(=O)c1ccnc(c1)O 271570a_203496583355_100011213083 [0,2,0,0,0,0|2,0,0]=4 3607 B12R1.17 CCOC(=O)c1cncc(c1)O 271570a_203496583355_100000170250 [0,2,0,0,0,0|2,0,0]=4 3608 B12R1.17 CNCC(=O)c1cccc(c1)Br 2230a_106832991635_100000212080 [0,2,0,0,0,0|0,0,0]=2 3609 B12R1.17 CNCC(=O)c1cccc(c1)Br 34a_100102657272_100000212080 [0,2,0,0,0,0|0,0,0]=2 3610 B12R1.17 CNCC(=O)c1cccc(c1)Br 7a_106832991635_100000212080 [0,2,0,0,0,0|0,0,0]=2 3611 B12R1.17 CNCC(=O)c1cccc(c1)C 2230a_106832991635_100000739480 [0,2,0,0,0,0|0,0,0]=2 3612 B12R1.17 CNCC(=O)c1cccc(c1)C 34a_100102657272_100000739480 [0,2,0,0,0,0|0,0,0]=2 3613 B12R1.17 CNCC(=O)c1cccc(c1)C 7a_106832991635_100000739480 [0,2,0,0,0,0|0,0,0]=2 3614 B12R1.17 CNCC(=O)c1cccc(c1)Cl 2230a_106832991635_100000211444 [0,2,0,0,0,0|0,0,0]=2 3615 B12R1.17 CNCC(=O)c1cccc(c1)Cl 34a_100102657272_100000211444 [0,2,0,0,0,0|0,0,0]=2 3616 B12R1.17 CNCC(=O)c1cccc(c1)Cl 7a_106832991635_100000211444 [0,2,0,0,0,0|0,0,0]=2 3617 B12R1.17 CNCC(=O)c1cccc(c1)F 2230a_106832991635_100000215616 [0,2,0,0,0,0|0,0,0]=2 3618 B12R1.17 CNCC(=O)c1cccc(c1)F 34a_100102657272_100000215616 [0,2,0,0,0,0|0,0,0]=2 3619 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [0,2,0,0,0,0|0,0,0]=2 3620 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [0,2,0,0,0,0|0,0,0]=2 3621 B12R1.17 CNCC(O)c1cccc(c1)O 2230a_100020657549_200000210301 [0,2,0,0,0,0|0,0,2]=4 3622 B12R1.17 CNCC(O)c1cccc(c1)O 271570a_203496583355_200000733937 [0,2,0,0,0,0|0,0,2]=4 3623 B12R1.17 CNCC(O)c1cccc(c1)O 34a_100020657549_200000210301 [0,2,0,0,0,0|0,0,2]=4 3624 B12R1.17 CNNC(=O)c1cccc(c1)Br 22a_100016993582_100000210664 [0,2,0,0,0,0|0,0,0]=2 3625 B12R1.17 CNNC(=O)c1cccc(c1)C 22a_100016993582_100000189346 [0,2,0,0,0,0|0,0,0]=2 3626 B12R1.17 CNNC(=O)c1cccc(c1)Cl 22a_100016993582_100000210390 [0,2,0,0,0,0|0,0,0]=2 3627 B12R1.17 CNNC(=O)c1cccc(c1)F 22a_100016993582_100000210950 [0,2,0,0,0,0|0,0,0]=2 3628 B12R1.17 CNNC(=O)c1cccc(c1)I 22a_100016993582_100000184098 [0,2,0,0,0,0|0,0,0]=2 3629 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [0,2,0,0,0,0|0,0,0]=2 3630 B12R1.17 COCC(=O)c1cccc(c1)Br 34a_100138415774_100000212080 [0,2,0,0,0,0|1,0,0]=3 3631 B12R1.17 COCC(=O)c1cccc(c1)C 34a_100138415774_100000739480 [0,2,0,0,0,0|1,0,0]=3 3632 B12R1.17 COCC(=O)c1cccc(c1)Cl 34a_100138415774_100000211444 [0,2,0,0,0,0|1,0,0]=3 3633 B12R1.17 COCC(=O)c1cccc(c1)Cl 7a_200011592804_200000210301 [0,2,0,0,0,0|1,0,0]=3 3634 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100011592800_200000210301 [0,2,0,0,0,0|1,0,0]=3 3635 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100138415774_100000215616 [0,2,0,0,0,0|1,0,0]=3 3636 B12R1.17 COCC(=O)c1cccc(c1)F 7a_100011592800_200000210301 [0,2,0,0,0,0|1,0,0]=3 3637 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [0,2,0,0,0,0|1,0,0]=3 3638 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_100000212080_200000210301 [0,2,0,0,0,0|1,0,0]=3 3639 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_200000210301_100000212080 [0,2,0,0,0,0|1,0,0]=3 3640 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_100000739480_200000210301 [0,2,0,0,0,0|1,0,0]=3 3641 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_200000210301_100000739480 [0,2,0,0,0,0|1,0,0]=3 3642 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_100000211444_200000210301 [0,2,0,0,0,0|1,0,0]=3 3643 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_200000210301_100000211444 [0,2,0,0,0,0|1,0,0]=3 3644 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_100000215616_200000210301 [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_200000210301_100000215616 [0,2,0,0,0,0|1,0,0]=3 3646 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [0,2,0,0,0,0|1,0,0]=3 3647 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [0,2,0,0,0,0|1,0,0]=3 3648 B12R1.17 CSCC(=O)c1ccnc(c1)Cl 62a_100009817076_200000210301 [0,2,0,0,0,0|2,0,0]=4 3649 B12R1.17 CSCC(=O)c1ccnc(c1)Cl 62a_200000210301_100009817076 [0,2,0,0,0,0|2,0,0]=4 3650 B12R1.17 C[C@@H](NCF)c1cccc(c1)F 34a_100015193778_100015361967 [0,2,0,0,0,0|1,0,1]=4 3651 B12R1.17 Cc1cccc(c1)C(=O)CC#N 1458a_100000189346_100011214920 [0,2,0,0,0,0|1,0,1]=4 3652 B12R1.17 Cc1cccc(c1)C(=O)CCF 1458a_100000189346_100011217306 [0,2,0,0,0,0|1,0,0]=3 3653 B12R1.17 Cc1cccc(c1)C(=O)CCO 1458a_100000189346_100000211926 [0,2,0,0,0,0|1,0,0]=3 3654 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_100000739480_200025704644 [0,2,0,0,0,0|1,0,0]=3 3655 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_200025704644_100000739480 [0,2,0,0,0,0|1,0,0]=3 3656 B12R1.17 Cc1cccc(c1)[C@@H](C)NCF 34a_100000698126_100015361967 [0,2,0,0,0,0|1,0,1]=4 3657 B12R1.17 N#CCC(=O)c1cccc(c1)Br 1458a_100000210664_100011214920 [0,2,0,0,0,0|1,0,1]=4 3658 B12R1.17 N#CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011214920 [0,2,0,0,0,0|1,0,1]=4 3659 B12R1.17 N#CCC(=O)c1cccc(c1)F 1458a_100000210950_100011214920 [0,2,0,0,0,0|1,0,1]=4 3660 B12R1.17 N#CCC(=O)c1cccc(c1)I 1458a_100000184098_100011214920 [0,2,0,0,0,0|1,0,1]=4 3661 B12R1.17 N#CCC(=O)c1cccc(c1)O 1458a_100000183914_100011214920 [0,2,0,0,0,0|1,0,1]=4 3662 B12R1.17 N#CCC(=O)c1cccc(c1)O 271570a_203496583355_100000740218 [0,2,0,0,0,0|1,0,1]=4 3663 B12R1.17 O=C(CCF)c1cccc(c1)Br 1458a_100000210664_100011217306 [0,2,0,0,0,0|1,0,0]=3 3664 B12R1.17 O=C(CCF)c1cccc(c1)Cl 1458a_100000210390_100011217306 [0,2,0,0,0,0|1,0,0]=3 3665 B12R1.17 O=C(CCF)c1cccc(c1)F 1458a_100000210950_100011217306 [0,2,0,0,0,0|1,0,0]=3 3666 B12R1.17 O=C(CCF)c1cccc(c1)I 1458a_100000184098_100011217306 [0,2,0,0,0,0|1,0,0]=3 3667 B12R1.17 O=C(CCF)c1cccc(c1)O 1458a_100000183914_100011217306 [0,2,0,0,0,0|1,0,0]=3 3668 B12R1.17 O=C(CCO)c1cccc(c1)Br 1458a_100000210664_100000211926 [0,2,0,0,0,0|1,0,0]=3 3669 B12R1.17 O=C(CCO)c1cccc(c1)Cl 1458a_100000210390_100000211926 [0,2,0,0,0,0|1,0,0]=3 3670 B12R1.17 O=C(CCO)c1cccc(c1)F 1458a_100000210950_100000211926 [0,2,0,0,0,0|1,0,0]=3 3671 B12R1.17 O=C(CCO)c1cccc(c1)I 1458a_100000184098_100000211926 [0,2,0,0,0,0|1,0,0]=3 3672 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [0,2,0,0,0,0|1,0,0]=3 3673 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 2230a_100020657549_200025704644 [0,2,0,0,0,0|0,0,2]=4 3674 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 34a_100020657549_200025704644 [0,2,0,0,0,0|0,0,2]=4 3675 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)Cl 7a_200011592804_200025704644 [0,2,0,0,0,0|1,0,0]=3 3676 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 34a_100011592800_200025704644 [0,2,0,0,0,0|1,0,0]=3 3677 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 7a_100011592800_200025704644 [0,2,0,0,0,0|1,0,0]=3 3678 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_100000212080_200025704644 [0,2,0,0,0,0|1,0,0]=3 3679 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_200025704644_100000212080 [0,2,0,0,0,0|1,0,0]=3 3680 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_100000211444_200025704644 [0,2,0,0,0,0|1,0,0]=3 3681 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_200025704644_100000211444 [0,2,0,0,0,0|1,0,0]=3 3682 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_100000215616_200025704644 [0,2,0,0,0,0|1,0,0]=3 3683 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_200025704644_100000215616 [0,2,0,0,0,0|1,0,0]=3 3684 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [0,2,0,0,0,0|1,0,0]=3 3685 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [0,2,0,0,0,0|1,0,0]=3 3686 B12R1.17 [13CH3]SCC(=O)c1ccnc(c1)Cl 62a_100009817076_200025704644 [0,2,0,0,0,0|2,0,0]=4 3687 B12R1.17 [13CH3]SCC(=O)c1ccnc(c1)Cl 62a_200025704644_100009817076 [0,2,0,0,0,0|2,0,0]=4 3688 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [0,2,0,0,0,0|1,0,0]=3 3689 B12R1.30 C#CCNC(=O)c1ccccc1 11a_100000212058_100000185807 [0,2,0,0,0,0|0,0,0]=2 3690 B12R1.30 C#CCNC(=O)c1ccccc1 1626a_100000212058_100000185807 [0,2,0,0,0,0|0,0,0]=2 3691 B12R1.30 C#CCNC(=O)c1ccccc1 240690a_100000212058_100000185807 [0,2,0,0,0,0|0,0,0]=2 3692 B12R1.30 C#CCNC(=O)c1ccccc1 527a_100000212058_100000185807 [0,2,0,0,0,0|0,0,0]=2 3693 B12R1.30 C#CCNC(C)c1ccccc1 34a_100000212058_100000211855 [0,2,0,0,0,0|1,0,1]=4 3694 B12R1.30 C#CCN[C@H](C)c1ccccc1 2230a_100000751104_100000038162 [0,2,0,0,0,0|1,0,1]=4 3695 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [0,2,0,0,0,0|1,0,0]=3 3696 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [0,2,0,0,0,0|1,0,0]=3 3697 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [0,2,0,0,0,0|0,0,0]=2 3698 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [0,2,0,0,0,0|0,0,0]=2 3699 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [0,2,0,0,0,0|0,0,0]=2 3700 B12R1.30 C=CCNC(C)c1ccccc1 2230a_100020586998_100000230085 [0,2,0,0,0,0|1,0,1]=4 3701 B12R1.30 C=CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210623 [0,2,0,0,0,0|1,0,1]=4 3702 B12R1.30 CC#CCC(=O)c1ccccc1 1458a_100000185807_100000748600 [0,2,0,0,0,0|1,0,0]=3 3703 B12R1.30 CC(CNCF)c1ccccc1 34a_100000701038_100015361967 [0,2,0,0,0,0|1,0,1]=4 3704 B12R1.30 CC(NCCF)c1ccccc1 269862a_100000724931_100000185851 [0,2,0,0,0,0|1,0,1]=4 3705 B12R1.30 CC(NCCF)c1ccccc1 34a_100000724931_100000211855 [0,2,0,0,0,0|1,0,1]=4 3706 B12R1.30 CC(NCCO)c1ccccc1 2230a_100016997473_100000230085 [0,2,0,0,0,0|1,0,1]=4 3707 B12R1.30 CC(NCCO)c1ccccc1 269862a_100000210304_100000185851 [0,2,0,0,0,0|1,0,1]=4 3708 B12R1.30 CC(NCCO)c1ccccc1 34a_100016990907_100000211855 [0,2,0,0,0,0|1,0,1]=4 3709 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [0,2,0,0,0,0|1,0,0]=3 3710 B12R1.30 CC=NNC(=O)c1ccccc1 4a_100000184135_200000210099 [0,2,0,0,0,0|0,0,0]=2 3711 B12R1.30 CC=NNC(=O)c1ccccn1 4a_100000184044_200000210099 [0,2,0,0,0,0|1,0,0]=3 3712 B12R1.30 CC=NNC(=O)c1cccnc1 4a_100000189771_200000210099 [0,2,0,0,0,0|1,0,0]=3 3713 B12R1.30 CC=NNC(=O)c1ccncc1 4a_100000189768_200000210099 [0,2,0,0,0,0|1,0,0]=3 3714 B12R1.30 CC=NNC(=O)c1ccncn1 4a_100000084330_200000210099 [0,2,0,0,0,0|2,0,0]=4 3715 B12R1.30 CC=NNC(=O)c1cnccn1 4a_100000189795_200000210099 [0,2,0,0,0,0|2,0,0]=4 3716 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [0,2,0,0,0,0|1,0,0]=3 3717 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [0,2,0,0,0,0|0,0,0]=2 3718 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [0,2,0,0,0,0|0,0,0]=2 3719 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [0,2,0,0,0,0|0,0,0]=2 3720 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [0,2,0,0,0,0|0,0,0]=2 3721 B12R1.30 CCCNC(C)c1ccccc1 269862a_100020643023_100000185851 [0,2,0,0,0,0|1,0,1]=4 3722 B12R1.30 CCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210303 [0,2,0,0,0,0|1,0,1]=4 3723 B12R1.30 CCNCC(C)c1ccccc1 2230a_100000701038_100000210202 [0,2,0,0,0,0|1,0,1]=4 3724 B12R1.30 CCNCC(C)c1ccccc1 2230a_100015525214_100000756946 [0,2,0,0,0,0|1,0,1]=4 3725 B12R1.30 CCNCC(C)c1ccccc1 270004a_100015525214_100000212034 [0,2,0,0,0,0|1,0,1]=4 3726 B12R1.30 CCNCC(C)c1ccccc1 34a_100000701038_100000210202 [0,2,0,0,0,0|1,0,1]=4 3727 B12R1.30 CCNCC(O)c1ccccc1 2230a_100000210709_100000210202 [0,2,0,0,0,0|0,0,2]=4 3728 B12R1.30 CCNCC(O)c1ccccc1 2230a_100015525214_100000185958 [0,2,0,0,0,0|0,0,2]=4 3729 B12R1.30 CCNC[C@@H](O)c1ccccc1 2230a_100015525214_100011933945 [0,2,0,0,0,0|0,0,2]=4 3730 B12R1.30 CCNN=C(C)c1ccccc1 4a_100000756455_100000185851 [0,2,0,0,0,0|1,0,0]=3 3731 B12R1.30 CCNN=C(C)c1ccccn1 4a_100000756455_100000210467 [0,2,0,0,0,0|2,0,0]=4 3732 B12R1.30 CCNN=C(C)c1cccnc1 4a_100000756455_100000210468 [0,2,0,0,0,0|2,0,0]=4 3733 B12R1.30 CCNN=C(C)c1ccncc1 4a_100000756455_100000185792 [0,2,0,0,0,0|2,0,0]=4 3734 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [0,2,0,0,0,0|0,0,0]=2 3735 B12R1.30 CCOCC(=O)c1ccccn1 34a_100121572206_100000027445 [0,2,0,0,0,0|2,0,0]=4 3736 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [0,2,0,0,0,0|1,0,0]=3 3737 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [0,2,0,0,0,0|1,0,0]=3 3738 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000027445_100000210202 [0,2,0,0,0,0|2,0,0]=4 3739 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000210202_100000027445 [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000210202_100000757877 [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000757877_100000210202 [0,2,0,0,0,0|2,0,0]=4 3742 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000027454_100000210202 [0,2,0,0,0,0|2,0,0]=4 3743 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000210202_100000027454 [0,2,0,0,0,0|2,0,0]=4 3744 B12R1.30 CCSCS(=O)c1ccccc1 62a_100000210202_100000031784 [0,2,0,0,0,0|2,0,0]=4 3745 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [0,2,0,0,0,0|0,0,0]=2 3746 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [0,2,0,0,0,0|0,0,0]=2 3747 B12R1.30 CNCCC(C)c1ccccc1 270004a_106832991635_100000189432 [0,2,0,0,0,0|1,0,1]=4 3748 B12R1.30 CNCCC(O)c1ccccc1 2230a_100000763605_200000210301 [0,2,0,0,0,0|0,0,2]=4 3749 B12R1.30 CNCCS(=O)c1ccccc1 2230a_106832991635_100000740319 [0,2,0,0,0,0|1,0,0]=3 3750 B12R1.30 CNCCS(=O)c1ccccc1 7a_106832991635_100000740319 [0,2,0,0,0,0|1,0,0]=3 3751 B12R1.30 CNCC[C@@H](O)c1ccccc1 2230a_106832991635_100000729684 [0,2,0,0,0,0|0,0,2]=4 3752 B12R1.30 CNCC[C@@H](O)c1ccccc1 34a_100102657272_100000729684 [0,2,0,0,0,0|0,0,2]=4 3753 B12R1.30 CNCC[C@@H](O)c1ccccc1 7a_106832991635_100000729684 [0,2,0,0,0,0|0,0,2]=4 3754 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [0,2,0,0,0,0|0,0,0]=2 3755 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [0,2,0,0,0,0|1,0,0]=3 3756 B12R1.30 COCN[C@H](C)c1ccccc1 2230a_100000751104_100000766300 [0,2,0,0,0,0|1,0,1]=4 3757 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [0,2,0,0,0,0|1,0,0]=3 3758 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [0,2,0,0,0,0|1,0,0]=3 3759 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [0,2,0,0,0,0|1,0,0]=3 3760 B12R1.30 CSCCS(=O)c1ccccc1 62a_200000210301_100000740319 [0,2,0,0,0,0|2,0,0]=4 3761 B12R1.30 CSCN[C@H](C)c1ccccc1 2230a_100000751104_100011218213 [0,2,0,0,0,0|1,0,1]=4 3762 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [0,2,0,0,0,0|1,0,0]=3 3763 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [0,2,0,0,0,0|1,0,0]=3 3764 B12R1.30 C[C@@H](NCC#N)c1ccccc1 2230a_100000751104_100011215382 [0,2,0,0,0,0|1,0,1]=4 3765 B12R1.30 C[C@@H](NCC=O)c1ccccc1 2230a_100000751104_200015260668 [0,2,0,0,0,0|1,0,1]=4 3766 B12R1.30 C[C@@H](NCCF)c1ccccc1 2230a_100000751104_100011217306 [0,2,0,0,0,0|1,0,1]=4 3767 B12R1.30 C[C@@H](NCCO)c1ccccc1 2230a_100000751104_100000211926 [0,2,0,0,0,0|1,0,1]=4 3768 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [0,2,0,0,0,0|1,0,0]=3 3769 B12R1.30 N#CCNC(=O)c1ccccc1 1626a_100000734998_100000185807 [0,2,0,0,0,0|0,0,0]=2 3770 B12R1.30 N#CCNC(=O)c1ccccc1 527a_100000734998_100000185807 [0,2,0,0,0,0|0,0,0]=2 3771 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [0,2,0,0,0,0|1,0,0]=3 3772 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [0,2,0,0,0,0|1,0,0]=3 3773 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [0,2,0,0,0,0|1,0,0]=3 3774 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [0,2,0,0,0,0|1,0,0]=3 3775 B12R1.30 O=C(CSCF)c1ccccn1 62a_100000027445_100015361967 [0,2,0,0,0,0|2,0,0]=4 3776 B12R1.30 O=C(CSCF)c1ccccn1 62a_100015361967_100000027445 [0,2,0,0,0,0|2,0,0]=4 3777 B12R1.30 O=C(CSCF)c1cccnc1 62a_100000757877_100015361967 [0,2,0,0,0,0|2,0,0]=4 3778 B12R1.30 O=C(CSCF)c1cccnc1 62a_100015361967_100000757877 [0,2,0,0,0,0|2,0,0]=4 3779 B12R1.30 O=C(CSCF)c1ccncc1 62a_100000027454_100015361967 [0,2,0,0,0,0|2,0,0]=4 3780 B12R1.30 O=C(CSCF)c1ccncc1 62a_100015361967_100000027454 [0,2,0,0,0,0|2,0,0]=4 3781 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [0,2,0,0,0,0|0,0,0]=2 3782 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [0,2,0,0,0,0|0,0,0]=2 3783 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [0,2,0,0,0,0|0,0,0]=2 3784 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [0,2,0,0,0,0|0,0,0]=2 3785 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [0,2,0,0,0,0|0,0,0]=2 3786 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [0,2,0,0,0,0|0,0,0]=2 3787 B12R1.30 O=S(CSCF)c1ccccc1 62a_100015361967_100000031784 [0,2,0,0,0,0|2,0,0]=4 3788 B12R1.30 [13CH3]NCCC(O)c1ccccc1 2230a_100000763605_200025704644 [0,2,0,0,0,0|0,0,2]=4 3789 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [0,2,0,0,0,0|1,0,0]=3 3790 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [0,2,0,0,0,0|1,0,0]=3 3791 B12R1.30 [13CH3]SCCS(=O)c1ccccc1 62a_200025704644_100000740319 [0,2,0,0,0,0|2,0,0]=4 3792 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [0,2,0,0,0,0|1,0,0]=3 3793 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [0,2,0,0,0,0|1,0,0]=3 3794 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [0,2,0,0,0,0|1,0,0]=3 3795 B12R1.107 C=C(F)CC(=O)c1ccccc1 1458a_100000185807_100009893438 [0,2,0,0,0,0|1,0,1]=4 3796 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [0,2,0,0,0,0|2,0,0]=4 3797 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [0,2,0,0,0,0|2,0,0]=4 3798 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [0,2,0,0,0,0|1,0,0]=3 3799 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [0,2,0,0,0,0|2,0,0]=4 3800 B12R1.107 CC(=O)CC(=O)c1cccnc1 1458a_100000070787_100015188593 [0,2,0,0,0,0|2,0,0]=4 3801 B12R1.107 CC(=O)CC(=O)c1ccncc1 1458a_100000070787_100000027454 [0,2,0,0,0,0|2,0,0]=4 3802 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100015343762 [0,2,0,0,0,0|1,0,1]=4 3803 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100015343762 [0,2,0,0,0,0|1,0,1]=4 3804 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100015343762 [0,2,0,0,0,0|1,0,1]=4 3805 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100103153847 [0,2,0,0,0,0|1,0,1]=4 3806 B12R1.107 CC(C)CC(=O)c1ccccc1 1458a_100000185807_100000210624 [0,2,0,0,0,0|1,0,0]=3 3807 B12R1.107 CC(C)NC(=O)c1ccccc1 11a_100138425928_100000185807 [0,2,0,0,0,0|0,0,0]=2 3808 B12R1.107 CC(C)NC(=O)c1ccccc1 1626a_100138425928_100000185807 [0,2,0,0,0,0|0,0,0]=2 3809 B12R1.107 CC(C)NC(=O)c1ccccc1 240690a_100138425928_100000185807 [0,2,0,0,0,0|0,0,0]=2 3810 B12R1.107 CC(C)NC(=O)c1ccccc1 527a_100138425928_100000185807 [0,2,0,0,0,0|0,0,0]=2 3811 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [0,2,0,0,0,0|1,0,1]=4 3812 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [0,2,0,0,0,0|1,0,1]=4 3813 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [0,2,0,0,0,0|1,0,1]=4 3814 B12R1.107 CC(CN(C)C)c1ccccc1 2230a_100102631434_100000756946 [0,2,0,0,0,0|1,0,1]=4 3815 B12R1.107 CC(CN(C)C)c1ccccc1 269982a_100102631434_100000756946 [0,2,0,0,0,0|1,0,1]=4 3816 B12R1.107 CC(CN(C)C)c1ccccc1 270004a_100102631434_100000212034 [0,2,0,0,0,0|1,0,1]=4 3817 B12R1.107 CC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218427 [0,2,0,0,0,0|1,0,0]=3 3818 B12R1.107 CN(C)CC(=O)c1ccccc1 269982a_100102631434_100000211460 [0,2,0,0,0,0|0,0,0]=2 3819 B12R1.107 CN(C)CC(=O)c1ccccn1 269982a_100102631434_100000027445 [0,2,0,0,0,0|1,0,0]=3 3820 B12R1.107 CN(C)CC(=O)c1cccnc1 269982a_100102631434_100000757877 [0,2,0,0,0,0|1,0,0]=3 3821 B12R1.107 CN(C)CC(=O)c1ccncc1 269982a_100102631434_100000027454 [0,2,0,0,0,0|1,0,0]=3 3822 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [0,2,0,0,0,0|0,0,2]=4 3823 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [0,2,0,0,0,0|0,0,2]=4 3824 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [0,2,0,0,0,0|0,0,2]=4 3825 B12R1.107 CN(C)CS(=O)c1ccccc1 269982a_100102631434_100000031784 [0,2,0,0,0,0|1,0,0]=3 3826 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [0,2,0,0,0,0|0,0,2]=4 3827 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [0,2,0,0,0,0|0,0,2]=4 3828 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [0,2,0,0,0,0|0,0,2]=4 3829 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [0,2,0,0,0,0|1,0,1]=4 3830 B12R1.107 O=C(CC(F)F)c1ccccc1 1458a_100000185807_100011934356 [0,2,0,0,0,0|1,0,0]=3 3831 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 1458a_100000185807_100000761209 [0,2,0,0,0,0|1,0,1]=4 3832 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [0,2,0,0,0,0|1,0,1]=4 3833 B12R1.308 C#CCC(=O)c1ccccc1Br 1458a_100000188424_100000184674 [0,2,0,0,0,0|1,0,1]=4 3834 B12R1.308 C#CCC(=O)c1ccccc1C 1458a_100000212026_100000184674 [0,2,0,0,0,0|1,0,1]=4 3835 B12R1.308 C#CCC(=O)c1ccccc1Cl 1458a_100000185844_100000184674 [0,2,0,0,0,0|1,0,1]=4 3836 B12R1.308 C#CCC(=O)c1ccccc1F 1458a_100000188656_100000184674 [0,2,0,0,0,0|1,0,1]=4 3837 B12R1.308 C#CCC(=O)c1ccccc1I 1458a_100000187884_100000184674 [0,2,0,0,0,0|1,0,1]=4 3838 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [0,2,0,0,0,0|1,0,1]=4 3839 B12R1.308 C#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000184674 [0,2,0,0,0,0|1,0,1]=4 3840 B12R1.308 C=CCC(=O)c1ccccc1Br 1458a_100000188424_100000210623 [0,2,0,0,0,0|1,0,1]=4 3841 B12R1.308 C=CCC(=O)c1ccccc1C 1458a_100000212026_100000210623 [0,2,0,0,0,0|1,0,1]=4 3842 B12R1.308 C=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210623 [0,2,0,0,0,0|1,0,1]=4 3843 B12R1.308 C=CCC(=O)c1ccccc1F 1458a_100000188656_100000210623 [0,2,0,0,0,0|1,0,1]=4 3844 B12R1.308 C=CCC(=O)c1ccccc1I 1458a_100000187884_100000210623 [0,2,0,0,0,0|1,0,1]=4 3845 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [0,2,0,0,0,0|1,0,1]=4 3846 B12R1.308 C=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210623 [0,2,0,0,0,0|1,0,1]=4 3847 B12R1.308 CC(NCF)c1ccccc1Cl 34a_100000174978_100015361967 [0,2,0,0,0,0|1,0,1]=4 3848 B12R1.308 CC(NCF)c1ccccc1F 34a_100000181408_100015361967 [0,2,0,0,0,0|1,0,1]=4 3849 B12R1.308 CCCC(=O)c1ccccc1Br 1458a_100000188424_100000210303 [0,2,0,0,0,0|1,0,0]=3 3850 B12R1.308 CCCC(=O)c1ccccc1C 1458a_100000212026_100000210303 [0,2,0,0,0,0|1,0,0]=3 3851 B12R1.308 CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210303 [0,2,0,0,0,0|1,0,0]=3 3852 B12R1.308 CCCC(=O)c1ccccc1F 1458a_100000188656_100000210303 [0,2,0,0,0,0|1,0,0]=3 3853 B12R1.308 CCCC(=O)c1ccccc1I 1458a_100000187884_100000210303 [0,2,0,0,0,0|1,0,0]=3 3854 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [0,2,0,0,0,0|1,0,0]=3 3855 B12R1.308 CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210303 [0,2,0,0,0,0|1,0,0]=3 3856 B12R1.308 CCNC(=O)c1ccccc1Br 11a_100015525214_100000188424 [0,2,0,0,0,0|0,0,0]=2 3857 B12R1.308 CCNC(=O)c1ccccc1Br 240690a_100015525214_100000188424 [0,2,0,0,0,0|0,0,0]=2 3858 B12R1.308 CCNC(=O)c1ccccc1Br 527a_100015525214_100000188424 [0,2,0,0,0,0|0,0,0]=2 3859 B12R1.308 CCNC(=O)c1ccccc1C 11a_100015525214_100000212026 [0,2,0,0,0,0|0,0,0]=2 3860 B12R1.308 CCNC(=O)c1ccccc1C 240690a_100015525214_100000212026 [0,2,0,0,0,0|0,0,0]=2 3861 B12R1.308 CCNC(=O)c1ccccc1C 527a_100015525214_100000212026 [0,2,0,0,0,0|0,0,0]=2 3862 B12R1.308 CCNC(=O)c1ccccc1Cl 11a_100015525214_100000185844 [0,2,0,0,0,0|0,0,0]=2 3863 B12R1.308 CCNC(=O)c1ccccc1Cl 240690a_100015525214_100000185844 [0,2,0,0,0,0|0,0,0]=2 3864 B12R1.308 CCNC(=O)c1ccccc1Cl 527a_100015525214_100000185844 [0,2,0,0,0,0|0,0,0]=2 3865 B12R1.308 CCNC(=O)c1ccccc1F 11a_100015525214_100000188656 [0,2,0,0,0,0|0,0,0]=2 3866 B12R1.308 CCNC(=O)c1ccccc1F 240690a_100015525214_100000188656 [0,2,0,0,0,0|0,0,0]=2 3867 B12R1.308 CCNC(=O)c1ccccc1F 527a_100015525214_100000188656 [0,2,0,0,0,0|0,0,0]=2 3868 B12R1.308 CCNC(=O)c1ccccc1I 11a_100015525214_100000187884 [0,2,0,0,0,0|0,0,0]=2 3869 B12R1.308 CCNC(=O)c1ccccc1I 240690a_100015525214_100000187884 [0,2,0,0,0,0|0,0,0]=2 3870 B12R1.308 CCNC(=O)c1ccccc1I 527a_100015525214_100000187884 [0,2,0,0,0,0|0,0,0]=2 3871 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [0,2,0,0,0,0|0,0,0]=2 3872 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [0,2,0,0,0,0|0,0,0]=2 3873 B12R1.308 CCNC(=O)c1ccccc1[O-] 240690a_100015525214_100009911694 [0,2,0,0,0,0|0,0,0]=2 3874 B12R1.308 CCNC(=O)c1ccccc1[O-] 527a_100015525214_100009911694 [0,2,0,0,0,0|0,0,0]=2 3875 B12R1.308 CCNC(=O)c1cccnc1O 271570a_203496583355_100000160120 [0,2,0,0,0,0|1,0,0]=3 3876 B12R1.308 CCNC(C)c1ccccc1Br 2230a_100000181357_100000210202 [0,2,0,0,0,0|1,0,1]=4 3877 B12R1.308 CCNC(C)c1ccccc1Br 269862a_100015525214_100000187085 [0,2,0,0,0,0|1,0,1]=4 3878 B12R1.308 CCNC(C)c1ccccc1C 2230a_100000181355_100000210202 [0,2,0,0,0,0|1,0,1]=4 3879 B12R1.308 CCNC(C)c1ccccc1C 269862a_100015525214_100000211656 [0,2,0,0,0,0|1,0,1]=4 3880 B12R1.308 CCNC(C)c1ccccc1C 34a_100000181355_100000210202 [0,2,0,0,0,0|1,0,1]=4 3881 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100000174978_100000210202 [0,2,0,0,0,0|1,0,1]=4 3882 B12R1.308 CCNC(C)c1ccccc1Cl 2230a_100015525214_100000181259 [0,2,0,0,0,0|1,0,1]=4 3883 B12R1.308 CCNC(C)c1ccccc1Cl 269862a_100015525214_100000210134 [0,2,0,0,0,0|1,0,1]=4 3884 B12R1.308 CCNC(C)c1ccccc1Cl 34a_100000174978_100000210202 [0,2,0,0,0,0|1,0,1]=4 3885 B12R1.308 CCNC(C)c1ccccc1F 2230a_100000181408_100000210202 [0,2,0,0,0,0|1,0,1]=4 3886 B12R1.308 CCNC(C)c1ccccc1F 2230a_100015525214_200000741388 [0,2,0,0,0,0|1,0,1]=4 3887 B12R1.308 CCNC(C)c1ccccc1F 269862a_100015525214_100000210632 [0,2,0,0,0,0|1,0,1]=4 3888 B12R1.308 CCNC(C)c1ccccc1F 34a_100000181408_100000210202 [0,2,0,0,0,0|1,0,1]=4 3889 B12R1.308 CCNC(C)c1ccccc1I 269862a_100015525214_100000751169 [0,2,0,0,0,0|1,0,1]=4 3890 B12R1.308 CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210202 [0,2,0,0,0,0|1,0,1]=4 3891 B12R1.308 CCOC(=O)c1ccccc1O 271570a_203496583355_100000169879 [0,2,0,0,0,0|1,0,0]=3 3892 B12R1.308 CCOC(=O)c1cccnc1O 271570a_203496583355_100000170124 [0,2,0,0,0,0|2,0,0]=4 3893 B12R1.308 CCOC(=O)c1ccncc1O 271570a_203496583355_100010238393 [0,2,0,0,0,0|2,0,0]=4 3894 B12R1.308 CCOC(=O)c1cnccc1O 271570a_203496583355_100016987518 [0,2,0,0,0,0|2,0,0]=4 3895 B12R1.308 CCOC(=O)c1ncccc1O 271570a_203496583355_100012351660 [0,2,0,0,0,0|2,0,0]=4 3896 B12R1.308 CNCC(=O)c1ccccc1Br 34a_100102657272_100000199116 [0,2,0,0,0,0|0,0,0]=2 3897 B12R1.308 CNCC(=O)c1ccccc1C 2230a_106832991635_100000741374 [0,2,0,0,0,0|0,0,0]=2 3898 B12R1.308 CNCC(=O)c1ccccc1C 34a_100102657272_100000741374 [0,2,0,0,0,0|0,0,0]=2 3899 B12R1.308 CNCC(=O)c1ccccc1C 7a_106832991635_100000741374 [0,2,0,0,0,0|0,0,0]=2 3900 B12R1.308 CNCC(=O)c1ccccc1Cl 34a_100102657272_100000211432 [0,2,0,0,0,0|0,0,0]=2 3901 B12R1.308 CNCC(=O)c1ccccc1F 34a_100102657272_100000204681 [0,2,0,0,0,0|0,0,0]=2 3902 B12R1.308 CNCC(=O)c1ccccc1F 7a_106832991635_100000204681 [0,2,0,0,0,0|0,0,0]=2 3903 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [0,2,0,0,0,0|0,0,0]=2 3904 B12R1.308 CNCC(O)c1ccccc1Br 2230a_100011236429_200000210301 [0,2,0,0,0,0|0,0,2]=4 3905 B12R1.308 CNCC(O)c1ccccc1Cl 2230a_200000759403_200000210301 [0,2,0,0,0,0|0,0,2]=4 3906 B12R1.308 CNCC(O)c1ccccc1Cl 34a_200000759403_200000210301 [0,2,0,0,0,0|0,0,2]=4 3907 B12R1.308 CNNC(=O)c1ccccc1Br 22a_100016993582_100000188424 [0,2,0,0,0,0|0,0,0]=2 3908 B12R1.308 CNNC(=O)c1ccccc1C 22a_100016993582_100000212026 [0,2,0,0,0,0|0,0,0]=2 3909 B12R1.308 CNNC(=O)c1ccccc1Cl 22a_100016993582_100000185844 [0,2,0,0,0,0|0,0,0]=2 3910 B12R1.308 CNNC(=O)c1ccccc1F 22a_100016993582_100000188656 [0,2,0,0,0,0|0,0,0]=2 3911 B12R1.308 CNNC(=O)c1ccccc1I 22a_100016993582_100000187884 [0,2,0,0,0,0|0,0,0]=2 3912 B12R1.308 CNNC(=O)c1ccccc1O 22a_100016993582_100015234032 [0,2,0,0,0,0|0,0,0]=2 3913 B12R1.308 CNNC(=O)c1ccccc1[O-] 22a_100016993582_100009911694 [0,2,0,0,0,0|0,0,0]=2 3914 B12R1.308 COCC(=O)c1ccccc1Br 34a_100138415774_100000199116 [0,2,0,0,0,0|1,0,0]=3 3915 B12R1.308 COCC(=O)c1ccccc1C 34a_100138415774_100000741374 [0,2,0,0,0,0|1,0,0]=3 3916 B12R1.308 COCC(=O)c1ccccc1Cl 34a_100138415774_100000211432 [0,2,0,0,0,0|1,0,0]=3 3917 B12R1.308 COCC(=O)c1ccccc1F 34a_100138415774_100000204681 [0,2,0,0,0,0|1,0,0]=3 3918 B12R1.308 CSCC(=O)c1ccccc1Br 62a_100000199116_200000210301 [0,2,0,0,0,0|1,0,0]=3 3919 B12R1.308 CSCC(=O)c1ccccc1C 62a_100000741374_200000210301 [0,2,0,0,0,0|1,0,0]=3 3920 B12R1.308 CSCC(=O)c1ccccc1C 62a_200000210301_100000741374 [0,2,0,0,0,0|1,0,0]=3 3921 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_100000211432_200000210301 [0,2,0,0,0,0|1,0,0]=3 3922 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_200000210301_100000211432 [0,2,0,0,0,0|1,0,0]=3 3923 B12R1.308 CSCC(=O)c1ccccc1F 62a_100000204681_200000210301 [0,2,0,0,0,0|1,0,0]=3 3924 B12R1.308 CSCC(=O)c1ccccc1F 62a_200000210301_100000204681 [0,2,0,0,0,0|1,0,0]=3 3925 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [0,2,0,0,0,0|1,0,0]=3 3926 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [0,2,0,0,0,0|1,0,0]=3 3927 B12R1.308 Cc1ccccc1C(=O)CC#N 1458a_100000212026_100011214920 [0,2,0,0,0,0|1,0,1]=4 3928 B12R1.308 Cc1ccccc1C(=O)CCF 1458a_100000212026_100011217306 [0,2,0,0,0,0|1,0,0]=3 3929 B12R1.308 Cc1ccccc1C(=O)CCO 1458a_100000212026_100000211926 [0,2,0,0,0,0|1,0,0]=3 3930 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_100000741374_200025704644 [0,2,0,0,0,0|1,0,0]=3 3931 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_200025704644_100000741374 [0,2,0,0,0,0|1,0,0]=3 3932 B12R1.308 Cc1ccccc1C(C)NCF 34a_100000181355_100015361967 [0,2,0,0,0,0|1,0,1]=4 3933 B12R1.308 N#CCC(=O)c1ccccc1Br 1458a_100000188424_100011214920 [0,2,0,0,0,0|1,0,1]=4 3934 B12R1.308 N#CCC(=O)c1ccccc1Cl 1458a_100000185844_100011214920 [0,2,0,0,0,0|1,0,1]=4 3935 B12R1.308 N#CCC(=O)c1ccccc1F 1458a_100000188656_100011214920 [0,2,0,0,0,0|1,0,1]=4 3936 B12R1.308 N#CCC(=O)c1ccccc1I 1458a_100000187884_100011214920 [0,2,0,0,0,0|1,0,1]=4 3937 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [0,2,0,0,0,0|1,0,1]=4 3938 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [0,2,0,0,0,0|1,0,1]=4 3939 B12R1.308 N#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100011214920 [0,2,0,0,0,0|1,0,1]=4 3940 B12R1.308 O=C(CCF)c1ccccc1Br 1458a_100000188424_100011217306 [0,2,0,0,0,0|1,0,0]=3 3941 B12R1.308 O=C(CCF)c1ccccc1Cl 1458a_100000185844_100011217306 [0,2,0,0,0,0|1,0,0]=3 3942 B12R1.308 O=C(CCF)c1ccccc1F 1458a_100000188656_100011217306 [0,2,0,0,0,0|1,0,0]=3 3943 B12R1.308 O=C(CCF)c1ccccc1I 1458a_100000187884_100011217306 [0,2,0,0,0,0|1,0,0]=3 3944 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [0,2,0,0,0,0|1,0,0]=3 3945 B12R1.308 O=C(CCF)c1ccccc1[O-] 1458a_100009911694_100011217306 [0,2,0,0,0,0|1,0,0]=3 3946 B12R1.308 O=C(CCO)c1ccccc1Br 1458a_100000188424_100000211926 [0,2,0,0,0,0|1,0,0]=3 3947 B12R1.308 O=C(CCO)c1ccccc1Cl 1458a_100000185844_100000211926 [0,2,0,0,0,0|1,0,0]=3 3948 B12R1.308 O=C(CCO)c1ccccc1F 1458a_100000188656_100000211926 [0,2,0,0,0,0|1,0,0]=3 3949 B12R1.308 O=C(CCO)c1ccccc1I 1458a_100000187884_100000211926 [0,2,0,0,0,0|1,0,0]=3 3950 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [0,2,0,0,0,0|1,0,0]=3 3951 B12R1.308 O=C(CCO)c1ccccc1[O-] 1458a_100009911694_100000211926 [0,2,0,0,0,0|1,0,0]=3 3952 B12R1.308 [13CH3]NCC(O)c1ccccc1Br 2230a_100011236429_200025704644 [0,2,0,0,0,0|0,0,2]=4 3953 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 2230a_200000759403_200025704644 [0,2,0,0,0,0|0,0,2]=4 3954 B12R1.308 [13CH3]NCC(O)c1ccccc1Cl 34a_200000759403_200025704644 [0,2,0,0,0,0|0,0,2]=4 3955 B12R1.308 [13CH3]SCC(=O)c1ccccc1Br 62a_100000199116_200025704644 [0,2,0,0,0,0|1,0,0]=3 3956 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_100000211432_200025704644 [0,2,0,0,0,0|1,0,0]=3 3957 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_200025704644_100000211432 [0,2,0,0,0,0|1,0,0]=3 3958 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_100000204681_200025704644 [0,2,0,0,0,0|1,0,0]=3 3959 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_200025704644_100000204681 [0,2,0,0,0,0|1,0,0]=3 3960 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [0,2,0,0,0,0|1,0,0]=3 3961 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [0,2,0,0,0,0|1,0,0]=3 3962 B12R1.5 C#Cc1ccc(cc1)C(=O)CC 1458a_100011217615_100000210202 [0,2,0,0,0,0|1,0,0]=3 3963 B12R1.5 C#Cc1ccc(cc1)C(=O)CF 1458a_100011217615_100015361967 [0,2,0,0,0,0|2,0,0]=4 3964 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 11a_106832991635_100011217615 [0,2,0,0,0,0|0,0,0]=2 3965 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100011217615 [0,2,0,0,0,0|0,0,0]=2 3966 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100011217615 [0,2,0,0,0,0|0,0,0]=2 3967 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 527a_100102657272_100011217615 [0,2,0,0,0,0|0,0,0]=2 3968 B12R1.5 C=Cc1ccc(cc1)C(=O)C#N 271570a_100011290941_100009994572 [0,2,0,0,0,0|2,0,0]=4 3969 B12R1.5 C=Cc1ccc(cc1)C(=O)C=O 271570a_100011290941_100000725942 [0,2,0,0,0,0|2,0,0]=4 3970 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 1458a_100000687532_100000210202 [0,2,0,0,0,0|1,0,0]=3 3971 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 271570a_100011290941_100000211647 [0,2,0,0,0,0|1,0,0]=3 3972 B12R1.5 C=Cc1ccc(cc1)C(=O)CF 1458a_100000687532_100015361967 [0,2,0,0,0,0|2,0,0]=4 3973 B12R1.5 C=Cc1ccc(cc1)C(=O)CN 271570a_100011290941_100000017248 [0,2,0,0,0,0|2,0,0]=4 3974 B12R1.5 C=Cc1ccc(cc1)C(=O)CO 271570a_100011290941_100011219529 [0,2,0,0,0,0|2,0,0]=4 3975 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 11a_106832991635_100000687532 [0,2,0,0,0,0|0,0,0]=2 3976 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100000687532 [0,2,0,0,0,0|0,0,0]=2 3977 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100000687532 [0,2,0,0,0,0|0,0,0]=2 3978 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 271570a_100011290941_100000155074 [0,2,0,0,0,0|0,0,0]=2 3979 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 527a_100102657272_100000687532 [0,2,0,0,0,0|0,0,0]=2 3980 B12R1.5 C=Cc1ccc(cc1)C(=O)NN 271570a_100011290941_100000183614 [0,2,0,0,0,0|1,0,0]=3 3981 B12R1.5 C=Cc1ccc(cc1)C(=O)OC 271570a_100011290941_100000150774 [0,2,0,0,0,0|1,0,0]=3 3982 B12R1.5 C=Cc1ccc(cc1)C(C)NC 2230a_200012023546_200000210301 [0,2,0,0,0,0|1,0,1]=4 3983 B12R1.5 C=Cc1ccc(cc1)C(C)NC 271570a_100011290941_100000231103 [0,2,0,0,0,0|1,0,1]=4 3984 B12R1.5 C=Cc1ccc(cc1)C(C)NC 34a_200012023546_200000210301 [0,2,0,0,0,0|1,0,1]=4 3985 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 2230a_200012023546_200025704644 [0,2,0,0,0,0|1,0,1]=4 3986 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 34a_200012023546_200025704644 [0,2,0,0,0,0|1,0,1]=4 3987 B12R1.5 C=Cc1ccc(cn1)C(=O)NC 271570a_100011290941_100000159860 [0,2,0,0,0,0|1,0,0]=3 3988 B12R1.5 C=Cc1ccc(cn1)C(=O)NN 271570a_100011290941_100000189807 [0,2,0,0,0,0|2,0,0]=4 3989 B12R1.5 C=Cc1ccc(cn1)C(=O)OC 271570a_100011290941_100000733799 [0,2,0,0,0,0|2,0,0]=4 3990 B12R1.5 C=Cc1ccc(nc1)C(=O)CC 271570a_100011290941_100012351654 [0,2,0,0,0,0|2,0,0]=4 3991 B12R1.5 C=Cc1ccc(nc1)C(=O)NC 271570a_100011290941_100011781262 [0,2,0,0,0,0|1,0,0]=3 3992 B12R1.5 C=Cc1ccc(nc1)C(=O)NN 271570a_100011290941_100011781063 [0,2,0,0,0,0|2,0,0]=4 3993 B12R1.5 C=Cc1ccc(nc1)C(=O)OC 271570a_100011290941_100000690920 [0,2,0,0,0,0|2,0,0]=4 3994 B12R1.5 C=Cc1cnc(nc1)C(=O)NC 271570a_100011290941_200010127873 [0,2,0,0,0,0|2,0,0]=4 3995 B12R1.5 CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210202 [0,2,0,0,0,0|1,0,0]=3 3996 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [0,2,0,0,0,0|1,0,0]=3 3997 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,2,0,0,0,0|1,0,0]=3 3998 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,2,0,0,0,0|1,0,0]=3 3999 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,2,0,0,0,0|1,0,0]=3 4000 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,2,0,0,0,0|1,0,0]=3 4001 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,2,0,0,0,0|1,0,0]=3 4002 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,2,0,0,0,0|1,0,0]=3 4003 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [0,2,0,0,0,0|1,0,0]=3 4004 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [0,2,0,0,0,0|1,0,0]=3 4005 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [0,2,0,0,0,0|1,0,0]=3 4006 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [0,2,0,0,0,0|1,0,0]=3 4007 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [0,2,0,0,0,0|1,0,0]=3 4008 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_100012351654_200000210301 [0,2,0,0,0,0|2,0,0]=4 4009 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_200000210301_100012351654 [0,2,0,0,0,0|2,0,0]=4 4010 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_100012351654_200025704644 [0,2,0,0,0,0|2,0,0]=4 4011 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100012351654 [0,2,0,0,0,0|2,0,0]=4 4012 B12R1.5 CCc1ccc(cc1)C(=O)CF 1458a_100000211226_100015361967 [0,2,0,0,0,0|2,0,0]=4 4013 B12R1.5 CCc1ccc(cc1)C(=O)NC 11a_106832991635_100000211226 [0,2,0,0,0,0|0,0,0]=2 4014 B12R1.5 CCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4015 B12R1.5 CCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4016 B12R1.5 CCc1ccc(cc1)C(=O)NC 527a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4017 B12R1.5 CCc1ccc(cc1)C(C)NC 2230a_100015186439_200000210301 [0,2,0,0,0,0|1,0,1]=4 4018 B12R1.5 CCc1ccc(cc1)C(C)NC 269862a_106832991636_100000211630 [0,2,0,0,0,0|1,0,1]=4 4019 B12R1.5 CCc1ccc(cc1)C(C)NC 34a_100015186439_200000210301 [0,2,0,0,0,0|1,0,1]=4 4020 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 2230a_100015186439_200025704644 [0,2,0,0,0,0|1,0,1]=4 4021 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 34a_100015186439_200025704644 [0,2,0,0,0,0|1,0,1]=4 4022 B12R1.5 CNC(=O)c1ccc(cc1)C#N 11a_106832991635_100000210717 [0,2,0,0,0,0|0,0,0]=2 4023 B12R1.5 CNC(=O)c1ccc(cc1)C#N 1626a_100102657272_100000210717 [0,2,0,0,0,0|0,0,0]=2 4024 B12R1.5 CNC(=O)c1ccc(cc1)C#N 240690a_100102657272_100000210717 [0,2,0,0,0,0|0,0,0]=2 4025 B12R1.5 CNC(=O)c1ccc(cc1)C#N 527a_100102657272_100000210717 [0,2,0,0,0,0|0,0,0]=2 4026 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [0,2,0,0,0,0|0,0,0]=2 4027 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [0,2,0,0,0,0|0,0,0]=2 4028 B12R1.5 CNC(=O)c1ccc(cc1)NC 2230a_100000184841_200000210301 [0,2,0,0,0,0|0,0,0]=2 4029 B12R1.5 CNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155074 [0,2,0,0,0,0|0,0,0]=2 4030 B12R1.5 CNC(=O)c1ccc(cc1)NC 34a_100000184841_200000210301 [0,2,0,0,0,0|0,0,0]=2 4031 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000184841_200025704644 [0,2,0,0,0,0|0,0,0]=2 4032 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 34a_100000184841_200025704644 [0,2,0,0,0,0|0,0,0]=2 4033 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [0,2,0,0,0,0|0,0,0]=2 4034 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4035 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4036 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [0,2,0,0,0,0|0,0,0]=2 4037 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4038 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [0,2,0,0,0,0|0,0,0]=2 4039 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [0,2,0,0,0,0|0,0,0]=2 4040 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [0,2,0,0,0,0|0,0,0]=2 4041 B12R1.5 CNC(=O)c1ccc(cc1)SC 11a_106832991635_100000189692 [0,2,0,0,0,0|0,0,0]=2 4042 B12R1.5 CNC(=O)c1ccc(cc1)SC 1626a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4043 B12R1.5 CNC(=O)c1ccc(cc1)SC 240690a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4044 B12R1.5 CNC(=O)c1ccc(cc1)SC 527a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4045 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_100000155074_200000210301 [0,2,0,0,0,0|0,0,0]=2 4046 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155074 [0,2,0,0,0,0|0,0,0]=2 4047 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155074_200025704644 [0,2,0,0,0,0|0,0,0]=2 4048 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155074 [0,2,0,0,0,0|0,0,0]=2 4049 B12R1.5 CNC(=O)c1ccc(cn1)NC 27a_100102657272_100011781262 [0,2,0,0,0,0|1,0,0]=3 4050 B12R1.5 CNC(=O)c1ccc(cn1)OC 34a_100009861314_200000210301 [0,2,0,0,0,0|1,0,0]=3 4051 B12R1.5 CNC(=O)c1ccc(cn1)OC 7a_100009861314_200000210301 [0,2,0,0,0,0|1,0,0]=3 4052 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 34a_100009861314_200025704644 [0,2,0,0,0,0|1,0,0]=3 4053 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 7a_100009861314_200025704644 [0,2,0,0,0,0|1,0,0]=3 4054 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_100011781262_200000210301 [0,2,0,0,0,0|1,0,0]=3 4055 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_200000210301_100011781262 [0,2,0,0,0,0|1,0,0]=3 4056 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_100011781262_200025704644 [0,2,0,0,0,0|1,0,0]=3 4057 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100011781262 [0,2,0,0,0,0|1,0,0]=3 4058 B12R1.5 CNC(=O)c1ccc(nc1)NC 27a_100102657272_100000159860 [0,2,0,0,0,0|1,0,0]=3 4059 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_100000159860_200000210301 [0,2,0,0,0,0|1,0,0]=3 4060 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_200000210301_100000159860 [0,2,0,0,0,0|1,0,0]=3 4061 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_100000159860_200025704644 [0,2,0,0,0,0|1,0,0]=3 4062 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000159860 [0,2,0,0,0,0|1,0,0]=3 4063 B12R1.5 CNC(=O)c1ncc(cn1)NC 27a_100102657272_200010127873 [0,2,0,0,0,0|2,0,0]=4 4064 B12R1.5 CNC(=O)c1ncc(cn1)SC 62a_200000210301_200010127873 [0,2,0,0,0,0|2,0,0]=4 4065 B12R1.5 CNC(=O)c1ncc(cn1)SC 62a_200010127873_200000210301 [0,2,0,0,0,0|2,0,0]=4 4066 B12R1.5 CNC(=O)c1ncc(cn1)S[13CH3] 62a_200010127873_200025704644 [0,2,0,0,0,0|2,0,0]=4 4067 B12R1.5 CNC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_200010127873 [0,2,0,0,0,0|2,0,0]=4 4068 B12R1.5 CNC(C)c1ccc(cc1)C#N 269862a_106832991636_100000182420 [0,2,0,0,0,0|1,0,1]=4 4069 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,2,0,0,0,0|1,0,1]=4 4070 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,2,0,0,0,0|1,0,1]=4 4071 B12R1.5 CNC(C)c1ccc(cc1)SC 2230a_100000738722_200000210301 [0,2,0,0,0,0|1,0,1]=4 4072 B12R1.5 CNC(C)c1ccc(cc1)SC 269862a_106832991636_100000185071 [0,2,0,0,0,0|1,0,1]=4 4073 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 4074 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_200000210301_100000231103 [0,2,0,0,0,0|1,0,1]=4 4075 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 4076 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000231103 [0,2,0,0,0,0|1,0,1]=4 4077 B12R1.5 CN[C@H](C)c1ccc(cc1)C#N 2230a_100016991473_200000210301 [0,2,0,0,0,0|1,0,1]=4 4078 B12R1.5 CN[C@H](C)c1ccc(cc1)C#N 34a_100016991473_200000210301 [0,2,0,0,0,0|1,0,1]=4 4079 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,2,0,0,0,0|1,0,1]=4 4080 B12R1.5 CNc1ccc(cc1)C(=O)NN 27a_100102657272_100000183614 [0,2,0,0,0,0|1,0,0]=3 4081 B12R1.5 CNc1ccc(cc1)C(C)NC 269862a_106832991636_100011806243 [0,2,0,0,0,0|1,0,1]=4 4082 B12R1.5 CNc1ccc(cn1)C(=O)NN 27a_100102657272_100000189807 [0,2,0,0,0,0|2,0,0]=4 4083 B12R1.5 CNc1ccc(cn1)C(=O)OC 27a_100102657272_100000733799 [0,2,0,0,0,0|2,0,0]=4 4084 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [0,2,0,0,0,0|1,0,0]=3 4085 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [0,2,0,0,0,0|1,0,0]=3 4086 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [0,2,0,0,0,0|1,0,0]=3 4089 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [0,2,0,0,0,0|1,0,0]=3 4090 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [0,2,0,0,0,0|1,0,0]=3 4091 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [0,2,0,0,0,0|1,0,0]=3 4092 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [0,2,0,0,0,0|2,0,0]=4 4093 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [0,2,0,0,0,0|2,0,0]=4 4094 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [0,2,0,0,0,0|2,0,0]=4 4095 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [0,2,0,0,0,0|2,0,0]=4 4096 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_100102712061_200000210301 [0,2,0,0,0,0|2,0,0]=4 4097 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_200000210301_100102712061 [0,2,0,0,0,0|2,0,0]=4 4098 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_100102712061_200025704644 [0,2,0,0,0,0|2,0,0]=4 4099 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100102712061 [0,2,0,0,0,0|2,0,0]=4 4100 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_100000733799_200000210301 [0,2,0,0,0,0|2,0,0]=4 4101 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_200000210301_100000733799 [0,2,0,0,0,0|2,0,0]=4 4102 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_100000733799_200025704644 [0,2,0,0,0,0|2,0,0]=4 4103 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000733799 [0,2,0,0,0,0|2,0,0]=4 4104 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,2,0,0,0,0|2,0,0]=4 4105 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,2,0,0,0,0|2,0,0]=4 4106 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,2,0,0,0,0|2,0,0]=4 4107 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 4108 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 4109 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [0,2,0,0,0,0|1,0,0]=3 4110 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,2,0,0,0,0|1,0,1]=4 4111 B12R1.5 CSc1ccc(cc1)C(=O)C#N 62a_200000210301_100009994572 [0,2,0,0,0,0|2,0,0]=4 4112 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000210301 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_200000210301_100000725942 [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.5 CSc1ccc(cc1)C(=O)CF 1458a_100000189692_100015361967 [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_100000017248_200000210301 [0,2,0,0,0,0|2,0,0]=4 4116 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_200000210301_100000017248 [0,2,0,0,0,0|2,0,0]=4 4117 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_100011219529_200000210301 [0,2,0,0,0,0|2,0,0]=4 4118 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_200000210301_100011219529 [0,2,0,0,0,0|2,0,0]=4 4119 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_100000183614_200000210301 [0,2,0,0,0,0|1,0,0]=3 4120 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_200000210301_100000183614 [0,2,0,0,0,0|1,0,0]=3 4121 B12R1.5 CSc1ccc(cc1)C(C)N[13CH3] 2230a_100000738722_200025704644 [0,2,0,0,0,0|1,0,1]=4 4122 B12R1.5 CSc1ccc(cn1)C(=O)NN 62a_100000189807_200000210301 [0,2,0,0,0,0|2,0,0]=4 4123 B12R1.5 CSc1ccc(cn1)C(=O)NN 62a_200000210301_100000189807 [0,2,0,0,0,0|2,0,0]=4 4124 B12R1.5 CSc1ccc(nc1)C(=O)NN 62a_100011781063_200000210301 [0,2,0,0,0,0|2,0,0]=4 4125 B12R1.5 CSc1ccc(nc1)C(=O)NN 62a_200000210301_100011781063 [0,2,0,0,0,0|2,0,0]=4 4126 B12R1.5 C[C@@H](N[13CH3])c1ccc(cc1)C#N 2230a_100016991473_200025704644 [0,2,0,0,0,0|1,0,1]=4 4127 B12R1.5 C[C@@H](N[13CH3])c1ccc(cc1)C#N 34a_100016991473_200025704644 [0,2,0,0,0,0|1,0,1]=4 4128 B12R1.5 N#Cc1ccc(cc1)C(=O)CF 1458a_100000210717_100015361967 [0,2,0,0,0,0|2,0,0]=4 4129 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,2,0,0,0,0|2,0,0]=4 4130 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,2,0,0,0,0|2,0,0]=4 4131 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,2,0,0,0,0|2,0,0]=4 4132 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 4133 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 4134 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [0,2,0,0,0,0|1,0,0]=3 4135 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C#N 62a_200025704644_100009994572 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200025704644 [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_200025704644_100000725942 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_100000017248_200025704644 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_200025704644_100000017248 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_100011219529_200025704644 [0,2,0,0,0,0|2,0,0]=4 4141 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_200025704644_100011219529 [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_100000183614_200025704644 [0,2,0,0,0,0|1,0,0]=3 4143 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_200025704644_100000183614 [0,2,0,0,0,0|1,0,0]=3 4144 B12R1.5 [13CH3]Sc1ccc(cn1)C(=O)NN 62a_100000189807_200025704644 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.5 [13CH3]Sc1ccc(cn1)C(=O)NN 62a_200025704644_100000189807 [0,2,0,0,0,0|2,0,0]=4 4146 B12R1.5 [13CH3]Sc1ccc(nc1)C(=O)NN 62a_100011781063_200025704644 [0,2,0,0,0,0|2,0,0]=4 4147 B12R1.5 [13CH3]Sc1ccc(nc1)C(=O)NN 62a_200025704644_100011781063 [0,2,0,0,0,0|2,0,0]=4 4148 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,2,0,0,0,0|2,0,0]=4 4149 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,2,0,0,0,0|2,0,0]=4 4150 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,2,0,0,0,0|2,0,0]=4 4151 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,2,0,0,0,0|2,0,0]=4 4152 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,2,0,0,0,0|2,0,0]=4 4153 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,2,0,0,0,0|2,0,0]=4 4154 B12R1.20 CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000210206 [0,2,0,0,0,0|1,0,0]=3 4155 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210206 [0,2,0,0,0,0|1,0,0]=3 4156 B12R1.20 CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000210206 [0,2,0,0,0,0|1,0,0]=3 4157 B12R1.20 CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000210206 [0,2,0,0,0,0|1,0,0]=3 4158 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,2,0,0,0,0|1,0,0]=3 4159 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,2,0,0,0,0|1,0,0]=3 4160 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,2,0,0,0,0|2,0,0]=4 4161 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 4162 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100102631434_100000755118 [0,2,0,0,0,0|1,0,1]=4 4163 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 4164 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100102631434_100000755118 [0,2,0,0,0,0|1,0,1]=4 4165 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 2230a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 4166 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 269982a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 4167 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100000231102_200000210301 [0,2,0,0,0,0|1,0,1]=4 4168 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100102631434_100000684792 [0,2,0,0,0,0|1,0,1]=4 4169 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100000231102_200000210301 [0,2,0,0,0,0|1,0,1]=4 4170 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100102631434_100000684792 [0,2,0,0,0,0|1,0,1]=4 4171 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 2230a_100000231102_200025704644 [0,2,0,0,0,0|1,0,1]=4 4172 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 269982a_100000231102_200025704644 [0,2,0,0,0,0|1,0,1]=4 4173 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 4174 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100102631434_100000743420 [0,2,0,0,0,0|1,0,1]=4 4175 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100102631434_100000743420 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.20 CC(c1ccc(cc1)F)N(C)C 34a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 4178 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 2230a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 269982a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 4180 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 34a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 4181 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 11a_100102631434_100000185839 [0,2,0,0,0,0|0,0,0]=2 4182 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 1626a_100102631434_100000185839 [0,2,0,0,0,0|0,0,0]=2 4183 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 240690a_100102631434_100000185839 [0,2,0,0,0,0|0,0,0]=2 4184 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 527a_100102631434_100000185839 [0,2,0,0,0,0|0,0,0]=2 4185 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 11a_100102631434_100000210187 [0,2,0,0,0,0|0,0,0]=2 4186 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 1626a_100102631434_100000210187 [0,2,0,0,0,0|0,0,0]=2 4187 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 240690a_100102631434_100000210187 [0,2,0,0,0,0|0,0,0]=2 4188 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 527a_100102631434_100000210187 [0,2,0,0,0,0|0,0,0]=2 4189 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 11a_100102631434_100000187176 [0,2,0,0,0,0|0,0,0]=2 4190 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 1626a_100102631434_100000187176 [0,2,0,0,0,0|0,0,0]=2 4191 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 240690a_100102631434_100000187176 [0,2,0,0,0,0|0,0,0]=2 4192 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 527a_100102631434_100000187176 [0,2,0,0,0,0|0,0,0]=2 4193 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 11a_100102631434_100000187904 [0,2,0,0,0,0|0,0,0]=2 4194 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 1626a_100102631434_100000187904 [0,2,0,0,0,0|0,0,0]=2 4195 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 240690a_100102631434_100000187904 [0,2,0,0,0,0|0,0,0]=2 4196 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 527a_100102631434_100000187904 [0,2,0,0,0,0|0,0,0]=2 4197 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,2,0,0,0,0|0,0,0]=2 4198 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,2,0,0,0,0|0,0,0]=2 4199 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,2,0,0,0,0|0,0,0]=2 4200 B12R1.20 CN(C)C(=O)c1ccc(cn1)O 271570a_203496583355_200011781295 [0,2,0,0,0,0|1,0,0]=3 4201 B12R1.20 CN(C)C(=O)c1ccc(nc1)O 271570a_203496583355_100000159593 [0,2,0,0,0,0|1,0,0]=3 4202 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,2,0,0,0,0|1,0,0]=3 4203 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000188618 [0,2,0,0,0,0|0,0,0]=2 4204 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000188618 [0,2,0,0,0,0|0,0,0]=2 4205 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000188618 [0,2,0,0,0,0|0,0,0]=2 4206 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000188618 [0,2,0,0,0,0|0,0,0]=2 4207 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [0,2,0,0,0,0|1,0,1]=4 4208 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [0,2,0,0,0,0|1,0,1]=4 4209 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,2,0,0,0,0|2,0,0]=4 4210 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000743459_200025704644 [0,2,0,0,0,0|1,0,1]=4 4211 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000743459_200025704644 [0,2,0,0,0,0|1,0,1]=4 4212 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 2230a_100000756309_200025704644 [0,2,0,0,0,0|1,0,1]=4 4213 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 34a_100000756309_200025704644 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210202 [0,2,0,0,0,0|1,0,0]=3 4215 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [0,2,0,0,0,0|1,0,0]=3 4216 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [0,2,0,0,0,0|1,0,0]=3 4217 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210202 [0,2,0,0,0,0|1,0,0]=3 4218 B12R1.367 CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210202 [0,2,0,0,0,0|1,0,0]=3 4219 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,2,0,0,0,0|1,0,0]=3 4220 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [0,2,0,0,0,0|1,0,0]=3 4221 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [0,2,0,0,0,0|1,0,0]=3 4222 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [0,2,0,0,0,0|1,0,0]=3 4223 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [0,2,0,0,0,0|1,0,0]=3 4224 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [0,2,0,0,0,0|1,0,0]=3 4225 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,2,0,0,0,0|1,0,0]=3 4226 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,2,0,0,0,0|1,0,0]=3 4227 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210202 [0,2,0,0,0,0|1,0,0]=3 4228 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [0,2,0,0,0,0|1,0,0]=3 4229 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [0,2,0,0,0,0|1,0,0]=3 4230 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210202 [0,2,0,0,0,0|1,0,0]=3 4231 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210202 [0,2,0,0,0,0|1,0,0]=3 4232 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,2,0,0,0,0|1,0,0]=3 4233 B12R1.367 CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210202 [0,2,0,0,0,0|1,0,0]=3 4234 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [0,2,0,0,0,0|1,0,0]=3 4235 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [0,2,0,0,0,0|1,0,0]=3 4236 B12R1.367 CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210202 [0,2,0,0,0,0|1,0,0]=3 4237 B12R1.367 CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210202 [0,2,0,0,0,0|1,0,0]=3 4238 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,2,0,0,0,0|1,0,0]=3 4239 B12R1.367 CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210202 [0,2,0,0,0,0|1,0,0]=3 4240 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [0,2,0,0,0,0|1,0,0]=3 4241 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [0,2,0,0,0,0|1,0,0]=3 4242 B12R1.367 CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210202 [0,2,0,0,0,0|1,0,0]=3 4243 B12R1.367 CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210202 [0,2,0,0,0,0|1,0,0]=3 4244 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,2,0,0,0,0|1,0,0]=3 4245 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,2,0,0,0,0|1,0,0]=3 4246 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,2,0,0,0,0|1,0,0]=3 4247 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,2,0,0,0,0|1,0,0]=3 4248 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,2,0,0,0,0|1,0,0]=3 4249 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,2,0,0,0,0|1,0,0]=3 4250 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,2,0,0,0,0|1,0,0]=3 4251 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,2,0,0,0,0|1,0,0]=3 4252 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 11a_106832991635_100012339404 [0,2,0,0,0,0|0,0,0]=2 4253 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 1626a_100102657272_100012339404 [0,2,0,0,0,0|0,0,0]=2 4254 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 240690a_100102657272_100012339404 [0,2,0,0,0,0|0,0,0]=2 4255 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 527a_100102657272_100012339404 [0,2,0,0,0,0|0,0,0]=2 4256 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 11a_106832991635_100000186397 [0,2,0,0,0,0|0,0,0]=2 4257 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 1626a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 4258 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 240690a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 4259 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 527a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 4260 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 11a_106832991635_100000691181 [0,2,0,0,0,0|0,0,0]=2 4261 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100102657272_100000691181 [0,2,0,0,0,0|0,0,0]=2 4262 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100102657272_100000691181 [0,2,0,0,0,0|0,0,0]=2 4263 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 527a_100102657272_100000691181 [0,2,0,0,0,0|0,0,0]=2 4264 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 11a_106832991635_100000760357 [0,2,0,0,0,0|0,0,0]=2 4265 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 1626a_100102657272_100000760357 [0,2,0,0,0,0|0,0,0]=2 4266 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 240690a_100102657272_100000760357 [0,2,0,0,0,0|0,0,0]=2 4267 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 527a_100102657272_100000760357 [0,2,0,0,0,0|0,0,0]=2 4268 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 11a_106832991635_100000739115 [0,2,0,0,0,0|0,0,0]=2 4269 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 1626a_100102657272_100000739115 [0,2,0,0,0,0|0,0,0]=2 4270 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 240690a_100102657272_100000739115 [0,2,0,0,0,0|0,0,0]=2 4271 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 527a_100102657272_100000739115 [0,2,0,0,0,0|0,0,0]=2 4272 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,2,0,0,0,0|0,0,0]=2 4273 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 11a_106832991635_100000692631 [0,2,0,0,0,0|0,0,0]=2 4274 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 1626a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 4275 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 240690a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 4276 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 527a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 4277 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [0,2,0,0,0,0|0,0,0]=2 4278 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 4279 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 4280 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 4281 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [0,2,0,0,0,0|0,0,0]=2 4282 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 4283 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 4284 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 4285 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 11a_106832991635_100000751819 [0,2,0,0,0,0|0,0,0]=2 4286 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 1626a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 4287 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 240690a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 4288 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 527a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 4289 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 11a_106832991635_100000751300 [0,2,0,0,0,0|0,0,0]=2 4290 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 1626a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 4291 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 240690a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 4292 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 527a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 4293 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,2,0,0,0,0|0,0,0]=2 4294 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,2,0,0,0,0|0,0,0]=2 4295 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 11a_106832991635_100000687082 [0,2,0,0,0,0|0,0,0]=2 4296 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100102657272_100000687082 [0,2,0,0,0,0|0,0,0]=2 4297 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100102657272_100000687082 [0,2,0,0,0,0|0,0,0]=2 4298 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 527a_100102657272_100000687082 [0,2,0,0,0,0|0,0,0]=2 4299 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 11a_106832991635_100000751740 [0,2,0,0,0,0|0,0,0]=2 4300 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 1626a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 4301 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 240690a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 4302 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 527a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 4303 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 11a_106832991635_100000210401 [0,2,0,0,0,0|0,0,0]=2 4304 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102657272_100000210401 [0,2,0,0,0,0|0,0,0]=2 4305 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210401 [0,2,0,0,0,0|0,0,0]=2 4306 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100102657272_100000210401 [0,2,0,0,0,0|0,0,0]=2 4307 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 11a_106832991635_100000686462 [0,2,0,0,0,0|0,0,0]=2 4308 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 1626a_100102657272_100000686462 [0,2,0,0,0,0|0,0,0]=2 4309 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 240690a_100102657272_100000686462 [0,2,0,0,0,0|0,0,0]=2 4310 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 527a_100102657272_100000686462 [0,2,0,0,0,0|0,0,0]=2 4311 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 11a_106832991635_100000684831 [0,2,0,0,0,0|0,0,0]=2 4312 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 1626a_100102657272_100000684831 [0,2,0,0,0,0|0,0,0]=2 4313 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 240690a_100102657272_100000684831 [0,2,0,0,0,0|0,0,0]=2 4314 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 527a_100102657272_100000684831 [0,2,0,0,0,0|0,0,0]=2 4315 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,2,0,0,0,0|0,0,0]=2 4316 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,2,0,0,0,0|0,0,0]=2 4317 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 11a_106832991635_100000743946 [0,2,0,0,0,0|0,0,0]=2 4318 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 1626a_100102657272_100000743946 [0,2,0,0,0,0|0,0,0]=2 4319 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 240690a_100102657272_100000743946 [0,2,0,0,0,0|0,0,0]=2 4320 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 527a_100102657272_100000743946 [0,2,0,0,0,0|0,0,0]=2 4321 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 11a_106832991635_100000212313 [0,2,0,0,0,0|0,0,0]=2 4322 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 1626a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 4323 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 240690a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 4324 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 527a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 4325 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 11a_106832991635_100000743183 [0,2,0,0,0,0|0,0,0]=2 4326 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 1626a_100102657272_100000743183 [0,2,0,0,0,0|0,0,0]=2 4327 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 240690a_100102657272_100000743183 [0,2,0,0,0,0|0,0,0]=2 4328 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 527a_100102657272_100000743183 [0,2,0,0,0,0|0,0,0]=2 4329 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 11a_106832991635_100000209822 [0,2,0,0,0,0|0,0,0]=2 4330 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 1626a_100102657272_100000209822 [0,2,0,0,0,0|0,0,0]=2 4331 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 240690a_100102657272_100000209822 [0,2,0,0,0,0|0,0,0]=2 4332 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 527a_100102657272_100000209822 [0,2,0,0,0,0|0,0,0]=2 4333 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 11a_106832991635_100000062624 [0,2,0,0,0,0|0,0,0]=2 4334 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 1626a_100102657272_100000062624 [0,2,0,0,0,0|0,0,0]=2 4335 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 240690a_100102657272_100000062624 [0,2,0,0,0,0|0,0,0]=2 4336 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 527a_100102657272_100000062624 [0,2,0,0,0,0|0,0,0]=2 4337 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,2,0,0,0,0|0,0,0]=2 4338 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,2,0,0,0,0|0,0,0]=2 4339 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 11a_106832991635_100012343876 [0,2,0,0,0,0|0,0,0]=2 4340 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 1626a_100102657272_100012343876 [0,2,0,0,0,0|0,0,0]=2 4341 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 240690a_100102657272_100012343876 [0,2,0,0,0,0|0,0,0]=2 4342 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 527a_100102657272_100012343876 [0,2,0,0,0,0|0,0,0]=2 4343 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 11a_106832991635_100000751299 [0,2,0,0,0,0|0,0,0]=2 4344 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 1626a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 4345 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 240690a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 4346 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 527a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 4347 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 11a_106832991635_100000739381 [0,2,0,0,0,0|0,0,0]=2 4348 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 1626a_100102657272_100000739381 [0,2,0,0,0,0|0,0,0]=2 4349 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 240690a_100102657272_100000739381 [0,2,0,0,0,0|0,0,0]=2 4350 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 527a_100102657272_100000739381 [0,2,0,0,0,0|0,0,0]=2 4351 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 11a_106832991635_100000688015 [0,2,0,0,0,0|0,0,0]=2 4352 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 1626a_100102657272_100000688015 [0,2,0,0,0,0|0,0,0]=2 4353 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 240690a_100102657272_100000688015 [0,2,0,0,0,0|0,0,0]=2 4354 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 527a_100102657272_100000688015 [0,2,0,0,0,0|0,0,0]=2 4355 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 11a_106832991635_100000725830 [0,2,0,0,0,0|0,0,0]=2 4356 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 1626a_100102657272_100000725830 [0,2,0,0,0,0|0,0,0]=2 4357 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 240690a_100102657272_100000725830 [0,2,0,0,0,0|0,0,0]=2 4358 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 527a_100102657272_100000725830 [0,2,0,0,0,0|0,0,0]=2 4359 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,2,0,0,0,0|0,0,0]=2 4360 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,2,0,0,0,0|0,0,0]=2 4361 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [0,2,0,0,0,0|0,0,0]=2 4362 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [0,2,0,0,0,0|0,0,0]=2 4363 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [0,2,0,0,0,0|0,0,0]=2 4364 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [0,2,0,0,0,0|0,0,0]=2 4365 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [0,2,0,0,0,0|0,0,0]=2 4366 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [0,2,0,0,0,0|0,0,0]=2 4367 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [0,2,0,0,0,0|0,0,0]=2 4368 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [0,2,0,0,0,0|0,0,0]=2 4369 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [0,2,0,0,0,0|0,0,0]=2 4370 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [0,2,0,0,0,0|0,0,0]=2 4371 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [0,2,0,0,0,0|0,0,0]=2 4372 B12R1.367 CNC(C)c1ccc(c(c1)Br)Br 269862a_106832991636_100009814466 [0,2,0,0,0,0|1,0,1]=4 4373 B12R1.367 CNC(C)c1ccc(c(c1)Br)C 269862a_106832991636_100011934287 [0,2,0,0,0,0|1,0,1]=4 4374 B12R1.367 CNC(C)c1ccc(c(c1)Br)Cl 269862a_106832991636_100012356427 [0,2,0,0,0,0|1,0,1]=4 4375 B12R1.367 CNC(C)c1ccc(c(c1)Br)F 269862a_106832991636_100000239719 [0,2,0,0,0,0|1,0,1]=4 4376 B12R1.367 CNC(C)c1ccc(c(c1)Br)I 269862a_106832991636_100010146554 [0,2,0,0,0,0|1,0,1]=4 4377 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [0,2,0,0,0,0|1,0,1]=4 4378 B12R1.367 CNC(C)c1ccc(c(c1)C)Br 269862a_106832991636_100000697869 [0,2,0,0,0,0|1,0,1]=4 4379 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [0,2,0,0,0,0|1,0,1]=4 4380 B12R1.367 CNC(C)c1ccc(c(c1)C)Cl 269862a_106832991636_100011216000 [0,2,0,0,0,0|1,0,1]=4 4381 B12R1.367 CNC(C)c1ccc(c(c1)C)F 2230a_100000705826_200000210301 [0,2,0,0,0,0|1,0,1]=4 4382 B12R1.367 CNC(C)c1ccc(c(c1)C)F 269862a_106832991636_100000754758 [0,2,0,0,0,0|1,0,1]=4 4383 B12R1.367 CNC(C)c1ccc(c(c1)C)F 34a_100000705826_200000210301 [0,2,0,0,0,0|1,0,1]=4 4384 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,2,0,0,0,0|1,0,1]=4 4385 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Br 269862a_106832991636_100012353846 [0,2,0,0,0,0|1,0,1]=4 4386 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 2230a_100012005020_200000210301 [0,2,0,0,0,0|1,0,1]=4 4387 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 269862a_106832991636_100012002458 [0,2,0,0,0,0|1,0,1]=4 4388 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 34a_100012005020_200000210301 [0,2,0,0,0,0|1,0,1]=4 4389 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_200000210301 [0,2,0,0,0,0|1,0,1]=4 4390 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 269862a_106832991636_100000210641 [0,2,0,0,0,0|1,0,1]=4 4391 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_200000210301 [0,2,0,0,0,0|1,0,1]=4 4392 B12R1.367 CNC(C)c1ccc(c(c1)Cl)F 269862a_106832991636_100000737303 [0,2,0,0,0,0|1,0,1]=4 4393 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [0,2,0,0,0,0|1,0,1]=4 4394 B12R1.367 CNC(C)c1ccc(c(c1)F)Br 269862a_106832991636_100000690002 [0,2,0,0,0,0|1,0,1]=4 4395 B12R1.367 CNC(C)c1ccc(c(c1)F)C 269862a_106832991636_100000767010 [0,2,0,0,0,0|1,0,1]=4 4396 B12R1.367 CNC(C)c1ccc(c(c1)F)Cl 269862a_106832991636_100000693814 [0,2,0,0,0,0|1,0,1]=4 4397 B12R1.367 CNC(C)c1ccc(c(c1)F)F 2230a_100000756309_200000210301 [0,2,0,0,0,0|1,0,1]=4 4398 B12R1.367 CNC(C)c1ccc(c(c1)F)F 269862a_106832991636_100000184692 [0,2,0,0,0,0|1,0,1]=4 4399 B12R1.367 CNC(C)c1ccc(c(c1)F)F 34a_100000756309_200000210301 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [0,2,0,0,0,0|1,0,1]=4 4401 B12R1.367 CNC(C)c1ccc(c(c1)I)Br 269862a_106832991636_100010146556 [0,2,0,0,0,0|1,0,1]=4 4402 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [0,2,0,0,0,0|1,0,1]=4 4403 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [0,2,0,0,0,0|1,0,1]=4 4404 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 2230a_100000753309_200000210301 [0,2,0,0,0,0|1,0,1]=4 4405 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 34a_100000753309_200000210301 [0,2,0,0,0,0|1,0,1]=4 4406 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 2230a_100134618348_200000210301 [0,2,0,0,0,0|1,0,1]=4 4407 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 34a_100134618348_200000210301 [0,2,0,0,0,0|1,0,1]=4 4408 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 2230a_100011997884_200000210301 [0,2,0,0,0,0|1,0,1]=4 4409 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 34a_100011997884_200000210301 [0,2,0,0,0,0|1,0,1]=4 4410 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 4411 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 4412 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 2230a_100016987892_200000210301 [0,2,0,0,0,0|1,0,1]=4 4413 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 34a_100016987892_200000210301 [0,2,0,0,0,0|1,0,1]=4 4414 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_200000210301 [0,2,0,0,0,0|1,0,1]=4 4415 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_200000210301 [0,2,0,0,0,0|1,0,1]=4 4416 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.367 COC(=O)c1cc(c(cn1)O)N 271570a_203496583355_100016001589 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,2,0,0,0,0|1,0,0]=3 4420 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,2,0,0,0,0|1,0,0]=3 4421 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,2,0,0,0,0|1,0,0]=3 4422 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,2,0,0,0,0|1,0,0]=3 4423 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,2,0,0,0,0|1,0,0]=3 4424 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [0,2,0,0,0,0|1,0,0]=3 4425 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [0,2,0,0,0,0|1,0,0]=3 4426 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [0,2,0,0,0,0|1,0,0]=3 4427 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [0,2,0,0,0,0|1,0,0]=3 4428 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [0,2,0,0,0,0|1,0,0]=3 4429 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,2,0,0,0,0|1,0,0]=3 4430 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,2,0,0,0,0|1,0,0]=3 4431 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.367 COC(=O)c1ccc(c(n1)F)O 271570a_203496583355_100010189630 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.367 COC(=O)c1ccc(c(n1)N)O 271570a_203496583355_100010187631 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.367 COC(=O)c1ccc(c(n1)O)F 271570a_203496583355_100010189626 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [0,2,0,0,0,0|2,0,0]=4 4437 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [0,2,0,0,0,0|2,0,0]=4 4438 B12R1.367 COC(=O)c1cnc(c(c1)Br)O 271570a_203496583355_100010114297 [0,2,0,0,0,0|2,0,0]=4 4439 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [0,2,0,0,0,0|2,0,0]=4 4440 B12R1.367 COC(=O)c1cnc(c(c1)F)O 271570a_203496583355_100010189625 [0,2,0,0,0,0|2,0,0]=4 4441 B12R1.367 COC(=O)c1cnc(c(c1)N)O 271570a_203496583355_100000079130 [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.367 COC(=O)c1cnc(c(c1)O)Cl 271570a_203496583355_100010188758 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.367 COC(=O)c1cnc(c(c1)O)F 271570a_203496583355_100000117919 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.367 COC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816800 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.367 COC(=O)c1coc(=O)c(c1)O 271570a_203496583355_100009812866 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 2230a_100016987892_200025704644 [0,2,0,0,0,0|1,0,1]=4 4449 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 34a_100016987892_200025704644 [0,2,0,0,0,0|1,0,1]=4 4450 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 2230a_100016987903_200025704644 [0,2,0,0,0,0|1,0,1]=4 4451 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 34a_100016987903_200025704644 [0,2,0,0,0,0|1,0,1]=4 4452 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 2230a_100000753309_200025704644 [0,2,0,0,0,0|1,0,1]=4 4453 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 34a_100000753309_200025704644 [0,2,0,0,0,0|1,0,1]=4 4454 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 2230a_100134618348_200025704644 [0,2,0,0,0,0|1,0,1]=4 4455 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 34a_100134618348_200025704644 [0,2,0,0,0,0|1,0,1]=4 4456 B12R1.367 Cc1cc(ccc1Br)C(=O)CF 1458a_100000692631_100015361967 [0,2,0,0,0,0|2,0,0]=4 4457 B12R1.367 Cc1cc(ccc1Cl)C(=O)CF 1458a_100000686306_100015361967 [0,2,0,0,0,0|2,0,0]=4 4458 B12R1.367 Cc1cc(ccc1F)C(=O)CF 1458a_100000751819_100015361967 [0,2,0,0,0,0|2,0,0]=4 4459 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 2230a_100000705826_200025704644 [0,2,0,0,0,0|1,0,1]=4 4460 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 34a_100000705826_200025704644 [0,2,0,0,0,0|1,0,1]=4 4461 B12R1.367 Cc1cc(ccc1I)C(=O)CF 1458a_100000751300_100015361967 [0,2,0,0,0,0|2,0,0]=4 4462 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,2,0,0,0,0|2,0,0]=4 4463 B12R1.367 Cc1cc(ccc1O)C(=O)NN 271570a_203496583355_100012339724 [0,2,0,0,0,0|1,0,0]=3 4464 B12R1.367 Cc1ccc(cc1Br)C(=O)CF 1458a_100000186397_100015361967 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.367 Cc1ccc(cc1C)C(=O)CF 1458a_100000210898_100015361967 [0,2,0,0,0,0|2,0,0]=4 4466 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 4467 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 4468 B12R1.367 Cc1ccc(cc1Cl)C(=O)CF 1458a_100000751740_100015361967 [0,2,0,0,0,0|2,0,0]=4 4469 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 2230a_100012005020_200025704644 [0,2,0,0,0,0|1,0,1]=4 4470 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 34a_100012005020_200025704644 [0,2,0,0,0,0|1,0,1]=4 4471 B12R1.367 Cc1ccc(cc1F)C(=O)CF 1458a_100000212313_100015361967 [0,2,0,0,0,0|2,0,0]=4 4472 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 2230a_100011997884_200025704644 [0,2,0,0,0,0|1,0,1]=4 4473 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 34a_100011997884_200025704644 [0,2,0,0,0,0|1,0,1]=4 4474 B12R1.367 Cc1ccc(cc1I)C(=O)CF 1458a_100000751299_100015361967 [0,2,0,0,0,0|2,0,0]=4 4475 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [0,2,0,0,0,0|2,0,0]=4 4476 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [0,2,0,0,0,0|1,0,0]=3 4477 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,2,0,0,0,0|2,0,0]=4 4478 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [0,2,0,0,0,0|1,0,0]=3 4479 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Br 1458a_100012339404_100015361967 [0,2,0,0,0,0|2,0,0]=4 4480 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100015361967 [0,2,0,0,0,0|2,0,0]=4 4481 B12R1.367 O=C(CF)c1ccc(c(c1)Br)F 1458a_100000760357_100015361967 [0,2,0,0,0,0|2,0,0]=4 4482 B12R1.367 O=C(CF)c1ccc(c(c1)Br)I 1458a_100000739115_100015361967 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100015361967 [0,2,0,0,0,0|2,0,0]=4 4485 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100015361967 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)F 1458a_100000686462_100015361967 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)I 1458a_100000684831_100015361967 [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.367 O=C(CF)c1ccc(c(c1)F)Br 1458a_100000743946_100015361967 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.367 O=C(CF)c1ccc(c(c1)F)Cl 1458a_100000743183_100015361967 [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.367 O=C(CF)c1ccc(c(c1)F)F 1458a_100000209822_100015361967 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.367 O=C(CF)c1ccc(c(c1)F)I 1458a_100000062624_100015361967 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.367 O=C(CF)c1ccc(c(c1)I)Br 1458a_100012343876_100015361967 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.367 O=C(CF)c1ccc(c(c1)I)Cl 1458a_100000739381_100015361967 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.367 O=C(CF)c1ccc(c(c1)I)F 1458a_100000688015_100015361967 [0,2,0,0,0,0|2,0,0]=4 4497 B12R1.367 O=C(CF)c1ccc(c(c1)I)I 1458a_100000725830_100015361967 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,2,0,0,0,0|2,0,0]=4 4499 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [0,2,0,0,0,0|2,0,0]=4 4500 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [0,2,0,0,0,0|2,0,0]=4 4501 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [0,2,0,0,0,0|2,0,0]=4 4502 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [0,2,0,0,0,0|2,0,0]=4 4503 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,2,0,0,0,0|2,0,0]=4 4504 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 2230a_100000179772_200025704644 [0,2,0,0,0,0|1,0,1]=4 4505 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 34a_100000179772_200025704644 [0,2,0,0,0,0|1,0,1]=4 4506 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 2230a_100000730447_200025704644 [0,2,0,0,0,0|1,0,1]=4 4507 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 34a_100000730447_200025704644 [0,2,0,0,0,0|1,0,1]=4 4508 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 2230a_100000181410_200025704644 [0,2,0,0,0,0|1,0,1]=4 4509 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 34a_100000181410_200025704644 [0,2,0,0,0,0|1,0,1]=4 4510 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,2,0,0,0,0|1,0,0]=3 4511 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,2,0,0,0,0|1,0,0]=3 4512 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,2,0,0,0,0|1,0,0]=3 4513 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,2,0,0,0,0|1,0,0]=3 4514 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,2,0,0,0,0|1,0,0]=3 4515 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|1,0,0]=3 4516 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,2,0,0,0,0|1,0,0]=3 4517 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,2,0,0,0,0|1,0,0]=3 4518 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,2,0,0,0,0|1,0,0]=3 4519 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,2,0,0,0,0|1,0,0]=3 4520 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,2,0,0,0,0|1,0,0]=3 4521 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|1,0,0]=3 4522 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|1,0,0]=3 4523 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,2,0,0,0,0|1,0,0]=3 4524 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,2,0,0,0,0|1,0,0]=3 4525 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,2,0,0,0,0|1,0,0]=3 4526 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,2,0,0,0,0|1,0,0]=3 4527 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,2,0,0,0,0|1,0,0]=3 4528 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|1,0,0]=3 4529 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,2,0,0,0,0|1,0,0]=3 4530 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,2,0,0,0,0|1,0,0]=3 4531 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,2,0,0,0,0|1,0,0]=3 4532 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,2,0,0,0,0|1,0,0]=3 4533 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,2,0,0,0,0|1,0,0]=3 4534 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|1,0,0]=3 4535 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|1,0,0]=3 4536 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,2,0,0,0,0|1,0,0]=3 4537 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,2,0,0,0,0|1,0,0]=3 4538 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,2,0,0,0,0|1,0,0]=3 4539 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,2,0,0,0,0|1,0,0]=3 4540 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,2,0,0,0,0|1,0,0]=3 4541 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,2,0,0,0,0|1,0,0]=3 4542 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,2,0,0,0,0|1,0,0]=3 4543 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,2,0,0,0,0|1,0,0]=3 4544 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,2,0,0,0,0|1,0,0]=3 4545 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,2,0,0,0,0|1,0,0]=3 4546 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|1,0,0]=3 4547 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 11a_106832991635_100000762965 [0,2,0,0,0,0|0,0,0]=2 4548 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 1626a_100102657272_100000762965 [0,2,0,0,0,0|0,0,0]=2 4549 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 240690a_100102657272_100000762965 [0,2,0,0,0,0|0,0,0]=2 4550 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 527a_100102657272_100000762965 [0,2,0,0,0,0|0,0,0]=2 4551 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 11a_106832991635_100000685072 [0,2,0,0,0,0|0,0,0]=2 4552 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 1626a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 4553 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 240690a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 4554 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 527a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 4555 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [0,2,0,0,0,0|0,0,0]=2 4556 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [0,2,0,0,0,0|0,0,0]=2 4557 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [0,2,0,0,0,0|0,0,0]=2 4558 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [0,2,0,0,0,0|0,0,0]=2 4559 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 11a_106832991635_100000212304 [0,2,0,0,0,0|0,0,0]=2 4560 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1626a_100102657272_100000212304 [0,2,0,0,0,0|0,0,0]=2 4561 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 240690a_100102657272_100000212304 [0,2,0,0,0,0|0,0,0]=2 4562 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 527a_100102657272_100000212304 [0,2,0,0,0,0|0,0,0]=2 4563 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 11a_106832991635_100012360512 [0,2,0,0,0,0|0,0,0]=2 4564 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 1626a_100102657272_100012360512 [0,2,0,0,0,0|0,0,0]=2 4565 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 240690a_100102657272_100012360512 [0,2,0,0,0,0|0,0,0]=2 4566 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 527a_100102657272_100012360512 [0,2,0,0,0,0|0,0,0]=2 4567 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,2,0,0,0,0|0,0,0]=2 4568 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,2,0,0,0,0|0,0,0]=2 4569 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 11a_106832991635_100000741311 [0,2,0,0,0,0|0,0,0]=2 4570 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1626a_100102657272_100000741311 [0,2,0,0,0,0|0,0,0]=2 4571 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 240690a_100102657272_100000741311 [0,2,0,0,0,0|0,0,0]=2 4572 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 527a_100102657272_100000741311 [0,2,0,0,0,0|0,0,0]=2 4573 B12R1.1703 CNC(=O)c1ccc(cc1C)C 11a_106832991635_100000211164 [0,2,0,0,0,0|0,0,0]=2 4574 B12R1.1703 CNC(=O)c1ccc(cc1C)C 1626a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 4575 B12R1.1703 CNC(=O)c1ccc(cc1C)C 240690a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 4576 B12R1.1703 CNC(=O)c1ccc(cc1C)C 527a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 4577 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [0,2,0,0,0,0|0,0,0]=2 4578 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [0,2,0,0,0,0|0,0,0]=2 4579 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [0,2,0,0,0,0|0,0,0]=2 4580 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [0,2,0,0,0,0|0,0,0]=2 4581 B12R1.1703 CNC(=O)c1ccc(cc1C)F 11a_106832991635_100000686989 [0,2,0,0,0,0|0,0,0]=2 4582 B12R1.1703 CNC(=O)c1ccc(cc1C)F 1626a_100102657272_100000686989 [0,2,0,0,0,0|0,0,0]=2 4583 B12R1.1703 CNC(=O)c1ccc(cc1C)F 240690a_100102657272_100000686989 [0,2,0,0,0,0|0,0,0]=2 4584 B12R1.1703 CNC(=O)c1ccc(cc1C)F 527a_100102657272_100000686989 [0,2,0,0,0,0|0,0,0]=2 4585 B12R1.1703 CNC(=O)c1ccc(cc1C)I 11a_106832991635_100010189873 [0,2,0,0,0,0|0,0,0]=2 4586 B12R1.1703 CNC(=O)c1ccc(cc1C)I 1626a_100102657272_100010189873 [0,2,0,0,0,0|0,0,0]=2 4587 B12R1.1703 CNC(=O)c1ccc(cc1C)I 240690a_100102657272_100010189873 [0,2,0,0,0,0|0,0,0]=2 4588 B12R1.1703 CNC(=O)c1ccc(cc1C)I 527a_100102657272_100010189873 [0,2,0,0,0,0|0,0,0]=2 4589 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,2,0,0,0,0|0,0,0]=2 4590 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,2,0,0,0,0|0,0,0]=2 4591 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 11a_106832991635_100000741628 [0,2,0,0,0,0|0,0,0]=2 4592 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 1626a_100102657272_100000741628 [0,2,0,0,0,0|0,0,0]=2 4593 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 240690a_100102657272_100000741628 [0,2,0,0,0,0|0,0,0]=2 4594 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 527a_100102657272_100000741628 [0,2,0,0,0,0|0,0,0]=2 4595 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 11a_106832991635_100000766932 [0,2,0,0,0,0|0,0,0]=2 4596 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 1626a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 4597 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 240690a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 4598 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 527a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 4599 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [0,2,0,0,0,0|0,0,0]=2 4600 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [0,2,0,0,0,0|0,0,0]=2 4601 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [0,2,0,0,0,0|0,0,0]=2 4602 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [0,2,0,0,0,0|0,0,0]=2 4603 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 11a_106832991635_100000211397 [0,2,0,0,0,0|0,0,0]=2 4604 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 1626a_100102657272_100000211397 [0,2,0,0,0,0|0,0,0]=2 4605 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 240690a_100102657272_100000211397 [0,2,0,0,0,0|0,0,0]=2 4606 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 527a_100102657272_100000211397 [0,2,0,0,0,0|0,0,0]=2 4607 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 11a_106832991635_100000751301 [0,2,0,0,0,0|0,0,0]=2 4608 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 1626a_100102657272_100000751301 [0,2,0,0,0,0|0,0,0]=2 4609 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 240690a_100102657272_100000751301 [0,2,0,0,0,0|0,0,0]=2 4610 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 527a_100102657272_100000751301 [0,2,0,0,0,0|0,0,0]=2 4611 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,2,0,0,0,0|0,0,0]=2 4612 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,2,0,0,0,0|0,0,0]=2 4613 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 11a_106832991635_100000214689 [0,2,0,0,0,0|0,0,0]=2 4614 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1626a_100102657272_100000214689 [0,2,0,0,0,0|0,0,0]=2 4615 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 240690a_100102657272_100000214689 [0,2,0,0,0,0|0,0,0]=2 4616 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 527a_100102657272_100000214689 [0,2,0,0,0,0|0,0,0]=2 4617 B12R1.1703 CNC(=O)c1ccc(cc1F)C 11a_106832991635_100000766033 [0,2,0,0,0,0|0,0,0]=2 4618 B12R1.1703 CNC(=O)c1ccc(cc1F)C 1626a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 4619 B12R1.1703 CNC(=O)c1ccc(cc1F)C 240690a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 4620 B12R1.1703 CNC(=O)c1ccc(cc1F)C 527a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 4621 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [0,2,0,0,0,0|0,0,0]=2 4622 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [0,2,0,0,0,0|0,0,0]=2 4623 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [0,2,0,0,0,0|0,0,0]=2 4624 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [0,2,0,0,0,0|0,0,0]=2 4625 B12R1.1703 CNC(=O)c1ccc(cc1F)F 11a_106832991635_100000211022 [0,2,0,0,0,0|0,0,0]=2 4626 B12R1.1703 CNC(=O)c1ccc(cc1F)F 1626a_100102657272_100000211022 [0,2,0,0,0,0|0,0,0]=2 4627 B12R1.1703 CNC(=O)c1ccc(cc1F)F 240690a_100102657272_100000211022 [0,2,0,0,0,0|0,0,0]=2 4628 B12R1.1703 CNC(=O)c1ccc(cc1F)F 527a_100102657272_100000211022 [0,2,0,0,0,0|0,0,0]=2 4629 B12R1.1703 CNC(=O)c1ccc(cc1F)I 11a_106832991635_100000037189 [0,2,0,0,0,0|0,0,0]=2 4630 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1626a_100102657272_100000037189 [0,2,0,0,0,0|0,0,0]=2 4631 B12R1.1703 CNC(=O)c1ccc(cc1F)I 240690a_100102657272_100000037189 [0,2,0,0,0,0|0,0,0]=2 4632 B12R1.1703 CNC(=O)c1ccc(cc1F)I 527a_100102657272_100000037189 [0,2,0,0,0,0|0,0,0]=2 4633 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,2,0,0,0,0|0,0,0]=2 4634 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,2,0,0,0,0|0,0,0]=2 4635 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,2,0,0,0,0|0,0,0]=2 4636 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 11a_106832991635_100000751167 [0,2,0,0,0,0|0,0,0]=2 4637 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 1626a_100102657272_100000751167 [0,2,0,0,0,0|0,0,0]=2 4638 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 240690a_100102657272_100000751167 [0,2,0,0,0,0|0,0,0]=2 4639 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 527a_100102657272_100000751167 [0,2,0,0,0,0|0,0,0]=2 4640 B12R1.1703 CNC(=O)c1ccc(cc1I)C 11a_106832991635_100009999607 [0,2,0,0,0,0|0,0,0]=2 4641 B12R1.1703 CNC(=O)c1ccc(cc1I)C 1626a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 4642 B12R1.1703 CNC(=O)c1ccc(cc1I)C 240690a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 4643 B12R1.1703 CNC(=O)c1ccc(cc1I)C 527a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 4644 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [0,2,0,0,0,0|0,0,0]=2 4645 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [0,2,0,0,0,0|0,0,0]=2 4646 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [0,2,0,0,0,0|0,0,0]=2 4647 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [0,2,0,0,0,0|0,0,0]=2 4648 B12R1.1703 CNC(=O)c1ccc(cc1I)F 11a_106832991635_100000739341 [0,2,0,0,0,0|0,0,0]=2 4649 B12R1.1703 CNC(=O)c1ccc(cc1I)F 1626a_100102657272_100000739341 [0,2,0,0,0,0|0,0,0]=2 4650 B12R1.1703 CNC(=O)c1ccc(cc1I)F 240690a_100102657272_100000739341 [0,2,0,0,0,0|0,0,0]=2 4651 B12R1.1703 CNC(=O)c1ccc(cc1I)F 527a_100102657272_100000739341 [0,2,0,0,0,0|0,0,0]=2 4652 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [0,2,0,0,0,0|0,0,0]=2 4653 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [0,2,0,0,0,0|0,0,0]=2 4654 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 4655 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 4656 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 4657 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [0,2,0,0,0,0|0,0,0]=2 4658 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [0,2,0,0,0,0|0,0,0]=2 4659 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [0,2,0,0,0,0|0,0,0]=2 4660 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [0,2,0,0,0,0|0,0,0]=2 4661 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [0,2,0,0,0,0|0,0,0]=2 4662 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [0,2,0,0,0,0|0,0,0]=2 4663 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [0,2,0,0,0,0|0,0,0]=2 4664 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [0,2,0,0,0,0|0,0,0]=2 4665 B12R1.1703 CNC(C)c1ccc(cc1Br)Br 269862a_106832991636_100000183147 [0,2,0,0,0,0|1,0,1]=4 4666 B12R1.1703 CNC(C)c1ccc(cc1Br)C 269862a_106832991636_100012353930 [0,2,0,0,0,0|1,0,1]=4 4667 B12R1.1703 CNC(C)c1ccc(cc1Br)Cl 269862a_106832991636_100011934292 [0,2,0,0,0,0|1,0,1]=4 4668 B12R1.1703 CNC(C)c1ccc(cc1Br)F 269862a_106832991636_100000686192 [0,2,0,0,0,0|1,0,1]=4 4669 B12R1.1703 CNC(C)c1ccc(cc1C)Br 269862a_106832991636_100012360112 [0,2,0,0,0,0|1,0,1]=4 4670 B12R1.1703 CNC(C)c1ccc(cc1C)C 269862a_106832991636_100000211561 [0,2,0,0,0,0|1,0,1]=4 4671 B12R1.1703 CNC(C)c1ccc(cc1C)Cl 269862a_106832991636_100011998434 [0,2,0,0,0,0|1,0,1]=4 4672 B12R1.1703 CNC(C)c1ccc(cc1C)F 269862a_106832991636_100000753884 [0,2,0,0,0,0|1,0,1]=4 4673 B12R1.1703 CNC(C)c1ccc(cc1Cl)Br 269862a_106832991636_100000693907 [0,2,0,0,0,0|1,0,1]=4 4674 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_200000210301 [0,2,0,0,0,0|1,0,1]=4 4675 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 269862a_106832991636_100000210972 [0,2,0,0,0,0|1,0,1]=4 4676 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_200000210301 [0,2,0,0,0,0|1,0,1]=4 4677 B12R1.1703 CNC(C)c1ccc(cc1Cl)F 269862a_106832991636_100000214953 [0,2,0,0,0,0|1,0,1]=4 4678 B12R1.1703 CNC(C)c1ccc(cc1F)Br 2230a_100000730447_200000210301 [0,2,0,0,0,0|1,0,1]=4 4679 B12R1.1703 CNC(C)c1ccc(cc1F)Br 269862a_106832991636_100000690205 [0,2,0,0,0,0|1,0,1]=4 4680 B12R1.1703 CNC(C)c1ccc(cc1F)Br 34a_100000730447_200000210301 [0,2,0,0,0,0|1,0,1]=4 4681 B12R1.1703 CNC(C)c1ccc(cc1F)C 269862a_106832991636_100011216410 [0,2,0,0,0,0|1,0,1]=4 4682 B12R1.1703 CNC(C)c1ccc(cc1F)Cl 269862a_106832991636_100011805184 [0,2,0,0,0,0|1,0,1]=4 4683 B12R1.1703 CNC(C)c1ccc(cc1F)F 2230a_100000181410_200000210301 [0,2,0,0,0,0|1,0,1]=4 4684 B12R1.1703 CNC(C)c1ccc(cc1F)F 269862a_106832991636_100000185200 [0,2,0,0,0,0|1,0,1]=4 4685 B12R1.1703 CNC(C)c1ccc(cc1F)F 34a_100000181410_200000210301 [0,2,0,0,0,0|1,0,1]=4 4686 B12R1.1703 CNC(C)c1ccc(cc1O)Br 269862a_106832991636_100000188348 [0,2,0,0,0,0|1,0,1]=4 4687 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|1,0,1]=4 4688 B12R1.1703 CNC(C)c1ccc(cc1O)Cl 269862a_106832991636_100000061402 [0,2,0,0,0,0|1,0,1]=4 4689 B12R1.1703 CNC(C)c1ccc(cc1O)F 269862a_106832991636_100011215782 [0,2,0,0,0,0|1,0,1]=4 4690 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 2230a_100000745882_200000210301 [0,2,0,0,0,0|1,0,1]=4 4691 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 34a_100000745882_200000210301 [0,2,0,0,0,0|1,0,1]=4 4692 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_200000210301 [0,2,0,0,0,0|1,0,1]=4 4693 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_200000210301 [0,2,0,0,0,0|1,0,1]=4 4694 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 2230a_100025704064_200000210301 [0,2,0,0,0,0|1,0,1]=4 4695 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 34a_100025704064_200000210301 [0,2,0,0,0,0|1,0,1]=4 4696 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 2230a_100015196781_200000210301 [0,2,0,0,0,0|1,0,1]=4 4697 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 34a_100015196781_200000210301 [0,2,0,0,0,0|1,0,1]=4 4698 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])O 271570a_203496583355_100015641791 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,2,0,0,0,0|1,0,0]=3 4700 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,2,0,0,0,0|1,0,0]=3 4701 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,2,0,0,0,0|1,0,0]=3 4702 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,2,0,0,0,0|1,0,0]=3 4703 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,2,0,0,0,0|1,0,0]=3 4704 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [0,2,0,0,0,0|1,0,0]=3 4705 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [0,2,0,0,0,0|1,0,0]=3 4706 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [0,2,0,0,0,0|1,0,0]=3 4707 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [0,2,0,0,0,0|1,0,0]=3 4708 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [0,2,0,0,0,0|1,0,0]=3 4709 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|1,0,0]=3 4710 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|1,0,0]=3 4711 B12R1.1703 COC(=O)c1ccc(nc1C)O 271570a_203496583355_100000692007 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.1703 COC(=O)c1ccc(nc1F)O 271570a_203496583355_100010189635 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.1703 COC(=O)c1ccc(nc1N)O 271570a_203496583355_100000142702 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.1703 COC(=O)c1ccc(nc1O)N 271570a_203496583355_100009865240 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.1703 COC(=O)c1cnc(cc1C)O 271570a_203496583355_100009871181 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.1703 COC(=O)c1cnc(cc1N)O 271570a_203496583355_100009862510 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [0,2,0,0,0,0|2,0,0]=4 4721 B12R1.1703 COC(=O)c1ncc(cc1C)O 271570a_203496583355_100010178714 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.1703 COC(=O)c1ncc(cc1F)O 271570a_203496583355_100000695675 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.1703 COC(=O)c1ncc(cc1N)O 271570a_203496583355_100010090751 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.1703 COC(=O)c1ncc(cc1O)F 271570a_203496583355_100010189631 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 2230a_100025704064_200025704644 [0,2,0,0,0,0|1,0,1]=4 4728 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 34a_100025704064_200025704644 [0,2,0,0,0,0|1,0,1]=4 4729 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 2230a_100015196781_200025704644 [0,2,0,0,0,0|1,0,1]=4 4730 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 34a_100015196781_200025704644 [0,2,0,0,0,0|1,0,1]=4 4731 B12R1.1703 Cc1cc(ccc1C(=O)CF)Br 1458a_100000741311_100015361967 [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.1703 Cc1cc(ccc1C(=O)CF)F 1458a_100000686989_100015361967 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.1703 Cc1cc(ccc1C(=O)CF)I 1458a_100010189873_100015361967 [0,2,0,0,0,0|2,0,0]=4 4735 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,2,0,0,0,0|2,0,0]=4 4736 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 2230a_100020633667_200025704644 [0,2,0,0,0,0|1,0,1]=4 4737 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 34a_100020633667_200025704644 [0,2,0,0,0,0|1,0,1]=4 4738 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)CF 1458a_100000685072_100015361967 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CF 1458a_100000211164_100015361967 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 2230a_100000745882_200025704644 [0,2,0,0,0,0|1,0,1]=4 4741 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 34a_100000745882_200025704644 [0,2,0,0,0,0|1,0,1]=4 4742 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)CF 1458a_100000766932_100015361967 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.1703 Cc1ccc(c(c1)F)C(=O)CF 1458a_100000766033_100015361967 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.1703 Cc1ccc(c(c1)I)C(=O)CF 1458a_100009999607_100015361967 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN 271570a_203496583355_200012340525 [0,2,0,0,0,0|1,0,0]=3 4747 B12R1.1703 NNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203923 [0,2,0,0,0,0|1,0,0]=3 4748 B12R1.1703 O=C(CF)c1ccc(cc1Br)Br 1458a_100000762965_100015361967 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.1703 O=C(CF)c1ccc(cc1Br)F 1458a_100000212304_100015361967 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.1703 O=C(CF)c1ccc(cc1Br)I 1458a_100012360512_100015361967 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Br 1458a_100000741628_100015361967 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.1703 O=C(CF)c1ccc(cc1Cl)F 1458a_100000211397_100015361967 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.1703 O=C(CF)c1ccc(cc1Cl)I 1458a_100000751301_100015361967 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.1703 O=C(CF)c1ccc(cc1F)Br 1458a_100000214689_100015361967 [0,2,0,0,0,0|2,0,0]=4 4759 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.1703 O=C(CF)c1ccc(cc1F)F 1458a_100000211022_100015361967 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.1703 O=C(CF)c1ccc(cc1F)I 1458a_100000037189_100015361967 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.1703 O=C(CF)c1ccc(cc1I)Br 1458a_100000751167_100015361967 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.1703 O=C(CF)c1ccc(cc1I)F 1458a_100000739341_100015361967 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [0,2,0,0,0,0|2,0,0]=4 4769 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|2,0,0]=4 4771 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)Cl 2230a_100015335525_200025704644 [0,2,0,0,0,0|1,0,1]=4 4772 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)Cl 34a_100015335525_200025704644 [0,2,0,0,0,0|1,0,1]=4 4773 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)F 2230a_100103153465_200025704644 [0,2,0,0,0,0|1,0,1]=4 4774 B12R1.24 CC(N[13CH3])c1cccc(c1Cl)F 34a_100103153465_200025704644 [0,2,0,0,0,0|1,0,1]=4 4775 B12R1.24 CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210202 [0,2,0,0,0,0|1,0,0]=3 4776 B12R1.24 CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210202 [0,2,0,0,0,0|1,0,0]=3 4777 B12R1.24 CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210202 [0,2,0,0,0,0|1,0,0]=3 4778 B12R1.24 CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210202 [0,2,0,0,0,0|1,0,0]=3 4779 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [0,2,0,0,0,0|1,0,0]=3 4780 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [0,2,0,0,0,0|1,0,0]=3 4781 B12R1.24 CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210202 [0,2,0,0,0,0|1,0,0]=3 4782 B12R1.24 CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210202 [0,2,0,0,0,0|1,0,0]=3 4783 B12R1.24 CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210202 [0,2,0,0,0,0|1,0,0]=3 4784 B12R1.24 CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210202 [0,2,0,0,0,0|1,0,0]=3 4785 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [0,2,0,0,0,0|1,0,0]=3 4786 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [0,2,0,0,0,0|1,0,0]=3 4787 B12R1.24 CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210202 [0,2,0,0,0,0|1,0,0]=3 4788 B12R1.24 CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210202 [0,2,0,0,0,0|1,0,0]=3 4789 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210202 [0,2,0,0,0,0|1,0,0]=3 4790 B12R1.24 CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210202 [0,2,0,0,0,0|1,0,0]=3 4791 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [0,2,0,0,0,0|1,0,0]=3 4792 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [0,2,0,0,0,0|1,0,0]=3 4793 B12R1.24 CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210202 [0,2,0,0,0,0|1,0,0]=3 4794 B12R1.24 CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210202 [0,2,0,0,0,0|1,0,0]=3 4795 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210202 [0,2,0,0,0,0|1,0,0]=3 4796 B12R1.24 CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210202 [0,2,0,0,0,0|1,0,0]=3 4797 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [0,2,0,0,0,0|1,0,0]=3 4798 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [0,2,0,0,0,0|1,0,0]=3 4799 B12R1.24 CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210202 [0,2,0,0,0,0|1,0,0]=3 4800 B12R1.24 CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210202 [0,2,0,0,0,0|1,0,0]=3 4801 B12R1.24 CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210202 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.24 CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210202 [0,2,0,0,0,0|1,0,0]=3 4803 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [0,2,0,0,0,0|1,0,0]=3 4804 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [0,2,0,0,0,0|1,0,0]=3 4805 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [0,2,0,0,0,0|1,0,0]=3 4807 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [0,2,0,0,0,0|1,0,0]=3 4808 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.24 CNC(=O)c1cccc(c1Br)Br 11a_106832991635_100012360534 [0,2,0,0,0,0|0,0,0]=2 4810 B12R1.24 CNC(=O)c1cccc(c1Br)Br 1626a_100102657272_100012360534 [0,2,0,0,0,0|0,0,0]=2 4811 B12R1.24 CNC(=O)c1cccc(c1Br)Br 240690a_100102657272_100012360534 [0,2,0,0,0,0|0,0,0]=2 4812 B12R1.24 CNC(=O)c1cccc(c1Br)Br 527a_100102657272_100012360534 [0,2,0,0,0,0|0,0,0]=2 4813 B12R1.24 CNC(=O)c1cccc(c1Br)C 11a_106832991635_100000692419 [0,2,0,0,0,0|0,0,0]=2 4814 B12R1.24 CNC(=O)c1cccc(c1Br)C 1626a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 4815 B12R1.24 CNC(=O)c1cccc(c1Br)C 240690a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 4816 B12R1.24 CNC(=O)c1cccc(c1Br)C 527a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 4817 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 11a_106832991635_100012339722 [0,2,0,0,0,0|0,0,0]=2 4818 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 1626a_100102657272_100012339722 [0,2,0,0,0,0|0,0,0]=2 4819 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 240690a_100102657272_100012339722 [0,2,0,0,0,0|0,0,0]=2 4820 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 527a_100102657272_100012339722 [0,2,0,0,0,0|0,0,0]=2 4821 B12R1.24 CNC(=O)c1cccc(c1Br)F 11a_106832991635_100011217547 [0,2,0,0,0,0|0,0,0]=2 4822 B12R1.24 CNC(=O)c1cccc(c1Br)F 1626a_100102657272_100011217547 [0,2,0,0,0,0|0,0,0]=2 4823 B12R1.24 CNC(=O)c1cccc(c1Br)F 240690a_100102657272_100011217547 [0,2,0,0,0,0|0,0,0]=2 4824 B12R1.24 CNC(=O)c1cccc(c1Br)F 527a_100102657272_100011217547 [0,2,0,0,0,0|0,0,0]=2 4825 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [0,2,0,0,0,0|0,0,0]=2 4826 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [0,2,0,0,0,0|0,0,0]=2 4827 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [0,2,0,0,0,0|0,0,0]=2 4828 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [0,2,0,0,0,0|0,0,0]=2 4829 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [0,2,0,0,0,0|0,0,0]=2 4830 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [0,2,0,0,0,0|0,0,0]=2 4831 B12R1.24 CNC(=O)c1cccc(c1C)Br 11a_106832991635_100000760464 [0,2,0,0,0,0|0,0,0]=2 4832 B12R1.24 CNC(=O)c1cccc(c1C)Br 1626a_100102657272_100000760464 [0,2,0,0,0,0|0,0,0]=2 4833 B12R1.24 CNC(=O)c1cccc(c1C)Br 240690a_100102657272_100000760464 [0,2,0,0,0,0|0,0,0]=2 4834 B12R1.24 CNC(=O)c1cccc(c1C)Br 527a_100102657272_100000760464 [0,2,0,0,0,0|0,0,0]=2 4835 B12R1.24 CNC(=O)c1cccc(c1C)C 11a_106832991635_100000183679 [0,2,0,0,0,0|0,0,0]=2 4836 B12R1.24 CNC(=O)c1cccc(c1C)C 1626a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 4837 B12R1.24 CNC(=O)c1cccc(c1C)C 240690a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 4838 B12R1.24 CNC(=O)c1cccc(c1C)C 527a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 4839 B12R1.24 CNC(=O)c1cccc(c1C)Cl 11a_106832991635_100000690184 [0,2,0,0,0,0|0,0,0]=2 4840 B12R1.24 CNC(=O)c1cccc(c1C)Cl 1626a_100102657272_100000690184 [0,2,0,0,0,0|0,0,0]=2 4841 B12R1.24 CNC(=O)c1cccc(c1C)Cl 240690a_100102657272_100000690184 [0,2,0,0,0,0|0,0,0]=2 4842 B12R1.24 CNC(=O)c1cccc(c1C)Cl 527a_100102657272_100000690184 [0,2,0,0,0,0|0,0,0]=2 4843 B12R1.24 CNC(=O)c1cccc(c1C)F 11a_106832991635_100011218272 [0,2,0,0,0,0|0,0,0]=2 4844 B12R1.24 CNC(=O)c1cccc(c1C)F 1626a_100102657272_100011218272 [0,2,0,0,0,0|0,0,0]=2 4845 B12R1.24 CNC(=O)c1cccc(c1C)F 240690a_100102657272_100011218272 [0,2,0,0,0,0|0,0,0]=2 4846 B12R1.24 CNC(=O)c1cccc(c1C)F 527a_100102657272_100011218272 [0,2,0,0,0,0|0,0,0]=2 4847 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [0,2,0,0,0,0|0,0,0]=2 4848 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [0,2,0,0,0,0|0,0,0]=2 4849 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [0,2,0,0,0,0|0,0,0]=2 4850 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [0,2,0,0,0,0|0,0,0]=2 4851 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [0,2,0,0,0,0|0,0,0]=2 4852 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [0,2,0,0,0,0|0,0,0]=2 4853 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 11a_106832991635_100000760540 [0,2,0,0,0,0|0,0,0]=2 4854 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 1626a_100102657272_100000760540 [0,2,0,0,0,0|0,0,0]=2 4855 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 240690a_100102657272_100000760540 [0,2,0,0,0,0|0,0,0]=2 4856 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 527a_100102657272_100000760540 [0,2,0,0,0,0|0,0,0]=2 4857 B12R1.24 CNC(=O)c1cccc(c1Cl)C 11a_106832991635_100000693142 [0,2,0,0,0,0|0,0,0]=2 4858 B12R1.24 CNC(=O)c1cccc(c1Cl)C 1626a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 4859 B12R1.24 CNC(=O)c1cccc(c1Cl)C 240690a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 4860 B12R1.24 CNC(=O)c1cccc(c1Cl)C 527a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 4861 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 11a_106832991635_100000183631 [0,2,0,0,0,0|0,0,0]=2 4862 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 1626a_100102657272_100000183631 [0,2,0,0,0,0|0,0,0]=2 4863 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 240690a_100102657272_100000183631 [0,2,0,0,0,0|0,0,0]=2 4864 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 527a_100102657272_100000183631 [0,2,0,0,0,0|0,0,0]=2 4865 B12R1.24 CNC(=O)c1cccc(c1Cl)F 11a_106832991635_100000759904 [0,2,0,0,0,0|0,0,0]=2 4866 B12R1.24 CNC(=O)c1cccc(c1Cl)F 1626a_100102657272_100000759904 [0,2,0,0,0,0|0,0,0]=2 4867 B12R1.24 CNC(=O)c1cccc(c1Cl)F 240690a_100102657272_100000759904 [0,2,0,0,0,0|0,0,0]=2 4868 B12R1.24 CNC(=O)c1cccc(c1Cl)F 527a_100102657272_100000759904 [0,2,0,0,0,0|0,0,0]=2 4869 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [0,2,0,0,0,0|0,0,0]=2 4870 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [0,2,0,0,0,0|0,0,0]=2 4871 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [0,2,0,0,0,0|0,0,0]=2 4872 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [0,2,0,0,0,0|0,0,0]=2 4873 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [0,2,0,0,0,0|0,0,0]=2 4874 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [0,2,0,0,0,0|0,0,0]=2 4875 B12R1.24 CNC(=O)c1cccc(c1F)Br 11a_106832991635_100000756403 [0,2,0,0,0,0|0,0,0]=2 4876 B12R1.24 CNC(=O)c1cccc(c1F)Br 1626a_100102657272_100000756403 [0,2,0,0,0,0|0,0,0]=2 4877 B12R1.24 CNC(=O)c1cccc(c1F)Br 240690a_100102657272_100000756403 [0,2,0,0,0,0|0,0,0]=2 4878 B12R1.24 CNC(=O)c1cccc(c1F)Br 527a_100102657272_100000756403 [0,2,0,0,0,0|0,0,0]=2 4879 B12R1.24 CNC(=O)c1cccc(c1F)C 11a_106832991635_100000766181 [0,2,0,0,0,0|0,0,0]=2 4880 B12R1.24 CNC(=O)c1cccc(c1F)C 1626a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 4881 B12R1.24 CNC(=O)c1cccc(c1F)C 240690a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 4882 B12R1.24 CNC(=O)c1cccc(c1F)C 527a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 4883 B12R1.24 CNC(=O)c1cccc(c1F)Cl 11a_106832991635_100000688816 [0,2,0,0,0,0|0,0,0]=2 4884 B12R1.24 CNC(=O)c1cccc(c1F)Cl 1626a_100102657272_100000688816 [0,2,0,0,0,0|0,0,0]=2 4885 B12R1.24 CNC(=O)c1cccc(c1F)Cl 240690a_100102657272_100000688816 [0,2,0,0,0,0|0,0,0]=2 4886 B12R1.24 CNC(=O)c1cccc(c1F)Cl 527a_100102657272_100000688816 [0,2,0,0,0,0|0,0,0]=2 4887 B12R1.24 CNC(=O)c1cccc(c1F)F 11a_106832991635_100000748134 [0,2,0,0,0,0|0,0,0]=2 4888 B12R1.24 CNC(=O)c1cccc(c1F)F 1626a_100102657272_100000748134 [0,2,0,0,0,0|0,0,0]=2 4889 B12R1.24 CNC(=O)c1cccc(c1F)F 240690a_100102657272_100000748134 [0,2,0,0,0,0|0,0,0]=2 4890 B12R1.24 CNC(=O)c1cccc(c1F)F 527a_100102657272_100000748134 [0,2,0,0,0,0|0,0,0]=2 4891 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [0,2,0,0,0,0|0,0,0]=2 4892 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [0,2,0,0,0,0|0,0,0]=2 4893 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [0,2,0,0,0,0|0,0,0]=2 4894 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [0,2,0,0,0,0|0,0,0]=2 4895 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [0,2,0,0,0,0|0,0,0]=2 4896 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [0,2,0,0,0,0|0,0,0]=2 4897 B12R1.24 CNC(=O)c1cccc(c1I)Br 11a_106832991635_100000688019 [0,2,0,0,0,0|0,0,0]=2 4898 B12R1.24 CNC(=O)c1cccc(c1I)Br 1626a_100102657272_100000688019 [0,2,0,0,0,0|0,0,0]=2 4899 B12R1.24 CNC(=O)c1cccc(c1I)Br 240690a_100102657272_100000688019 [0,2,0,0,0,0|0,0,0]=2 4900 B12R1.24 CNC(=O)c1cccc(c1I)Br 527a_100102657272_100000688019 [0,2,0,0,0,0|0,0,0]=2 4901 B12R1.24 CNC(=O)c1cccc(c1I)C 11a_106832991635_100000739377 [0,2,0,0,0,0|0,0,0]=2 4902 B12R1.24 CNC(=O)c1cccc(c1I)C 1626a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 4903 B12R1.24 CNC(=O)c1cccc(c1I)C 240690a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 4904 B12R1.24 CNC(=O)c1cccc(c1I)C 527a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 4905 B12R1.24 CNC(=O)c1cccc(c1I)Cl 11a_106832991635_100010176784 [0,2,0,0,0,0|0,0,0]=2 4906 B12R1.24 CNC(=O)c1cccc(c1I)Cl 1626a_100102657272_100010176784 [0,2,0,0,0,0|0,0,0]=2 4907 B12R1.24 CNC(=O)c1cccc(c1I)Cl 240690a_100102657272_100010176784 [0,2,0,0,0,0|0,0,0]=2 4908 B12R1.24 CNC(=O)c1cccc(c1I)Cl 527a_100102657272_100010176784 [0,2,0,0,0,0|0,0,0]=2 4909 B12R1.24 CNC(=O)c1cccc(c1I)F 11a_106832991635_100000690930 [0,2,0,0,0,0|0,0,0]=2 4910 B12R1.24 CNC(=O)c1cccc(c1I)F 1626a_100102657272_100000690930 [0,2,0,0,0,0|0,0,0]=2 4911 B12R1.24 CNC(=O)c1cccc(c1I)F 240690a_100102657272_100000690930 [0,2,0,0,0,0|0,0,0]=2 4912 B12R1.24 CNC(=O)c1cccc(c1I)F 527a_100102657272_100000690930 [0,2,0,0,0,0|0,0,0]=2 4913 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [0,2,0,0,0,0|0,0,0]=2 4914 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [0,2,0,0,0,0|0,0,0]=2 4915 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [0,2,0,0,0,0|0,0,0]=2 4916 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [0,2,0,0,0,0|0,0,0]=2 4917 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [0,2,0,0,0,0|0,0,0]=2 4918 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [0,2,0,0,0,0|0,0,0]=2 4919 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [0,2,0,0,0,0|0,0,0]=2 4920 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [0,2,0,0,0,0|0,0,0]=2 4921 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [0,2,0,0,0,0|0,0,0]=2 4922 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [0,2,0,0,0,0|0,0,0]=2 4923 B12R1.24 CNC(C)c1cccc(c1Br)Cl 269862a_106832991636_100010145520 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.24 CNC(C)c1cccc(c1Br)F 269862a_106832991636_100012362612 [0,2,0,0,0,0|1,0,1]=4 4925 B12R1.24 CNC(C)c1cccc(c1C)Br 269862a_106832991636_100012706834 [0,2,0,0,0,0|1,0,1]=4 4926 B12R1.24 CNC(C)c1cccc(c1C)C 2230a_106832991635_100012183177 [0,2,0,0,0,0|1,0,1]=4 4927 B12R1.24 CNC(C)c1cccc(c1C)C 269862a_106832991636_100000756305 [0,2,0,0,0,0|1,0,1]=4 4928 B12R1.24 CNC(C)c1cccc(c1C)C 34a_100102657272_100012183177 [0,2,0,0,0,0|1,0,1]=4 4929 B12R1.24 CNC(C)c1cccc(c1C)C 7a_106832991635_100012183177 [0,2,0,0,0,0|1,0,1]=4 4930 B12R1.24 CNC(C)c1cccc(c1C)Cl 269862a_106832991636_100012002460 [0,2,0,0,0,0|1,0,1]=4 4931 B12R1.24 CNC(C)c1cccc(c1C)F 269862a_106832991636_100000061526 [0,2,0,0,0,0|1,0,1]=4 4932 B12R1.24 CNC(C)c1cccc(c1C)I 269862a_106832991636_100010725598 [0,2,0,0,0,0|1,0,1]=4 4933 B12R1.24 CNC(C)c1cccc(c1Cl)Br 269862a_106832991636_100012349481 [0,2,0,0,0,0|1,0,1]=4 4934 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 2230a_100015335525_200000210301 [0,2,0,0,0,0|1,0,1]=4 4935 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 269862a_106832991636_100000756844 [0,2,0,0,0,0|1,0,1]=4 4936 B12R1.24 CNC(C)c1cccc(c1Cl)Cl 34a_100015335525_200000210301 [0,2,0,0,0,0|1,0,1]=4 4937 B12R1.24 CNC(C)c1cccc(c1Cl)F 2230a_100103153465_200000210301 [0,2,0,0,0,0|1,0,1]=4 4938 B12R1.24 CNC(C)c1cccc(c1Cl)F 269862a_106832991636_100000699253 [0,2,0,0,0,0|1,0,1]=4 4939 B12R1.24 CNC(C)c1cccc(c1Cl)F 34a_100103153465_200000210301 [0,2,0,0,0,0|1,0,1]=4 4940 B12R1.24 CNC(C)c1cccc(c1F)Br 269862a_106832991636_100012355707 [0,2,0,0,0,0|1,0,1]=4 4941 B12R1.24 CNC(C)c1cccc(c1F)C 269862a_106832991636_100012182731 [0,2,0,0,0,0|1,0,1]=4 4942 B12R1.24 CNC(C)c1cccc(c1F)Cl 269862a_106832991636_100011830330 [0,2,0,0,0,0|1,0,1]=4 4943 B12R1.24 CNC(C)c1cccc(c1F)F 269862a_106832991636_100000696358 [0,2,0,0,0,0|1,0,1]=4 4944 B12R1.24 CNC(C)c1cccc(c1O)Br 269862a_106832991636_100009815558 [0,2,0,0,0,0|1,0,1]=4 4945 B12R1.24 CNC(C)c1cccc(c1O)C 269862a_106832991636_100009847209 [0,2,0,0,0,0|1,0,1]=4 4946 B12R1.24 CNC(C)c1cccc(c1O)Cl 269862a_106832991636_100000043392 [0,2,0,0,0,0|1,0,1]=4 4947 B12R1.24 CNC(C)c1cccc(c1O)F 269862a_106832991636_100011246037 [0,2,0,0,0,0|1,0,1]=4 4948 B12R1.24 CN[C@@H](C)c1cccc(c1F)F 2230a_100020612118_200000210301 [0,2,0,0,0,0|1,0,1]=4 4949 B12R1.24 CN[C@@H](C)c1cccc(c1F)F 34a_100020612118_200000210301 [0,2,0,0,0,0|1,0,1]=4 4950 B12R1.24 CN[C@H](C)c1cccc(c1F)Cl 2230a_100016987989_200000210301 [0,2,0,0,0,0|1,0,1]=4 4951 B12R1.24 CN[C@H](C)c1cccc(c1F)Cl 34a_100016987989_200000210301 [0,2,0,0,0,0|1,0,1]=4 4952 B12R1.24 COC(=O)c1c[nH]cc(c1=O)O 271570a_203496583355_100010873956 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [0,2,0,0,0,0|1,0,0]=3 4954 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [0,2,0,0,0,0|1,0,0]=3 4955 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [0,2,0,0,0,0|1,0,0]=3 4956 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [0,2,0,0,0,0|1,0,0]=3 4957 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [0,2,0,0,0,0|1,0,0]=3 4958 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [0,2,0,0,0,0|1,0,0]=3 4959 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [0,2,0,0,0,0|1,0,0]=3 4960 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [0,2,0,0,0,0|1,0,0]=3 4961 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [0,2,0,0,0,0|1,0,0]=3 4962 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [0,2,0,0,0,0|1,0,0]=3 4963 B12R1.24 COC(=O)c1ccnc(c1C)O 271570a_203496583355_100000087782 [0,2,0,0,0,0|2,0,0]=4 4964 B12R1.24 COC(=O)c1ccnc(c1F)O 271570a_203496583355_100000081818 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.24 COC(=O)c1ccnc(c1N)O 271570a_203496583355_100000067308 [0,2,0,0,0,0|2,0,0]=4 4966 B12R1.24 COC(=O)c1cncc(c1C)O 271570a_203496583355_100010713144 [0,2,0,0,0,0|2,0,0]=4 4967 B12R1.24 COC(=O)c1nccc(c1C)O 271570a_203496583355_100000094583 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.24 COC(=O)c1nccc(c1F)O 271570a_203496583355_100000687924 [0,2,0,0,0,0|2,0,0]=4 4969 B12R1.24 C[C@@H](N[13CH3])c1cccc(c1F)Cl 2230a_100016987989_200025704644 [0,2,0,0,0,0|1,0,1]=4 4970 B12R1.24 C[C@@H](N[13CH3])c1cccc(c1F)Cl 34a_100016987989_200025704644 [0,2,0,0,0,0|1,0,1]=4 4971 B12R1.24 C[C@H](N[13CH3])c1cccc(c1F)F 2230a_100020612118_200025704644 [0,2,0,0,0,0|1,0,1]=4 4972 B12R1.24 C[C@H](N[13CH3])c1cccc(c1F)F 34a_100020612118_200025704644 [0,2,0,0,0,0|1,0,1]=4 4973 B12R1.24 Cc1c(cccc1C(=O)CF)Br 1458a_100000760464_100015361967 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.24 Cc1c(cccc1C(=O)CF)Cl 1458a_100000690184_100015361967 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.24 Cc1c(cccc1C(=O)CF)F 1458a_100011218272_100015361967 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.24 Cc1c(cccc1C(=O)CF)I 1458a_100000751865_100015361967 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.24 Cc1cccc(c1Br)C(=O)CF 1458a_100000692419_100015361967 [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.24 Cc1cccc(c1C)C(=O)CF 1458a_100000183679_100015361967 [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.24 Cc1cccc(c1Cl)C(=O)CF 1458a_100000693142_100015361967 [0,2,0,0,0,0|2,0,0]=4 4982 B12R1.24 Cc1cccc(c1F)C(=O)CF 1458a_100000766181_100015361967 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.24 Cc1cccc(c1I)C(=O)CF 1458a_100000739377_100015361967 [0,2,0,0,0,0|2,0,0]=4 4984 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.24 O=C(CF)c1cccc(c1Br)Br 1458a_100012360534_100015361967 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.24 O=C(CF)c1cccc(c1Br)Cl 1458a_100012339722_100015361967 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.24 O=C(CF)c1cccc(c1Br)F 1458a_100011217547_100015361967 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.24 O=C(CF)c1cccc(c1Br)I 1458a_100010232522_100015361967 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.24 O=C(CF)c1cccc(c1Cl)Br 1458a_100000760540_100015361967 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.24 O=C(CF)c1cccc(c1Cl)Cl 1458a_100000183631_100015361967 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.24 O=C(CF)c1cccc(c1Cl)F 1458a_100000759904_100015361967 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.24 O=C(CF)c1cccc(c1Cl)I 1458a_100010176783_100015361967 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.24 O=C(CF)c1cccc(c1F)Br 1458a_100000756403_100015361967 [0,2,0,0,0,0|2,0,0]=4 4996 B12R1.24 O=C(CF)c1cccc(c1F)Cl 1458a_100000688816_100015361967 [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.24 O=C(CF)c1cccc(c1F)F 1458a_100000748134_100015361967 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.24 O=C(CF)c1cccc(c1F)I 1458a_100010185205_100015361967 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [0,2,0,0,0,0|2,0,0]=4 5000 B12R1.24 O=C(CF)c1cccc(c1I)Br 1458a_100000688019_100015361967 [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.24 O=C(CF)c1cccc(c1I)Cl 1458a_100010176784_100015361967 [0,2,0,0,0,0|2,0,0]=4 5002 B12R1.24 O=C(CF)c1cccc(c1I)F 1458a_100000690930_100015361967 [0,2,0,0,0,0|2,0,0]=4 5003 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [0,2,0,0,0,0|2,0,0]=4 5004 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [0,2,0,0,0,0|2,0,0]=4 5005 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [0,2,0,0,0,0|2,0,0]=4 5006 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [0,2,0,0,0,0|2,0,0]=4 5007 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [0,2,0,0,0,0|2,0,0]=4 5008 B12R1.225 CC(=C(C)c1cccc(c1)Br)C 271570a_200000049429_100000691529 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.225 CC(=C(C)c1cccc(c1)C)C 271570a_200000049429_100011215228 [0,2,0,0,0,0|2,0,0]=4 5010 B12R1.225 CC(=C(C)c1cccc(c1)Cl)C 271570a_200000049429_100000699651 [0,2,0,0,0,0|2,0,0]=4 5011 B12R1.225 CC(=C(C)c1cccc(c1)F)C 271570a_200000049429_100000685547 [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.225 CC(=C(C)c1cccc(c1)N)C 271570a_200000049429_100000210019 [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,2,0,0,0,0|2,0,0]=4 5014 B12R1.225 CC(=C(C)c1cccc(c1)[S])C 271570a_200000049429_114929384022 [0,2,0,0,0,0|2,0,0]=4 5015 B12R1.225 CC(C)C(=O)c1cccc(c1)Br 1458a_100000210664_100000210206 [0,2,0,0,0,0|1,0,0]=3 5016 B12R1.225 CC(C)C(=O)c1cccc(c1)Cl 1458a_100000210390_100000210206 [0,2,0,0,0,0|1,0,0]=3 5017 B12R1.225 CC(C)C(=O)c1cccc(c1)F 1458a_100000210950_100000210206 [0,2,0,0,0,0|1,0,0]=3 5018 B12R1.225 CC(C)C(=O)c1cccc(c1)I 1458a_100000184098_100000210206 [0,2,0,0,0,0|1,0,0]=3 5019 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [0,2,0,0,0,0|1,0,0]=3 5020 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [0,2,0,0,0,0|1,0,0]=3 5021 B12R1.225 CC(c1cccc(c1)Br)N(C)C 2230a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 5022 B12R1.225 CC(c1cccc(c1)Br)N(C)C 269982a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 5023 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 2230a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 5024 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 269982a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 5025 B12R1.225 CC(c1cccc(c1)F)N(C)C 2230a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 5026 B12R1.225 CC(c1cccc(c1)F)N(C)C 269982a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 5027 B12R1.225 CC(c1cccc(c1)F)N(C)C 34a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 2230a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 5029 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 269982a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 5030 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 34a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 5031 B12R1.225 CN(C)C(=O)c1cc(ccn1)O 271570a_203496583355_200000198538 [0,2,0,0,0,0|1,0,0]=3 5032 B12R1.225 CN(C)C(=O)c1cccc(c1)Br 11a_100102631434_100000210664 [0,2,0,0,0,0|0,0,0]=2 5033 B12R1.225 CN(C)C(=O)c1cccc(c1)Br 1626a_100102631434_100000210664 [0,2,0,0,0,0|0,0,0]=2 5034 B12R1.225 CN(C)C(=O)c1cccc(c1)Br 240690a_100102631434_100000210664 [0,2,0,0,0,0|0,0,0]=2 5035 B12R1.225 CN(C)C(=O)c1cccc(c1)Br 527a_100102631434_100000210664 [0,2,0,0,0,0|0,0,0]=2 5036 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl 11a_100102631434_100000210390 [0,2,0,0,0,0|0,0,0]=2 5037 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl 1626a_100102631434_100000210390 [0,2,0,0,0,0|0,0,0]=2 5038 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl 240690a_100102631434_100000210390 [0,2,0,0,0,0|0,0,0]=2 5039 B12R1.225 CN(C)C(=O)c1cccc(c1)Cl 527a_100102631434_100000210390 [0,2,0,0,0,0|0,0,0]=2 5040 B12R1.225 CN(C)C(=O)c1cccc(c1)F 11a_100102631434_100000210950 [0,2,0,0,0,0|0,0,0]=2 5041 B12R1.225 CN(C)C(=O)c1cccc(c1)F 1626a_100102631434_100000210950 [0,2,0,0,0,0|0,0,0]=2 5042 B12R1.225 CN(C)C(=O)c1cccc(c1)F 240690a_100102631434_100000210950 [0,2,0,0,0,0|0,0,0]=2 5043 B12R1.225 CN(C)C(=O)c1cccc(c1)F 527a_100102631434_100000210950 [0,2,0,0,0,0|0,0,0]=2 5044 B12R1.225 CN(C)C(=O)c1cccc(c1)I 11a_100102631434_100000184098 [0,2,0,0,0,0|0,0,0]=2 5045 B12R1.225 CN(C)C(=O)c1cccc(c1)I 1626a_100102631434_100000184098 [0,2,0,0,0,0|0,0,0]=2 5046 B12R1.225 CN(C)C(=O)c1cccc(c1)I 240690a_100102631434_100000184098 [0,2,0,0,0,0|0,0,0]=2 5047 B12R1.225 CN(C)C(=O)c1cccc(c1)I 527a_100102631434_100000184098 [0,2,0,0,0,0|0,0,0]=2 5048 B12R1.225 CN(C)C(=O)c1cccc(c1)O 240690a_100102631434_100000183914 [0,2,0,0,0,0|0,0,0]=2 5049 B12R1.225 CN(C)C(=O)c1cccc(c1)O 271570a_203496583355_100000159571 [0,2,0,0,0,0|0,0,0]=2 5050 B12R1.225 CN(C)C(=O)c1cccc(c1)O 527a_100102631434_100000183914 [0,2,0,0,0,0|0,0,0]=2 5051 B12R1.225 CN(C)C(=O)c1ccnc(c1)O 271570a_203496583355_100000229821 [0,2,0,0,0,0|1,0,0]=3 5052 B12R1.225 CN(C)C(=O)c1cncc(c1)O 271570a_203496583355_200000159598 [0,2,0,0,0,0|1,0,0]=3 5053 B12R1.225 Cc1cccc(c1)C(=O)C(C)C 1458a_100000189346_100000210206 [0,2,0,0,0,0|1,0,0]=3 5054 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 11a_100102631434_100000189346 [0,2,0,0,0,0|0,0,0]=2 5055 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100000189346 [0,2,0,0,0,0|0,0,0]=2 5056 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100000189346 [0,2,0,0,0,0|0,0,0]=2 5057 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 527a_100102631434_100000189346 [0,2,0,0,0,0|0,0,0]=2 5058 B12R1.354 CC(N[13CH3])c1cc(ccc1Br)F 2230a_100012343209_200025704644 [0,2,0,0,0,0|1,0,1]=4 5059 B12R1.354 CC(N[13CH3])c1cc(ccc1Br)F 34a_100012343209_200025704644 [0,2,0,0,0,0|1,0,1]=4 5060 B12R1.354 CC(N[13CH3])c1cc(ccc1Cl)Cl 2230a_100000737532_200025704644 [0,2,0,0,0,0|1,0,1]=4 5061 B12R1.354 CC(N[13CH3])c1cc(ccc1Cl)Cl 34a_100000737532_200025704644 [0,2,0,0,0,0|1,0,1]=4 5062 B12R1.354 CC(N[13CH3])c1cc(ccc1F)F 2230a_100000737541_200025704644 [0,2,0,0,0,0|1,0,1]=4 5063 B12R1.354 CC(N[13CH3])c1cc(ccc1F)F 34a_100000737541_200025704644 [0,2,0,0,0,0|1,0,1]=4 5064 B12R1.354 CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210202 [0,2,0,0,0,0|1,0,0]=3 5065 B12R1.354 CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210202 [0,2,0,0,0,0|1,0,0]=3 5066 B12R1.354 CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210202 [0,2,0,0,0,0|1,0,0]=3 5067 B12R1.354 CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210202 [0,2,0,0,0,0|1,0,0]=3 5068 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [0,2,0,0,0,0|1,0,0]=3 5069 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [0,2,0,0,0,0|1,0,0]=3 5070 B12R1.354 CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210202 [0,2,0,0,0,0|1,0,0]=3 5071 B12R1.354 CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210202 [0,2,0,0,0,0|1,0,0]=3 5072 B12R1.354 CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210202 [0,2,0,0,0,0|1,0,0]=3 5073 B12R1.354 CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210202 [0,2,0,0,0,0|1,0,0]=3 5074 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [0,2,0,0,0,0|1,0,0]=3 5075 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [0,2,0,0,0,0|1,0,0]=3 5076 B12R1.354 CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210202 [0,2,0,0,0,0|1,0,0]=3 5077 B12R1.354 CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210202 [0,2,0,0,0,0|1,0,0]=3 5078 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210202 [0,2,0,0,0,0|1,0,0]=3 5079 B12R1.354 CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210202 [0,2,0,0,0,0|1,0,0]=3 5080 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [0,2,0,0,0,0|1,0,0]=3 5081 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [0,2,0,0,0,0|1,0,0]=3 5082 B12R1.354 CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210202 [0,2,0,0,0,0|1,0,0]=3 5083 B12R1.354 CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210202 [0,2,0,0,0,0|1,0,0]=3 5084 B12R1.354 CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210202 [0,2,0,0,0,0|1,0,0]=3 5085 B12R1.354 CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210202 [0,2,0,0,0,0|1,0,0]=3 5086 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [0,2,0,0,0,0|1,0,0]=3 5087 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [0,2,0,0,0,0|1,0,0]=3 5088 B12R1.354 CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210202 [0,2,0,0,0,0|1,0,0]=3 5089 B12R1.354 CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210202 [0,2,0,0,0,0|1,0,0]=3 5090 B12R1.354 CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210202 [0,2,0,0,0,0|1,0,0]=3 5091 B12R1.354 CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210202 [0,2,0,0,0,0|1,0,0]=3 5092 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [0,2,0,0,0,0|1,0,0]=3 5093 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [0,2,0,0,0,0|1,0,0]=3 5094 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [0,2,0,0,0,0|1,0,0]=3 5095 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [0,2,0,0,0,0|1,0,0]=3 5096 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [0,2,0,0,0,0|1,0,0]=3 5097 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [0,2,0,0,0,0|1,0,0]=3 5098 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [0,2,0,0,0,0|1,0,0]=3 5099 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [0,2,0,0,0,0|1,0,0]=3 5100 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [0,2,0,0,0,0|1,0,0]=3 5101 B12R1.354 CNC(=O)C1=NC(=O)CC=C1Cl 240690a_100102657272_100009855368 [0,2,0,0,0,0|1,0,1]=4 5102 B12R1.354 CNC(=O)C1=NC(=O)CC=C1Cl 527a_100102657272_100009855368 [0,2,0,0,0,0|1,0,1]=4 5103 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 11a_106832991635_100000690610 [0,2,0,0,0,0|0,0,0]=2 5104 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 1626a_100102657272_100000690610 [0,2,0,0,0,0|0,0,0]=2 5105 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 240690a_100102657272_100000690610 [0,2,0,0,0,0|0,0,0]=2 5106 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 527a_100102657272_100000690610 [0,2,0,0,0,0|0,0,0]=2 5107 B12R1.354 CNC(=O)c1cc(ccc1Br)C 11a_106832991635_100000689033 [0,2,0,0,0,0|0,0,0]=2 5108 B12R1.354 CNC(=O)c1cc(ccc1Br)C 1626a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 5109 B12R1.354 CNC(=O)c1cc(ccc1Br)C 240690a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 5110 B12R1.354 CNC(=O)c1cc(ccc1Br)C 527a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 5111 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 11a_106832991635_100000736951 [0,2,0,0,0,0|0,0,0]=2 5112 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 1626a_100102657272_100000736951 [0,2,0,0,0,0|0,0,0]=2 5113 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 240690a_100102657272_100000736951 [0,2,0,0,0,0|0,0,0]=2 5114 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 527a_100102657272_100000736951 [0,2,0,0,0,0|0,0,0]=2 5115 B12R1.354 CNC(=O)c1cc(ccc1Br)F 11a_106832991635_100000212315 [0,2,0,0,0,0|0,0,0]=2 5116 B12R1.354 CNC(=O)c1cc(ccc1Br)F 1626a_100102657272_100000212315 [0,2,0,0,0,0|0,0,0]=2 5117 B12R1.354 CNC(=O)c1cc(ccc1Br)F 240690a_100102657272_100000212315 [0,2,0,0,0,0|0,0,0]=2 5118 B12R1.354 CNC(=O)c1cc(ccc1Br)F 527a_100102657272_100000212315 [0,2,0,0,0,0|0,0,0]=2 5119 B12R1.354 CNC(=O)c1cc(ccc1Br)I 11a_106832991635_100000698340 [0,2,0,0,0,0|0,0,0]=2 5120 B12R1.354 CNC(=O)c1cc(ccc1Br)I 1626a_100102657272_100000698340 [0,2,0,0,0,0|0,0,0]=2 5121 B12R1.354 CNC(=O)c1cc(ccc1Br)I 240690a_100102657272_100000698340 [0,2,0,0,0,0|0,0,0]=2 5122 B12R1.354 CNC(=O)c1cc(ccc1Br)I 527a_100102657272_100000698340 [0,2,0,0,0,0|0,0,0]=2 5123 B12R1.354 CNC(=O)c1cc(ccc1Br)O 240690a_100102657272_100012352043 [0,2,0,0,0,0|0,0,0]=2 5124 B12R1.354 CNC(=O)c1cc(ccc1Br)O 527a_100102657272_100012352043 [0,2,0,0,0,0|0,0,0]=2 5125 B12R1.354 CNC(=O)c1cc(ccc1C)Br 11a_106832991635_100000759961 [0,2,0,0,0,0|0,0,0]=2 5126 B12R1.354 CNC(=O)c1cc(ccc1C)Br 1626a_100102657272_100000759961 [0,2,0,0,0,0|0,0,0]=2 5127 B12R1.354 CNC(=O)c1cc(ccc1C)Br 240690a_100102657272_100000759961 [0,2,0,0,0,0|0,0,0]=2 5128 B12R1.354 CNC(=O)c1cc(ccc1C)Br 527a_100102657272_100000759961 [0,2,0,0,0,0|0,0,0]=2 5129 B12R1.354 CNC(=O)c1cc(ccc1C)C 11a_106832991635_100000195421 [0,2,0,0,0,0|0,0,0]=2 5130 B12R1.354 CNC(=O)c1cc(ccc1C)C 1626a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 5131 B12R1.354 CNC(=O)c1cc(ccc1C)C 240690a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 5132 B12R1.354 CNC(=O)c1cc(ccc1C)C 527a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 5133 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 11a_106832991635_100000692595 [0,2,0,0,0,0|0,0,0]=2 5134 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 1626a_100102657272_100000692595 [0,2,0,0,0,0|0,0,0]=2 5135 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 240690a_100102657272_100000692595 [0,2,0,0,0,0|0,0,0]=2 5136 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 527a_100102657272_100000692595 [0,2,0,0,0,0|0,0,0]=2 5137 B12R1.354 CNC(=O)c1cc(ccc1C)F 11a_106832991635_100000240043 [0,2,0,0,0,0|0,0,0]=2 5138 B12R1.354 CNC(=O)c1cc(ccc1C)F 1626a_100102657272_100000240043 [0,2,0,0,0,0|0,0,0]=2 5139 B12R1.354 CNC(=O)c1cc(ccc1C)F 240690a_100102657272_100000240043 [0,2,0,0,0,0|0,0,0]=2 5140 B12R1.354 CNC(=O)c1cc(ccc1C)F 527a_100102657272_100000240043 [0,2,0,0,0,0|0,0,0]=2 5141 B12R1.354 CNC(=O)c1cc(ccc1C)I 11a_106832991635_100000688012 [0,2,0,0,0,0|0,0,0]=2 5142 B12R1.354 CNC(=O)c1cc(ccc1C)I 1626a_100102657272_100000688012 [0,2,0,0,0,0|0,0,0]=2 5143 B12R1.354 CNC(=O)c1cc(ccc1C)I 240690a_100102657272_100000688012 [0,2,0,0,0,0|0,0,0]=2 5144 B12R1.354 CNC(=O)c1cc(ccc1C)I 527a_100102657272_100000688012 [0,2,0,0,0,0|0,0,0]=2 5145 B12R1.354 CNC(=O)c1cc(ccc1C)O 240690a_100102657272_100000687834 [0,2,0,0,0,0|0,0,0]=2 5146 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 11a_106832991635_100000211212 [0,2,0,0,0,0|0,0,0]=2 5147 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 1626a_100102657272_100000211212 [0,2,0,0,0,0|0,0,0]=2 5148 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 240690a_100102657272_100000211212 [0,2,0,0,0,0|0,0,0]=2 5149 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 527a_100102657272_100000211212 [0,2,0,0,0,0|0,0,0]=2 5150 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 11a_106832991635_100011290873 [0,2,0,0,0,0|0,0,0]=2 5151 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 1626a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 5152 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 240690a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 5153 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 527a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 5154 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 11a_106832991635_100000210642 [0,2,0,0,0,0|0,0,0]=2 5155 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 1626a_100102657272_100000210642 [0,2,0,0,0,0|0,0,0]=2 5156 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 240690a_100102657272_100000210642 [0,2,0,0,0,0|0,0,0]=2 5157 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 527a_100102657272_100000210642 [0,2,0,0,0,0|0,0,0]=2 5158 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 11a_106832991635_100011219680 [0,2,0,0,0,0|0,0,0]=2 5159 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 1626a_100102657272_100011219680 [0,2,0,0,0,0|0,0,0]=2 5160 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 240690a_100102657272_100011219680 [0,2,0,0,0,0|0,0,0]=2 5161 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 527a_100102657272_100011219680 [0,2,0,0,0,0|0,0,0]=2 5162 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 11a_106832991635_100000688013 [0,2,0,0,0,0|0,0,0]=2 5163 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 1626a_100102657272_100000688013 [0,2,0,0,0,0|0,0,0]=2 5164 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 240690a_100102657272_100000688013 [0,2,0,0,0,0|0,0,0]=2 5165 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 527a_100102657272_100000688013 [0,2,0,0,0,0|0,0,0]=2 5166 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 240690a_100102657272_100000719527 [0,2,0,0,0,0|0,0,0]=2 5167 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 527a_100102657272_100000719527 [0,2,0,0,0,0|0,0,0]=2 5168 B12R1.354 CNC(=O)c1cc(ccc1F)Br 11a_106832991635_100000212322 [0,2,0,0,0,0|0,0,0]=2 5169 B12R1.354 CNC(=O)c1cc(ccc1F)Br 1626a_100102657272_100000212322 [0,2,0,0,0,0|0,0,0]=2 5170 B12R1.354 CNC(=O)c1cc(ccc1F)Br 240690a_100102657272_100000212322 [0,2,0,0,0,0|0,0,0]=2 5171 B12R1.354 CNC(=O)c1cc(ccc1F)Br 527a_100102657272_100000212322 [0,2,0,0,0,0|0,0,0]=2 5172 B12R1.354 CNC(=O)c1cc(ccc1F)C 11a_106832991635_100000749327 [0,2,0,0,0,0|0,0,0]=2 5173 B12R1.354 CNC(=O)c1cc(ccc1F)C 1626a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 5174 B12R1.354 CNC(=O)c1cc(ccc1F)C 240690a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 5175 B12R1.354 CNC(=O)c1cc(ccc1F)C 527a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 5176 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 11a_106832991635_100000214954 [0,2,0,0,0,0|0,0,0]=2 5177 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 1626a_100102657272_100000214954 [0,2,0,0,0,0|0,0,0]=2 5178 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 240690a_100102657272_100000214954 [0,2,0,0,0,0|0,0,0]=2 5179 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 527a_100102657272_100000214954 [0,2,0,0,0,0|0,0,0]=2 5180 B12R1.354 CNC(=O)c1cc(ccc1F)F 11a_106832991635_100000198512 [0,2,0,0,0,0|0,0,0]=2 5181 B12R1.354 CNC(=O)c1cc(ccc1F)F 1626a_100102657272_100000198512 [0,2,0,0,0,0|0,0,0]=2 5182 B12R1.354 CNC(=O)c1cc(ccc1F)F 240690a_100102657272_100000198512 [0,2,0,0,0,0|0,0,0]=2 5183 B12R1.354 CNC(=O)c1cc(ccc1F)F 527a_100102657272_100000198512 [0,2,0,0,0,0|0,0,0]=2 5184 B12R1.354 CNC(=O)c1cc(ccc1F)I 11a_106832991635_100000688014 [0,2,0,0,0,0|0,0,0]=2 5185 B12R1.354 CNC(=O)c1cc(ccc1F)I 1626a_100102657272_100000688014 [0,2,0,0,0,0|0,0,0]=2 5186 B12R1.354 CNC(=O)c1cc(ccc1F)I 240690a_100102657272_100000688014 [0,2,0,0,0,0|0,0,0]=2 5187 B12R1.354 CNC(=O)c1cc(ccc1F)I 527a_100102657272_100000688014 [0,2,0,0,0,0|0,0,0]=2 5188 B12R1.354 CNC(=O)c1cc(ccc1F)O 240690a_100102657272_100000037260 [0,2,0,0,0,0|0,0,0]=2 5189 B12R1.354 CNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155058 [0,2,0,0,0,0|0,0,0]=2 5190 B12R1.354 CNC(=O)c1cc(ccc1F)O 527a_100102657272_100000037260 [0,2,0,0,0,0|0,0,0]=2 5191 B12R1.354 CNC(=O)c1cc(ccc1I)Br 11a_106832991635_100000183945 [0,2,0,0,0,0|0,0,0]=2 5192 B12R1.354 CNC(=O)c1cc(ccc1I)Br 1626a_100102657272_100000183945 [0,2,0,0,0,0|0,0,0]=2 5193 B12R1.354 CNC(=O)c1cc(ccc1I)Br 240690a_100102657272_100000183945 [0,2,0,0,0,0|0,0,0]=2 5194 B12R1.354 CNC(=O)c1cc(ccc1I)C 11a_106832991635_100000057929 [0,2,0,0,0,0|0,0,0]=2 5195 B12R1.354 CNC(=O)c1cc(ccc1I)C 1626a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 5196 B12R1.354 CNC(=O)c1cc(ccc1I)C 240690a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 5197 B12R1.354 CNC(=O)c1cc(ccc1I)C 527a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 5198 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 11a_106832991635_100000739379 [0,2,0,0,0,0|0,0,0]=2 5199 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 1626a_100102657272_100000739379 [0,2,0,0,0,0|0,0,0]=2 5200 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 240690a_100102657272_100000739379 [0,2,0,0,0,0|0,0,0]=2 5201 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 527a_100102657272_100000739379 [0,2,0,0,0,0|0,0,0]=2 5202 B12R1.354 CNC(=O)c1cc(ccc1I)F 11a_106832991635_100000748905 [0,2,0,0,0,0|0,0,0]=2 5203 B12R1.354 CNC(=O)c1cc(ccc1I)F 1626a_100102657272_100000748905 [0,2,0,0,0,0|0,0,0]=2 5204 B12R1.354 CNC(=O)c1cc(ccc1I)F 240690a_100102657272_100000748905 [0,2,0,0,0,0|0,0,0]=2 5205 B12R1.354 CNC(=O)c1cc(ccc1I)F 527a_100102657272_100000748905 [0,2,0,0,0,0|0,0,0]=2 5206 B12R1.354 CNC(=O)c1cc(ccc1I)I 11a_106832991635_100000750460 [0,2,0,0,0,0|0,0,0]=2 5207 B12R1.354 CNC(=O)c1cc(ccc1I)I 1626a_100102657272_100000750460 [0,2,0,0,0,0|0,0,0]=2 5208 B12R1.354 CNC(=O)c1cc(ccc1I)I 240690a_100102657272_100000750460 [0,2,0,0,0,0|0,0,0]=2 5209 B12R1.354 CNC(=O)c1cc(ccc1I)I 527a_100102657272_100000750460 [0,2,0,0,0,0|0,0,0]=2 5210 B12R1.354 CNC(=O)c1cc(ccc1I)O 1626a_100102657272_200009995701 [0,2,0,0,0,0|0,0,0]=2 5211 B12R1.354 CNC(=O)c1cc(ccc1I)O 240690a_100102657272_200009995701 [0,2,0,0,0,0|0,0,0]=2 5212 B12R1.354 CNC(=O)c1cc(ccc1I)O 527a_100102657272_200009995701 [0,2,0,0,0,0|0,0,0]=2 5213 B12R1.354 CNC(=O)c1cc(ccc1N)O 271570a_203496583355_100000690504 [0,2,0,0,0,0|0,0,0]=2 5214 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [0,2,0,0,0,0|0,0,0]=2 5215 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [0,2,0,0,0,0|0,0,0]=2 5216 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [0,2,0,0,0,0|0,0,0]=2 5217 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [0,2,0,0,0,0|0,0,0]=2 5218 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [0,2,0,0,0,0|0,0,0]=2 5219 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [0,2,0,0,0,0|0,0,0]=2 5220 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [0,2,0,0,0,0|0,0,0]=2 5221 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [0,2,0,0,0,0|0,0,0]=2 5222 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [0,2,0,0,0,0|0,0,0]=2 5223 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [0,2,0,0,0,0|0,0,0]=2 5224 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [0,2,0,0,0,0|0,0,0]=2 5225 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [0,2,0,0,0,0|0,0,0]=2 5226 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [0,2,0,0,0,0|0,0,0]=2 5227 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [0,2,0,0,0,0|0,0,0]=2 5228 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [0,2,0,0,0,0|0,0,0]=2 5229 B12R1.354 CNC(C)c1cc(ccc1Br)Br 269862a_106832991636_100011206948 [0,2,0,0,0,0|1,0,1]=4 5230 B12R1.354 CNC(C)c1cc(ccc1Br)C 269862a_106832991636_100012361225 [0,2,0,0,0,0|1,0,1]=4 5231 B12R1.354 CNC(C)c1cc(ccc1Br)Cl 269862a_106832991636_100012361343 [0,2,0,0,0,0|1,0,1]=4 5232 B12R1.354 CNC(C)c1cc(ccc1Br)F 2230a_100012343209_200000210301 [0,2,0,0,0,0|1,0,1]=4 5233 B12R1.354 CNC(C)c1cc(ccc1Br)F 269862a_106832991636_100012353695 [0,2,0,0,0,0|1,0,1]=4 5234 B12R1.354 CNC(C)c1cc(ccc1Br)F 34a_100012343209_200000210301 [0,2,0,0,0,0|1,0,1]=4 5235 B12R1.354 CNC(C)c1cc(ccc1C)Br 269862a_106832991636_100012706819 [0,2,0,0,0,0|1,0,1]=4 5236 B12R1.354 CNC(C)c1cc(ccc1C)C 269862a_106832991636_100000211711 [0,2,0,0,0,0|1,0,1]=4 5237 B12R1.354 CNC(C)c1cc(ccc1C)Cl 269862a_106832991636_100012002457 [0,2,0,0,0,0|1,0,1]=4 5238 B12R1.354 CNC(C)c1cc(ccc1C)F 2230a_100011191733_200000210301 [0,2,0,0,0,0|1,0,1]=4 5239 B12R1.354 CNC(C)c1cc(ccc1C)F 269862a_106832991636_100011220403 [0,2,0,0,0,0|1,0,1]=4 5240 B12R1.354 CNC(C)c1cc(ccc1C)F 34a_100011191733_200000210301 [0,2,0,0,0,0|1,0,1]=4 5241 B12R1.354 CNC(C)c1cc(ccc1Cl)Br 269862a_106832991636_100011934286 [0,2,0,0,0,0|1,0,1]=4 5242 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 2230a_100000737532_200000210301 [0,2,0,0,0,0|1,0,1]=4 5243 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 269862a_106832991636_100000184594 [0,2,0,0,0,0|1,0,1]=4 5244 B12R1.354 CNC(C)c1cc(ccc1Cl)Cl 34a_100000737532_200000210301 [0,2,0,0,0,0|1,0,1]=4 5245 B12R1.354 CNC(C)c1cc(ccc1Cl)F 269862a_106832991636_100011218795 [0,2,0,0,0,0|1,0,1]=4 5246 B12R1.354 CNC(C)c1cc(ccc1Cl)I 269862a_106832991636_100010712560 [0,2,0,0,0,0|1,0,1]=4 5247 B12R1.354 CNC(C)c1cc(ccc1F)Br 269862a_106832991636_100000689017 [0,2,0,0,0,0|1,0,1]=4 5248 B12R1.354 CNC(C)c1cc(ccc1F)C 269862a_106832991636_100000760338 [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.354 CNC(C)c1cc(ccc1F)Cl 269862a_106832991636_100011218796 [0,2,0,0,0,0|1,0,1]=4 5250 B12R1.354 CNC(C)c1cc(ccc1F)F 2230a_100000737541_200000210301 [0,2,0,0,0,0|1,0,1]=4 5251 B12R1.354 CNC(C)c1cc(ccc1F)F 269862a_106832991636_100000185199 [0,2,0,0,0,0|1,0,1]=4 5252 B12R1.354 CNC(C)c1cc(ccc1F)F 34a_100000737541_200000210301 [0,2,0,0,0,0|1,0,1]=4 5253 B12R1.354 CNC(C)c1cc(ccc1F)I 269862a_106832991636_100010254839 [0,2,0,0,0,0|1,0,1]=4 5254 B12R1.354 CNC(C)c1cc(ccc1I)Br 269862a_106832991636_100012349576 [0,2,0,0,0,0|1,0,1]=4 5255 B12R1.354 CNC(C)c1cc(ccc1I)F 269862a_106832991636_100010200798 [0,2,0,0,0,0|1,0,1]=4 5256 B12R1.354 CNC(C)c1cc(ccc1O)Br 269862a_106832991636_100000212127 [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.354 CNC(C)c1cc(ccc1O)C 269862a_106832991636_100000195442 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.354 CNC(C)c1cc(ccc1O)Cl 269862a_106832991636_100000185566 [0,2,0,0,0,0|1,0,1]=4 5259 B12R1.354 CNC(C)c1cc(ccc1O)F 269862a_106832991636_100000182812 [0,2,0,0,0,0|1,0,1]=4 5260 B12R1.354 CNC(C)c1cc(ccc1O)I 269862a_106832991636_100010712555 [0,2,0,0,0,0|1,0,1]=4 5261 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_200000210301 [0,2,0,0,0,0|1,0,1]=4 5262 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_200000210301 [0,2,0,0,0,0|1,0,1]=4 5263 B12R1.354 CN[C@@H](C)c1cc(ccc1F)Cl 2230a_100000695052_200000210301 [0,2,0,0,0,0|1,0,1]=4 5264 B12R1.354 CN[C@@H](C)c1cc(ccc1F)Cl 34a_100000695052_200000210301 [0,2,0,0,0,0|1,0,1]=4 5265 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_200000210301 [0,2,0,0,0,0|1,0,1]=4 5266 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_200000210301 [0,2,0,0,0,0|1,0,1]=4 5267 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_200000210301 [0,2,0,0,0,0|1,0,1]=4 5268 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_200000210301 [0,2,0,0,0,0|1,0,1]=4 5269 B12R1.354 COC(=O)c1cc(c[nH]c1=O)O 271570a_203496583355_100009816710 [0,2,0,0,0,0|2,0,0]=4 5270 B12R1.354 COC(=O)c1cc(ccc1Br)O 271570a_203496583355_100012340073 [0,2,0,0,0,0|1,0,0]=3 5271 B12R1.354 COC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360116 [0,2,0,0,0,0|1,0,0]=3 5272 B12R1.354 COC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100012353682 [0,2,0,0,0,0|1,0,0]=3 5273 B12R1.354 COC(=O)c1cc(ccc1F)O 271570a_203496583355_100000154357 [0,2,0,0,0,0|1,0,0]=3 5274 B12R1.354 COC(=O)c1cc(ccc1N)O 271570a_203496583355_100000212070 [0,2,0,0,0,0|1,0,0]=3 5275 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [0,2,0,0,0,0|1,0,0]=3 5276 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [0,2,0,0,0,0|1,0,0]=3 5277 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [0,2,0,0,0,0|1,0,0]=3 5278 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [0,2,0,0,0,0|1,0,0]=3 5279 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [0,2,0,0,0,0|1,0,0]=3 5280 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [0,2,0,0,0,0|1,0,0]=3 5281 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [0,2,0,0,0,0|1,0,0]=3 5282 B12R1.354 COC(=O)c1cc(cnc1C)O 271570a_203496583355_100010180201 [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.354 COC(=O)c1cc(cnc1F)O 271570a_203496583355_100010243567 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.354 COC(=O)c1cc(cnc1N)O 271570a_203496583355_100009816750 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.354 COC(=O)c1cc(cnc1O)C 271570a_203496583355_100000085774 [0,2,0,0,0,0|2,0,0]=4 5286 B12R1.354 COC(=O)c1cc(cnc1O)F 271570a_203496583355_100012000215 [0,2,0,0,0,0|2,0,0]=4 5287 B12R1.354 COC(=O)c1cc(cnc1O)N 271570a_203496583355_200012182668 [0,2,0,0,0,0|2,0,0]=4 5288 B12R1.354 COC(=O)c1cc(ncc1C)O 271570a_203496583355_100009858526 [0,2,0,0,0,0|2,0,0]=4 5289 B12R1.354 COC(=O)c1cc(ncc1F)O 271570a_203496583355_100010218257 [0,2,0,0,0,0|2,0,0]=4 5290 B12R1.354 COC(=O)c1cc(ncc1N)O 271570a_203496583355_100012180746 [0,2,0,0,0,0|2,0,0]=4 5291 B12R1.354 COC(=O)c1cc(ncc1O)N 271570a_203496583355_100011934820 [0,2,0,0,0,0|2,0,0]=4 5292 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100009816900 [0,2,0,0,0,0|2,0,0]=4 5293 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100010136202 [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.354 COC(=O)c1nc(ccc1C)O 271570a_203496583355_100000117997 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.354 COC(=O)c1nc(ccc1F)O 271570a_203496583355_100000697719 [0,2,0,0,0,0|2,0,0]=4 5296 B12R1.354 COC(=O)c1nc(ccc1N)O 271570a_203496583355_100009860768 [0,2,0,0,0,0|2,0,0]=4 5297 B12R1.354 COC(=O)c1nc(ccc1O)N 271570a_203496583355_100009816986 [0,2,0,0,0,0|2,0,0]=4 5298 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100000697862 [0,2,0,0,0,0|2,0,0]=4 5299 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100010189638 [0,2,0,0,0,0|2,0,0]=4 5300 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 2230a_100011853016_200025704644 [0,2,0,0,0,0|1,0,1]=4 5301 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 34a_100011853016_200025704644 [0,2,0,0,0,0|1,0,1]=4 5302 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1F)Cl 2230a_100000695052_200025704644 [0,2,0,0,0,0|1,0,1]=4 5303 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1F)Cl 34a_100000695052_200025704644 [0,2,0,0,0,0|1,0,1]=4 5304 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 2230a_100160469477_200025704644 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 34a_100160469477_200025704644 [0,2,0,0,0,0|1,0,1]=4 5306 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Br 1458a_100000689033_100015361967 [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.354 Cc1ccc(c(c1)C(=O)CF)C 1458a_100000195421_100015361967 [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Cl 1458a_100011290873_100015361967 [0,2,0,0,0,0|2,0,0]=4 5309 B12R1.354 Cc1ccc(c(c1)C(=O)CF)F 1458a_100000749327_100015361967 [0,2,0,0,0,0|2,0,0]=4 5310 B12R1.354 Cc1ccc(c(c1)C(=O)CF)I 1458a_100000057929_100015361967 [0,2,0,0,0,0|2,0,0]=4 5311 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [0,2,0,0,0,0|2,0,0]=4 5312 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 2230a_100000695983_200025704644 [0,2,0,0,0,0|1,0,1]=4 5313 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 34a_100000695983_200025704644 [0,2,0,0,0,0|1,0,1]=4 5314 B12R1.354 Cc1ccc(cc1C(=O)CF)Br 1458a_100000759961_100015361967 [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.354 Cc1ccc(cc1C(=O)CF)Cl 1458a_100000692595_100015361967 [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.354 Cc1ccc(cc1C(=O)CF)F 1458a_100000240043_100015361967 [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.354 Cc1ccc(cc1C(=O)CF)I 1458a_100000688012_100015361967 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.354 Cc1ccc(cc1C(=O)CF)O 1458a_100000687834_100015361967 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.354 Cc1ccc(cc1C(C)N[13CH3])F 2230a_100011191733_200025704644 [0,2,0,0,0,0|1,0,1]=4 5320 B12R1.354 Cc1ccc(cc1C(C)N[13CH3])F 34a_100011191733_200025704644 [0,2,0,0,0,0|1,0,1]=4 5321 B12R1.354 NNC(=O)c1cc(ccc1Br)O 271570a_203496583355_200011356971 [0,2,0,0,0,0|1,0,0]=3 5322 B12R1.354 NNC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200000049959 [0,2,0,0,0,0|1,0,0]=3 5323 B12R1.354 NNC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205862 [0,2,0,0,0,0|1,0,0]=3 5324 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [0,2,0,0,0,0|1,0,0]=3 5325 B12R1.354 O=C(CF)c1cc(ccc1Br)Br 1458a_100000690610_100015361967 [0,2,0,0,0,0|2,0,0]=4 5326 B12R1.354 O=C(CF)c1cc(ccc1Br)Cl 1458a_100000736951_100015361967 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.354 O=C(CF)c1cc(ccc1Br)F 1458a_100000212315_100015361967 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.354 O=C(CF)c1cc(ccc1Br)I 1458a_100000698340_100015361967 [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.354 O=C(CF)c1cc(ccc1Br)O 1458a_100012352043_100015361967 [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.354 O=C(CF)c1cc(ccc1Cl)Br 1458a_100000211212_100015361967 [0,2,0,0,0,0|2,0,0]=4 5331 B12R1.354 O=C(CF)c1cc(ccc1Cl)Cl 1458a_100000210642_100015361967 [0,2,0,0,0,0|2,0,0]=4 5332 B12R1.354 O=C(CF)c1cc(ccc1Cl)F 1458a_100011219680_100015361967 [0,2,0,0,0,0|2,0,0]=4 5333 B12R1.354 O=C(CF)c1cc(ccc1Cl)I 1458a_100000688013_100015361967 [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.354 O=C(CF)c1cc(ccc1Cl)O 1458a_100000719527_100015361967 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.354 O=C(CF)c1cc(ccc1F)Br 1458a_100000212322_100015361967 [0,2,0,0,0,0|2,0,0]=4 5336 B12R1.354 O=C(CF)c1cc(ccc1F)Cl 1458a_100000214954_100015361967 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.354 O=C(CF)c1cc(ccc1F)F 1458a_100000198512_100015361967 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.354 O=C(CF)c1cc(ccc1F)I 1458a_100000688014_100015361967 [0,2,0,0,0,0|2,0,0]=4 5339 B12R1.354 O=C(CF)c1cc(ccc1F)O 1458a_100000037260_100015361967 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.354 O=C(CF)c1cc(ccc1I)Br 1458a_100000183945_100015361967 [0,2,0,0,0,0|2,0,0]=4 5341 B12R1.354 O=C(CF)c1cc(ccc1I)Cl 1458a_100000739379_100015361967 [0,2,0,0,0,0|2,0,0]=4 5342 B12R1.354 O=C(CF)c1cc(ccc1I)F 1458a_100000748905_100015361967 [0,2,0,0,0,0|2,0,0]=4 5343 B12R1.354 O=C(CF)c1cc(ccc1I)I 1458a_100000750460_100015361967 [0,2,0,0,0,0|2,0,0]=4 5344 B12R1.354 O=C(CF)c1cc(ccc1I)O 1458a_200009995701_100015361967 [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.358 CC(N[13CH3])c1cc(cc(c1)Cl)Cl 2230a_100020620772_200025704644 [0,2,0,0,0,0|1,0,1]=4 5351 B12R1.358 CC(N[13CH3])c1cc(cc(c1)Cl)Cl 34a_100020620772_200025704644 [0,2,0,0,0,0|1,0,1]=4 5352 B12R1.358 CCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210202 [0,2,0,0,0,0|1,0,0]=3 5353 B12R1.358 CCC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_100000210202 [0,2,0,0,0,0|1,0,0]=3 5354 B12R1.358 CCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210202 [0,2,0,0,0,0|1,0,0]=3 5355 B12R1.358 CCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210202 [0,2,0,0,0,0|1,0,0]=3 5356 B12R1.358 CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210202 [0,2,0,0,0,0|1,0,0]=3 5357 B12R1.358 CCC(=O)c1cc(cc(c1)C)C 1458a_100000210874_100000210202 [0,2,0,0,0,0|1,0,0]=3 5358 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_100000210202 [0,2,0,0,0,0|1,0,0]=3 5359 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210202 [0,2,0,0,0,0|1,0,0]=3 5360 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210202 [0,2,0,0,0,0|1,0,0]=3 5361 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210202 [0,2,0,0,0,0|1,0,0]=3 5362 B12R1.358 CCC(=O)c1cc(cc(c1)F)C 1458a_100000763163_100000210202 [0,2,0,0,0,0|1,0,0]=3 5363 B12R1.358 CCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210202 [0,2,0,0,0,0|1,0,0]=3 5364 B12R1.358 CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210202 [0,2,0,0,0,0|1,0,0]=3 5365 B12R1.358 CCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210202 [0,2,0,0,0,0|1,0,0]=3 5366 B12R1.358 CCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210202 [0,2,0,0,0,0|1,0,0]=3 5367 B12R1.358 CCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210202 [0,2,0,0,0,0|1,0,0]=3 5368 B12R1.358 CCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210202 [0,2,0,0,0,0|1,0,0]=3 5369 B12R1.358 CCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210202 [0,2,0,0,0,0|1,0,0]=3 5370 B12R1.358 CCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210202 [0,2,0,0,0,0|1,0,0]=3 5371 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 11a_106832991635_100000687083 [0,2,0,0,0,0|0,0,0]=2 5372 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 1626a_100102657272_100000687083 [0,2,0,0,0,0|0,0,0]=2 5373 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 240690a_100102657272_100000687083 [0,2,0,0,0,0|0,0,0]=2 5374 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 527a_100102657272_100000687083 [0,2,0,0,0,0|0,0,0]=2 5375 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 11a_106832991635_100000760426 [0,2,0,0,0,0|0,0,0]=2 5376 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 1626a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 5377 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 240690a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 5378 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 527a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 5379 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 11a_106832991635_100000687899 [0,2,0,0,0,0|0,0,0]=2 5380 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 1626a_100102657272_100000687899 [0,2,0,0,0,0|0,0,0]=2 5381 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 240690a_100102657272_100000687899 [0,2,0,0,0,0|0,0,0]=2 5382 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 527a_100102657272_100000687899 [0,2,0,0,0,0|0,0,0]=2 5383 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 11a_106832991635_100000739618 [0,2,0,0,0,0|0,0,0]=2 5384 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 1626a_100102657272_100000739618 [0,2,0,0,0,0|0,0,0]=2 5385 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 240690a_100102657272_100000739618 [0,2,0,0,0,0|0,0,0]=2 5386 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 527a_100102657272_100000739618 [0,2,0,0,0,0|0,0,0]=2 5387 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O 240690a_100102657272_100011934545 [0,2,0,0,0,0|0,0,0]=2 5388 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O 527a_100102657272_100011934545 [0,2,0,0,0,0|0,0,0]=2 5389 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 11a_106832991635_100000210874 [0,2,0,0,0,0|0,0,0]=2 5390 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 1626a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 5391 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 240690a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 5392 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 527a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 5393 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 11a_106832991635_100000684526 [0,2,0,0,0,0|0,0,0]=2 5394 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 1626a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 5395 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 240690a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 5396 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 527a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 5397 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 11a_106832991635_100000210701 [0,2,0,0,0,0|0,0,0]=2 5398 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 1626a_100102657272_100000210701 [0,2,0,0,0,0|0,0,0]=2 5399 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100102657272_100000210701 [0,2,0,0,0,0|0,0,0]=2 5400 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 527a_100102657272_100000210701 [0,2,0,0,0,0|0,0,0]=2 5401 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 11a_106832991635_100000685768 [0,2,0,0,0,0|0,0,0]=2 5402 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 1626a_100102657272_100000685768 [0,2,0,0,0,0|0,0,0]=2 5403 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 240690a_100102657272_100000685768 [0,2,0,0,0,0|0,0,0]=2 5404 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 527a_100102657272_100000685768 [0,2,0,0,0,0|0,0,0]=2 5405 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O 240690a_100102657272_100011997059 [0,2,0,0,0,0|0,0,0]=2 5406 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O 527a_100102657272_100011997059 [0,2,0,0,0,0|0,0,0]=2 5407 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 11a_106832991635_100000763163 [0,2,0,0,0,0|0,0,0]=2 5408 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 1626a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 5409 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 240690a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 5410 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 527a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 5411 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 11a_106832991635_100000211655 [0,2,0,0,0,0|0,0,0]=2 5412 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 1626a_100102657272_100000211655 [0,2,0,0,0,0|0,0,0]=2 5413 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 240690a_100102657272_100000211655 [0,2,0,0,0,0|0,0,0]=2 5414 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 527a_100102657272_100000211655 [0,2,0,0,0,0|0,0,0]=2 5415 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 11a_106832991635_100012017291 [0,2,0,0,0,0|0,0,0]=2 5416 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 240690a_100102657272_100012017291 [0,2,0,0,0,0|0,0,0]=2 5417 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011295653 [0,2,0,0,0,0|0,0,0]=2 5418 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 527a_100102657272_100012017291 [0,2,0,0,0,0|0,0,0]=2 5419 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 11a_106832991635_100000689235 [0,2,0,0,0,0|0,0,0]=2 5420 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 1626a_100102657272_100000689235 [0,2,0,0,0,0|0,0,0]=2 5421 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 240690a_100102657272_100000689235 [0,2,0,0,0,0|0,0,0]=2 5422 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 527a_100102657272_100000689235 [0,2,0,0,0,0|0,0,0]=2 5423 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 11a_106832991635_100000729426 [0,2,0,0,0,0|0,0,0]=2 5424 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 1626a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 5425 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 240690a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 5426 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 527a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 5427 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 11a_106832991635_100012047205 [0,2,0,0,0,0|0,0,0]=2 5428 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 1626a_100102657272_100012047205 [0,2,0,0,0,0|0,0,0]=2 5429 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 240690a_100102657272_100012047205 [0,2,0,0,0,0|0,0,0]=2 5430 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 527a_100102657272_100012047205 [0,2,0,0,0,0|0,0,0]=2 5431 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 11a_106832991635_100012047268 [0,2,0,0,0,0|0,0,0]=2 5432 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 1626a_100102657272_100012047268 [0,2,0,0,0,0|0,0,0]=2 5433 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 240690a_100102657272_100012047268 [0,2,0,0,0,0|0,0,0]=2 5434 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 527a_100102657272_100012047268 [0,2,0,0,0,0|0,0,0]=2 5435 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 11a_106832991635_100011204819 [0,2,0,0,0,0|0,0,0]=2 5436 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 1626a_100102657272_100011204819 [0,2,0,0,0,0|0,0,0]=2 5437 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 240690a_100102657272_100011204819 [0,2,0,0,0,0|0,0,0]=2 5438 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 527a_100102657272_100011204819 [0,2,0,0,0,0|0,0,0]=2 5439 B12R1.358 CNC(=O)c1cc(cc(c1)O)C 240690a_100102657272_100000094094 [0,2,0,0,0,0|0,0,0]=2 5440 B12R1.358 CNC(=O)c1cc(cc(c1)O)C 527a_100102657272_100000094094 [0,2,0,0,0,0|0,0,0]=2 5441 B12R1.358 CNC(=O)c1cc(cc(c1)O)O 240690a_100102657272_100000690292 [0,2,0,0,0,0|0,0,0]=2 5442 B12R1.358 CNC(=O)c1cc(cc(c1)O)O 527a_100102657272_100000690292 [0,2,0,0,0,0|0,0,0]=2 5443 B12R1.358 CNC(C)c1cc(cc(c1)Br)Br 269862a_106832991636_100012339319 [0,2,0,0,0,0|1,0,1]=4 5444 B12R1.358 CNC(C)c1cc(cc(c1)Br)C 269862a_106832991636_100000694479 [0,2,0,0,0,0|1,0,1]=4 5445 B12R1.358 CNC(C)c1cc(cc(c1)Br)Cl 269862a_106832991636_100012351652 [0,2,0,0,0,0|1,0,1]=4 5446 B12R1.358 CNC(C)c1cc(cc(c1)Br)F 269862a_106832991636_100012361402 [0,2,0,0,0,0|1,0,1]=4 5447 B12R1.358 CNC(C)c1cc(cc(c1)C)C 2230a_100000753145_200000210301 [0,2,0,0,0,0|1,0,1]=4 5448 B12R1.358 CNC(C)c1cc(cc(c1)C)C 269862a_106832991636_100000753124 [0,2,0,0,0,0|1,0,1]=4 5449 B12R1.358 CNC(C)c1cc(cc(c1)C)C 34a_100000753145_200000210301 [0,2,0,0,0,0|1,0,1]=4 5450 B12R1.358 CNC(C)c1cc(cc(c1)Cl)Cl 2230a_100020620772_200000210301 [0,2,0,0,0,0|1,0,1]=4 5451 B12R1.358 CNC(C)c1cc(cc(c1)Cl)Cl 269862a_106832991636_100000686458 [0,2,0,0,0,0|1,0,1]=4 5452 B12R1.358 CNC(C)c1cc(cc(c1)Cl)Cl 34a_100020620772_200000210301 [0,2,0,0,0,0|1,0,1]=4 5453 B12R1.358 CNC(C)c1cc(cc(c1)Cl)F 269862a_106832991636_100000062022 [0,2,0,0,0,0|1,0,1]=4 5454 B12R1.358 CNC(C)c1cc(cc(c1)F)C 269862a_106832991636_100011830400 [0,2,0,0,0,0|1,0,1]=4 5455 B12R1.358 CNC(C)c1cc(cc(c1)F)F 269862a_106832991636_100000748097 [0,2,0,0,0,0|1,0,1]=4 5456 B12R1.358 CNC(C)c1cc(cc(c1)I)Br 269862a_106832991636_100010005435 [0,2,0,0,0,0|1,0,1]=4 5457 B12R1.358 CNC(C)c1cc(cc(c1)O)C 269862a_106832991636_100009855872 [0,2,0,0,0,0|1,0,1]=4 5458 B12R1.358 CN[C@@H](C)c1cc(cc(c1)Cl)F 2230a_100020639286_200000210301 [0,2,0,0,0,0|1,0,1]=4 5459 B12R1.358 CN[C@@H](C)c1cc(cc(c1)Cl)F 34a_100020639286_200000210301 [0,2,0,0,0,0|1,0,1]=4 5460 B12R1.358 CN[C@H](C)c1cc(cc(c1)F)F 2230a_100016987943_200000210301 [0,2,0,0,0,0|1,0,1]=4 5461 B12R1.358 CN[C@H](C)c1cc(cc(c1)F)F 34a_100016987943_200000210301 [0,2,0,0,0,0|1,0,1]=4 5462 B12R1.358 COC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100012339729 [0,2,0,0,0,0|1,0,0]=3 5463 B12R1.358 COC(=O)c1cc(cc(c1)Cl)O 271570a_203496583355_100000695173 [0,2,0,0,0,0|1,0,0]=3 5464 B12R1.358 COC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100000698578 [0,2,0,0,0,0|1,0,0]=3 5465 B12R1.358 COC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100012359405 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.358 COC(=O)c1cc(cc(c1)O)N 271570a_203496583355_100138415615 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.358 COC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100000696291 [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.358 COC(=O)c1cc(cc(n1)O)C 271570a_203496583355_100009865194 [0,2,0,0,0,0|2,0,0]=4 5469 B12R1.358 COC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100000695393 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.358 COC(=O)c1cc(nc(c1)O)N 271570a_203496583355_100000062536 [0,2,0,0,0,0|2,0,0]=4 5471 B12R1.358 C[C@@H](N[13CH3])c1cc(cc(c1)F)F 2230a_100016987943_200025704644 [0,2,0,0,0,0|1,0,1]=4 5472 B12R1.358 C[C@@H](N[13CH3])c1cc(cc(c1)F)F 34a_100016987943_200025704644 [0,2,0,0,0,0|1,0,1]=4 5473 B12R1.358 C[C@H](N[13CH3])c1cc(cc(c1)Cl)F 2230a_100020639286_200025704644 [0,2,0,0,0,0|1,0,1]=4 5474 B12R1.358 C[C@H](N[13CH3])c1cc(cc(c1)Cl)F 34a_100020639286_200025704644 [0,2,0,0,0,0|1,0,1]=4 5475 B12R1.358 Cc1cc(cc(c1)C(=O)CF)Br 1458a_100000760426_100015361967 [0,2,0,0,0,0|2,0,0]=4 5476 B12R1.358 Cc1cc(cc(c1)C(=O)CF)C 1458a_100000210874_100015361967 [0,2,0,0,0,0|2,0,0]=4 5477 B12R1.358 Cc1cc(cc(c1)C(=O)CF)Cl 1458a_100000684526_100015361967 [0,2,0,0,0,0|2,0,0]=4 5478 B12R1.358 Cc1cc(cc(c1)C(=O)CF)F 1458a_100000763163_100015361967 [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.358 Cc1cc(cc(c1)C(=O)CF)I 1458a_100000729426_100015361967 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.358 Cc1cc(cc(c1)C(=O)CF)O 1458a_100000094094_100015361967 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.358 Cc1cc(cc(c1)C(C)N[13CH3])C 2230a_100000753145_200025704644 [0,2,0,0,0,0|1,0,1]=4 5482 B12R1.358 Cc1cc(cc(c1)C(C)N[13CH3])C 34a_100000753145_200025704644 [0,2,0,0,0,0|1,0,1]=4 5483 B12R1.358 NNC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100011279999 [0,2,0,0,0,0|1,0,0]=3 5484 B12R1.358 O=C(CF)c1cc(cc(c1)Br)Br 1458a_100000687083_100015361967 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.358 O=C(CF)c1cc(cc(c1)Br)Cl 1458a_100000687899_100015361967 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.358 O=C(CF)c1cc(cc(c1)Br)F 1458a_100000739618_100015361967 [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.358 O=C(CF)c1cc(cc(c1)Br)O 1458a_100011934545_100015361967 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100015361967 [0,2,0,0,0,0|2,0,0]=4 5489 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)F 1458a_100000685768_100015361967 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)O 1458a_100011997059_100015361967 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.358 O=C(CF)c1cc(cc(c1)F)F 1458a_100000211655_100015361967 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.358 O=C(CF)c1cc(cc(c1)F)O 1458a_100012017291_100015361967 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.358 O=C(CF)c1cc(cc(c1)I)Br 1458a_100000689235_100015361967 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.358 O=C(CF)c1cc(cc(c1)I)Cl 1458a_100012047205_100015361967 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.358 O=C(CF)c1cc(cc(c1)I)F 1458a_100012047268_100015361967 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.358 O=C(CF)c1cc(cc(c1)I)I 1458a_100011204819_100015361967 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.435 C#Cc1cccc(c1)C(=O)CC 1458a_100011997762_100000210202 [0,2,0,0,0,0|1,0,0]=3 5498 B12R1.435 C#Cc1cccc(c1)C(=O)CF 1458a_100011997762_100015361967 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.435 C#Cc1cccc(c1)C(=O)NC 11a_106832991635_100011997762 [0,2,0,0,0,0|0,0,0]=2 5500 B12R1.435 C#Cc1cccc(c1)C(=O)NC 1626a_100102657272_100011997762 [0,2,0,0,0,0|0,0,0]=2 5501 B12R1.435 C#Cc1cccc(c1)C(=O)NC 240690a_100102657272_100011997762 [0,2,0,0,0,0|0,0,0]=2 5502 B12R1.435 C#Cc1cccc(c1)C(=O)NC 527a_100102657272_100011997762 [0,2,0,0,0,0|0,0,0]=2 5503 B12R1.435 C=Cc1cc(ccn1)C(=O)NC 271570a_100011290941_100011196506 [0,2,0,0,0,0|1,0,0]=3 5504 B12R1.435 C=Cc1cc(ccn1)C(=O)NN 271570a_100011290941_100000021280 [0,2,0,0,0,0|2,0,0]=4 5505 B12R1.435 C=Cc1cc(ccn1)C(=O)OC 271570a_100011290941_100011934382 [0,2,0,0,0,0|2,0,0]=4 5506 B12R1.435 C=Cc1cccc(c1)C(=O)C#N 271570a_100011290941_100010169886 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.435 C=Cc1cccc(c1)C(=O)C=O 271570a_100011290941_100000726164 [0,2,0,0,0,0|2,0,0]=4 5508 B12R1.435 C=Cc1cccc(c1)C(=O)CC 1458a_100011215009_100000210202 [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.435 C=Cc1cccc(c1)C(=O)CC 271570a_100011290941_100000211677 [0,2,0,0,0,0|1,0,0]=3 5510 B12R1.435 C=Cc1cccc(c1)C(=O)CF 1458a_100011215009_100015361967 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.435 C=Cc1cccc(c1)C(=O)CN 271570a_100011290941_100020587001 [0,2,0,0,0,0|2,0,0]=4 5512 B12R1.435 C=Cc1cccc(c1)C(=O)NC 11a_106832991635_100011215009 [0,2,0,0,0,0|0,0,0]=2 5513 B12R1.435 C=Cc1cccc(c1)C(=O)NC 1626a_100102657272_100011215009 [0,2,0,0,0,0|0,0,0]=2 5514 B12R1.435 C=Cc1cccc(c1)C(=O)NC 240690a_100102657272_100011215009 [0,2,0,0,0,0|0,0,0]=2 5515 B12R1.435 C=Cc1cccc(c1)C(=O)NC 271570a_100011290941_100000155082 [0,2,0,0,0,0|0,0,0]=2 5516 B12R1.435 C=Cc1cccc(c1)C(=O)NC 527a_100102657272_100011215009 [0,2,0,0,0,0|0,0,0]=2 5517 B12R1.435 C=Cc1cccc(c1)C(=O)NN 271570a_100011290941_100000189783 [0,2,0,0,0,0|1,0,0]=3 5518 B12R1.435 C=Cc1cccc(c1)C(=O)OC 271570a_100011290941_100000148679 [0,2,0,0,0,0|1,0,0]=3 5519 B12R1.435 C=Cc1cccc(c1)C(C)NC 271570a_100011290941_100025717457 [0,2,0,0,0,0|1,0,1]=4 5520 B12R1.435 C=Cc1cccc(n1)C(=O)CC 271570a_100011290941_100011004013 [0,2,0,0,0,0|2,0,0]=4 5521 B12R1.435 C=Cc1cccc(n1)C(=O)NC 271570a_100011290941_100000755456 [0,2,0,0,0,0|1,0,0]=3 5522 B12R1.435 C=Cc1cccc(n1)C(=O)NN 271570a_100011290941_100011631096 [0,2,0,0,0,0|2,0,0]=4 5523 B12R1.435 C=Cc1cccc(n1)C(=O)OC 271570a_100011290941_100000708286 [0,2,0,0,0,0|2,0,0]=4 5524 B12R1.435 C=Cc1ccnc(c1)C(=O)CC 271570a_100011290941_200000094848 [0,2,0,0,0,0|2,0,0]=4 5525 B12R1.435 C=Cc1ccnc(c1)C(=O)NC 271570a_100011290941_100000204654 [0,2,0,0,0,0|1,0,0]=3 5526 B12R1.435 C=Cc1ccnc(c1)C(=O)NN 271570a_100011290941_100000017052 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.435 C=Cc1ccnc(c1)C(=O)OC 271570a_100011290941_100000693414 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.435 C=Cc1cncc(c1)C(=O)NC 271570a_100011290941_200000155086 [0,2,0,0,0,0|1,0,0]=3 5529 B12R1.435 C=Cc1cncc(c1)C(=O)NN 271570a_100011290941_100000189809 [0,2,0,0,0,0|2,0,0]=4 5530 B12R1.435 C=Cc1cncc(c1)C(=O)OC 271570a_100011290941_100000148912 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.435 CC(N[13CH3])c1cccc(c1)C#N 2230a_100016987922_200025704644 [0,2,0,0,0,0|1,0,1]=4 5532 B12R1.435 CC(N[13CH3])c1cccc(c1)C#N 34a_100016987922_200025704644 [0,2,0,0,0,0|1,0,1]=4 5533 B12R1.435 CCC(=O)c1cc(ccn1)SC 62a_200000094848_200000210301 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.435 CCC(=O)c1cc(ccn1)SC 62a_200000210301_200000094848 [0,2,0,0,0,0|2,0,0]=4 5535 B12R1.435 CCC(=O)c1cc(ccn1)S[13CH3] 62a_200000094848_200025704644 [0,2,0,0,0,0|2,0,0]=4 5536 B12R1.435 CCC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_200000094848 [0,2,0,0,0,0|2,0,0]=4 5537 B12R1.435 CCC(=O)c1cccc(c1)C#N 1458a_100000183950_100000210202 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.435 CCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210202 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.435 CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210202 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [0,2,0,0,0,0|1,0,0]=3 5542 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [0,2,0,0,0,0|1,0,0]=3 5545 B12R1.435 CCC(=O)c1cccc(c1)SC 1458a_100011217804_100000210202 [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_100000211677_200000210301 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_200000210301_100000211677 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_100000211677_200025704644 [0,2,0,0,0,0|1,0,0]=3 5549 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000211677 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.435 CCC(=O)c1cccc(n1)SC 62a_100011004013_200000210301 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.435 CCC(=O)c1cccc(n1)SC 62a_200000210301_100011004013 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.435 CCC(=O)c1cccc(n1)S[13CH3] 62a_100011004013_200025704644 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.435 CCC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100011004013 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.435 CCc1cccc(c1)C(=O)CF 1458a_100011933908_100015361967 [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.435 CCc1cccc(c1)C(=O)NC 11a_106832991635_100011933908 [0,2,0,0,0,0|0,0,0]=2 5556 B12R1.435 CCc1cccc(c1)C(=O)NC 1626a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 5557 B12R1.435 CCc1cccc(c1)C(=O)NC 240690a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 5558 B12R1.435 CCc1cccc(c1)C(=O)NC 527a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 5559 B12R1.435 CCc1cccc(c1)C(C)NC 269862a_106832991636_100011220055 [0,2,0,0,0,0|1,0,1]=4 5560 B12R1.435 CNC(=O)c1cc(ccn1)NC 27a_100102657272_100000204654 [0,2,0,0,0,0|1,0,0]=3 5561 B12R1.435 CNC(=O)c1cc(ccn1)SC 62a_100000204654_200000210301 [0,2,0,0,0,0|1,0,0]=3 5562 B12R1.435 CNC(=O)c1cc(ccn1)SC 62a_200000210301_100000204654 [0,2,0,0,0,0|1,0,0]=3 5563 B12R1.435 CNC(=O)c1cc(ccn1)S[13CH3] 62a_100000204654_200025704644 [0,2,0,0,0,0|1,0,0]=3 5564 B12R1.435 CNC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000204654 [0,2,0,0,0,0|1,0,0]=3 5565 B12R1.435 CNC(=O)c1cccc(c1)C#N 11a_106832991635_100000183950 [0,2,0,0,0,0|0,0,0]=2 5566 B12R1.435 CNC(=O)c1cccc(c1)C#N 1626a_100102657272_100000183950 [0,2,0,0,0,0|0,0,0]=2 5567 B12R1.435 CNC(=O)c1cccc(c1)C#N 240690a_100102657272_100000183950 [0,2,0,0,0,0|0,0,0]=2 5568 B12R1.435 CNC(=O)c1cccc(c1)C#N 527a_100102657272_100000183950 [0,2,0,0,0,0|0,0,0]=2 5569 B12R1.435 CNC(=O)c1cccc(c1)CO 240690a_100102657272_100000746274 [0,2,0,0,0,0|0,0,0]=2 5570 B12R1.435 CNC(=O)c1cccc(c1)NC 34a_100000185133_200000210301 [0,2,0,0,0,0|0,0,0]=2 5571 B12R1.435 CNC(=O)c1cccc(c1)N[13CH3] 34a_100000185133_200025704644 [0,2,0,0,0,0|0,0,0]=2 5572 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [0,2,0,0,0,0|0,0,0]=2 5573 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 5574 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 5575 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [0,2,0,0,0,0|0,0,0]=2 5576 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 5577 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [0,2,0,0,0,0|0,0,0]=2 5578 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [0,2,0,0,0,0|0,0,0]=2 5579 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [0,2,0,0,0,0|0,0,0]=2 5580 B12R1.435 CNC(=O)c1cccc(c1)SC 11a_106832991635_100011217804 [0,2,0,0,0,0|0,0,0]=2 5581 B12R1.435 CNC(=O)c1cccc(c1)SC 1626a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 5582 B12R1.435 CNC(=O)c1cccc(c1)SC 240690a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 5583 B12R1.435 CNC(=O)c1cccc(c1)SC 527a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 5584 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_100000155082_200000210301 [0,2,0,0,0,0|0,0,0]=2 5585 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_200000210301_100000155082 [0,2,0,0,0,0|0,0,0]=2 5586 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_100000155082_200025704644 [0,2,0,0,0,0|0,0,0]=2 5587 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000155082 [0,2,0,0,0,0|0,0,0]=2 5588 B12R1.435 CNC(=O)c1cccc(n1)NC 27a_100102657272_100000755456 [0,2,0,0,0,0|1,0,0]=3 5589 B12R1.435 CNC(=O)c1cccc(n1)SC 62a_100000755456_200000210301 [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.435 CNC(=O)c1cccc(n1)SC 62a_200000210301_100000755456 [0,2,0,0,0,0|1,0,0]=3 5591 B12R1.435 CNC(=O)c1cccc(n1)S[13CH3] 62a_100000755456_200025704644 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.435 CNC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100000755456 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_100011196506_200000210301 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_200000210301_100011196506 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_100011196506_200025704644 [0,2,0,0,0,0|1,0,0]=3 5596 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011196506 [0,2,0,0,0,0|1,0,0]=3 5597 B12R1.435 CNC(=O)c1cncc(c1)NC 27a_100102657272_200000155086 [0,2,0,0,0,0|1,0,0]=3 5598 B12R1.435 CNC(=O)c1cncc(c1)SC 62a_200000155086_200000210301 [0,2,0,0,0,0|1,0,0]=3 5599 B12R1.435 CNC(=O)c1cncc(c1)SC 62a_200000210301_200000155086 [0,2,0,0,0,0|1,0,0]=3 5600 B12R1.435 CNC(=O)c1cncc(c1)S[13CH3] 62a_200000155086_200025704644 [0,2,0,0,0,0|1,0,0]=3 5601 B12R1.435 CNC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_200000155086 [0,2,0,0,0,0|1,0,0]=3 5602 B12R1.435 CNC(C)c1cccc(c1)C#N 2230a_100016987922_200000210301 [0,2,0,0,0,0|1,0,1]=4 5603 B12R1.435 CNC(C)c1cccc(c1)C#N 269862a_106832991636_100000738961 [0,2,0,0,0,0|1,0,1]=4 5604 B12R1.435 CNC(C)c1cccc(c1)C#N 34a_100016987922_200000210301 [0,2,0,0,0,0|1,0,1]=4 5605 B12R1.435 CNC(C)c1cccc(c1)OC 2230a_100000737859_200000210301 [0,2,0,0,0,0|1,0,1]=4 5606 B12R1.435 CNC(C)c1cccc(c1)OC 269862a_106832991636_100000171656 [0,2,0,0,0,0|1,0,1]=4 5607 B12R1.435 CNC(C)c1cccc(c1)SC 62a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 5608 B12R1.435 CNC(C)c1cccc(c1)SC 62a_200000210301_100025717457 [0,2,0,0,0,0|1,0,1]=4 5609 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 5610 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100025717457 [0,2,0,0,0,0|1,0,1]=4 5611 B12R1.435 CNc1cccc(n1)C(=O)OC 27a_100102657272_100000708286 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.435 COC(=O)c1cc(ccn1)OC 34a_200020638413_200000210301 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.435 COC(=O)c1cc(ccn1)O[13CH3] 34a_200020638413_200025704644 [0,2,0,0,0,0|2,0,0]=4 5614 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_100000693414_200000210301 [0,2,0,0,0,0|2,0,0]=4 5615 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_200000210301_100000693414 [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_100000693414_200025704644 [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000693414 [0,2,0,0,0,0|2,0,0]=4 5618 B12R1.435 COC(=O)c1cccc(c1)OC 34a_100000150331_200000210301 [0,2,0,0,0,0|1,0,0]=3 5619 B12R1.435 COC(=O)c1cccc(c1)OC 7a_100000150331_200000210301 [0,2,0,0,0,0|1,0,0]=3 5620 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 34a_100000150331_200025704644 [0,2,0,0,0,0|1,0,0]=3 5621 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 7a_100000150331_200025704644 [0,2,0,0,0,0|1,0,0]=3 5622 B12R1.435 COC(=O)c1cccc(c1)SC 62a_100000148848_200000210301 [0,2,0,0,0,0|1,0,0]=3 5623 B12R1.435 COC(=O)c1cccc(c1)SC 62a_200000210301_100000148848 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_100000148848_200025704644 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000148848 [0,2,0,0,0,0|1,0,0]=3 5626 B12R1.435 COC(=O)c1cccc(n1)SC 62a_100000708286_200000210301 [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.435 COC(=O)c1cccc(n1)SC 62a_200000210301_100000708286 [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_100000708286_200025704644 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100000708286 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.435 COC(=O)c1ccnc(c1)OC 34a_100138552365_200000210301 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.435 COC(=O)c1ccnc(c1)O[13CH3] 34a_100138552365_200025704644 [0,2,0,0,0,0|2,0,0]=4 5632 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_100011934382_200000210301 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_200000210301_100011934382 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_100011934382_200025704644 [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011934382 [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.435 COC(=O)c1cncc(c1)OC 34a_100000687108_200000210301 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.435 COC(=O)c1cncc(c1)OC 7a_100000687108_200000210301 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 34a_100000687108_200025704644 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 7a_100000687108_200025704644 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.435 COC(=O)c1cncc(c1)SC 62a_100000148912_200000210301 [0,2,0,0,0,0|2,0,0]=4 5641 B12R1.435 COC(=O)c1cncc(c1)SC 62a_200000210301_100000148912 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_100000148912_200025704644 [0,2,0,0,0,0|2,0,0]=4 5643 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100000148912 [0,2,0,0,0,0|2,0,0]=4 5644 B12R1.435 COc1cccc(c1)C(=O)CBr 7a_100009813753_200000210301 [0,2,0,0,0,0|2,0,0]=4 5645 B12R1.435 COc1cccc(c1)C(=O)CF 1458a_100000188888_100015361967 [0,2,0,0,0,0|2,0,0]=4 5646 B12R1.435 COc1cccc(c1)C(=O)NN 34a_100000184184_200000210301 [0,2,0,0,0,0|1,0,0]=3 5647 B12R1.435 COc1cccc(c1)C(C)N[13CH3] 2230a_100000737859_200025704644 [0,2,0,0,0,0|1,0,1]=4 5648 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_100000021280_200000210301 [0,2,0,0,0,0|2,0,0]=4 5649 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_200000210301_100000021280 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.435 CSc1cccc(c1)C(=O)C#N 62a_200000210301_100010169886 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.435 CSc1cccc(c1)C(=O)C=O 62a_100000726164_200000210301 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.435 CSc1cccc(c1)C(=O)C=O 62a_200000210301_100000726164 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.435 CSc1cccc(c1)C(=O)CF 1458a_100011217804_100015361967 [0,2,0,0,0,0|2,0,0]=4 5654 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_100020587001_200000210301 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_200000210301_100020587001 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_100000189783_200000210301 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_200000210301_100000189783 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.435 CSc1cccc(n1)C(=O)NN 62a_100011631096_200000210301 [0,2,0,0,0,0|2,0,0]=4 5659 B12R1.435 CSc1cccc(n1)C(=O)NN 62a_200000210301_100011631096 [0,2,0,0,0,0|2,0,0]=4 5660 B12R1.435 CSc1ccnc(c1)C(=O)NN 62a_100000017052_200000210301 [0,2,0,0,0,0|2,0,0]=4 5661 B12R1.435 CSc1ccnc(c1)C(=O)NN 62a_200000210301_100000017052 [0,2,0,0,0,0|2,0,0]=4 5662 B12R1.435 CSc1cncc(c1)C(=O)NN 62a_100000189809_200000210301 [0,2,0,0,0,0|2,0,0]=4 5663 B12R1.435 CSc1cncc(c1)C(=O)NN 62a_200000210301_100000189809 [0,2,0,0,0,0|2,0,0]=4 5664 B12R1.435 N#Cc1cccc(c1)C(=O)CF 1458a_100000183950_100015361967 [0,2,0,0,0,0|2,0,0]=4 5665 B12R1.435 O=C(CF)c1cccc(c1)CO 1458a_100000746274_100015361967 [0,2,0,0,0,0|2,0,0]=4 5666 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)CBr 7a_100009813753_200025704644 [0,2,0,0,0,0|2,0,0]=4 5667 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)NN 34a_100000184184_200025704644 [0,2,0,0,0,0|1,0,0]=3 5668 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_100000021280_200025704644 [0,2,0,0,0,0|2,0,0]=4 5669 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_200025704644_100000021280 [0,2,0,0,0,0|2,0,0]=4 5670 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C#N 62a_200025704644_100010169886 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C=O 62a_100000726164_200025704644 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C=O 62a_200025704644_100000726164 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_100020587001_200025704644 [0,2,0,0,0,0|2,0,0]=4 5674 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_200025704644_100020587001 [0,2,0,0,0,0|2,0,0]=4 5675 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_100000189783_200025704644 [0,2,0,0,0,0|1,0,0]=3 5676 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_200025704644_100000189783 [0,2,0,0,0,0|1,0,0]=3 5677 B12R1.435 [13CH3]Sc1cccc(n1)C(=O)NN 62a_100011631096_200025704644 [0,2,0,0,0,0|2,0,0]=4 5678 B12R1.435 [13CH3]Sc1cccc(n1)C(=O)NN 62a_200025704644_100011631096 [0,2,0,0,0,0|2,0,0]=4 5679 B12R1.435 [13CH3]Sc1ccnc(c1)C(=O)NN 62a_100000017052_200025704644 [0,2,0,0,0,0|2,0,0]=4 5680 B12R1.435 [13CH3]Sc1ccnc(c1)C(=O)NN 62a_200025704644_100000017052 [0,2,0,0,0,0|2,0,0]=4 5681 B12R1.435 [13CH3]Sc1cncc(c1)C(=O)NN 62a_100000189809_200025704644 [0,2,0,0,0,0|2,0,0]=4 5682 B12R1.435 [13CH3]Sc1cncc(c1)C(=O)NN 62a_200025704644_100000189809 [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.124 CC(=C(C)c1ccccc1Br)C 271570a_200000049429_100000695589 [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.124 CC(=C(C)c1ccccc1C)C 271570a_200000049429_100000210755 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.124 CC(=C(C)c1ccccc1Cl)C 271570a_200000049429_100000764095 [0,2,0,0,0,0|2,0,0]=4 5686 B12R1.124 CC(=C(C)c1ccccc1F)C 271570a_200000049429_100011215700 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.124 CC(=C(C)c1ccccc1N)C 271570a_200000049429_100000210017 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [0,2,0,0,0,0|2,0,0]=4 5689 B12R1.124 CC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000210206 [0,2,0,0,0,0|1,0,0]=3 5690 B12R1.124 CC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000210206 [0,2,0,0,0,0|1,0,0]=3 5691 B12R1.124 CC(C)C(=O)c1ccccc1F 1458a_100000188656_100000210206 [0,2,0,0,0,0|1,0,0]=3 5692 B12R1.124 CC(C)C(=O)c1ccccc1I 1458a_100000187884_100000210206 [0,2,0,0,0,0|1,0,0]=3 5693 B12R1.124 CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000210206 [0,2,0,0,0,0|1,0,0]=3 5694 B12R1.124 CC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000210206 [0,2,0,0,0,0|1,0,0]=3 5695 B12R1.124 CC(c1ccccc1Br)N(C)C 2230a_100000692418_200000210301 [0,2,0,0,0,0|1,0,1]=4 5696 B12R1.124 CC(c1ccccc1Br)N(C)C 269982a_100000692418_200000210301 [0,2,0,0,0,0|1,0,1]=4 5697 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 2230a_100000692418_200025704644 [0,2,0,0,0,0|1,0,1]=4 5698 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 269982a_100000692418_200025704644 [0,2,0,0,0,0|1,0,1]=4 5699 B12R1.124 CC(c1ccccc1Cl)N(C)C 2230a_100102631434_100000181259 [0,2,0,0,0,0|1,0,1]=4 5700 B12R1.124 CC(c1ccccc1Cl)N(C)C 269982a_100102631434_100000181259 [0,2,0,0,0,0|1,0,1]=4 5701 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 5702 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100102631434_200000741388 [0,2,0,0,0,0|1,0,1]=4 5703 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 5704 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100102631434_200000741388 [0,2,0,0,0,0|1,0,1]=4 5705 B12R1.124 CC(c1ccccc1F)N(C)C 34a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 5706 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 2230a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 5707 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 269982a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 5708 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 34a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 5709 B12R1.124 CN(C)C(=O)c1ccccc1Br 11a_100102631434_100000188424 [0,2,0,0,0,0|0,0,0]=2 5710 B12R1.124 CN(C)C(=O)c1ccccc1Br 1626a_100102631434_100000188424 [0,2,0,0,0,0|0,0,0]=2 5711 B12R1.124 CN(C)C(=O)c1ccccc1Br 240690a_100102631434_100000188424 [0,2,0,0,0,0|0,0,0]=2 5712 B12R1.124 CN(C)C(=O)c1ccccc1Br 527a_100102631434_100000188424 [0,2,0,0,0,0|0,0,0]=2 5713 B12R1.124 CN(C)C(=O)c1ccccc1Cl 11a_100102631434_100000185844 [0,2,0,0,0,0|0,0,0]=2 5714 B12R1.124 CN(C)C(=O)c1ccccc1Cl 1626a_100102631434_100000185844 [0,2,0,0,0,0|0,0,0]=2 5715 B12R1.124 CN(C)C(=O)c1ccccc1Cl 240690a_100102631434_100000185844 [0,2,0,0,0,0|0,0,0]=2 5716 B12R1.124 CN(C)C(=O)c1ccccc1Cl 527a_100102631434_100000185844 [0,2,0,0,0,0|0,0,0]=2 5717 B12R1.124 CN(C)C(=O)c1ccccc1F 11a_100102631434_100000188656 [0,2,0,0,0,0|0,0,0]=2 5718 B12R1.124 CN(C)C(=O)c1ccccc1F 1626a_100102631434_100000188656 [0,2,0,0,0,0|0,0,0]=2 5719 B12R1.124 CN(C)C(=O)c1ccccc1F 240690a_100102631434_100000188656 [0,2,0,0,0,0|0,0,0]=2 5720 B12R1.124 CN(C)C(=O)c1ccccc1F 527a_100102631434_100000188656 [0,2,0,0,0,0|0,0,0]=2 5721 B12R1.124 CN(C)C(=O)c1ccccc1I 11a_100102631434_100000187884 [0,2,0,0,0,0|0,0,0]=2 5722 B12R1.124 CN(C)C(=O)c1ccccc1I 1626a_100102631434_100000187884 [0,2,0,0,0,0|0,0,0]=2 5723 B12R1.124 CN(C)C(=O)c1ccccc1I 240690a_100102631434_100000187884 [0,2,0,0,0,0|0,0,0]=2 5724 B12R1.124 CN(C)C(=O)c1ccccc1I 527a_100102631434_100000187884 [0,2,0,0,0,0|0,0,0]=2 5725 B12R1.124 CN(C)C(=O)c1ccccc1O 240690a_100102631434_100015234032 [0,2,0,0,0,0|0,0,0]=2 5726 B12R1.124 CN(C)C(=O)c1ccccc1O 271570a_203496583355_100000159526 [0,2,0,0,0,0|0,0,0]=2 5727 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 1626a_100102631434_100009911694 [0,2,0,0,0,0|0,0,0]=2 5728 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 240690a_100102631434_100009911694 [0,2,0,0,0,0|0,0,0]=2 5729 B12R1.124 CN(C)C(=O)c1ccccc1[O-] 527a_100102631434_100009911694 [0,2,0,0,0,0|0,0,0]=2 5730 B12R1.124 CN(C)C(=O)c1cccnc1O 271570a_203496583355_100000159563 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.124 Cc1ccccc1C(=O)C(C)C 1458a_100000212026_100000210206 [0,2,0,0,0,0|1,0,0]=3 5732 B12R1.124 Cc1ccccc1C(=O)N(C)C 11a_100102631434_100000212026 [0,2,0,0,0,0|0,0,0]=2 5733 B12R1.124 Cc1ccccc1C(=O)N(C)C 1626a_100102631434_100000212026 [0,2,0,0,0,0|0,0,0]=2 5734 B12R1.124 Cc1ccccc1C(=O)N(C)C 240690a_100102631434_100000212026 [0,2,0,0,0,0|0,0,0]=2 5735 B12R1.124 Cc1ccccc1C(=O)N(C)C 527a_100102631434_100000212026 [0,2,0,0,0,0|0,0,0]=2 5736 B12R1.564 O=C(c1ccccc1)C(F)(F)F 1458a_100000185807_200000243211 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.77 C#Cc1ccccc1C(=O)CC 1458a_100011243808_100000210202 [0,2,0,0,0,0|1,0,0]=3 5738 B12R1.77 C#Cc1ccccc1C(=O)CF 1458a_100011243808_100015361967 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.77 C#Cc1ccccc1C(=O)NC 527a_100102657272_100011243808 [0,2,0,0,0,0|0,0,0]=2 5740 B12R1.77 C=Cc1ccccc1C(=O)CC 1458a_100011830265_100000210202 [0,2,0,0,0,0|1,0,0]=3 5741 B12R1.77 C=Cc1ccccc1C(=O)CF 1458a_100011830265_100015361967 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.77 C=Cc1ccccc1C(=O)NC 1626a_100102657272_100011830265 [0,2,0,0,0,0|0,0,0]=2 5743 B12R1.77 C=Cc1ccccc1C(=O)NC 271570a_100011290941_100000155073 [0,2,0,0,0,0|0,0,0]=2 5744 B12R1.77 C=Cc1ccccc1C(=O)NN 271570a_100011290941_100000190081 [0,2,0,0,0,0|1,0,0]=3 5745 B12R1.77 C=Cc1ccccc1C(=O)OC 271570a_100011290941_100000148710 [0,2,0,0,0,0|1,0,0]=3 5746 B12R1.77 C=Cc1ccccc1C(C)NC 271570a_100011290941_100000692418 [0,2,0,0,0,0|1,0,1]=4 5747 B12R1.77 C=Cc1cccnc1C(=O)OC 271570a_100011290941_100011935214 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.77 C=Cc1ccncc1C(=O)OC 271570a_100011290941_100020629055 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.77 C=Cc1cnccc1C(=O)OC 271570a_100011290941_100010008606 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.77 C=Cc1ncccc1C(=O)NC 271570a_100011290941_100000159833 [0,2,0,0,0,0|1,0,0]=3 5751 B12R1.77 C=Cc1ncccc1C(=O)OC 271570a_100011290941_100000150852 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.77 CC(N[13CH3])c1ccccc1C#N 2230a_100160469468_200025704644 [0,2,0,0,0,0|1,0,1]=4 5753 B12R1.77 CCC(=O)c1ccccc1C#N 1458a_100000742908_100000210202 [0,2,0,0,0,0|1,0,0]=3 5754 B12R1.77 CCC(=O)c1ccccc1CC 1458a_100000689120_100000210202 [0,2,0,0,0,0|1,0,0]=3 5755 B12R1.77 CCC(=O)c1ccccc1CO 1458a_100011301526_100000210202 [0,2,0,0,0,0|1,0,0]=3 5756 B12R1.77 CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210202 [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.77 CCC(=O)c1ccccc1OC 1458a_100000185835_100000210202 [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.77 CCC(=O)c1ccccc1OC 7a_100000184720_200000210301 [0,2,0,0,0,0|1,0,0]=3 5759 B12R1.77 CCC(=O)c1ccccc1O[13CH3] 7a_100000184720_200025704644 [0,2,0,0,0,0|1,0,0]=3 5760 B12R1.77 CCC(=O)c1ccccc1SC 1458a_100000183967_100000210202 [0,2,0,0,0,0|1,0,0]=3 5761 B12R1.77 CCc1ccccc1C(=O)CF 1458a_100000689120_100015361967 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.77 CCc1ccccc1C(=O)NC 11a_106832991635_100000689120 [0,2,0,0,0,0|0,0,0]=2 5763 B12R1.77 CCc1ccccc1C(=O)NC 1626a_100102657272_100000689120 [0,2,0,0,0,0|0,0,0]=2 5764 B12R1.77 CCc1ccccc1C(=O)NC 240690a_100102657272_100000689120 [0,2,0,0,0,0|0,0,0]=2 5765 B12R1.77 CCc1ccccc1C(=O)NC 527a_100102657272_100000689120 [0,2,0,0,0,0|0,0,0]=2 5766 B12R1.77 CNC(=O)c1ccccc1C#N 11a_106832991635_100000742908 [0,2,0,0,0,0|0,0,0]=2 5767 B12R1.77 CNC(=O)c1ccccc1C#N 1626a_100102657272_100000742908 [0,2,0,0,0,0|0,0,0]=2 5768 B12R1.77 CNC(=O)c1ccccc1C#N 527a_100102657272_100000742908 [0,2,0,0,0,0|0,0,0]=2 5769 B12R1.77 CNC(=O)c1ccccc1I=O 1626a_100102657272_100000032414 [0,2,0,0,0,0|0,0,0]=2 5770 B12R1.77 CNC(=O)c1ccccc1I=O 240690a_100102657272_100000032414 [0,2,0,0,0,0|0,0,0]=2 5771 B12R1.77 CNC(=O)c1ccccc1I=O 527a_100102657272_100000032414 [0,2,0,0,0,0|0,0,0]=2 5772 B12R1.77 CNC(=O)c1ccccc1NC 27a_100102657272_100000155073 [0,2,0,0,0,0|0,0,0]=2 5773 B12R1.77 CNC(=O)c1ccccc1NC 34a_100000185696_200000210301 [0,2,0,0,0,0|0,0,0]=2 5774 B12R1.77 CNC(=O)c1ccccc1N[13CH3] 34a_100000185696_200025704644 [0,2,0,0,0,0|0,0,0]=2 5775 B12R1.77 CNC(=O)c1ccccc1OC 11a_106832991635_100000185835 [0,2,0,0,0,0|0,0,0]=2 5776 B12R1.77 CNC(=O)c1ccccc1OC 1626a_100102657272_100000185835 [0,2,0,0,0,0|0,0,0]=2 5777 B12R1.77 CNC(=O)c1ccccc1OC 240690a_100102657272_100000185835 [0,2,0,0,0,0|0,0,0]=2 5778 B12R1.77 CNC(=O)c1ccccc1OC 34a_100000185920_200000210301 [0,2,0,0,0,0|0,0,0]=2 5779 B12R1.77 CNC(=O)c1ccccc1OC 527a_100102657272_100000185835 [0,2,0,0,0,0|0,0,0]=2 5780 B12R1.77 CNC(=O)c1ccccc1OC 7a_100000185920_200000210301 [0,2,0,0,0,0|0,0,0]=2 5781 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 34a_100000185920_200025704644 [0,2,0,0,0,0|0,0,0]=2 5782 B12R1.77 CNC(=O)c1ccccc1O[13CH3] 7a_100000185920_200025704644 [0,2,0,0,0,0|0,0,0]=2 5783 B12R1.77 CNC(=O)c1ccccc1SC 11a_106832991635_100000183967 [0,2,0,0,0,0|0,0,0]=2 5784 B12R1.77 CNC(=O)c1ccccc1SC 1626a_100102657272_100000183967 [0,2,0,0,0,0|0,0,0]=2 5785 B12R1.77 CNC(=O)c1ccccc1SC 240690a_100102657272_100000183967 [0,2,0,0,0,0|0,0,0]=2 5786 B12R1.77 CNC(=O)c1ccccc1SC 527a_100102657272_100000183967 [0,2,0,0,0,0|0,0,0]=2 5787 B12R1.77 CNC(=O)c1ccccc1SC 62a_100000155073_200000210301 [0,2,0,0,0,0|0,0,0]=2 5788 B12R1.77 CNC(=O)c1ccccc1SC 62a_200000210301_100000155073 [0,2,0,0,0,0|0,0,0]=2 5789 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_100000155073_200025704644 [0,2,0,0,0,0|0,0,0]=2 5790 B12R1.77 CNC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000155073 [0,2,0,0,0,0|0,0,0]=2 5791 B12R1.77 CNC(=O)c1cccnc1NC 27a_100102657272_100000159833 [0,2,0,0,0,0|1,0,0]=3 5792 B12R1.77 CNC(=O)c1cccnc1SC 62a_100000159833_200000210301 [0,2,0,0,0,0|1,0,0]=3 5793 B12R1.77 CNC(=O)c1cccnc1SC 62a_200000210301_100000159833 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.77 CNC(=O)c1cccnc1S[13CH3] 62a_100000159833_200025704644 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.77 CNC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000159833 [0,2,0,0,0,0|1,0,0]=3 5796 B12R1.77 CNC(=O)c1ncccc1OC 34a_100011376092_200000210301 [0,2,0,0,0,0|1,0,0]=3 5797 B12R1.77 CNC(=O)c1ncccc1OC 7a_100011376092_200000210301 [0,2,0,0,0,0|1,0,0]=3 5798 B12R1.77 CNC(=O)c1ncccc1O[13CH3] 34a_100011376092_200025704644 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.77 CNC(=O)c1ncccc1O[13CH3] 7a_100011376092_200025704644 [0,2,0,0,0,0|1,0,0]=3 5800 B12R1.77 CNC(C)c1ccccc1C#N 2230a_100160469468_200000210301 [0,2,0,0,0,0|1,0,1]=4 5801 B12R1.77 CNC(C)c1ccccc1OC 2230a_100000185323_200000210301 [0,2,0,0,0,0|1,0,1]=4 5802 B12R1.77 CNC(C)c1ccccc1OC 269862a_106832991636_100000173324 [0,2,0,0,0,0|1,0,1]=4 5803 B12R1.77 CNC(C)c1ccccc1SC 62a_100000692418_200000210301 [0,2,0,0,0,0|1,0,1]=4 5804 B12R1.77 CNC(C)c1ccccc1SC 62a_200000210301_100000692418 [0,2,0,0,0,0|1,0,1]=4 5805 B12R1.77 CNC(C)c1ccccc1S[13CH3] 62a_100000692418_200025704644 [0,2,0,0,0,0|1,0,1]=4 5806 B12R1.77 CNC(C)c1ccccc1S[13CH3] 62a_200025704644_100000692418 [0,2,0,0,0,0|1,0,1]=4 5807 B12R1.77 CNc1ncccc1C(=O)OC 27a_100102657272_100000150852 [0,2,0,0,0,0|2,0,0]=4 5808 B12R1.77 COC(=O)c1ccccc1OC 7a_100000150335_200000210301 [0,2,0,0,0,0|1,0,0]=3 5809 B12R1.77 COC(=O)c1ccccc1O[13CH3] 7a_100000150335_200025704644 [0,2,0,0,0,0|1,0,0]=3 5810 B12R1.77 COC(=O)c1ccccc1SC 62a_100000148710_200000210301 [0,2,0,0,0,0|1,0,0]=3 5811 B12R1.77 COC(=O)c1ccccc1SC 62a_200000210301_100000148710 [0,2,0,0,0,0|1,0,0]=3 5812 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_100000148710_200025704644 [0,2,0,0,0,0|1,0,0]=3 5813 B12R1.77 COC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000148710 [0,2,0,0,0,0|1,0,0]=3 5814 B12R1.77 COC(=O)c1cccnc1SC 62a_100011587185_200000210301 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.77 COC(=O)c1cccnc1SC 62a_200000210301_100000150852 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_100011587185_200025704644 [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.77 COC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000150852 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.77 COC(=O)c1ccncc1SC 62a_100010008606_200000210301 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.77 COC(=O)c1ccncc1SC 62a_200000210301_100010008606 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_100010008606_200025704644 [0,2,0,0,0,0|2,0,0]=4 5821 B12R1.77 COC(=O)c1ccncc1S[13CH3] 62a_200025704644_100010008606 [0,2,0,0,0,0|2,0,0]=4 5822 B12R1.77 COC(=O)c1cnccc1SC 62a_100020629055_200000210301 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.77 COC(=O)c1cnccc1SC 62a_200000210301_100020629055 [0,2,0,0,0,0|2,0,0]=4 5824 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_100020629055_200025704644 [0,2,0,0,0,0|2,0,0]=4 5825 B12R1.77 COC(=O)c1cnccc1S[13CH3] 62a_200025704644_100020629055 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.77 COC(=O)c1ncccc1OC 34a_100000744052_200000210301 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.77 COC(=O)c1ncccc1OC 7a_100000744052_200000210301 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.77 COC(=O)c1ncccc1O[13CH3] 34a_100000744052_200025704644 [0,2,0,0,0,0|2,0,0]=4 5829 B12R1.77 COC(=O)c1ncccc1O[13CH3] 7a_100000744052_200025704644 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.77 COC(=O)c1ncccc1SC 62a_100011935214_200000210301 [0,2,0,0,0,0|2,0,0]=4 5831 B12R1.77 COC(=O)c1ncccc1SC 62a_200000210301_100011935214 [0,2,0,0,0,0|2,0,0]=4 5832 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_100011935214_200025704644 [0,2,0,0,0,0|2,0,0]=4 5833 B12R1.77 COC(=O)c1ncccc1S[13CH3] 62a_200025704644_100011935214 [0,2,0,0,0,0|2,0,0]=4 5834 B12R1.77 COc1ccccc1C(=O)CBr 7a_100000188908_200000210301 [0,2,0,0,0,0|2,0,0]=4 5835 B12R1.77 COc1ccccc1C(=O)CF 1458a_100000185835_100015361967 [0,2,0,0,0,0|2,0,0]=4 5836 B12R1.77 COc1ccccc1C(=O)NN 34a_100000186518_200000210301 [0,2,0,0,0,0|1,0,0]=3 5837 B12R1.77 COc1ccccc1C(=O)NO 34a_100000188472_200000210301 [0,2,0,0,0,0|1,0,0]=3 5838 B12R1.77 COc1ccccc1C(C)N[13CH3] 2230a_100000185323_200025704644 [0,2,0,0,0,0|1,0,1]=4 5839 B12R1.77 CSc1ccccc1C(=O)CF 1458a_100000183967_100015361967 [0,2,0,0,0,0|2,0,0]=4 5840 B12R1.77 CSc1ccccc1C(=O)NN 62a_100000190081_200000210301 [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.77 CSc1ccccc1C(=O)NN 62a_200000210301_100000190081 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.77 CSc1ccccc1C(=O)O[Na] 62a_200000210301_114855342371 [0,2,0,0,0,0|2,0,0]=4 5843 B12R1.77 N#Cc1ccccc1C(=O)CF 1458a_100000742908_100015361967 [0,2,0,0,0,0|2,0,0]=4 5844 B12R1.77 O=C(CF)c1ccccc1CO 1458a_100011301526_100015361967 [0,2,0,0,0,0|2,0,0]=4 5845 B12R1.77 O=Ic1ccccc1C(=O)CF 1458a_100000032414_100015361967 [0,2,0,0,0,0|2,0,0]=4 5846 B12R1.77 [13CH3]Oc1ccccc1C(=O)CBr 7a_100000188908_200025704644 [0,2,0,0,0,0|2,0,0]=4 5847 B12R1.77 [13CH3]Oc1ccccc1C(=O)NN 34a_100000186518_200025704644 [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.77 [13CH3]Oc1ccccc1C(=O)NO 34a_100000188472_200025704644 [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.77 [13CH3]Sc1ccccc1C(=O)NN 62a_100000190081_200025704644 [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.77 [13CH3]Sc1ccccc1C(=O)NN 62a_200025704644_100000190081 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.77 [13CH3]Sc1ccccc1C(=O)O[Na] 62a_200025704644_114855342371 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.3441 CC(N[13CH3])c1c(cccc1F)F 2230a_100025772709_200025704644 [0,2,0,0,0,0|1,0,1]=4 5853 B12R1.3441 CC(N[13CH3])c1c(cccc1F)F 34a_100025772709_200025704644 [0,2,0,0,0,0|1,0,1]=4 5854 B12R1.3441 CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210202 [0,2,0,0,0,0|1,0,0]=3 5855 B12R1.3441 CCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210202 [0,2,0,0,0,0|1,0,0]=3 5856 B12R1.3441 CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210202 [0,2,0,0,0,0|1,0,0]=3 5857 B12R1.3441 CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210202 [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.3441 CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210202 [0,2,0,0,0,0|1,0,0]=3 5859 B12R1.3441 CCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210202 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.3441 CCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210202 [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.3441 CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210202 [0,2,0,0,0,0|1,0,0]=3 5862 B12R1.3441 CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210202 [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.3441 CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210202 [0,2,0,0,0,0|1,0,0]=3 5864 B12R1.3441 CCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210202 [0,2,0,0,0,0|1,0,0]=3 5865 B12R1.3441 CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210202 [0,2,0,0,0,0|1,0,0]=3 5866 B12R1.3441 CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210202 [0,2,0,0,0,0|1,0,0]=3 5867 B12R1.3441 CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210202 [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.3441 CCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210202 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.3441 CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210202 [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.3441 CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210202 [0,2,0,0,0,0|1,0,0]=3 5871 B12R1.3441 CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210202 [0,2,0,0,0,0|1,0,0]=3 5872 B12R1.3441 CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210202 [0,2,0,0,0,0|1,0,0]=3 5873 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 11a_106832991635_100000690891 [0,2,0,0,0,0|0,0,0]=2 5874 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 1626a_100102657272_100000690891 [0,2,0,0,0,0|0,0,0]=2 5875 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 240690a_100102657272_100000690891 [0,2,0,0,0,0|0,0,0]=2 5876 B12R1.3441 CNC(=O)c1c(cccc1Br)Br 527a_100102657272_100000690891 [0,2,0,0,0,0|0,0,0]=2 5877 B12R1.3441 CNC(=O)c1c(cccc1Br)C 11a_106832991635_100000701904 [0,2,0,0,0,0|0,0,0]=2 5878 B12R1.3441 CNC(=O)c1c(cccc1Br)C 1626a_100102657272_100000701904 [0,2,0,0,0,0|0,0,0]=2 5879 B12R1.3441 CNC(=O)c1c(cccc1Br)C 240690a_100102657272_100000701904 [0,2,0,0,0,0|0,0,0]=2 5880 B12R1.3441 CNC(=O)c1c(cccc1Br)C 527a_100102657272_100000701904 [0,2,0,0,0,0|0,0,0]=2 5881 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 11a_106832991635_100011253703 [0,2,0,0,0,0|0,0,0]=2 5882 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 1626a_100102657272_100011253703 [0,2,0,0,0,0|0,0,0]=2 5883 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 240690a_100102657272_100011253703 [0,2,0,0,0,0|0,0,0]=2 5884 B12R1.3441 CNC(=O)c1c(cccc1Br)Cl 527a_100102657272_100011253703 [0,2,0,0,0,0|0,0,0]=2 5885 B12R1.3441 CNC(=O)c1c(cccc1Br)F 11a_106832991635_100000752694 [0,2,0,0,0,0|0,0,0]=2 5886 B12R1.3441 CNC(=O)c1c(cccc1Br)F 1626a_100102657272_100000752694 [0,2,0,0,0,0|0,0,0]=2 5887 B12R1.3441 CNC(=O)c1c(cccc1Br)F 240690a_100102657272_100000752694 [0,2,0,0,0,0|0,0,0]=2 5888 B12R1.3441 CNC(=O)c1c(cccc1Br)F 527a_100102657272_100000752694 [0,2,0,0,0,0|0,0,0]=2 5889 B12R1.3441 CNC(=O)c1c(cccc1Br)O 240690a_100102657272_100011935254 [0,2,0,0,0,0|0,0,0]=2 5890 B12R1.3441 CNC(=O)c1c(cccc1Br)O 527a_100102657272_100011935254 [0,2,0,0,0,0|0,0,0]=2 5891 B12R1.3441 CNC(=O)c1c(cccc1C)C 11a_106832991635_100000758298 [0,2,0,0,0,0|0,0,0]=2 5892 B12R1.3441 CNC(=O)c1c(cccc1C)C 1626a_100102657272_100000758298 [0,2,0,0,0,0|0,0,0]=2 5893 B12R1.3441 CNC(=O)c1c(cccc1C)C 240690a_100102657272_100000758298 [0,2,0,0,0,0|0,0,0]=2 5894 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 11a_106832991635_100000692601 [0,2,0,0,0,0|0,0,0]=2 5895 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 1626a_100102657272_100000692601 [0,2,0,0,0,0|0,0,0]=2 5896 B12R1.3441 CNC(=O)c1c(cccc1Cl)C 240690a_100102657272_100000692601 [0,2,0,0,0,0|0,0,0]=2 5897 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 11a_106832991635_100000210656 [0,2,0,0,0,0|0,0,0]=2 5898 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 1626a_100102657272_100000210656 [0,2,0,0,0,0|0,0,0]=2 5899 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl 240690a_100102657272_100000210656 [0,2,0,0,0,0|0,0,0]=2 5900 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 11a_106832991635_100000210369 [0,2,0,0,0,0|0,0,0]=2 5901 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 1626a_100102657272_100000210369 [0,2,0,0,0,0|0,0,0]=2 5902 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 240690a_100102657272_100000210369 [0,2,0,0,0,0|0,0,0]=2 5903 B12R1.3441 CNC(=O)c1c(cccc1Cl)F 527a_100102657272_100000210369 [0,2,0,0,0,0|0,0,0]=2 5904 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 240690a_100102657272_100000745519 [0,2,0,0,0,0|0,0,0]=2 5905 B12R1.3441 CNC(=O)c1c(cccc1Cl)O 527a_100102657272_100000745519 [0,2,0,0,0,0|0,0,0]=2 5906 B12R1.3441 CNC(=O)c1c(cccc1F)C 11a_106832991635_100000762013 [0,2,0,0,0,0|0,0,0]=2 5907 B12R1.3441 CNC(=O)c1c(cccc1F)C 1626a_100102657272_100000762013 [0,2,0,0,0,0|0,0,0]=2 5908 B12R1.3441 CNC(=O)c1c(cccc1F)C 240690a_100102657272_100000762013 [0,2,0,0,0,0|0,0,0]=2 5909 B12R1.3441 CNC(=O)c1c(cccc1F)C 527a_100102657272_100000762013 [0,2,0,0,0,0|0,0,0]=2 5910 B12R1.3441 CNC(=O)c1c(cccc1F)F 11a_106832991635_100000210804 [0,2,0,0,0,0|0,0,0]=2 5911 B12R1.3441 CNC(=O)c1c(cccc1F)F 1626a_100102657272_100000210804 [0,2,0,0,0,0|0,0,0]=2 5912 B12R1.3441 CNC(=O)c1c(cccc1F)F 240690a_100102657272_100000210804 [0,2,0,0,0,0|0,0,0]=2 5913 B12R1.3441 CNC(=O)c1c(cccc1F)F 527a_100102657272_100000210804 [0,2,0,0,0,0|0,0,0]=2 5914 B12R1.3441 CNC(=O)c1c(cccc1F)O 271570a_203496583355_100012642803 [0,2,0,0,0,0|0,0,0]=2 5915 B12R1.3441 CNC(=O)c1c(cccc1F)O 527a_100102657272_100000763259 [0,2,0,0,0,0|0,0,0]=2 5916 B12R1.3441 CNC(=O)c1c(cccc1I)Br 11a_106832991635_100010232521 [0,2,0,0,0,0|0,0,0]=2 5917 B12R1.3441 CNC(=O)c1c(cccc1I)Br 1626a_100102657272_100010232521 [0,2,0,0,0,0|0,0,0]=2 5918 B12R1.3441 CNC(=O)c1c(cccc1I)Br 240690a_100102657272_100010232521 [0,2,0,0,0,0|0,0,0]=2 5919 B12R1.3441 CNC(=O)c1c(cccc1I)Br 527a_100102657272_100010232521 [0,2,0,0,0,0|0,0,0]=2 5920 B12R1.3441 CNC(=O)c1c(cccc1I)C 11a_106832991635_100000688020 [0,2,0,0,0,0|0,0,0]=2 5921 B12R1.3441 CNC(=O)c1c(cccc1I)C 1626a_100102657272_100000688020 [0,2,0,0,0,0|0,0,0]=2 5922 B12R1.3441 CNC(=O)c1c(cccc1I)C 240690a_100102657272_100000688020 [0,2,0,0,0,0|0,0,0]=2 5923 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 11a_106832991635_100000702859 [0,2,0,0,0,0|0,0,0]=2 5924 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 1626a_100102657272_100000702859 [0,2,0,0,0,0|0,0,0]=2 5925 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 240690a_100102657272_100000702859 [0,2,0,0,0,0|0,0,0]=2 5926 B12R1.3441 CNC(=O)c1c(cccc1I)Cl 527a_100102657272_100000702859 [0,2,0,0,0,0|0,0,0]=2 5927 B12R1.3441 CNC(=O)c1c(cccc1I)F 11a_106832991635_100000023732 [0,2,0,0,0,0|0,0,0]=2 5928 B12R1.3441 CNC(=O)c1c(cccc1I)F 1626a_100102657272_100000023732 [0,2,0,0,0,0|0,0,0]=2 5929 B12R1.3441 CNC(=O)c1c(cccc1I)F 240690a_100102657272_100000023732 [0,2,0,0,0,0|0,0,0]=2 5930 B12R1.3441 CNC(=O)c1c(cccc1O)O 527a_100102657272_100000755285 [0,2,0,0,0,0|0,0,0]=2 5931 B12R1.3441 CNC(C)c1c(cccc1F)F 2230a_100025772709_200000210301 [0,2,0,0,0,0|1,0,1]=4 5932 B12R1.3441 CNC(C)c1c(cccc1F)F 34a_100025772709_200000210301 [0,2,0,0,0,0|1,0,1]=4 5933 B12R1.3441 CN[C@@H](C)c1c(cccc1C)C 2230a_100016987977_200000210301 [0,2,0,0,0,0|1,0,1]=4 5934 B12R1.3441 CN[C@@H](C)c1c(cccc1C)C 34a_100016987977_200000210301 [0,2,0,0,0,0|1,0,1]=4 5935 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)Cl 2230a_100016989663_200000210301 [0,2,0,0,0,0|1,0,1]=4 5936 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)Cl 34a_100016989663_200000210301 [0,2,0,0,0,0|1,0,1]=4 5937 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)F 2230a_100011997870_200000210301 [0,2,0,0,0,0|1,0,1]=4 5938 B12R1.3441 CN[C@H](C)c1c(cccc1Cl)F 34a_100011997870_200000210301 [0,2,0,0,0,0|1,0,1]=4 5939 B12R1.3441 COC(=O)c1c(cccc1Br)O 271570a_203496583355_100010247157 [0,2,0,0,0,0|1,0,0]=3 5940 B12R1.3441 COC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010150959 [0,2,0,0,0,0|1,0,0]=3 5941 B12R1.3441 COC(=O)c1c(cccc1F)O 271570a_203496583355_100000150693 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.3441 COC(=O)c1c(cccc1O)C 271570a_203496583355_100010204206 [0,2,0,0,0,0|1,0,0]=3 5943 B12R1.3441 COC(=O)c1c(cccc1O)N 271570a_203496583355_100010253892 [0,2,0,0,0,0|1,0,0]=3 5944 B12R1.3441 COC(=O)c1c(ccnc1Cl)O 271570a_203496583355_100010138530 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.3441 COC(=O)c1c(ccnc1F)O 271570a_203496583355_100010150474 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.3441 COC(=O)c1c(ccnc1O)F 271570a_203496583355_100015560809 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.3441 COC(=O)c1c(ccnc1O)N 271570a_203496583355_100009985557 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.3441 COC(=O)c1c(cncc1F)O 271570a_203496583355_100010189632 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)Cl 2230a_100016989663_200025704644 [0,2,0,0,0,0|1,0,1]=4 5950 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)Cl 34a_100016989663_200025704644 [0,2,0,0,0,0|1,0,1]=4 5951 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)F 2230a_100011997870_200025704644 [0,2,0,0,0,0|1,0,1]=4 5952 B12R1.3441 C[C@@H](N[13CH3])c1c(cccc1Cl)F 34a_100011997870_200025704644 [0,2,0,0,0,0|1,0,1]=4 5953 B12R1.3441 Cc1cccc(c1C(=O)CF)Br 1458a_100000701904_100015361967 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.3441 Cc1cccc(c1C(=O)CF)C 1458a_100000758298_100015361967 [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.3441 Cc1cccc(c1C(=O)CF)Cl 1458a_100000692601_100015361967 [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.3441 Cc1cccc(c1C(=O)CF)F 1458a_100000762013_100015361967 [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.3441 Cc1cccc(c1C(=O)CF)I 1458a_100000688020_100015361967 [0,2,0,0,0,0|2,0,0]=4 5958 B12R1.3441 Cc1cccc(c1C(=O)CF)O 1458a_100011934116_100015361967 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.3441 Cc1cccc(c1[C@H](C)N[13CH3])C 2230a_100016987977_200025704644 [0,2,0,0,0,0|1,0,1]=4 5960 B12R1.3441 Cc1cccc(c1[C@H](C)N[13CH3])C 34a_100016987977_200025704644 [0,2,0,0,0,0|1,0,1]=4 5961 B12R1.3441 O=C(CF)c1c(cccc1Br)Br 1458a_100000690891_100015361967 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.3441 O=C(CF)c1c(cccc1Br)Cl 1458a_100011253703_100015361967 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.3441 O=C(CF)c1c(cccc1Br)F 1458a_100000752694_100015361967 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.3441 O=C(CF)c1c(cccc1Br)O 1458a_100011935254_100015361967 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.3441 O=C(CF)c1c(cccc1Cl)Cl 1458a_100000210656_100015361967 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.3441 O=C(CF)c1c(cccc1Cl)F 1458a_100000210369_100015361967 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.3441 O=C(CF)c1c(cccc1Cl)O 1458a_100000745519_100015361967 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.3441 O=C(CF)c1c(cccc1F)F 1458a_100000210804_100015361967 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.3441 O=C(CF)c1c(cccc1F)O 1458a_100000763259_100015361967 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.3441 O=C(CF)c1c(cccc1I)Br 1458a_100010232521_100015361967 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.3441 O=C(CF)c1c(cccc1I)Cl 1458a_100000702859_100015361967 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.3441 O=C(CF)c1c(cccc1I)F 1458a_100000023732_100015361967 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.3441 O=C(CF)c1c(cccc1O)O 1458a_100000755285_100015361967 [0,2,0,0,0,0|2,0,0]=4 5974 B10R1.176 C=Cc1c[nH]c(=O)c(c1)Br 271570a_100011290941_100010125443 [0,0,1,1,0,0|1,0,1]=4 5975 B10R1.176 C=Cc1c[nH]c(=O)c(c1)F 271570a_100011290941_100000723523 [0,0,1,1,0,0|1,0,1]=4 5976 B10R1.176 C=Cc1c[nH]c(=O)c(c1)O 271570a_100011290941_100009814561 [0,0,1,1,0,0|1,0,1]=4 5977 B10R1.176 C=Cc1cc(c(=O)[nH]n1)C 271570a_100011290941_100012187101 [0,0,1,1,0,0|1,0,1]=4 5978 B10R1.176 C=Cc1cc(c(=O)[nH]n1)N 271570a_100011290941_100000102183 [0,0,1,1,0,0|2,0,0]=4 5979 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [0,0,1,1,0,0|2,0,0]=4 5980 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [0,0,1,1,0,0|2,0,0]=4 5981 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [0,0,1,1,0,0|2,0,0]=4 5982 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [0,0,1,1,0,0|2,0,0]=4 5983 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [0,0,1,1,0,0|1,0,1]=4 5984 B10R1.2 C=Cc1cccn(c1=O)C 271570a_100011290941_100000687173 [0,0,1,1,0,0|0,0,0]=2 5985 B10R1.2 COc1cccn(c1=O)C 34a_100000117616_200000210301 [0,0,1,1,0,0|1,0,1]=4 5986 B10R1.2 COc1cccn(c1=O)C 7a_100000117616_200000210301 [0,0,1,1,0,0|1,0,1]=4 5987 B10R1.2 CSc1cccn(c1=O)C 62a_100000687173_200000210301 [0,0,1,1,0,0|1,0,1]=4 5988 B10R1.2 CSc1cccn(c1=O)C 62a_200000210301_100000687173 [0,0,1,1,0,0|1,0,1]=4 5989 B10R1.2 Cn1cccc(c1=O)O[13CH3] 34a_100000117616_200025704644 [0,0,1,1,0,0|1,0,1]=4 5990 B10R1.2 Cn1cccc(c1=O)O[13CH3] 7a_100000117616_200025704644 [0,0,1,1,0,0|1,0,1]=4 5991 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_100000687173_200025704644 [0,0,1,1,0,0|1,0,1]=4 5992 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_200025704644_100000687173 [0,0,1,1,0,0|1,0,1]=4 5993 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [0,0,1,1,0,0|2,0,0]=4 5994 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [0,0,1,1,0,0|1,0,0]=3 5995 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [0,0,1,1,0,0|1,0,0]=3 5996 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [0,0,1,1,0,0|2,0,0]=4 5997 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [0,0,1,1,0,0|1,0,0]=3 5998 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [0,0,1,1,0,0|2,0,0]=4 5999 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [0,0,1,1,0,0|2,0,0]=4 6000 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [0,0,1,1,0,0|2,0,0]=4 6001 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [0,0,1,1,0,0|2,0,0]=4 6002 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [0,0,1,1,0,0|2,0,0]=4 6003 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [0,0,1,1,0,0|2,0,0]=4 6004 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [0,0,1,1,0,0|2,0,0]=4 6005 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [0,0,1,1,0,0|1,0,0]=3 6006 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [0,0,1,1,0,0|2,0,0]=4 6007 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [0,0,1,1,0,0|2,0,0]=4 6008 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [0,0,1,1,0,0|2,0,0]=4 6009 B10R1.20 C=Cc1cnccc1NC 271570a_100011290941_100010069531 [0,0,1,1,0,0|2,0,0]=4 6010 B10R1.20 C=Cc1cncnc1NC 271570a_100011290941_200012180720 [0,0,1,1,0,0|2,0,0]=4 6011 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [0,0,1,1,0,0|2,0,0]=4 6012 B10R1.20 C=Cc1nccnc1NC 271570a_100011290941_100011529439 [0,0,1,1,0,0|2,0,0]=4 6013 B10R1.27 CNC(=O)Cc1ccc[nH]1 11a_106832991635_100000238377 [0,0,1,1,0,0|1,0,1]=4 6014 B10R1.27 CNC(=O)Cc1ccc[nH]1 240690a_100102657272_100000238377 [0,0,1,1,0,0|1,0,1]=4 6015 B10R1.27 CNC(=O)Cc1ccc[nH]1 527a_100102657272_100000238377 [0,0,1,1,0,0|1,0,1]=4 6016 B10R1.27 CNC(=O)Cc1ccco1 11a_106832991635_100011217309 [0,0,1,1,0,0|1,0,1]=4 6017 B10R1.27 CNC(=O)Cc1ccco1 527a_100102657272_100011217309 [0,0,1,1,0,0|1,0,1]=4 6018 B10R1.27 CNC(=O)Cc1cccs1 11a_106832991635_100000210189 [0,0,1,1,0,0|1,0,1]=4 6019 B10R1.27 CNC(=O)Cc1cccs1 1626a_100102657272_100000210189 [0,0,1,1,0,0|1,0,1]=4 6020 B10R1.27 CNC(=O)Cc1cccs1 240690a_100102657272_100000210189 [0,0,1,1,0,0|1,0,1]=4 6021 B10R1.27 CNC(=O)Cc1ccoc1 11a_106832991635_100000684892 [0,0,1,1,0,0|1,0,1]=4 6022 B10R1.27 CNC(=O)Cc1ccoc1 1626a_100102657272_100000684892 [0,0,1,1,0,0|1,0,1]=4 6023 B10R1.27 CNC(=O)Cc1ccoc1 240690a_100102657272_100000684892 [0,0,1,1,0,0|1,0,1]=4 6024 B10R1.27 CNC(=O)Cc1ccoc1 527a_100102657272_100000684892 [0,0,1,1,0,0|1,0,1]=4 6025 B10R1.27 CNC(=O)Cc1ccsc1 11a_106832991635_100000184062 [0,0,1,1,0,0|1,0,1]=4 6026 B10R1.27 CNC(=O)Cc1ccsc1 1626a_100102657272_100000184062 [0,0,1,1,0,0|1,0,1]=4 6027 B10R1.27 CNC(=O)Cc1ccsc1 240690a_100102657272_100000184062 [0,0,1,1,0,0|1,0,1]=4 6028 B10R1.27 CNC(=O)Cc1ccsc1 527a_100102657272_100000184062 [0,0,1,1,0,0|1,0,1]=4 6029 B10R1.27 CNC(=O)Cn1cccc1 11a_106832991635_100011196272 [0,0,1,1,0,0|1,0,1]=4 6030 B10R1.27 CNC(=O)Cn1cccc1 1626a_100102657272_100011196272 [0,0,1,1,0,0|1,0,1]=4 6031 B10R1.27 CNC(=O)Cn1cccc1 527a_100102657272_100011196272 [0,0,1,1,0,0|1,0,1]=4 6032 B10R1.172 C=Cc1cc(ccn1)NC 271570a_100011290941_100009869472 [0,0,1,1,0,0|2,0,0]=4 6033 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [0,0,1,1,0,0|2,0,0]=4 6034 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [0,0,1,1,0,0|1,0,0]=3 6035 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [0,0,1,1,0,0|1,0,0]=3 6036 B10R1.172 C=Cc1cccc(c1)NN 271570a_100011290941_100000217339 [0,0,1,1,0,0|2,0,0]=4 6037 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [0,0,1,1,0,0|1,0,0]=3 6038 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [0,0,1,1,0,0|2,0,0]=4 6039 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [0,0,1,1,0,0|2,0,0]=4 6040 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [0,0,1,1,0,0|2,0,0]=4 6041 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [0,0,1,1,0,0|2,0,0]=4 6042 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [0,0,1,1,0,0|2,0,0]=4 6043 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [0,0,1,1,0,0|2,0,0]=4 6044 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [0,0,1,1,0,0|2,0,0]=4 6045 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [0,0,1,1,0,0|2,0,0]=4 6046 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [0,0,1,1,0,0|2,0,0]=4 6047 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [0,0,1,1,0,0|2,0,0]=4 6048 B10R1.172 C=Cc1cccc(n1)CC 271570a_100011290941_100009856026 [0,0,1,1,0,0|2,0,0]=4 6049 B10R1.172 C=Cc1cccc(n1)NC 271570a_100011290941_100000703281 [0,0,1,1,0,0|1,0,0]=3 6050 B10R1.172 C=Cc1cccc(n1)NN 271570a_100011290941_100009817029 [0,0,1,1,0,0|2,0,0]=4 6051 B10R1.172 C=Cc1cccc(n1)OC 271570a_100011290941_100000760917 [0,0,1,1,0,0|2,0,0]=4 6052 B10R1.172 C=Cc1cccc(n1)SC 271570a_100011290941_100011960944 [0,0,1,1,0,0|2,0,0]=4 6053 B10R1.172 C=Cc1ccnc(c1)NC 271570a_100011290941_100009819592 [0,0,1,1,0,0|2,0,0]=4 6054 B10R1.172 C=Cc1ccnc(n1)NC 271570a_100011290941_100012000420 [0,0,1,1,0,0|2,0,0]=4 6055 B10R1.172 C=Cc1cncc(c1)NC 271570a_100011290941_100012184536 [0,0,1,1,0,0|2,0,0]=4 6056 B10R1.172 C=Cc1cncc(n1)NC 271570a_100011290941_100011529438 [0,0,1,1,0,0|2,0,0]=4 6057 B10R1.172 C=Cc1nccc(n1)NC 271570a_100011290941_100011649947 [0,0,1,1,0,0|2,0,0]=4 6058 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|1,0,1]=4 6059 B12R2.11 CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 6060 B12R2.11 CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 6061 B12R2.11 CN1C[C@@H]1Cc2ccccc2 34a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 6062 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 2230a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 6063 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 269982a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 6064 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 34a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 6065 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,0,0,1,0,1|1,0,1]=4 6066 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [0,0,0,1,0,1|0,0,1]=3 6067 B12R2.27 CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_200000210301 [0,0,0,1,0,1|1,0,1]=4 6068 B12R2.27 CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_200000210301 [0,0,0,1,0,1|1,0,1]=4 6069 B12R2.27 [13CH3]N[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_200025704644 [0,0,0,1,0,1|1,0,1]=4 6070 B12R2.27 [13CH3]N[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_200025704644 [0,0,0,1,0,1|1,0,1]=4 6071 B12R2.32 CNC1Cc2ccccc2C1 2230a_100000753258_200000210301 [0,0,0,1,0,1|1,0,1]=4 6072 B12R2.32 CNC1Cc2ccccc2C1 34a_100000753258_200000210301 [0,0,0,1,0,1|1,0,1]=4 6073 B12R2.32 CNC1Cc2ccccc2C1 34a_100102657272_100000753484 [0,0,0,1,0,1|1,0,1]=4 6074 B12R2.32 CNC1Cc2ccccc2C1 7a_106832991635_100000753484 [0,0,0,1,0,1|1,0,1]=4 6075 B12R2.32 CNc1nc2ccccc2[nH]1 27a_100102657272_100009814255 [0,0,0,1,0,1|1,0,0]=3 6076 B12R2.32 CNc1nc2ccccc2s1 27a_100102657272_100000751744 [0,0,0,1,0,1|0,1,0]=3 6077 B12R2.32 CNc1nc2cccnc2s1 27a_100102657272_100010188088 [0,0,0,1,0,1|1,1,0]=4 6078 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,0,0,1,0,1|2,0,0]=4 6079 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,0,0,1,0,1|1,0,1]=4 6080 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,0,0,1,0,1|1,1,0]=4 6081 B12R2.32 CSc1nc2ccccc2[nH]1 62a_200000210301_100009814255 [0,0,0,1,0,1|2,0,0]=4 6082 B12R2.32 CSc1nc2ccccc2s1 62a_200000210301_100000751744 [0,0,0,1,0,1|1,1,0]=4 6083 B12R2.32 [13CH3]NC1Cc2ccccc2C1 2230a_100000753258_200025704644 [0,0,0,1,0,1|1,0,1]=4 6084 B12R2.32 [13CH3]NC1Cc2ccccc2C1 34a_100000753258_200025704644 [0,0,0,1,0,1|1,0,1]=4 6085 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,0,0,1,0,1|2,0,0]=4 6086 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,0,0,1,0,1|1,0,1]=4 6087 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,0,0,1,0,1|1,1,0]=4 6088 B12R2.32 [13CH3]Sc1nc2ccccc2[nH]1 62a_200025704644_100009814255 [0,0,0,1,0,1|2,0,0]=4 6089 B12R2.32 [13CH3]Sc1nc2ccccc2s1 62a_200025704644_100000751744 [0,0,0,1,0,1|1,1,0]=4 6090 B12R2.48 CNC1(CC1)c2ccccc2 2230a_100000749958_200000210301 [0,1,0,1,0,0|1,0,1]=4 6091 B12R2.48 [13CH3]NC1(CC1)c2ccccc2 2230a_100000749958_200025704644 [0,1,0,1,0,0|1,0,1]=4 6092 B12R2.1 CNC1CCc2c1cccc2 2230a_106832991635_200000721974 [0,1,0,1,0,0|1,0,1]=4 6093 B12R2.1 CNC1CCc2c1cccc2 269862a_106832991636_100000212051 [0,1,0,1,0,0|1,0,1]=4 6094 B12R2.1 CNC1COc2c1cccc2 2230a_100000747519_200000210301 [0,1,0,1,0,0|0,0,2]=4 6095 B12R2.1 CN[C@H]1CCc2c1cccc2 2230a_100016989578_200000210301 [0,1,0,1,0,0|1,0,1]=4 6096 B12R2.1 CN[C@H]1CCc2c1cccc2 34a_100016989578_200000210301 [0,1,0,1,0,0|1,0,1]=4 6097 B12R2.1 CNc1n[nH]c2c1cccn2 27a_100102657272_100009818534 [0,1,0,1,0,0|2,0,0]=4 6098 B12R2.1 CNc1n[nH]c2c1cncc2 27a_100102657272_100009820117 [0,1,0,1,0,0|2,0,0]=4 6099 B12R2.1 CNc1n[nH]c2c1nccc2 27a_100102657272_100009817118 [0,1,0,1,0,0|2,0,0]=4 6100 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,1,0,0|1,1,0]=4 6101 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,1,0,0|1,1,0]=4 6102 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,1,0,0|1,0,1]=4 6103 B12R2.1 CSc1csc2c1cccc2 62a_200000210301_100009813928 [0,1,0,1,0,0|1,1,0]=4 6104 B12R2.1 CSc1n[nH]c2c1cccc2 62a_200000210301_100000050141 [0,1,0,1,0,0|2,0,0]=4 6105 B12R2.1 CSc1noc2c1cccc2 62a_200000210301_200000703156 [0,1,0,1,0,0|1,0,1]=4 6106 B12R2.1 CSc1noc2c1cccc2 62a_200000703156_200000210301 [0,1,0,1,0,0|1,0,1]=4 6107 B12R2.1 [13CH3]NC1COc2c1cccc2 2230a_100000747519_200025704644 [0,1,0,1,0,0|0,0,2]=4 6108 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 2230a_100016989578_200025704644 [0,1,0,1,0,0|1,0,1]=4 6109 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 34a_100016989578_200025704644 [0,1,0,1,0,0|1,0,1]=4 6110 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,1,0,0|1,1,0]=4 6111 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,1,0,0|1,1,0]=4 6112 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,1,0,0|1,0,1]=4 6113 B12R2.1 [13CH3]Sc1csc2c1cccc2 62a_200025704644_100009813928 [0,1,0,1,0,0|1,1,0]=4 6114 B12R2.1 [13CH3]Sc1n[nH]c2c1cccc2 62a_200025704644_100000050141 [0,1,0,1,0,0|2,0,0]=4 6115 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200000703156_200025704644 [0,1,0,1,0,0|1,0,1]=4 6116 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200025704644_200000703156 [0,1,0,1,0,0|1,0,1]=4 6117 B12R2.2 C1=C(CCC1)c2ccccc2 271570a_100000089523_100000210277 [0,1,0,1,0,0|2,0,0]=4 6118 B12R2.2 C1=C(CCO1)c2ccccc2 271570a_100000118173_100000210277 [0,1,0,1,0,0|1,0,1]=4 6119 B12R2.2 C1=C(COC1)c2ccccc2 271570a_100009872500_100000210277 [0,1,0,1,0,0|1,0,1]=4 6120 B12R2.2 c1ccc(cc1)c2c[nH]cn2 271570a_100011218836_100000756875 [0,1,0,1,0,0|1,0,1]=4 6121 B12R2.2 c1ccc(cc1)c2cc[nH]c2 271570a_100000102155_100000210277 [0,1,0,1,0,0|1,0,1]=4 6122 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100000210277 [0,1,0,1,0,0|1,0,1]=4 6123 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100011218836_100000062575 [0,1,0,1,0,0|1,0,1]=4 6124 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100000041997_100000210277 [0,1,0,1,0,0|2,0,0]=4 6125 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100011218836_100000238712 [0,1,0,1,0,0|2,0,0]=4 6126 B12R2.2 c1ccc(cc1)c2nc[nH]n2 271570a_100011218836_100000761765 [0,1,0,1,0,0|1,0,1]=4 6127 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100011218836_100025796157 [0,1,0,1,0,0|1,0,1]=4 6128 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100000210277 [0,1,0,1,0,0|1,0,1]=4 6129 B12R2.2028 Cn1cc(c2c1nccc2)O 271570a_203496583355_100010205794 [0,1,0,1,0,0|1,0,1]=4 6130 B12R2.2028 Cn1nc(c2c1cccc2)O 271570a_203496583355_100009817141 [0,1,0,1,0,0|0,0,1]=3 6131 B12R2.2028 Cn1nc(c2c1cccn2)O 271570a_203496583355_100000761950 [0,1,0,1,0,0|1,0,1]=4 6132 B12R2.2028 Cn1nc(c2c1nccc2)O 271570a_203496583355_100010248644 [0,1,0,1,0,0|1,0,1]=4 6133 B12R2.2075 C=C(c1ccccc1)C2CC2 271570a_100010895485_100000210277 [0,1,0,1,0,0|2,0,0]=4 6134 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,1,0,0|1,0,1]=4 6135 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,1,0,0|1,0,0]=3 6136 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,1,0,0|2,0,0]=4 6137 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,1,0,0|0,0,0]=2 6138 B12R2.612 O=C1NCc2c1ccc(n2)O 271570a_203496583355_200009864240 [0,1,0,1,0,0|1,0,0]=3 6139 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,1,0,0|1,0,0]=3 6140 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,1,0,0|1,0,0]=3 6141 B12R2.612 O=c1[nH][nH]c2c1cnc(c2)O 271570a_203496583355_100016039622 [0,1,0,1,0,0|2,0,0]=4 6142 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,1,0,0|1,0,0]=3 6143 B12R2.132 O=C1CCc2c1cc(cn2)O 271570a_203496583355_100010174022 [0,1,0,1,0,0|2,0,0]=4 6144 B12R2.132 O=C1CCc2c1nc(cc2)O 271570a_203496583355_100000701527 [0,1,0,1,0,0|2,0,0]=4 6145 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,1,0,0|2,0,0]=4 6146 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,1,0,1,0,0|0,0,0]=2 6147 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,1,0,0|1,0,0]=3 6148 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,1,0,1,0,0|1,0,0]=3 6149 B12R2.132 O=c1[nH]nc2n1cc(cc2)O 271570a_203496583355_100010235869 [0,1,0,1,0,0|2,0,0]=4 6150 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,1,0,0|1,0,0]=3 6151 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,1,0,0|1,0,0]=3 6152 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,1,0,0|2,0,0]=4 6153 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,1,0,0|0,0,0]=2 6154 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,1,0,0|1,0,0]=3 6155 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,1,0,0|1,0,0]=3 6156 B12R2.3190 CN(C)C1Cc2c1cccc2 269982a_100102631434_100009813401 [0,1,0,1,0,0|1,0,1]=4 6157 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [0,1,0,1,0,0|1,0,0]=3 6158 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [0,1,0,1,0,0|2,0,0]=4 6159 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [0,1,0,1,0,0|0,0,0]=2 6160 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [0,1,0,1,0,0|1,0,0]=3 6161 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [0,1,0,1,0,0|1,0,0]=3 6162 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [1,0,0,0,1,0|2,0,0]=4 6163 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,0,0,0,1,0|2,0,0]=4 6164 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,0,0,0,1,0|2,0,0]=4 6165 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,0,0,0,1,0|2,0,0]=4 6166 B8R1.8 CC=Cc1ccco1 271570a_100016259895_100009814098 [1,0,0,0,1,0|2,0,0]=4 6167 B8R1.8 CC=Cc1cccs1 271570a_100016259895_100011215356 [1,0,0,0,1,0|2,0,0]=4 6168 B8R1.8 CC=Cc1ccoc1 271570a_100016259895_100011215275 [1,0,0,0,1,0|2,0,0]=4 6169 B8R1.8 CC=Cc1ccsc1 271570a_100016259895_100000738268 [1,0,0,0,1,0|2,0,0]=4 6170 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [1,0,0,0,1,0|1,0,1]=4 6171 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [1,0,0,0,1,0|1,0,1]=4 6172 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [1,0,0,0,1,0|1,0,1]=4 6173 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [1,0,0,0,1,0|1,0,1]=4 6174 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [1,0,0,0,1,0|1,0,1]=4 6175 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [1,0,0,0,1,0|1,0,1]=4 6176 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [1,0,0,0,1,0|1,0,1]=4 6177 B8R1.8 CNCc1ccoc1 207a_100102657272_100011215517 [1,0,0,0,1,0|1,0,1]=4 6178 B8R1.8 CNCc1ccoc1 2230a_100015206860_200000210301 [1,0,0,0,1,0|1,0,1]=4 6179 B8R1.8 CNCc1ccoc1 270004a_106832991635_100011215517 [1,0,0,0,1,0|1,0,1]=4 6180 B8R1.8 CNCc1ccoc1 34a_100015206860_200000210301 [1,0,0,0,1,0|1,0,1]=4 6181 B8R1.8 CNCc1ccsc1 207a_100102657272_100000188534 [1,0,0,0,1,0|1,0,1]=4 6182 B8R1.8 CNCc1ccsc1 2230a_100000186416_200000210301 [1,0,0,0,1,0|1,0,1]=4 6183 B8R1.8 CNCc1ccsc1 2230a_106832991635_100011261437 [1,0,0,0,1,0|1,0,1]=4 6184 B8R1.8 CNCc1ccsc1 270004a_106832991635_100000188534 [1,0,0,0,1,0|1,0,1]=4 6185 B8R1.8 CNCc1ccsc1 34a_100000186416_200000210301 [1,0,0,0,1,0|1,0,1]=4 6186 B8R1.8 CNCc1ccsc1 34a_100102657272_100011261437 [1,0,0,0,1,0|1,0,1]=4 6187 B8R1.8 CNCc1ccsc1 7a_106832991635_100011261437 [1,0,0,0,1,0|1,0,1]=4 6188 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [1,0,0,0,1,0|1,0,1]=4 6189 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [1,0,0,0,1,0|1,0,1]=4 6190 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [1,0,0,0,1,0|1,0,1]=4 6191 B8R1.8 [13CH3]NCc1ccoc1 2230a_100015206860_200025704644 [1,0,0,0,1,0|1,0,1]=4 6192 B8R1.8 [13CH3]NCc1ccoc1 34a_100015206860_200025704644 [1,0,0,0,1,0|1,0,1]=4 6193 B8R1.8 [13CH3]NCc1ccsc1 2230a_100000186416_200025704644 [1,0,0,0,1,0|1,0,1]=4 6194 B8R1.8 [13CH3]NCc1ccsc1 34a_100000186416_200025704644 [1,0,0,0,1,0|1,0,1]=4 6195 B12R1.27 C#CC(=O)CCc1ccccc1 1458a_100000211873_100000765856 [0,0,0,0,0,2|1,0,1]=4 6196 B12R1.27 C=CC(=O)CCc1ccccc1 1458a_100000185746_100000765856 [0,0,0,0,0,2|1,0,1]=4 6197 B12R1.27 C=CC(=O)NCc1ccccc1 1626a_100015324214_100000185746 [0,0,0,0,0,2|1,0,1]=4 6198 B12R1.27 C=CC(=O)NCc1ccccc1 240690a_100015324214_200121576911 [0,0,0,0,0,2|1,0,1]=4 6199 B12R1.27 C=CC(=O)NNc1ccccc1 22a_100015195140_100000185746 [0,0,0,0,0,2|1,0,1]=4 6200 B12R1.27 CC(CCc1ccccc1)N[13CH3] 2230a_100000210798_200025704644 [0,0,0,0,0,2|1,0,1]=4 6201 B12R1.27 CC(CCc1ccccc1)N[13CH3] 34a_100000210798_200025704644 [0,0,0,0,0,2|1,0,1]=4 6202 B12R1.27 CC(COc1ccccc1)N[13CH3] 2230a_100000746794_200025704644 [0,0,0,0,0,2|1,0,1]=4 6203 B12R1.27 CC(COc1ccccc1)N[13CH3] 34a_100000746794_200025704644 [0,0,0,0,0,2|1,0,1]=4 6204 B12R1.27 CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210202 [0,0,0,0,0,2|1,0,0]=3 6205 B12R1.27 CCC(=O)C#Cc1ccccn1 1458a_102125277312_100000210202 [0,0,0,0,0,2|2,0,0]=4 6206 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [0,0,0,0,0,2|1,0,0]=3 6207 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [0,0,0,0,0,2|2,0,0]=4 6208 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [0,0,0,0,0,2|2,0,0]=4 6209 B12R1.27 CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210202 [0,0,0,0,0,2|2,0,0]=4 6210 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000185753_100000210202 [0,0,0,0,0,2|1,0,0]=3 6211 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000210414_100000765856 [0,0,0,0,0,2|1,0,0]=3 6212 B12R1.27 CCC(=O)CCc1ccccn1 1458a_100000210414_100015183660 [0,0,0,0,0,2|2,0,0]=4 6213 B12R1.27 CCC(=O)CCc1ccccn1 1458a_100015195070_100000210202 [0,0,0,0,0,2|2,0,0]=4 6214 B12R1.27 CCC(=O)CCc1cccnc1 1458a_100000198484_100000210202 [0,0,0,0,0,2|2,0,0]=4 6215 B12R1.27 CCC(=O)CCc1cccnc1 1458a_100000210414_200011713674 [0,0,0,0,0,2|2,0,0]=4 6216 B12R1.27 CCC(=O)CCc1ccncc1 1458a_100000210414_100000723409 [0,0,0,0,0,2|2,0,0]=4 6217 B12R1.27 CCC(=O)CCc1ccncc1 1458a_100011225043_100000210202 [0,0,0,0,0,2|2,0,0]=4 6218 B12R1.27 CCC(=O)COc1ccccc1 1458a_100000186222_100000210202 [0,0,0,0,0,2|1,0,0]=3 6219 B12R1.27 CCC(=O)COc1ccccc1 7a_100000210340_100000747405 [0,0,0,0,0,2|1,0,0]=3 6220 B12R1.27 CCC(=O)COc1ccccn1 1458a_100102699861_100000210202 [0,0,0,0,0,2|2,0,0]=4 6221 B12R1.27 CCC(=O)COc1cccnc1 1458a_100015207166_100000210202 [0,0,0,0,0,2|2,0,0]=4 6222 B12R1.27 CCC(=O)COc1cccnc1 7a_100000210849_100000747405 [0,0,0,0,0,2|2,0,0]=4 6223 B12R1.27 CCC(=O)CSc1ccccc1 1458a_100000211596_100000210202 [0,0,0,0,0,2|1,0,0]=3 6224 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000719477_100000747405 [0,0,0,0,0,2|1,0,0]=3 6225 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000747405_100000041952 [0,0,0,0,0,2|1,0,0]=3 6226 B12R1.27 CCC(=O)CSc1ccccn1 1458a_100000156281_100000210202 [0,0,0,0,0,2|2,0,0]=4 6227 B12R1.27 CCC(=O)CSc1ccccn1 62a_100000747405_100011216584 [0,0,0,0,0,2|2,0,0]=4 6228 B12R1.27 CCC(=O)CSc1ccccn1 62a_100011216584_100000747405 [0,0,0,0,0,2|2,0,0]=4 6229 B12R1.27 CCC(=O)CSc1cccnc1 62a_100000210063_100000747405 [0,0,0,0,0,2|2,0,0]=4 6230 B12R1.27 CCC(=O)CSc1cccnc1 62a_100000747405_100000210063 [0,0,0,0,0,2|2,0,0]=4 6231 B12R1.27 CCC(=O)CSc1ccncc1 1458a_100000211328_100000210202 [0,0,0,0,0,2|2,0,0]=4 6232 B12R1.27 CCC(=O)CSc1ccncc1 62a_100000728582_100000747405 [0,0,0,0,0,2|2,0,0]=4 6233 B12R1.27 CCC(=O)CSc1ccncc1 62a_100000747405_100000728582 [0,0,0,0,0,2|2,0,0]=4 6234 B12R1.27 CCC(=O)NCc1ccccc1 11a_100015324214_100000210414 [0,0,0,0,0,2|1,0,0]=3 6235 B12R1.27 CCC(=O)NCc1ccccc1 1626a_100015324214_100000210414 [0,0,0,0,0,2|1,0,0]=3 6236 B12R1.27 CCC(=O)NCc1ccccc1 240690a_100015324214_100000210414 [0,0,0,0,0,2|1,0,0]=3 6237 B12R1.27 CCC(=O)NCc1ccccc1 527a_100015324214_100000210414 [0,0,0,0,0,2|1,0,0]=3 6238 B12R1.27 CCC(=O)NCc1ccccn1 11a_100000210449_100000210414 [0,0,0,0,0,2|2,0,0]=4 6239 B12R1.27 CCC(=O)NCc1ccccn1 1626a_100000210449_100000210414 [0,0,0,0,0,2|2,0,0]=4 6240 B12R1.27 CCC(=O)NCc1ccccn1 240690a_100000210449_100000210414 [0,0,0,0,0,2|2,0,0]=4 6241 B12R1.27 CCC(=O)NCc1ccccn1 527a_100000210449_100000210414 [0,0,0,0,0,2|2,0,0]=4 6242 B12R1.27 CCC(=O)NCc1cccnc1 11a_100000210453_100000210414 [0,0,0,0,0,2|2,0,0]=4 6243 B12R1.27 CCC(=O)NCc1cccnc1 240690a_100000210453_100000210414 [0,0,0,0,0,2|2,0,0]=4 6244 B12R1.27 CCC(=O)NCc1cccnc1 527a_100000210453_100000210414 [0,0,0,0,0,2|2,0,0]=4 6245 B12R1.27 CCC(=O)NCc1ccncc1 11a_100000210450_100000210414 [0,0,0,0,0,2|2,0,0]=4 6246 B12R1.27 CCC(=O)NCc1ccncc1 1626a_100000210450_100000210414 [0,0,0,0,0,2|2,0,0]=4 6247 B12R1.27 CCC(=O)NCc1ccncc1 240690a_100000210450_100000210414 [0,0,0,0,0,2|2,0,0]=4 6248 B12R1.27 CCC(=O)NCc1ccncc1 527a_100000210450_100000210414 [0,0,0,0,0,2|2,0,0]=4 6249 B12R1.27 CCC(=O)NNc1ccccc1 22a_100015195140_100000210414 [0,0,0,0,0,2|1,0,0]=3 6250 B12R1.27 CCC(=O)NNc1ccccn1 22a_100000183288_100000210414 [0,0,0,0,0,2|2,0,0]=4 6251 B12R1.27 CCC(=O)NNc1cccnc1 22a_100000728903_100000210414 [0,0,0,0,0,2|2,0,0]=4 6252 B12R1.27 CCC(=O)NNc1ccncc1 22a_100000698918_100000210414 [0,0,0,0,0,2|2,0,0]=4 6253 B12R1.27 CNC(=O)C#Cc1ccccc1 240690a_100102657272_100000736102 [0,0,0,0,0,2|0,0,0]=2 6254 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [0,0,0,0,0,2|0,0,0]=2 6255 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [0,0,0,0,0,2|0,0,0]=2 6256 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [0,0,0,0,0,2|1,0,0]=3 6257 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [0,0,0,0,0,2|1,0,0]=3 6258 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [0,0,0,0,0,2|1,0,0]=3 6259 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [0,0,0,0,0,2|1,0,0]=3 6260 B12R1.27 CNC(=O)C=Cc1ccncc1 240690a_100102657272_100000682801 [0,0,0,0,0,2|1,0,0]=3 6261 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [0,0,0,0,0,2|0,0,0]=2 6262 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [0,0,0,0,0,2|0,0,0]=2 6263 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [0,0,0,0,0,2|0,0,0]=2 6264 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [0,0,0,0,0,2|0,0,0]=2 6265 B12R1.27 CNC(=O)CCc1ccccn1 11a_106832991635_100015195070 [0,0,0,0,0,2|1,0,0]=3 6266 B12R1.27 CNC(=O)CCc1ccccn1 240690a_100102657272_100015195070 [0,0,0,0,0,2|1,0,0]=3 6267 B12R1.27 CNC(=O)CCc1ccccn1 527a_100102657272_100015195070 [0,0,0,0,0,2|1,0,0]=3 6268 B12R1.27 CNC(=O)CCc1cccnc1 11a_106832991635_100000198484 [0,0,0,0,0,2|1,0,0]=3 6269 B12R1.27 CNC(=O)CCc1cccnc1 1626a_100102657272_100000198484 [0,0,0,0,0,2|1,0,0]=3 6270 B12R1.27 CNC(=O)CCc1cccnc1 240690a_100102657272_100000198484 [0,0,0,0,0,2|1,0,0]=3 6271 B12R1.27 CNC(=O)CCc1cccnc1 527a_100102657272_100000198484 [0,0,0,0,0,2|1,0,0]=3 6272 B12R1.27 CNC(=O)CCc1ccncc1 11a_106832991635_100011225043 [0,0,0,0,0,2|1,0,0]=3 6273 B12R1.27 CNC(=O)CCc1ccncc1 240690a_100102657272_100011225043 [0,0,0,0,0,2|1,0,0]=3 6274 B12R1.27 CNC(=O)CCc1ccncc1 527a_100102657272_100011225043 [0,0,0,0,0,2|1,0,0]=3 6275 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [0,0,0,0,0,2|0,0,0]=2 6276 B12R1.27 CNC(=O)CNc1cccnn1 27a_100000693194_100016991348 [0,0,0,0,0,2|2,0,0]=4 6277 B12R1.27 CNC(=O)CNc1ccncn1 27a_100000693194_100000703185 [0,0,0,0,0,2|2,0,0]=4 6278 B12R1.27 CNC(=O)CNc1cnccn1 27a_100000693194_100000211759 [0,0,0,0,0,2|2,0,0]=4 6279 B12R1.27 CNC(=O)CNc1ncccn1 27a_100000693194_100000211032 [0,0,0,0,0,2|2,0,0]=4 6280 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [0,0,0,0,0,2|0,0,0]=2 6281 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [0,0,0,0,0,2|0,0,0]=2 6282 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [0,0,0,0,0,2|0,0,0]=2 6283 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [0,0,0,0,0,2|0,0,0]=2 6284 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [0,0,0,0,0,2|0,0,0]=2 6285 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [0,0,0,0,0,2|0,0,0]=2 6286 B12R1.27 CNC(=O)COc1ccccn1 1626a_100102657272_100102699861 [0,0,0,0,0,2|1,0,0]=3 6287 B12R1.27 CNC(=O)COc1ccccn1 240690a_100102657272_100102699861 [0,0,0,0,0,2|1,0,0]=3 6288 B12R1.27 CNC(=O)COc1ccccn1 527a_100102657272_100102699861 [0,0,0,0,0,2|1,0,0]=3 6289 B12R1.27 CNC(=O)COc1cccnc1 11a_106832991635_100015207166 [0,0,0,0,0,2|1,0,0]=3 6290 B12R1.27 CNC(=O)COc1cccnc1 1626a_100102657272_100015207166 [0,0,0,0,0,2|1,0,0]=3 6291 B12R1.27 CNC(=O)COc1cccnc1 240690a_100102657272_100015207166 [0,0,0,0,0,2|1,0,0]=3 6292 B12R1.27 CNC(=O)COc1cccnc1 34a_100000210849_100000183359 [0,0,0,0,0,2|1,0,0]=3 6293 B12R1.27 CNC(=O)COc1cccnc1 527a_100102657272_100015207166 [0,0,0,0,0,2|1,0,0]=3 6294 B12R1.27 CNC(=O)COc1cccnc1 7a_100000210849_100000183359 [0,0,0,0,0,2|1,0,0]=3 6295 B12R1.27 CNC(=O)COc1ccncc1 34a_100000212176_100000183359 [0,0,0,0,0,2|1,0,0]=3 6296 B12R1.27 CNC(=O)COc1ccnnc1 34a_100015204005_100000183359 [0,0,0,0,0,2|2,0,0]=4 6297 B12R1.27 CNC(=O)COc1cncnc1 7a_100000754086_100000183359 [0,0,0,0,0,2|2,0,0]=4 6298 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [0,0,0,0,0,2|0,0,0]=2 6299 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [0,0,0,0,0,2|0,0,0]=2 6300 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [0,0,0,0,0,2|0,0,0]=2 6301 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [0,0,0,0,0,2|0,0,0]=2 6302 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [0,0,0,0,0,2|0,0,0]=2 6303 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [0,0,0,0,0,2|0,0,0]=2 6304 B12R1.27 CNC(=O)CSc1ccccn1 11a_106832991635_100000156281 [0,0,0,0,0,2|1,0,0]=3 6305 B12R1.27 CNC(=O)CSc1ccccn1 240690a_100102657272_100000156281 [0,0,0,0,0,2|1,0,0]=3 6306 B12R1.27 CNC(=O)CSc1ccccn1 527a_100102657272_100000156281 [0,0,0,0,0,2|1,0,0]=3 6307 B12R1.27 CNC(=O)CSc1ccccn1 62a_100000183359_100011216584 [0,0,0,0,0,2|1,0,0]=3 6308 B12R1.27 CNC(=O)CSc1ccccn1 62a_100011216584_100000183359 [0,0,0,0,0,2|1,0,0]=3 6309 B12R1.27 CNC(=O)CSc1cccnc1 62a_100000183359_100000210063 [0,0,0,0,0,2|1,0,0]=3 6310 B12R1.27 CNC(=O)CSc1cccnc1 62a_100000210063_100000183359 [0,0,0,0,0,2|1,0,0]=3 6311 B12R1.27 CNC(=O)CSc1cccnn1 62a_100000183359_100016991348 [0,0,0,0,0,2|2,0,0]=4 6312 B12R1.27 CNC(=O)CSc1cccnn1 62a_100016991348_100000183359 [0,0,0,0,0,2|2,0,0]=4 6313 B12R1.27 CNC(=O)CSc1ccncc1 11a_106832991635_100000211328 [0,0,0,0,0,2|1,0,0]=3 6314 B12R1.27 CNC(=O)CSc1ccncc1 1626a_100102657272_100000211328 [0,0,0,0,0,2|1,0,0]=3 6315 B12R1.27 CNC(=O)CSc1ccncc1 240690a_100102657272_100000211328 [0,0,0,0,0,2|1,0,0]=3 6316 B12R1.27 CNC(=O)CSc1ccncc1 527a_100102657272_100000211328 [0,0,0,0,0,2|1,0,0]=3 6317 B12R1.27 CNC(=O)CSc1ccncc1 62a_100000183359_100000728582 [0,0,0,0,0,2|1,0,0]=3 6318 B12R1.27 CNC(=O)CSc1ccncc1 62a_100000728582_100000183359 [0,0,0,0,0,2|1,0,0]=3 6319 B12R1.27 CNC(=O)CSc1ccncn1 62a_100000183359_100000703185 [0,0,0,0,0,2|2,0,0]=4 6320 B12R1.27 CNC(=O)CSc1ccncn1 62a_100000703185_100000183359 [0,0,0,0,0,2|2,0,0]=4 6321 B12R1.27 CNC(=O)CSc1ccnnc1 62a_100000183359_100000732662 [0,0,0,0,0,2|2,0,0]=4 6322 B12R1.27 CNC(=O)CSc1ccnnc1 62a_100000732662_100000183359 [0,0,0,0,0,2|2,0,0]=4 6323 B12R1.27 CNC(=O)CSc1cnccn1 62a_100000183359_100000211759 [0,0,0,0,0,2|2,0,0]=4 6324 B12R1.27 CNC(=O)CSc1cnccn1 62a_100000211759_100000183359 [0,0,0,0,0,2|2,0,0]=4 6325 B12R1.27 CNC(=O)CSc1cncnc1 62a_100000183359_100011206942 [0,0,0,0,0,2|2,0,0]=4 6326 B12R1.27 CNC(=O)CSc1cncnc1 62a_100011206942_100000183359 [0,0,0,0,0,2|2,0,0]=4 6327 B12R1.27 CNC(=O)CSc1ncccn1 240690a_100102657272_200000156282 [0,0,0,0,0,2|2,0,0]=4 6328 B12R1.27 CNC(=O)CSc1ncccn1 62a_100000183359_100000211032 [0,0,0,0,0,2|2,0,0]=4 6329 B12R1.27 CNC(=O)CSc1ncccn1 62a_100000211032_100000183359 [0,0,0,0,0,2|2,0,0]=4 6330 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100015324214_106832991635 [0,0,0,0,0,2|0,0,0]=2 6331 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100102657272_100015324214 [0,0,0,0,0,2|0,0,0]=2 6332 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100015324214_100102657272 [0,0,0,0,0,2|0,0,0]=2 6333 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100102657272_100015324214 [0,0,0,0,0,2|0,0,0]=2 6334 B12R1.27 CNC(=O)NCc1ccccc1 512a_100015324214_100102657272 [0,0,0,0,0,2|0,0,0]=2 6335 B12R1.27 CNC(=O)NCc1ccccc1 512a_106832991638_100015324214 [0,0,0,0,0,2|0,0,0]=2 6336 B12R1.27 CNC(=O)NCc1ccccn1 2708a_100000210449_106832991635 [0,0,0,0,0,2|1,0,0]=3 6337 B12R1.27 CNC(=O)NCc1ccccn1 2708a_100102657272_100000210449 [0,0,0,0,0,2|1,0,0]=3 6338 B12R1.27 CNC(=O)NCc1ccccn1 273464a_100000210449_100102657272 [0,0,0,0,0,2|1,0,0]=3 6339 B12R1.27 CNC(=O)NCc1ccccn1 273464a_100102657272_100000210449 [0,0,0,0,0,2|1,0,0]=3 6340 B12R1.27 CNC(=O)NCc1ccccn1 512a_106832991638_100000210449 [0,0,0,0,0,2|1,0,0]=3 6341 B12R1.27 CNC(=O)NCc1cccnc1 2708a_100000210453_106832991635 [0,0,0,0,0,2|1,0,0]=3 6342 B12R1.27 CNC(=O)NCc1cccnc1 2708a_100102657272_100000210453 [0,0,0,0,0,2|1,0,0]=3 6343 B12R1.27 CNC(=O)NCc1cccnc1 273464a_100000210453_100102657272 [0,0,0,0,0,2|1,0,0]=3 6344 B12R1.27 CNC(=O)NCc1cccnc1 273464a_100102657272_100000210453 [0,0,0,0,0,2|1,0,0]=3 6345 B12R1.27 CNC(=O)NCc1cccnc1 512a_100000210453_100102657272 [0,0,0,0,0,2|1,0,0]=3 6346 B12R1.27 CNC(=O)NCc1cccnc1 512a_106832991638_100000210453 [0,0,0,0,0,2|1,0,0]=3 6347 B12R1.27 CNC(=O)NCc1cccnn1 2708a_100102657272_100159270163 [0,0,0,0,0,2|2,0,0]=4 6348 B12R1.27 CNC(=O)NCc1cccnn1 2708a_100159270163_106832991635 [0,0,0,0,0,2|2,0,0]=4 6349 B12R1.27 CNC(=O)NCc1cccnn1 273464a_100102657272_100159270163 [0,0,0,0,0,2|2,0,0]=4 6350 B12R1.27 CNC(=O)NCc1cccnn1 273464a_100159270163_100102657272 [0,0,0,0,0,2|2,0,0]=4 6351 B12R1.27 CNC(=O)NCc1cccnn1 512a_100159270163_100102657272 [0,0,0,0,0,2|2,0,0]=4 6352 B12R1.27 CNC(=O)NCc1cccnn1 512a_106832991638_100159270163 [0,0,0,0,0,2|2,0,0]=4 6353 B12R1.27 CNC(=O)NCc1ccncc1 2708a_100000210450_106832991635 [0,0,0,0,0,2|1,0,0]=3 6354 B12R1.27 CNC(=O)NCc1ccncc1 2708a_100102657272_100000210450 [0,0,0,0,0,2|1,0,0]=3 6355 B12R1.27 CNC(=O)NCc1ccncc1 273464a_100000210450_100102657272 [0,0,0,0,0,2|1,0,0]=3 6356 B12R1.27 CNC(=O)NCc1ccncc1 273464a_100102657272_100000210450 [0,0,0,0,0,2|1,0,0]=3 6357 B12R1.27 CNC(=O)NCc1ccncc1 512a_106832991638_100000210450 [0,0,0,0,0,2|1,0,0]=3 6358 B12R1.27 CNC(=O)NCc1ccncn1 2708a_100102657272_100000736019 [0,0,0,0,0,2|2,0,0]=4 6359 B12R1.27 CNC(=O)NCc1ccncn1 273464a_100102657272_100000736019 [0,0,0,0,0,2|2,0,0]=4 6360 B12R1.27 CNC(=O)NCc1ccncn1 512a_100000736019_100102657272 [0,0,0,0,0,2|2,0,0]=4 6361 B12R1.27 CNC(=O)NCc1ccncn1 512a_106832991638_100000736019 [0,0,0,0,0,2|2,0,0]=4 6362 B12R1.27 CNC(=O)NCc1cnccn1 2708a_100000737960_106832991635 [0,0,0,0,0,2|2,0,0]=4 6363 B12R1.27 CNC(=O)NCc1cnccn1 2708a_100102657272_100000737960 [0,0,0,0,0,2|2,0,0]=4 6364 B12R1.27 CNC(=O)NCc1cnccn1 273464a_100000737960_100102657272 [0,0,0,0,0,2|2,0,0]=4 6365 B12R1.27 CNC(=O)NCc1cnccn1 273464a_100102657272_100000737960 [0,0,0,0,0,2|2,0,0]=4 6366 B12R1.27 CNC(=O)NCc1cnccn1 512a_100000737960_100102657272 [0,0,0,0,0,2|2,0,0]=4 6367 B12R1.27 CNC(=O)NCc1cnccn1 512a_106832991638_100000737960 [0,0,0,0,0,2|2,0,0]=4 6368 B12R1.27 CNC(=O)NCc1cncnc1 2708a_100011243677_106832991635 [0,0,0,0,0,2|2,0,0]=4 6369 B12R1.27 CNC(=O)NCc1cncnc1 2708a_100102657272_100011243677 [0,0,0,0,0,2|2,0,0]=4 6370 B12R1.27 CNC(=O)NCc1cncnc1 273464a_100011243677_100102657272 [0,0,0,0,0,2|2,0,0]=4 6371 B12R1.27 CNC(=O)NCc1cncnc1 273464a_100102657272_100011243677 [0,0,0,0,0,2|2,0,0]=4 6372 B12R1.27 CNC(=O)NCc1cncnc1 512a_100011243677_100102657272 [0,0,0,0,0,2|2,0,0]=4 6373 B12R1.27 CNC(=O)NCc1cncnc1 512a_106832991638_100011243677 [0,0,0,0,0,2|2,0,0]=4 6374 B12R1.27 CNC(=O)NCc1ncccn1 2708a_100015189908_106832991635 [0,0,0,0,0,2|2,0,0]=4 6375 B12R1.27 CNC(=O)NCc1ncccn1 2708a_100102657272_100015189908 [0,0,0,0,0,2|2,0,0]=4 6376 B12R1.27 CNC(=O)NCc1ncccn1 273464a_100015189908_100102657272 [0,0,0,0,0,2|2,0,0]=4 6377 B12R1.27 CNC(=O)NCc1ncccn1 273464a_100102657272_100015189908 [0,0,0,0,0,2|2,0,0]=4 6378 B12R1.27 CNC(=O)NCc1ncccn1 512a_100015189908_100102657272 [0,0,0,0,0,2|2,0,0]=4 6379 B12R1.27 CNC(=O)NCc1ncccn1 512a_106832991638_100015189908 [0,0,0,0,0,2|2,0,0]=4 6380 B12R1.27 CNC(=O)NNc1ccccc1 273464a_100102657272_100015195140 [0,0,0,0,0,2|0,0,0]=2 6381 B12R1.27 CNC(=O)NNc1ccccc1 512a_106832991638_100015195140 [0,0,0,0,0,2|0,0,0]=2 6382 B12R1.27 CNC(=O)NNc1ccccn1 273464a_100102657272_100000183288 [0,0,0,0,0,2|1,0,0]=3 6383 B12R1.27 CNC(=O)NNc1ccccn1 512a_106832991638_100000183288 [0,0,0,0,0,2|1,0,0]=3 6384 B12R1.27 CNC(=O)NNc1cccnc1 273464a_100102657272_100000728903 [0,0,0,0,0,2|1,0,0]=3 6385 B12R1.27 CNC(=O)NNc1cccnc1 512a_106832991638_100000728903 [0,0,0,0,0,2|1,0,0]=3 6386 B12R1.27 CNC(=O)NNc1cccnn1 273464a_100102657272_100000757824 [0,0,0,0,0,2|2,0,0]=4 6387 B12R1.27 CNC(=O)NNc1cccnn1 512a_106832991638_100000757824 [0,0,0,0,0,2|2,0,0]=4 6388 B12R1.27 CNC(=O)NNc1ccncc1 273464a_100102657272_100000698918 [0,0,0,0,0,2|1,0,0]=3 6389 B12R1.27 CNC(=O)NNc1ccncc1 512a_106832991638_100000698918 [0,0,0,0,0,2|1,0,0]=3 6390 B12R1.27 CNC(=O)NNc1ccncn1 273464a_100102657272_100011438088 [0,0,0,0,0,2|2,0,0]=4 6391 B12R1.27 CNC(=O)NNc1ccncn1 512a_106832991638_100011438088 [0,0,0,0,0,2|2,0,0]=4 6392 B12R1.27 CNC(=O)NNc1cnccn1 273464a_100102657272_100000736894 [0,0,0,0,0,2|2,0,0]=4 6393 B12R1.27 CNC(=O)NNc1cnccn1 512a_106832991638_100000736894 [0,0,0,0,0,2|2,0,0]=4 6394 B12R1.27 CNC(=O)NNc1ncccn1 273464a_100102657272_100000736892 [0,0,0,0,0,2|2,0,0]=4 6395 B12R1.27 CNC(=O)NNc1ncccn1 512a_106832991638_100000736892 [0,0,0,0,0,2|2,0,0]=4 6396 B12R1.27 CNC(C)CCc1ccccc1 2230a_100000210798_200000210301 [0,0,0,0,0,2|1,0,1]=4 6397 B12R1.27 CNC(C)CCc1ccccc1 270004a_106832991635_100000210092 [0,0,0,0,0,2|1,0,1]=4 6398 B12R1.27 CNC(C)CCc1ccccc1 34a_100000210798_200000210301 [0,0,0,0,0,2|1,0,1]=4 6399 B12R1.27 CNC(C)COc1ccccc1 2230a_100000746794_200000210301 [0,0,0,0,0,2|1,0,1]=4 6400 B12R1.27 CNC(C)COc1ccccc1 270004a_106832991635_100000150576 [0,0,0,0,0,2|1,0,1]=4 6401 B12R1.27 CNC(C)COc1ccccc1 34a_100000746794_200000210301 [0,0,0,0,0,2|1,0,1]=4 6402 B12R1.27 CNC(C)CSc1ccccc1 270004a_106832991635_100000150717 [0,0,0,0,0,2|1,0,1]=4 6403 B12R1.27 COC(=O)CNc1ccccc1 34a_100000106764_100000747449 [0,0,0,0,0,2|1,0,0]=3 6404 B12R1.27 COC(=O)COc1ccccc1 34a_100000210340_100000747449 [0,0,0,0,0,2|1,0,0]=3 6405 B12R1.27 COC(=O)COc1ccccc1 7a_100000210340_100000747449 [0,0,0,0,0,2|1,0,0]=3 6406 B12R1.27 COC(=O)COc1cccnc1 34a_100000210849_100000747449 [0,0,0,0,0,2|2,0,0]=4 6407 B12R1.27 COC(=O)COc1cccnc1 7a_100000210849_100000747449 [0,0,0,0,0,2|2,0,0]=4 6408 B12R1.27 COC(=O)COc1ccncc1 34a_100000212176_100000747449 [0,0,0,0,0,2|2,0,0]=4 6409 B12R1.27 COC(=O)CSc1ccccc1 62a_100000719477_100000747449 [0,0,0,0,0,2|1,0,0]=3 6410 B12R1.27 COC(=O)CSc1ccccc1 62a_100000747449_100000041952 [0,0,0,0,0,2|1,0,0]=3 6411 B12R1.27 COC(=O)CSc1ccccn1 62a_100000747449_100011216584 [0,0,0,0,0,2|2,0,0]=4 6412 B12R1.27 COC(=O)CSc1ccccn1 62a_100011216584_100000747449 [0,0,0,0,0,2|2,0,0]=4 6413 B12R1.27 COC(=O)CSc1cccnc1 62a_100000210063_100000747449 [0,0,0,0,0,2|2,0,0]=4 6414 B12R1.27 COC(=O)CSc1cccnc1 62a_100000747449_100000210063 [0,0,0,0,0,2|2,0,0]=4 6415 B12R1.27 COC(=O)CSc1ccncc1 62a_100000728582_100000747449 [0,0,0,0,0,2|2,0,0]=4 6416 B12R1.27 COC(=O)CSc1ccncc1 62a_100000747449_100000728582 [0,0,0,0,0,2|2,0,0]=4 6417 B12R1.27 O=C(C#Cc1ccccc1)CF 1458a_100000736102_100015361967 [0,0,0,0,0,2|2,0,0]=4 6418 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [0,0,0,0,0,2|2,0,0]=4 6419 B12R1.27 O=C(CF)CCc1ccccc1 1458a_100000185753_100015361967 [0,0,0,0,0,2|2,0,0]=4 6420 B12R1.27 O=C(CF)COc1ccccc1 1458a_100000186222_100015361967 [0,0,0,0,0,2|2,0,0]=4 6421 B12R1.27 O=C(CF)CSc1ccccc1 1458a_100000211596_100015361967 [0,0,0,0,0,2|2,0,0]=4 6422 B12R1.27 O=C(CO)CCc1ccccc1 1458a_100000210174_100000765856 [0,0,0,0,0,2|2,0,0]=4 6423 B12R1.27 O=C(CO)NCc1ccccc1 240690a_100015324214_100000210174 [0,0,0,0,0,2|2,0,0]=4 6424 B12R1.27 O=C(CO)NCc1ccccc1 527a_100015324214_100000210174 [0,0,0,0,0,2|2,0,0]=4 6425 B12R1.27 O=C(CO)NNc1ccccc1 22a_100015195140_100000210174 [0,0,0,0,0,2|2,0,0]=4 6426 B7R0.3 C=CC=CC(=O)CC 1458a_100016291481_100000210202 [2,0,1,0,0,0|1,0,0]=4 6427 B7R0.3 C=CC=CC(=O)NC 1626a_100102657272_100016291481 [2,0,1,0,0,0|0,0,0]=3 6428 B7R0.4 C/C=C/C=CC(=O)C 1458a_100000185730_200000210301 [2,0,1,0,0,0|0,0,1]=4 6429 B7R0.4 C/C=C/C=CC(=O)[13CH3] 1458a_100000185730_200025704644 [2,0,1,0,0,0|0,0,1]=4 6430 B7R1.3 Oc1ccccc1 271570a_203496583355_100000210277 [3,0,0,0,0,0|0,0,1]=4 6431 B9R0.24 CC=C(C)C=CC(=O)NC 1626a_100102657272_100000692105 [1,1,1,0,0,0|0,0,1]=4 6432 B9R0.47 C/C=C/C=CC(=O)N(C)C 11a_100102631434_100000185730 [1,1,1,0,0,0|0,0,1]=4 6433 B9R0.47 C/C=C/C=CC(=O)N(C)C 1626a_100102631434_100000185730 [1,1,1,0,0,0|0,0,1]=4 6434 B9R0.47 C/C=C/C=CC(=O)N(C)C 240690a_100102631434_100000185730 [1,1,1,0,0,0|0,0,1]=4 6435 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [2,1,0,0,0,0|0,0,1]=4 6436 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [2,1,0,0,0,0|0,0,1]=4 6437 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [2,1,0,0,0,0|0,0,1]=4 6438 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [2,1,0,0,0,0|0,0,1]=4 6439 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [2,1,0,0,0,0|0,0,1]=4 6440 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [2,1,0,0,0,0|0,0,1]=4 6441 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [2,1,0,0,0,0|0,0,1]=4 6442 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [2,1,0,0,0,0|0,0,0]=3 6443 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [2,1,0,0,0,0|0,0,0]=3 6444 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [2,1,0,0,0,0|0,0,0]=3 6445 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [2,1,0,0,0,0|0,0,0]=3 6446 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [2,1,0,0,0,0|0,0,0]=3 6447 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [2,1,0,0,0,0|0,0,0]=3 6448 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [2,1,0,0,0,0|0,0,0]=3 6449 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [2,1,0,0,0,0|0,0,0]=3 6450 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [2,1,0,0,0,0|0,0,0]=3 6451 B9R1.1 CNc1ccc(cn1)Br 27a_100102657272_100000686858 [2,1,0,0,0,0|1,0,0]=4 6452 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [2,1,0,0,0,0|1,0,0]=4 6453 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [2,1,0,0,0,0|1,0,0]=4 6454 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [2,1,0,0,0,0|1,0,0]=4 6455 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [2,1,0,0,0,0|1,0,0]=4 6456 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [2,1,0,0,0,0|1,0,0]=4 6457 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [2,1,0,0,0,0|1,0,0]=4 6458 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [2,1,0,0,0,0|1,0,0]=4 6459 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [2,1,0,0,0,0|1,0,0]=4 6460 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [2,1,0,0,0,0|1,0,0]=4 6461 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [2,1,0,0,0,0|1,0,0]=4 6462 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [2,1,0,0,0,0|1,0,0]=4 6463 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [2,1,0,0,0,0|1,0,0]=4 6464 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [2,1,0,0,0,0|1,0,0]=4 6465 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [2,1,0,0,0,0|1,0,0]=4 6466 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [2,1,0,0,0,0|1,0,0]=4 6467 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [2,1,0,0,0,0|1,0,0]=4 6468 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [2,1,0,0,0,0|1,0,0]=4 6469 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [2,1,0,0,0,0|1,0,0]=4 6470 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [2,1,0,0,0,0|1,0,0]=4 6471 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [2,1,0,0,0,0|1,0,0]=4 6472 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [2,1,0,0,0,0|1,0,0]=4 6473 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [2,1,0,0,0,0|1,0,0]=4 6474 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [2,1,0,0,0,0|1,0,0]=4 6475 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [2,1,0,0,0,0|1,0,0]=4 6476 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [2,1,0,0,0,0|1,0,0]=4 6477 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [2,1,0,0,0,0|0,0,0]=3 6478 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [2,1,0,0,0,0|1,0,0]=4 6479 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [2,1,0,0,0,0|1,0,0]=4 6480 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [2,1,0,0,0,0|1,0,0]=4 6481 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [2,1,0,0,0,0|1,0,0]=4 6482 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [2,1,0,0,0,0|0,0,1]=4 6483 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [2,1,0,0,0,0|1,0,0]=4 6484 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [2,1,0,0,0,0|0,0,0]=3 6485 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [2,1,0,0,0,0|1,0,0]=4 6486 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [2,1,0,0,0,0|1,0,0]=4 6487 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [2,1,0,0,0,0|0,0,0]=3 6488 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [2,1,0,0,0,0|0,0,0]=3 6489 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [2,1,0,0,0,0|0,0,0]=3 6490 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [2,1,0,0,0,0|0,0,0]=3 6491 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [2,1,0,0,0,0|0,0,0]=3 6492 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [2,1,0,0,0,0|0,0,0]=3 6493 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [2,1,0,0,0,0|0,0,0]=3 6494 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [2,1,0,0,0,0|1,0,0]=4 6495 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [2,1,0,0,0,0|1,0,0]=4 6496 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [2,1,0,0,0,0|1,0,0]=4 6497 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [2,1,0,0,0,0|1,0,0]=4 6498 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [2,1,0,0,0,0|1,0,0]=4 6499 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [2,1,0,0,0,0|1,0,0]=4 6500 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [2,1,0,0,0,0|1,0,0]=4 6501 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [2,1,0,0,0,0|1,0,0]=4 6502 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [2,1,0,0,0,0|1,0,0]=4 6503 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [2,1,0,0,0,0|1,0,0]=4 6504 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [2,1,0,0,0,0|1,0,0]=4 6505 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [2,1,0,0,0,0|1,0,0]=4 6506 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [2,1,0,0,0,0|1,0,0]=4 6507 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [2,1,0,0,0,0|1,0,0]=4 6508 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [2,1,0,0,0,0|1,0,0]=4 6509 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [2,1,0,0,0,0|1,0,0]=4 6510 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [2,1,0,0,0,0|1,0,0]=4 6511 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,1,0,0,0,0|0,0,1]=4 6512 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,1,0,0,0,0|0,0,1]=4 6513 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,1,0,0,0,0|0,0,1]=4 6514 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,1,0,0,0,0|0,0,1]=4 6515 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,1,0,0,0,0|0,0,1]=4 6516 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,1,0,0,0,0|0,0,1]=4 6517 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,1,0,0,0,0|0,0,1]=4 6518 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,1,0,0,0,0|0,0,1]=4 6519 B9R1.2 CNc1cc(ccn1)F 27a_100102657272_100000764206 [2,1,0,0,0,0|1,0,0]=4 6520 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [2,1,0,0,0,0|1,0,0]=4 6521 B9R1.2 CNc1cc[nH]c(=O)c1 27a_100102657272_100000061649 [2,1,0,0,0,0|1,0,0]=4 6522 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,1,0,0,0,0|0,0,0]=3 6523 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,1,0,0,0,0|0,0,0]=3 6524 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,1,0,0,0,0|0,0,0]=3 6525 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,1,0,0,0,0|0,0,0]=3 6526 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,1,0,0,0,0|0,0,0]=3 6527 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,1,0,0,0,0|0,0,0]=3 6528 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,1,0,0,0,0|0,0,0]=3 6529 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,1,0,0,0,0|0,0,0]=3 6530 B9R1.2 CNc1cccc(n1)F 27a_100102657272_100009815982 [2,1,0,0,0,0|1,0,0]=4 6531 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [2,1,0,0,0,0|1,0,0]=4 6532 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [2,1,0,0,0,0|1,0,0]=4 6533 B9R1.2 CNc1ccnc(c1)F 27a_100102657272_100009816116 [2,1,0,0,0,0|1,0,0]=4 6534 B9R1.2 CNc1ccnc(c1)O 271570a_203496583355_100009869472 [2,1,0,0,0,0|1,0,0]=4 6535 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [2,1,0,0,0,0|1,0,0]=4 6536 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,1,0,0,0,0|1,0,0]=4 6537 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,1,0,0,0,0|1,0,0]=4 6538 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,1,0,0,0,0|1,0,0]=4 6539 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,1,0,0,0,0|1,0,0]=4 6540 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,1,0,0,0,0|1,0,0]=4 6541 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,1,0,0,0,0|1,0,0]=4 6542 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,1,0,0,0,0|1,0,0]=4 6543 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,1,0,0,0,0|1,0,0]=4 6544 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,1,0,0,0,0|1,0,0]=4 6545 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,1,0,0,0,0|1,0,0]=4 6546 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,1,0,0,0,0|1,0,0]=4 6547 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,1,0,0,0,0|1,0,0]=4 6548 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,1,0,0,0,0|1,0,0]=4 6549 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,1,0,0,0,0|1,0,0]=4 6550 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,1,0,0,0,0|1,0,0]=4 6551 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,1,0,0,0,0|1,0,0]=4 6552 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,1,0,0,0,0|1,0,0]=4 6553 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,1,0,0,0,0|1,0,0]=4 6554 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,1,0,0,0,0|1,0,0]=4 6555 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,1,0,0,0,0|1,0,0]=4 6556 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,1,0,0,0,0|1,0,0]=4 6557 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,1,0,0,0,0|1,0,0]=4 6558 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,1,0,0,0,0|1,0,0]=4 6559 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,1,0,0,0,0|1,0,0]=4 6560 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,1,0,0,0,0|1,0,0]=4 6561 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,1,0,0,0,0|1,0,0]=4 6562 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,1,0,0,0,0|0,0,0]=3 6563 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,1,0,0,0,0|0,0,0]=3 6564 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,1,0,0,0,0|1,0,0]=4 6565 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,1,0,0,0,0|1,0,0]=4 6566 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,1,0,0,0,0|1,0,0]=4 6567 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,1,0,0,0,0|1,0,0]=4 6568 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,1,0,0,0,0|0,0,1]=4 6569 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [2,1,0,0,0,0|1,0,0]=4 6570 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [2,1,0,0,0,0|1,0,0]=4 6571 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,1,0,0,0,0|0,0,0]=3 6572 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [2,1,0,0,0,0|1,0,0]=4 6573 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [2,1,0,0,0,0|1,0,0]=4 6574 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [2,1,0,0,0,0|1,0,0]=4 6575 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,1,0,0,0,0|0,0,0]=3 6576 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,1,0,0,0,0|0,0,0]=3 6577 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,1,0,0,0,0|0,0,0]=3 6578 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,1,0,0,0,0|0,0,0]=3 6579 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,1,0,0,0,0|0,0,0]=3 6580 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,1,0,0,0,0|1,0,0]=4 6581 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,1,0,0,0,0|1,0,0]=4 6582 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,1,0,0,0,0|1,0,0]=4 6583 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,1,0,0,0,0|1,0,0]=4 6584 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,1,0,0,0,0|1,0,0]=4 6585 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,1,0,0,0,0|1,0,0]=4 6586 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,1,0,0,0,0|1,0,0]=4 6587 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,1,0,0,0,0|1,0,0]=4 6588 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,1,0,0,0,0|1,0,0]=4 6589 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,1,0,0,0,0|1,0,0]=4 6590 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,1,0,0,0,0|1,0,0]=4 6591 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,1,0,0,0,0|1,0,0]=4 6592 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,1,0,0,0,0|1,0,0]=4 6593 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,1,0,0,0,0|1,0,0]=4 6594 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,1,0,0,0,0|1,0,0]=4 6595 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,1,0,0,0,0|1,0,0]=4 6596 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,1,0,0,0,0|1,0,0]=4 6597 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,1,0,0,0,0|1,0,0]=4 6598 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,1,0,0,0,0|1,0,0]=4 6599 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,1,0,0,0,0|1,0,0]=4 6600 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [2,1,0,0,0,0|0,0,1]=4 6601 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [2,1,0,0,0,0|0,0,1]=4 6602 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [2,1,0,0,0,0|0,0,1]=4 6603 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [2,1,0,0,0,0|0,0,1]=4 6604 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [2,1,0,0,0,0|0,0,1]=4 6605 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,1,0,0,0,0|0,0,1]=4 6606 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [2,1,0,0,0,0|0,0,1]=4 6607 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [2,1,0,0,0,0|0,0,0]=3 6608 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [2,1,0,0,0,0|0,0,0]=3 6609 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [2,1,0,0,0,0|0,0,0]=3 6610 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [2,1,0,0,0,0|0,0,0]=3 6611 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [2,1,0,0,0,0|0,0,0]=3 6612 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [2,1,0,0,0,0|0,0,0]=3 6613 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [2,1,0,0,0,0|0,0,0]=3 6614 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [2,1,0,0,0,0|1,0,0]=4 6615 B9R1.15 CNc1ccncc1Br 27a_100102657272_100000726257 [2,1,0,0,0,0|1,0,0]=4 6616 B9R1.15 CNc1ccncc1C 27a_100102657272_100000765111 [2,1,0,0,0,0|1,0,0]=4 6617 B9R1.15 CNc1ccncc1F 27a_100102657272_100000035921 [2,1,0,0,0,0|1,0,0]=4 6618 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [2,1,0,0,0,0|1,0,0]=4 6619 B9R1.15 CNc1ncccc1Br 27a_100102657272_100000696092 [2,1,0,0,0,0|1,0,0]=4 6620 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [2,1,0,0,0,0|1,0,0]=4 6621 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [2,1,0,0,0,0|1,0,0]=4 6622 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [2,1,0,0,0,0|1,0,0]=4 6623 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [2,1,0,0,0,0|1,0,0]=4 6624 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [2,1,0,0,0,0|1,0,0]=4 6625 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [2,1,0,0,0,0|1,0,0]=4 6626 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [2,1,0,0,0,0|1,0,0]=4 6627 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [2,1,0,0,0,0|1,0,0]=4 6628 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [2,1,0,0,0,0|1,0,0]=4 6629 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 6630 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 6631 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [2,1,0,0,0,0|1,0,0]=4 6632 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [2,1,0,0,0,0|1,0,0]=4 6633 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [2,1,0,0,0,0|1,0,0]=4 6634 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [2,1,0,0,0,0|1,0,0]=4 6635 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [2,1,0,0,0,0|1,0,0]=4 6636 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [2,1,0,0,0,0|1,0,0]=4 6637 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [2,1,0,0,0,0|1,0,0]=4 6638 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [2,1,0,0,0,0|1,0,0]=4 6639 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [2,1,0,0,0,0|1,0,0]=4 6640 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [2,1,0,0,0,0|1,0,0]=4 6641 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [2,1,0,0,0,0|1,0,0]=4 6642 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [2,1,0,0,0,0|1,0,0]=4 6643 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [2,1,0,0,0,0|1,0,0]=4 6644 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [2,1,0,0,0,0|1,0,0]=4 6645 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 6646 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [2,1,0,0,0,0|1,0,0]=4 6647 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [2,1,0,0,0,0|0,0,0]=3 6648 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [2,1,0,0,0,0|1,0,0]=4 6649 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [2,1,0,0,0,0|1,0,0]=4 6650 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [2,1,0,0,0,0|1,0,0]=4 6651 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [2,1,0,0,0,0|1,0,0]=4 6652 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [2,1,0,0,0,0|0,0,1]=4 6653 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [2,1,0,0,0,0|1,0,0]=4 6654 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,1,0,0,0,0|0,0,0]=3 6655 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [2,1,0,0,0,0|1,0,0]=4 6656 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [2,1,0,0,0,0|1,0,0]=4 6657 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [2,1,0,0,0,0|1,0,0]=4 6658 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [2,1,0,0,0,0|1,0,0]=4 6659 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [2,1,0,0,0,0|0,0,0]=3 6660 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [2,1,0,0,0,0|0,0,0]=3 6661 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [2,1,0,0,0,0|0,0,0]=3 6662 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [2,1,0,0,0,0|0,0,0]=3 6663 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [2,1,0,0,0,0|0,0,0]=3 6664 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [2,1,0,0,0,0|1,0,0]=4 6665 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [2,1,0,0,0,0|1,0,0]=4 6666 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [2,1,0,0,0,0|1,0,0]=4 6667 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [2,1,0,0,0,0|1,0,0]=4 6668 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [2,1,0,0,0,0|1,0,0]=4 6669 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [2,1,0,0,0,0|1,0,0]=4 6670 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 6671 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 6672 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [2,1,0,0,0,0|1,0,0]=4 6673 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [2,1,0,0,0,0|1,0,0]=4 6674 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [2,1,0,0,0,0|1,0,0]=4 6675 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [2,1,0,0,0,0|1,0,0]=4 6676 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [2,1,0,0,0,0|1,0,0]=4 6677 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [2,1,0,0,0,0|1,0,0]=4 6678 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [2,1,0,0,0,0|1,0,0]=4 6679 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [2,1,0,0,0,0|1,0,0]=4 6680 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [2,1,0,0,0,0|1,0,0]=4 6681 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [2,1,0,0,0,0|1,0,0]=4 6682 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 6683 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [2,1,0,0,0,0|1,0,0]=4 6684 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [1,1,0,0,1,0|1,0,0]=4 6685 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [1,1,0,0,1,0|1,0,0]=4 6686 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [1,1,0,0,1,0|1,0,0]=4 6687 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [1,1,0,0,1,0|1,0,0]=4 6688 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [1,1,0,0,1,0|1,0,0]=4 6689 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [1,1,0,0,1,0|1,0,0]=4 6690 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [1,1,0,0,1,0|1,0,0]=4 6691 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [1,1,0,0,1,0|1,0,0]=4 6692 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [1,1,0,0,1,0|1,0,0]=4 6693 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [1,1,0,0,1,0|1,0,0]=4 6694 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [1,1,0,0,1,0|1,0,0]=4 6695 B9R1.41 NC(=O)c1cscc1O 271570a_203496583355_100009817205 [1,1,0,0,1,0|1,0,0]=4 6696 B11R0.5 C=CC=CC(=O)CC(=O)NCC 1458a_100016291481_100000183381 [0,2,1,0,0,0|0,0,1]=4 6697 B11R0.5 C=CC=CC(=O)CC(=O)NCO 1458a_100016291481_100000185155 [0,2,1,0,0,0|0,0,1]=4 6698 B11R0.154 C/C=C/C=CC(=O)CC(=O)NC 1458a_100000185730_100000183359 [0,2,1,0,0,0|0,0,1]=4 6699 B11R0.163 C=CC=CC(=O)CC(=O)N(C)C 1458a_100016291481_100000185267 [0,2,1,0,0,0|0,0,1]=4 6700 B11R0.107 C=C(C)CC(=O)C=CC(=O)NC 1458a_100016259477_100000748629 [0,2,1,0,0,0|0,0,1]=4 6701 B11R0.107 C=C(F)CC(=O)C=CC(=O)NC 1458a_100016259477_100009893438 [0,2,1,0,0,0|0,0,1]=4 6702 B11R0.70 C/C=C/CC(=O)C=CC(=O)NC 1458a_100016259477_100102629194 [0,2,1,0,0,0|0,0,1]=4 6703 B11R0.70 C=CCCC(=O)C=CC(=O)NC 1458a_100016259477_100000754431 [0,2,1,0,0,0|0,0,1]=4 6704 B11R0.70 C=CCNC(=O)C=CC(=O)NC 1626a_100020586998_100016259477 [0,2,1,0,0,0|0,0,1]=4 6705 B11R0.70 C=CCOC(=O)C=CC(=O)NC 1626a_100102657272_200011996189 [0,2,1,0,0,0|0,0,1]=4 6706 B11R0.70 C=CCOC(=O)C=CC(=O)NC 240690a_100102657272_200011996189 [0,2,1,0,0,0|0,0,1]=4 6707 B11R0.70 CC=CCC(=O)C=CC(=O)NC 1458a_100016259477_100000070051 [0,2,1,0,0,0|0,0,1]=4 6708 B11R0.141 C=CCC(=O)C=CC(=O)N(C)C 1458a_100011200747_100000210623 [0,2,1,0,0,0|0,0,1]=4 6709 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [1,2,0,0,0,0|0,0,0]=3 6710 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [1,2,0,0,0,0|0,0,0]=3 6711 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [1,2,0,0,0,0|1,0,0]=4 6712 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [1,2,0,0,0,0|1,0,0]=4 6713 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [1,2,0,0,0,0|1,0,0]=4 6714 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [1,2,0,0,0,0|1,0,0]=4 6715 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [1,2,0,0,0,0|1,0,0]=4 6716 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [1,2,0,0,0,0|1,0,0]=4 6717 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [1,2,0,0,0,0|1,0,0]=4 6718 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [1,2,0,0,0,0|1,0,0]=4 6719 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [1,2,0,0,0,0|1,0,0]=4 6720 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [1,2,0,0,0,0|1,0,0]=4 6721 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [1,2,0,0,0,0|1,0,0]=4 6722 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [1,2,0,0,0,0|1,0,0]=4 6723 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [1,2,0,0,0,0|1,0,0]=4 6724 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [1,2,0,0,0,0|1,0,0]=4 6725 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [1,2,0,0,0,0|1,0,0]=4 6726 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [1,2,0,0,0,0|1,0,0]=4 6727 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [1,2,0,0,0,0|1,0,0]=4 6728 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [1,2,0,0,0,0|1,0,0]=4 6729 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [1,2,0,0,0,0|1,0,0]=4 6730 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [1,2,0,0,0,0|0,0,0]=3 6731 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [1,2,0,0,0,0|0,0,0]=3 6732 B11R1.3 C=Cc1ccc(cc1)C(=O)N 271570a_100011290941_100000162191 [1,2,0,0,0,0|0,0,0]=3 6733 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [1,2,0,0,0,0|0,0,0]=3 6734 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [1,2,0,0,0,0|1,0,0]=4 6735 B11R1.3 C=Cc1ccc(cn1)C(=O)C 271570a_100011290941_100000684857 [1,2,0,0,0,0|1,0,0]=4 6736 B11R1.3 C=Cc1ccc(cn1)C(=O)N 271570a_100011290941_100000162237 [1,2,0,0,0,0|1,0,0]=4 6737 B11R1.3 C=Cc1ccc(nc1)C(=O)C 271570a_100011290941_100000686046 [1,2,0,0,0,0|1,0,0]=4 6738 B11R1.3 C=Cc1ccc(nc1)C(=O)N 271570a_100011290941_100011219284 [1,2,0,0,0,0|1,0,0]=4 6739 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [1,2,0,0,0,0|0,0,0]=3 6740 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [1,2,0,0,0,0|0,0,0]=3 6741 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [1,2,0,0,0,0|0,0,0]=3 6742 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [1,2,0,0,0,0|0,0,0]=3 6743 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [1,2,0,0,0,0|0,0,0]=3 6744 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [1,2,0,0,0,0|0,0,0]=3 6745 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [1,2,0,0,0,0|1,0,0]=4 6746 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [1,2,0,0,0,0|1,0,0]=4 6747 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [1,2,0,0,0,0|1,0,0]=4 6748 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [1,2,0,0,0,0|1,0,0]=4 6749 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [1,2,0,0,0,0|1,0,0]=4 6750 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [1,2,0,0,0,0|1,0,0]=4 6751 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [1,2,0,0,0,0|0,0,0]=3 6752 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [1,2,0,0,0,0|0,0,0]=3 6753 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [1,2,0,0,0,0|0,0,0]=3 6754 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [1,2,0,0,0,0|0,0,0]=3 6755 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [1,2,0,0,0,0|1,0,0]=4 6756 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [1,2,0,0,0,0|1,0,0]=4 6757 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [1,2,0,0,0,0|0,0,0]=3 6758 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [1,2,0,0,0,0|0,0,0]=3 6759 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [1,2,0,0,0,0|0,0,0]=3 6760 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [1,2,0,0,0,0|0,0,0]=3 6761 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [1,2,0,0,0,0|0,0,0]=3 6762 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [1,2,0,0,0,0|0,0,0]=3 6763 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [1,2,0,0,0,0|1,0,0]=4 6764 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [1,2,0,0,0,0|1,0,0]=4 6765 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [1,2,0,0,0,0|1,0,0]=4 6766 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [1,2,0,0,0,0|1,0,0]=4 6767 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [1,2,0,0,0,0|1,0,0]=4 6768 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [1,2,0,0,0,0|1,0,0]=4 6769 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [1,2,0,0,0,0|1,0,0]=4 6770 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [1,2,0,0,0,0|0,0,0]=3 6771 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [1,2,0,0,0,0|0,0,0]=3 6772 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [1,2,0,0,0,0|0,0,0]=3 6773 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [1,2,0,0,0,0|0,0,0]=3 6774 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [1,2,0,0,0,0|0,0,0]=3 6775 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [1,2,0,0,0,0|0,0,0]=3 6776 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [1,2,0,0,0,0|1,0,0]=4 6777 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [1,2,0,0,0,0|1,0,0]=4 6778 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [1,2,0,0,0,0|1,0,0]=4 6779 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [1,2,0,0,0,0|1,0,0]=4 6780 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [1,2,0,0,0,0|1,0,0]=4 6781 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [1,2,0,0,0,0|1,0,0]=4 6782 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [1,2,0,0,0,0|1,0,0]=4 6783 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [1,2,0,0,0,0|1,0,0]=4 6784 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [1,2,0,0,0,0|1,0,0]=4 6785 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [1,2,0,0,0,0|0,0,0]=3 6786 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [1,2,0,0,0,0|0,0,0]=3 6787 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [1,2,0,0,0,0|0,0,0]=3 6788 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [1,2,0,0,0,0|0,0,0]=3 6789 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [1,2,0,0,0,0|0,0,0]=3 6790 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [1,2,0,0,0,0|0,0,0]=3 6791 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [1,2,0,0,0,0|0,0,0]=3 6792 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [1,2,0,0,0,0|1,0,0]=4 6793 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [1,2,0,0,0,0|1,0,0]=4 6794 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [1,2,0,0,0,0|1,0,0]=4 6795 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [1,2,0,0,0,0|1,0,0]=4 6796 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [1,2,0,0,0,0|1,0,0]=4 6797 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [1,2,0,0,0,0|1,0,0]=4 6798 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [1,2,0,0,0,0|1,0,0]=4 6799 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [1,2,0,0,0,0|1,0,0]=4 6800 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [1,2,0,0,0,0|1,0,0]=4 6801 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [1,2,0,0,0,0|1,0,0]=4 6802 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [1,2,0,0,0,0|1,0,0]=4 6803 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [1,2,0,0,0,0|1,0,0]=4 6804 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [1,2,0,0,0,0|1,0,0]=4 6805 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [1,2,0,0,0,0|1,0,0]=4 6806 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [1,2,0,0,0,0|1,0,0]=4 6807 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [1,2,0,0,0,0|1,0,0]=4 6808 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [1,2,0,0,0,0|1,0,0]=4 6809 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [1,2,0,0,0,0|1,0,0]=4 6810 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [1,2,0,0,0,0|1,0,0]=4 6811 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [1,2,0,0,0,0|1,0,0]=4 6812 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [1,2,0,0,0,0|1,0,0]=4 6813 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [1,2,0,0,0,0|1,0,0]=4 6814 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [1,2,0,0,0,0|1,0,0]=4 6815 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [1,2,0,0,0,0|1,0,0]=4 6816 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [1,2,0,0,0,0|1,0,0]=4 6817 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [1,2,0,0,0,0|1,0,0]=4 6818 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [1,2,0,0,0,0|1,0,0]=4 6819 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [1,2,0,0,0,0|1,0,0]=4 6820 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [1,2,0,0,0,0|1,0,0]=4 6821 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [1,2,0,0,0,0|1,0,0]=4 6822 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [1,2,0,0,0,0|1,0,0]=4 6823 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [1,2,0,0,0,0|1,0,0]=4 6824 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [1,2,0,0,0,0|1,0,0]=4 6825 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [1,2,0,0,0,0|1,0,0]=4 6826 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [1,2,0,0,0,0|1,0,0]=4 6827 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [1,2,0,0,0,0|1,0,0]=4 6828 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,2,0,0,0,0|1,0,0]=4 6829 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,2,0,0,0,0|1,0,0]=4 6830 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,2,0,0,0,0|1,0,0]=4 6831 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,2,0,0,0,0|1,0,0]=4 6832 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,2,0,0,0,0|1,0,0]=4 6833 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,2,0,0,0,0|1,0,0]=4 6834 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [1,2,0,0,0,0|1,0,0]=4 6835 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [1,2,0,0,0,0|0,0,0]=3 6836 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [1,2,0,0,0,0|0,0,0]=3 6837 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [1,2,0,0,0,0|0,0,0]=3 6838 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [1,2,0,0,0,0|0,0,0]=3 6839 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [1,2,0,0,0,0|0,0,0]=3 6840 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,2,0,0,0,0|0,0,0]=3 6841 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,2,0,0,0,0|0,0,0]=3 6842 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [1,2,0,0,0,0|0,0,0]=3 6843 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [1,2,0,0,0,0|0,0,0]=3 6844 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [1,2,0,0,0,0|0,0,0]=3 6845 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [1,2,0,0,0,0|0,0,0]=3 6846 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [1,2,0,0,0,0|0,0,0]=3 6847 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,2,0,0,0,0|0,0,0]=3 6848 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,2,0,0,0,0|0,0,0]=3 6849 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [1,2,0,0,0,0|0,0,0]=3 6850 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [1,2,0,0,0,0|0,0,0]=3 6851 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [1,2,0,0,0,0|0,0,0]=3 6852 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [1,2,0,0,0,0|0,0,0]=3 6853 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [1,2,0,0,0,0|0,0,0]=3 6854 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,2,0,0,0,0|0,0,0]=3 6855 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [1,2,0,0,0,0|0,0,0]=3 6856 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [1,2,0,0,0,0|0,0,0]=3 6857 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [1,2,0,0,0,0|0,0,0]=3 6858 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [1,2,0,0,0,0|0,0,0]=3 6859 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [1,2,0,0,0,0|0,0,0]=3 6860 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,2,0,0,0,0|0,0,0]=3 6861 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,2,0,0,0,0|0,0,0]=3 6862 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [1,2,0,0,0,0|0,0,0]=3 6863 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [1,2,0,0,0,0|0,0,0]=3 6864 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [1,2,0,0,0,0|0,0,0]=3 6865 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [1,2,0,0,0,0|0,0,0]=3 6866 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [1,2,0,0,0,0|0,0,0]=3 6867 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,2,0,0,0,0|0,0,0]=3 6868 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,2,0,0,0,0|0,0,0]=3 6869 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,2,0,0,0,0|0,0,0]=3 6870 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,2,0,0,0,0|0,0,0]=3 6871 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,2,0,0,0,0|0,0,0]=3 6872 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,2,0,0,0,0|0,0,0]=3 6873 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,2,0,0,0,0|0,0,0]=3 6874 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,2,0,0,0,0|0,0,0]=3 6875 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,2,0,0,0,0|0,0,0]=3 6876 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,2,0,0,0,0|0,0,0]=3 6877 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,2,0,0,0,0|0,0,0]=3 6878 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,2,0,0,0,0|0,0,0]=3 6879 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,2,0,0,0,0|0,0,0]=3 6880 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [1,2,0,0,0,0|1,0,0]=4 6881 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [1,2,0,0,0,0|1,0,0]=4 6882 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [1,2,0,0,0,0|0,0,0]=3 6883 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [1,2,0,0,0,0|0,0,0]=3 6884 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [1,2,0,0,0,0|0,0,0]=3 6885 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [1,2,0,0,0,0|0,0,0]=3 6886 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,2,0,0,0,0|0,0,0]=3 6887 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,2,0,0,0,0|0,0,0]=3 6888 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [1,2,0,0,0,0|0,0,0]=3 6889 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [1,2,0,0,0,0|0,0,0]=3 6890 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [1,2,0,0,0,0|0,0,0]=3 6891 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [1,2,0,0,0,0|0,0,0]=3 6892 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [1,2,0,0,0,0|0,0,0]=3 6893 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,2,0,0,0,0|0,0,0]=3 6894 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,2,0,0,0,0|0,0,0]=3 6895 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,2,0,0,0,0|0,0,0]=3 6896 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,2,0,0,0,0|0,0,0]=3 6897 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,2,0,0,0,0|0,0,0]=3 6898 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,2,0,0,0,0|0,0,0]=3 6899 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [1,2,0,0,0,0|0,0,0]=3 6900 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [1,2,0,0,0,0|0,0,0]=3 6901 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [1,2,0,0,0,0|0,0,0]=3 6902 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [1,2,0,0,0,0|0,0,0]=3 6903 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,2,0,0,0,0|0,0,0]=3 6904 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [1,2,0,0,0,0|0,0,0]=3 6905 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [1,2,0,0,0,0|0,0,0]=3 6906 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [1,2,0,0,0,0|0,0,0]=3 6907 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [1,2,0,0,0,0|0,0,0]=3 6908 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,2,0,0,0,0|0,0,0]=3 6909 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [1,2,0,0,0,0|0,0,0]=3 6910 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [1,2,0,0,0,0|0,0,0]=3 6911 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [1,2,0,0,0,0|0,0,0]=3 6912 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [1,2,0,0,0,0|0,0,0]=3 6913 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,2,0,0,0,0|0,0,0]=3 6914 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [1,2,0,0,0,0|0,0,0]=3 6915 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [1,2,0,0,0,0|0,0,0]=3 6916 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [1,2,0,0,0,0|0,0,0]=3 6917 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [1,2,0,0,0,0|0,0,0]=3 6918 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,2,0,0,0,0|0,0,0]=3 6919 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,2,0,0,0,0|0,0,0]=3 6920 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,2,0,0,0,0|0,0,0]=3 6921 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,2,0,0,0,0|0,0,0]=3 6922 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,2,0,0,0,0|0,0,0]=3 6923 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,2,0,0,0,0|0,0,0]=3 6924 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [1,2,0,0,0,0|1,0,0]=4 6925 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [1,2,0,0,0,0|1,0,0]=4 6926 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [1,2,0,0,0,0|1,0,0]=4 6927 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [1,2,0,0,0,0|1,0,0]=4 6928 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [1,2,0,0,0,0|1,0,0]=4 6929 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [1,2,0,0,0,0|1,0,0]=4 6930 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [1,2,0,0,0,0|1,0,0]=4 6931 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [1,2,0,0,0,0|1,0,0]=4 6932 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [1,2,0,0,0,0|1,0,0]=4 6933 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [1,2,0,0,0,0|1,0,0]=4 6934 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [1,2,0,0,0,0|1,0,0]=4 6935 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [1,2,0,0,0,0|1,0,0]=4 6936 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [1,2,0,0,0,0|1,0,0]=4 6937 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [1,2,0,0,0,0|1,0,0]=4 6938 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [1,2,0,0,0,0|1,0,0]=4 6939 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [1,2,0,0,0,0|1,0,0]=4 6940 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [1,2,0,0,0,0|1,0,0]=4 6941 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [1,2,0,0,0,0|1,0,0]=4 6942 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [1,2,0,0,0,0|1,0,0]=4 6943 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [1,2,0,0,0,0|1,0,0]=4 6944 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [1,2,0,0,0,0|1,0,0]=4 6945 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [1,2,0,0,0,0|1,0,0]=4 6946 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [1,2,0,0,0,0|1,0,0]=4 6947 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [1,2,0,0,0,0|1,0,0]=4 6948 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [1,2,0,0,0,0|1,0,0]=4 6949 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [1,2,0,0,0,0|1,0,0]=4 6950 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [1,2,0,0,0,0|1,0,0]=4 6951 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [1,2,0,0,0,0|1,0,0]=4 6952 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [1,2,0,0,0,0|1,0,0]=4 6953 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,2,0,0,0,0|1,0,0]=4 6954 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [1,2,0,0,0,0|1,0,0]=4 6955 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [1,2,0,0,0,0|1,0,0]=4 6956 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [1,2,0,0,0,0|1,0,0]=4 6957 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [1,2,0,0,0,0|1,0,0]=4 6958 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [1,2,0,0,0,0|1,0,0]=4 6959 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [1,2,0,0,0,0|0,0,0]=3 6960 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [1,2,0,0,0,0|0,0,0]=3 6961 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [1,2,0,0,0,0|0,0,0]=3 6962 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [1,2,0,0,0,0|0,0,0]=3 6963 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [1,2,0,0,0,0|0,0,0]=3 6964 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,2,0,0,0,0|0,0,0]=3 6965 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [1,2,0,0,0,0|0,0,0]=3 6966 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [1,2,0,0,0,0|0,0,0]=3 6967 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [1,2,0,0,0,0|0,0,0]=3 6968 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [1,2,0,0,0,0|0,0,0]=3 6969 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [1,2,0,0,0,0|0,0,0]=3 6970 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,2,0,0,0,0|0,0,0]=3 6971 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,2,0,0,0,0|0,0,0]=3 6972 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [1,2,0,0,0,0|0,0,0]=3 6973 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [1,2,0,0,0,0|0,0,0]=3 6974 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [1,2,0,0,0,0|0,0,0]=3 6975 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [1,2,0,0,0,0|0,0,0]=3 6976 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [1,2,0,0,0,0|0,0,0]=3 6977 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,2,0,0,0,0|0,0,0]=3 6978 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [1,2,0,0,0,0|0,0,0]=3 6979 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [1,2,0,0,0,0|0,0,0]=3 6980 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [1,2,0,0,0,0|0,0,0]=3 6981 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [1,2,0,0,0,0|0,0,0]=3 6982 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [1,2,0,0,0,0|0,0,0]=3 6983 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,2,0,0,0,0|0,0,0]=3 6984 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,2,0,0,0,0|0,0,0]=3 6985 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [1,2,0,0,0,0|0,0,0]=3 6986 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [1,2,0,0,0,0|0,0,0]=3 6987 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [1,2,0,0,0,0|0,0,0]=3 6988 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [1,2,0,0,0,0|0,0,0]=3 6989 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,2,0,0,0,0|0,0,0]=3 6990 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [1,2,0,0,0,0|0,0,0]=3 6991 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [1,2,0,0,0,0|0,0,0]=3 6992 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [1,2,0,0,0,0|0,0,0]=3 6993 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [1,2,0,0,0,0|0,0,0]=3 6994 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [1,2,0,0,0,0|0,0,0]=3 6995 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [1,2,0,0,0,0|0,0,0]=3 6996 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [1,2,0,0,0,0|0,0,0]=3 6997 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,2,0,0,0,0|0,0,0]=3 6998 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,2,0,0,0,0|0,0,0]=3 6999 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,2,0,0,0,0|0,0,0]=3 7000 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [1,2,0,0,0,0|1,0,0]=4 7001 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,2,0,0,0,0|0,0,0]=3 7002 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [1,2,0,0,0,0|0,0,0]=3 7003 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [1,2,0,0,0,0|0,0,0]=3 7004 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [1,2,0,0,0,0|0,0,0]=3 7005 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [1,2,0,0,0,0|0,0,0]=3 7006 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,2,0,0,0,0|0,0,0]=3 7007 B11R1.166 Cc1cc(ncc1C(=O)N)O 271570a_203496583355_200134614278 [1,2,0,0,0,0|1,0,0]=4 7008 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [1,2,0,0,0,0|0,0,0]=3 7009 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [1,2,0,0,0,0|0,0,0]=3 7010 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [1,2,0,0,0,0|0,0,0]=3 7011 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [1,2,0,0,0,0|0,0,0]=3 7012 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [1,2,0,0,0,0|0,0,0]=3 7013 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [1,2,0,0,0,0|0,0,0]=3 7014 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 271570a_203496583355_100000041523 [1,2,0,0,0,0|1,0,0]=4 7015 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,2,0,0,0,0|0,0,0]=3 7016 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,2,0,0,0,0|0,0,0]=3 7017 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,2,0,0,0,0|0,0,0]=3 7018 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [1,2,0,0,0,0|0,0,0]=3 7019 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [1,2,0,0,0,0|0,0,0]=3 7020 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,2,0,0,0,0|0,0,0]=3 7021 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [1,2,0,0,0,0|1,0,0]=4 7022 B11R1.166 NC(=O)c1ncc(cc1F)O 271570a_203496583355_200010161073 [1,2,0,0,0,0|1,0,0]=4 7023 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [1,2,0,0,0,0|1,0,0]=4 7024 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [1,2,0,0,0,0|0,0,0]=3 7025 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [1,2,0,0,0,0|0,0,0]=3 7026 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [1,2,0,0,0,0|0,0,0]=3 7027 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [1,2,0,0,0,0|0,0,0]=3 7028 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,2,0,0,0,0|0,0,0]=3 7029 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [1,2,0,0,0,0|0,0,0]=3 7030 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [1,2,0,0,0,0|0,0,0]=3 7031 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [1,2,0,0,0,0|0,0,0]=3 7032 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [1,2,0,0,0,0|0,0,0]=3 7033 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,2,0,0,0,0|0,0,0]=3 7034 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [1,2,0,0,0,0|0,0,0]=3 7035 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [1,2,0,0,0,0|0,0,0]=3 7036 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [1,2,0,0,0,0|0,0,0]=3 7037 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [1,2,0,0,0,0|0,0,0]=3 7038 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,2,0,0,0,0|0,0,0]=3 7039 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [1,2,0,0,0,0|0,0,0]=3 7040 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [1,2,0,0,0,0|0,0,0]=3 7041 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [1,2,0,0,0,0|0,0,0]=3 7042 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [1,2,0,0,0,0|0,0,0]=3 7043 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [1,2,0,0,0,0|0,0,0]=3 7044 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [1,2,0,0,0,0|0,0,0]=3 7045 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [1,2,0,0,0,0|0,0,0]=3 7046 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,2,0,0,0,0|0,0,0]=3 7047 B11R1.87 CS(=O)(=O)c1ccccc1O 271570a_203496583355_100000751929 [1,2,0,0,0,0|1,0,0]=4 7048 B11R1.87 NS(=O)(=O)c1ccccc1O 271570a_203496583355_100000735520 [1,2,0,0,0,0|1,0,0]=4 7049 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [1,2,0,0,0,0|1,0,0]=4 7050 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [1,2,0,0,0,0|1,0,0]=4 7051 B11R1.53 C#Cc1ccccc1C(=O)C 1458a_100011243808_200000210301 [1,2,0,0,0,0|0,0,0]=3 7052 B11R1.53 C#Cc1ccccc1C(=O)[13CH3] 1458a_100011243808_200025704644 [1,2,0,0,0,0|0,0,0]=3 7053 B11R1.53 C=C(C)c1ccccc1C#N 271570a_100000694244_100000188569 [1,2,0,0,0,0|1,0,0]=4 7054 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [1,2,0,0,0,0|1,0,0]=4 7055 B11R1.53 C=C(C)c1ccccc1CC 271570a_100000694244_100011215823 [1,2,0,0,0,0|1,0,0]=4 7056 B11R1.53 C=C(C)c1ccccc1CN 271570a_100000694244_100000689332 [1,2,0,0,0,0|1,0,0]=4 7057 B11R1.53 C=C(C)c1ccccc1CO 271570a_100000694244_100000187465 [1,2,0,0,0,0|1,0,0]=4 7058 B11R1.53 C=C(C)c1ccccc1NC 271570a_100000694244_100020606079 [1,2,0,0,0,0|1,0,0]=4 7059 B11R1.53 C=C(C)c1ccccc1NC 34a_100000037685_200000210301 [1,2,0,0,0,0|1,0,0]=4 7060 B11R1.53 C=C(C)c1ccccc1NN 271570a_100000694244_100000241748 [1,2,0,0,0,0|1,0,0]=4 7061 B11R1.53 C=C(C)c1ccccc1N[13CH3] 34a_100000037685_200025704644 [1,2,0,0,0,0|1,0,0]=4 7062 B11R1.53 C=C(C)c1ccccc1OC 271570a_100000694244_100000174000 [1,2,0,0,0,0|1,0,0]=4 7063 B11R1.53 C=C(C)c1ccccc1SC 271570a_100000694244_100011217816 [1,2,0,0,0,0|1,0,0]=4 7064 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [1,2,0,0,0,0|0,0,0]=3 7065 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [1,2,0,0,0,0|0,0,0]=3 7066 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [1,2,0,0,0,0|0,0,0]=3 7067 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [1,2,0,0,0,0|0,0,0]=3 7068 B11R1.53 C=Cc1ccccc1S(=O)C 271570a_100011290941_100000734199 [1,2,0,0,0,0|1,0,0]=4 7069 B11R1.53 C=Cc1cccnc1C(=O)C 271570a_100011290941_100012348690 [1,2,0,0,0,0|1,0,0]=4 7070 B11R1.53 C=Cc1cccnc1C(=O)N 271570a_100011290941_200012359670 [1,2,0,0,0,0|1,0,0]=4 7071 B11R1.53 C=Cc1ccncc1C(=O)C 271570a_100011290941_100160469449 [1,2,0,0,0,0|1,0,0]=4 7072 B11R1.53 C=Cc1ccncc1C(=O)N 271570a_100011290941_100000697804 [1,2,0,0,0,0|1,0,0]=4 7073 B11R1.53 C=Cc1cnccc1C(=O)C 271570a_100011290941_100009993184 [1,2,0,0,0,0|1,0,0]=4 7074 B11R1.53 C=Cc1cnccc1C(=O)N 271570a_100011290941_100010205435 [1,2,0,0,0,0|1,0,0]=4 7075 B11R1.53 C=Cc1ncccc1C(=O)C 271570a_100011290941_100000753718 [1,2,0,0,0,0|1,0,0]=4 7076 B11R1.53 C=Cc1ncccc1C(=O)N 271570a_100011290941_100000162199 [1,2,0,0,0,0|1,0,0]=4 7077 B11R1.53 CC(=O)c1ccccc1C#N 1458a_100000742908_200000210301 [1,2,0,0,0,0|0,0,0]=3 7078 B11R1.53 CC(=O)c1ccccc1CO 1458a_100011301526_200000210301 [1,2,0,0,0,0|0,0,0]=3 7079 B11R1.53 CC(=O)c1ccccc1I=O 1458a_100000032414_200000210301 [1,2,0,0,0,0|0,0,0]=3 7080 B11R1.53 CC(=O)c1ccccc1S[13CH3] 62a_100000751169_200025704644 [1,2,0,0,0,0|0,0,0]=3 7081 B11R1.53 CC(=O)c1cccnc1S[13CH3] 62a_100000753718_200025704644 [1,2,0,0,0,0|1,0,0]=4 7082 B11R1.53 CC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000753718 [1,2,0,0,0,0|1,0,0]=4 7083 B11R1.53 CC(=O)c1ccncc1O[13CH3] 7a_100009872882_200025704644 [1,2,0,0,0,0|1,0,0]=4 7084 B11R1.53 CC(=O)c1ccncc1S[13CH3] 62a_100009993184_200025704644 [1,2,0,0,0,0|1,0,0]=4 7085 B11R1.53 CC(=O)c1ccncc1S[13CH3] 62a_200025704644_100009993184 [1,2,0,0,0,0|1,0,0]=4 7086 B11R1.53 CC(=O)c1cnccc1S[13CH3] 62a_100160469449_200025704644 [1,2,0,0,0,0|1,0,0]=4 7087 B11R1.53 CC(=O)c1cnccc1S[13CH3] 62a_200025704644_100160469449 [1,2,0,0,0,0|1,0,0]=4 7088 B11R1.53 CC(=O)c1ncccc1O[13CH3] 34a_100000087166_200025704644 [1,2,0,0,0,0|1,0,0]=4 7089 B11R1.53 CC(=O)c1ncccc1O[13CH3] 7a_100000087166_200025704644 [1,2,0,0,0,0|1,0,0]=4 7090 B11R1.53 CC(=O)c1ncccc1S[13CH3] 62a_100012348690_200025704644 [1,2,0,0,0,0|1,0,0]=4 7091 B11R1.53 CC(=O)c1ncccc1S[13CH3] 62a_200025704644_100012348690 [1,2,0,0,0,0|1,0,0]=4 7092 B11R1.53 CCc1ccccc1C(=O)C 1458a_100000689120_200000210301 [1,2,0,0,0,0|0,0,0]=3 7093 B11R1.53 CCc1ccccc1C(=O)[13CH3] 1458a_100000689120_200025704644 [1,2,0,0,0,0|0,0,0]=3 7094 B11R1.53 CNc1ccccc1C(=O)N 34a_100000185089_200000210301 [1,2,0,0,0,0|0,0,0]=3 7095 B11R1.53 CNc1cccnc1C(=O)N 27a_100102657272_200012359670 [1,2,0,0,0,0|1,0,0]=4 7096 B11R1.53 CNc1ccncc1C(=O)C 27a_100102657272_100160469449 [1,2,0,0,0,0|1,0,0]=4 7097 B11R1.53 CNc1ccncc1C(=O)N 27a_100102657272_100000697804 [1,2,0,0,0,0|1,0,0]=4 7098 B11R1.53 CNc1ncccc1C(=O)C 27a_100102657272_100009816689 [1,2,0,0,0,0|1,0,0]=4 7099 B11R1.53 CNc1ncccc1C(=O)N 27a_100102657272_100000162199 [1,2,0,0,0,0|1,0,0]=4 7100 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [1,2,0,0,0,0|0,0,0]=3 7101 B11R1.53 COc1ccccc1C(=O)N 34a_100000192804_200000210301 [1,2,0,0,0,0|0,0,0]=3 7102 B11R1.53 COc1ccccc1C(=O)N 7a_100000192804_200000210301 [1,2,0,0,0,0|0,0,0]=3 7103 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [1,2,0,0,0,0|0,0,0]=3 7104 B11R1.53 COc1ccccc1C(=O)[O-] 7a_100015234032_200000210301 [1,2,0,0,0,0|1,0,0]=4 7105 B11R1.53 COc1ccccc1C(=S)N 7a_100000745089_200000210301 [1,2,0,0,0,0|0,1,0]=4 7106 B11R1.53 COc1cccnc1C(=O)C 34a_100000087166_200000210301 [1,2,0,0,0,0|1,0,0]=4 7107 B11R1.53 COc1cccnc1C(=O)C 7a_100000087166_200000210301 [1,2,0,0,0,0|1,0,0]=4 7108 B11R1.53 COc1cccnc1C(=O)N 34a_200011215183_200000210301 [1,2,0,0,0,0|1,0,0]=4 7109 B11R1.53 COc1cccnc1C(=O)N 7a_200011215183_200000210301 [1,2,0,0,0,0|1,0,0]=4 7110 B11R1.53 COc1ccncc1C(=O)N 34a_200011998761_200000210301 [1,2,0,0,0,0|1,0,0]=4 7111 B11R1.53 COc1cnccc1C(=O)C 7a_100009872882_200000210301 [1,2,0,0,0,0|1,0,0]=4 7112 B11R1.53 COc1cnccc1C(=O)N 7a_100012022987_200000210301 [1,2,0,0,0,0|1,0,0]=4 7113 B11R1.53 CS(=O)c1ccccc1S[13CH3] 62a_100000734199_200025704644 [1,2,0,0,0,0|1,0,0]=4 7114 B11R1.53 CSc1ccccc1C(=O)C 1458a_100000183967_200000210301 [1,2,0,0,0,0|0,0,0]=3 7115 B11R1.53 CSc1ccccc1C(=O)C 62a_100000751169_200000210301 [1,2,0,0,0,0|0,0,0]=3 7116 B11R1.53 CSc1ccccc1C(=O)N 62a_100000162227_200000210301 [1,2,0,0,0,0|0,0,0]=3 7117 B11R1.53 CSc1ccccc1C(=O)N 62a_200000210301_100000162227 [1,2,0,0,0,0|0,0,0]=3 7118 B11R1.53 CSc1ccccc1C(=O)O 62a_200000210301_100000734275 [1,2,0,0,0,0|1,0,0]=4 7119 B11R1.53 CSc1ccccc1C(=O)O 62a_202125556159_200000210301 [1,2,0,0,0,0|1,0,0]=4 7120 B11R1.53 CSc1ccccc1C(=O)[13CH3] 1458a_100000183967_200025704644 [1,2,0,0,0,0|0,0,0]=3 7121 B11R1.53 CSc1ccccc1S(=O)C 62a_100000734199_200000210301 [1,2,0,0,0,0|1,0,0]=4 7122 B11R1.53 CSc1cccnc1C(=O)C 62a_100012348690_200000210301 [1,2,0,0,0,0|1,0,0]=4 7123 B11R1.53 CSc1cccnc1C(=O)C 62a_200000210301_100012348690 [1,2,0,0,0,0|1,0,0]=4 7124 B11R1.53 CSc1cccnc1C(=O)N 62a_200000210301_200012359670 [1,2,0,0,0,0|1,0,0]=4 7125 B11R1.53 CSc1cccnc1C(=O)N 62a_200012359670_200000210301 [1,2,0,0,0,0|1,0,0]=4 7126 B11R1.53 CSc1ccncc1C(=O)C 62a_100160469449_200000210301 [1,2,0,0,0,0|1,0,0]=4 7127 B11R1.53 CSc1ccncc1C(=O)C 62a_200000210301_100160469449 [1,2,0,0,0,0|1,0,0]=4 7128 B11R1.53 CSc1ccncc1C(=O)N 62a_100000697804_200000210301 [1,2,0,0,0,0|1,0,0]=4 7129 B11R1.53 CSc1ccncc1C(=O)N 62a_200000210301_100000697804 [1,2,0,0,0,0|1,0,0]=4 7130 B11R1.53 CSc1cnccc1C(=O)C 62a_100009993184_200000210301 [1,2,0,0,0,0|1,0,0]=4 7131 B11R1.53 CSc1cnccc1C(=O)C 62a_200000210301_100009993184 [1,2,0,0,0,0|1,0,0]=4 7132 B11R1.53 CSc1cnccc1C(=O)N 62a_100010205435_200000210301 [1,2,0,0,0,0|1,0,0]=4 7133 B11R1.53 CSc1cnccc1C(=O)N 62a_200000210301_100010205435 [1,2,0,0,0,0|1,0,0]=4 7134 B11R1.53 CSc1ncccc1C(=O)C 62a_100000753718_200000210301 [1,2,0,0,0,0|1,0,0]=4 7135 B11R1.53 CSc1ncccc1C(=O)C 62a_200000210301_100000753718 [1,2,0,0,0,0|1,0,0]=4 7136 B11R1.53 CSc1ncccc1C(=O)N 62a_100000162199_200000210301 [1,2,0,0,0,0|1,0,0]=4 7137 B11R1.53 CSc1ncccc1C(=O)N 62a_200000210301_100000162199 [1,2,0,0,0,0|1,0,0]=4 7138 B11R1.53 [13CH3]C(=O)c1ccccc1C#N 1458a_100000742908_200025704644 [1,2,0,0,0,0|0,0,0]=3 7139 B11R1.53 [13CH3]C(=O)c1ccccc1CO 1458a_100011301526_200025704644 [1,2,0,0,0,0|0,0,0]=3 7140 B11R1.53 [13CH3]C(=O)c1ccccc1I=O 1458a_100000032414_200025704644 [1,2,0,0,0,0|0,0,0]=3 7141 B11R1.53 [13CH3]Nc1ccccc1C(=O)N 34a_100000185089_200025704644 [1,2,0,0,0,0|0,0,0]=3 7142 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 34a_100000192804_200025704644 [1,2,0,0,0,0|0,0,0]=3 7143 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 7a_100000192804_200025704644 [1,2,0,0,0,0|0,0,0]=3 7144 B11R1.53 [13CH3]Oc1ccccc1C(=O)[O-] 7a_100015234032_200025704644 [1,2,0,0,0,0|1,0,0]=4 7145 B11R1.53 [13CH3]Oc1ccccc1C(=S)N 7a_100000745089_200025704644 [1,2,0,0,0,0|0,1,0]=4 7146 B11R1.53 [13CH3]Oc1cccnc1C(=O)N 34a_200011215183_200025704644 [1,2,0,0,0,0|1,0,0]=4 7147 B11R1.53 [13CH3]Oc1cccnc1C(=O)N 7a_200011215183_200025704644 [1,2,0,0,0,0|1,0,0]=4 7148 B11R1.53 [13CH3]Oc1ccncc1C(=O)N 34a_200011998761_200025704644 [1,2,0,0,0,0|1,0,0]=4 7149 B11R1.53 [13CH3]Oc1cnccc1C(=O)N 7a_100012022987_200025704644 [1,2,0,0,0,0|1,0,0]=4 7150 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_100000162227_200025704644 [1,2,0,0,0,0|0,0,0]=3 7151 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_200025704644_100000162227 [1,2,0,0,0,0|0,0,0]=3 7152 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_200025704644_100000734275 [1,2,0,0,0,0|1,0,0]=4 7153 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_202125556159_200025704644 [1,2,0,0,0,0|1,0,0]=4 7154 B11R1.53 [13CH3]Sc1cccnc1C(=O)N 62a_200012359670_200025704644 [1,2,0,0,0,0|1,0,0]=4 7155 B11R1.53 [13CH3]Sc1cccnc1C(=O)N 62a_200025704644_200012359670 [1,2,0,0,0,0|1,0,0]=4 7156 B11R1.53 [13CH3]Sc1ccncc1C(=O)N 62a_100000697804_200025704644 [1,2,0,0,0,0|1,0,0]=4 7157 B11R1.53 [13CH3]Sc1ccncc1C(=O)N 62a_200025704644_100000697804 [1,2,0,0,0,0|1,0,0]=4 7158 B11R1.53 [13CH3]Sc1cnccc1C(=O)N 62a_100010205435_200025704644 [1,2,0,0,0,0|1,0,0]=4 7159 B11R1.53 [13CH3]Sc1cnccc1C(=O)N 62a_200025704644_100010205435 [1,2,0,0,0,0|1,0,0]=4 7160 B11R1.53 [13CH3]Sc1ncccc1C(=O)N 62a_100000162199_200025704644 [1,2,0,0,0,0|1,0,0]=4 7161 B11R1.53 [13CH3]Sc1ncccc1C(=O)N 62a_200025704644_100000162199 [1,2,0,0,0,0|1,0,0]=4 7162 B11R1.156 C=C(C)c1c(cccc1Br)Br 271570a_100000694244_100009994525 [1,2,0,0,0,0|1,0,0]=4 7163 B11R1.156 C=C(C)c1c(cccc1Br)Cl 271570a_100000694244_100010214488 [1,2,0,0,0,0|1,0,0]=4 7164 B11R1.156 C=C(C)c1c(cccc1Br)F 271570a_100000694244_100011219512 [1,2,0,0,0,0|1,0,0]=4 7165 B11R1.156 C=C(C)c1c(cccc1Br)N 271570a_100000694244_100020590159 [1,2,0,0,0,0|1,0,0]=4 7166 B11R1.156 C=C(C)c1c(cccc1Br)O 271570a_100000694244_100010187912 [1,2,0,0,0,0|1,0,0]=4 7167 B11R1.156 C=C(C)c1c(cccc1C)C 271570a_100000694244_100000033847 [1,2,0,0,0,0|1,0,0]=4 7168 B11R1.156 C=C(C)c1c(cccc1Cl)C 271570a_100000694244_100000043165 [1,2,0,0,0,0|1,0,0]=4 7169 B11R1.156 C=C(C)c1c(cccc1Cl)Cl 271570a_100000694244_100000034237 [1,2,0,0,0,0|1,0,0]=4 7170 B11R1.156 C=C(C)c1c(cccc1Cl)F 271570a_100000694244_100000050007 [1,2,0,0,0,0|1,0,0]=4 7171 B11R1.156 C=C(C)c1c(cccc1Cl)N 271570a_100000694244_100000049713 [1,2,0,0,0,0|1,0,0]=4 7172 B11R1.156 C=C(C)c1c(cccc1Cl)O 271570a_100000694244_100000050174 [1,2,0,0,0,0|1,0,0]=4 7173 B11R1.156 C=C(C)c1c(cccc1F)C 271570a_100000694244_100012349962 [1,2,0,0,0,0|1,0,0]=4 7174 B11R1.156 C=C(C)c1c(cccc1F)F 271570a_100000694244_100000693133 [1,2,0,0,0,0|1,0,0]=4 7175 B11R1.156 C=C(C)c1c(cccc1F)N 271570a_100000694244_100011934729 [1,2,0,0,0,0|1,0,0]=4 7176 B11R1.156 C=C(C)c1c(cccc1F)O 271570a_100000694244_100009820682 [1,2,0,0,0,0|1,0,0]=4 7177 B11R1.156 C=C(C)c1c(cccc1N)C 271570a_100000694244_100000684715 [1,2,0,0,0,0|1,0,0]=4 7178 B11R1.156 C=C(C)c1c(cccc1O)C 271570a_100000694244_100000686692 [1,2,0,0,0,0|1,0,0]=4 7179 B11R1.156 C=C(C)c1c(cccc1O)N 271570a_100000694244_100012183704 [1,2,0,0,0,0|1,0,0]=4 7180 B11R1.156 C=C(C)c1c(cccc1O)O 271570a_100000694244_100010205330 [1,2,0,0,0,0|1,0,0]=4 7181 B11R1.156 CC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000210301 [1,2,0,0,0,0|0,0,0]=3 7182 B11R1.156 CC(=O)c1c(cccc1Br)C 1458a_100000701904_200000210301 [1,2,0,0,0,0|0,0,0]=3 7183 B11R1.156 CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000210301 [1,2,0,0,0,0|0,0,0]=3 7184 B11R1.156 CC(=O)c1c(cccc1Br)F 1458a_100000752694_200000210301 [1,2,0,0,0,0|0,0,0]=3 7185 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [1,2,0,0,0,0|0,0,0]=3 7186 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [1,2,0,0,0,0|0,0,0]=3 7187 B11R1.156 CC(=O)c1c(cccc1Cl)C 1458a_100000692601_200000210301 [1,2,0,0,0,0|0,0,0]=3 7188 B11R1.156 CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000210301 [1,2,0,0,0,0|0,0,0]=3 7189 B11R1.156 CC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000210301 [1,2,0,0,0,0|0,0,0]=3 7190 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [1,2,0,0,0,0|0,0,0]=3 7191 B11R1.156 CC(=O)c1c(cccc1F)C 1458a_100000762013_200000210301 [1,2,0,0,0,0|0,0,0]=3 7192 B11R1.156 CC(=O)c1c(cccc1F)F 1458a_100000210804_200000210301 [1,2,0,0,0,0|0,0,0]=3 7193 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [1,2,0,0,0,0|0,0,0]=3 7194 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [1,2,0,0,0,0|0,0,0]=3 7195 B11R1.156 CC(=O)c1c(cccc1I)Br 1458a_100010232521_200000210301 [1,2,0,0,0,0|0,0,0]=3 7196 B11R1.156 CC(=O)c1c(cccc1I)C 1458a_100000688020_200000210301 [1,2,0,0,0,0|0,0,0]=3 7197 B11R1.156 CC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000210301 [1,2,0,0,0,0|0,0,0]=3 7198 B11R1.156 CC(=O)c1c(cccc1I)F 1458a_100000023732_200000210301 [1,2,0,0,0,0|0,0,0]=3 7199 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [1,2,0,0,0,0|0,0,0]=3 7200 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [1,2,0,0,0,0|0,0,0]=3 7201 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [1,2,0,0,0,0|0,0,0]=3 7202 B11R1.156 CC(=O)c1c(ccnc1O)N 271570a_203496583355_200010729368 [1,2,0,0,0,0|1,0,0]=4 7203 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Br 1458a_100000701904_200025704644 [1,2,0,0,0,0|0,0,0]=3 7204 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [1,2,0,0,0,0|0,0,0]=3 7205 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Cl 1458a_100000692601_200025704644 [1,2,0,0,0,0|0,0,0]=3 7206 B11R1.156 Cc1cccc(c1C(=O)[13CH3])F 1458a_100000762013_200025704644 [1,2,0,0,0,0|0,0,0]=3 7207 B11R1.156 Cc1cccc(c1C(=O)[13CH3])I 1458a_100000688020_200025704644 [1,2,0,0,0,0|0,0,0]=3 7208 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [1,2,0,0,0,0|0,0,0]=3 7209 B11R1.156 NC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010147686 [1,2,0,0,0,0|0,0,0]=3 7210 B11R1.156 NC(=O)c1c(cccc1F)O 271570a_203496583355_100011219063 [1,2,0,0,0,0|0,0,0]=3 7211 B11R1.156 NC(=O)c1c(cncc1F)O 271570a_203496583355_100010271514 [1,2,0,0,0,0|1,0,0]=4 7212 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Br 1458a_100000690891_200025704644 [1,2,0,0,0,0|0,0,0]=3 7213 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200025704644 [1,2,0,0,0,0|0,0,0]=3 7214 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)F 1458a_100000752694_200025704644 [1,2,0,0,0,0|0,0,0]=3 7215 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [1,2,0,0,0,0|0,0,0]=3 7216 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200025704644 [1,2,0,0,0,0|0,0,0]=3 7217 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)F 1458a_100000210369_200025704644 [1,2,0,0,0,0|0,0,0]=3 7218 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [1,2,0,0,0,0|0,0,0]=3 7219 B11R1.156 [13CH3]C(=O)c1c(cccc1F)F 1458a_100000210804_200025704644 [1,2,0,0,0,0|0,0,0]=3 7220 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [1,2,0,0,0,0|0,0,0]=3 7221 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Br 1458a_100010232521_200025704644 [1,2,0,0,0,0|0,0,0]=3 7222 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Cl 1458a_100000702859_200025704644 [1,2,0,0,0,0|0,0,0]=3 7223 B11R1.156 [13CH3]C(=O)c1c(cccc1I)F 1458a_100000023732_200025704644 [1,2,0,0,0,0|0,0,0]=3 7224 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [1,2,0,0,0,0|0,0,0]=3 7225 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,2,0,0,0,0|1,0,0]=4 7226 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [1,2,0,0,0,0|1,0,0]=4 7227 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [1,2,0,0,0,0|1,0,0]=4 7228 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [1,2,0,0,0,0|1,0,0]=4 7229 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [1,2,0,0,0,0|1,0,0]=4 7230 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [1,2,0,0,0,0|1,0,0]=4 7231 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,2,0,0,0,0|1,0,0]=4 7232 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [1,2,0,0,0,0|1,0,0]=4 7233 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [1,2,0,0,0,0|1,0,0]=4 7234 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [1,2,0,0,0,0|1,0,0]=4 7235 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [1,2,0,0,0,0|1,0,0]=4 7236 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,2,0,0,0,0|1,0,0]=4 7237 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [1,2,0,0,0,0|1,0,0]=4 7238 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [1,2,0,0,0,0|1,0,0]=4 7239 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [1,2,0,0,0,0|1,0,0]=4 7240 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [1,2,0,0,0,0|1,0,0]=4 7241 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [1,2,0,0,0,0|1,0,0]=4 7242 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,2,0,0,0,0|1,0,0]=4 7243 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [1,2,0,0,0,0|1,0,0]=4 7244 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [1,2,0,0,0,0|1,0,0]=4 7245 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [1,2,0,0,0,0|1,0,0]=4 7246 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [1,2,0,0,0,0|1,0,0]=4 7247 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [1,2,0,0,0,0|1,0,0]=4 7248 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,2,0,0,0,0|1,0,0]=4 7249 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [1,2,0,0,0,0|1,0,0]=4 7250 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [1,2,0,0,0,0|1,0,0]=4 7251 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [1,2,0,0,0,0|1,0,0]=4 7252 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [1,2,0,0,0,0|1,0,0]=4 7253 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [1,2,0,0,0,0|1,0,0]=4 7254 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,2,0,0,0,0|1,0,0]=4 7255 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [1,2,0,0,0,0|0,0,0]=3 7256 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,2,0,0,0,0|0,0,0]=3 7257 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [1,2,0,0,0,0|0,0,0]=3 7258 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [1,2,0,0,0,0|0,0,0]=3 7259 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [1,2,0,0,0,0|0,0,0]=3 7260 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,2,0,0,0,0|0,0,0]=3 7261 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [1,2,0,0,0,0|0,0,0]=3 7262 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,2,0,0,0,0|0,0,0]=3 7263 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [1,2,0,0,0,0|0,0,0]=3 7264 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [1,2,0,0,0,0|0,0,0]=3 7265 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [1,2,0,0,0,0|0,0,0]=3 7266 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,2,0,0,0,0|0,0,0]=3 7267 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,2,0,0,0,0|0,0,0]=3 7268 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [1,2,0,0,0,0|0,0,0]=3 7269 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,2,0,0,0,0|0,0,0]=3 7270 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [1,2,0,0,0,0|0,0,0]=3 7271 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [1,2,0,0,0,0|0,0,0]=3 7272 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [1,2,0,0,0,0|0,0,0]=3 7273 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,2,0,0,0,0|0,0,0]=3 7274 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [1,2,0,0,0,0|0,0,0]=3 7275 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,2,0,0,0,0|0,0,0]=3 7276 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [1,2,0,0,0,0|0,0,0]=3 7277 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [1,2,0,0,0,0|0,0,0]=3 7278 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [1,2,0,0,0,0|0,0,0]=3 7279 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,2,0,0,0,0|0,0,0]=3 7280 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,2,0,0,0,0|0,0,0]=3 7281 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [1,2,0,0,0,0|0,0,0]=3 7282 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,2,0,0,0,0|0,0,0]=3 7283 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [1,2,0,0,0,0|0,0,0]=3 7284 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [1,2,0,0,0,0|0,0,0]=3 7285 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,2,0,0,0,0|0,0,0]=3 7286 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,2,0,0,0,0|0,0,0]=3 7287 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,2,0,0,0,0|0,0,0]=3 7288 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,2,0,0,0,0|0,0,0]=3 7289 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,2,0,0,0,0|0,0,0]=3 7290 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,2,0,0,0,0|0,0,0]=3 7291 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,2,0,0,0,0|0,0,0]=3 7292 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,2,0,0,0,0|0,0,0]=3 7293 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [1,2,0,0,0,0|1,0,0]=4 7294 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [1,2,0,0,0,0|1,0,0]=4 7295 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [1,2,0,0,0,0|0,0,0]=3 7296 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [1,2,0,0,0,0|0,0,0]=3 7297 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [1,2,0,0,0,0|0,0,0]=3 7298 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [1,2,0,0,0,0|0,0,0]=3 7299 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [1,2,0,0,0,0|0,0,0]=3 7300 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,2,0,0,0,0|0,0,0]=3 7301 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,2,0,0,0,0|0,0,0]=3 7302 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,2,0,0,0,0|0,0,0]=3 7303 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,2,0,0,0,0|0,0,0]=3 7304 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,2,0,0,0,0|0,0,0]=3 7305 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,2,0,0,0,0|0,0,0]=3 7306 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,2,0,0,0,0|0,0,0]=3 7307 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,2,0,0,0,0|0,0,0]=3 7308 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [1,2,0,0,0,0|0,0,0]=3 7309 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [1,2,0,0,0,0|0,0,0]=3 7310 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [1,2,0,0,0,0|0,0,0]=3 7311 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [1,2,0,0,0,0|1,0,0]=4 7312 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [1,2,0,0,0,0|0,0,0]=3 7313 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [1,2,0,0,0,0|0,0,0]=3 7314 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [1,2,0,0,0,0|0,0,0]=3 7315 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [1,2,0,0,0,0|0,0,0]=3 7316 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,2,0,0,0,0|0,0,0]=3 7317 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [1,2,0,0,0,0|0,0,0]=3 7318 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [1,2,0,0,0,0|0,0,0]=3 7319 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [1,2,0,0,0,0|0,0,0]=3 7320 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [1,2,0,0,0,0|0,0,0]=3 7321 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,2,0,0,0,0|0,0,0]=3 7322 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [1,2,0,0,0,0|0,0,0]=3 7323 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [1,2,0,0,0,0|0,0,0]=3 7324 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [1,2,0,0,0,0|0,0,0]=3 7325 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [1,2,0,0,0,0|0,0,0]=3 7326 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,2,0,0,0,0|0,0,0]=3 7327 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [1,2,0,0,0,0|0,0,0]=3 7328 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [1,2,0,0,0,0|0,0,0]=3 7329 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [1,2,0,0,0,0|0,0,0]=3 7330 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,2,0,0,0,0|0,0,0]=3 7331 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,2,0,0,0,0|0,0,0]=3 7332 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,2,0,0,0,0|0,0,0]=3 7333 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,2,0,0,0,0|0,0,0]=3 7334 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,2,0,0,0,0|0,0,0]=3 7335 B11R1.167 C=C(C)c1cc(ccc1Br)Br 271570a_100000694244_100011483371 [1,2,0,0,0,0|1,0,0]=4 7336 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [1,2,0,0,0,0|1,0,0]=4 7337 B11R1.167 C=C(C)c1cc(ccc1Br)Cl 271570a_100000694244_100012339723 [1,2,0,0,0,0|1,0,0]=4 7338 B11R1.167 C=C(C)c1cc(ccc1Br)F 271570a_100000694244_100011217576 [1,2,0,0,0,0|1,0,0]=4 7339 B11R1.167 C=C(C)c1cc(ccc1Br)N 271570a_100000694244_100000750459 [1,2,0,0,0,0|1,0,0]=4 7340 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [1,2,0,0,0,0|1,0,0]=4 7341 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [1,2,0,0,0,0|1,0,0]=4 7342 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [1,2,0,0,0,0|1,0,0]=4 7343 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [1,2,0,0,0,0|1,0,0]=4 7344 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [1,2,0,0,0,0|1,0,0]=4 7345 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [1,2,0,0,0,0|1,0,0]=4 7346 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [1,2,0,0,0,0|1,0,0]=4 7347 B11R1.167 C=C(C)c1cc(ccc1Cl)Br 271570a_100000694244_100011772130 [1,2,0,0,0,0|1,0,0]=4 7348 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [1,2,0,0,0,0|1,0,0]=4 7349 B11R1.167 C=C(C)c1cc(ccc1Cl)Cl 271570a_100000694244_100000707729 [1,2,0,0,0,0|1,0,0]=4 7350 B11R1.167 C=C(C)c1cc(ccc1Cl)F 271570a_100000694244_100011217299 [1,2,0,0,0,0|1,0,0]=4 7351 B11R1.167 C=C(C)c1cc(ccc1Cl)N 271570a_100000694244_100012360549 [1,2,0,0,0,0|1,0,0]=4 7352 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [1,2,0,0,0,0|1,0,0]=4 7353 B11R1.167 C=C(C)c1cc(ccc1F)Br 271570a_100000694244_100011217312 [1,2,0,0,0,0|1,0,0]=4 7354 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [1,2,0,0,0,0|1,0,0]=4 7355 B11R1.167 C=C(C)c1cc(ccc1F)Cl 271570a_100000694244_100011218116 [1,2,0,0,0,0|1,0,0]=4 7356 B11R1.167 C=C(C)c1cc(ccc1F)F 271570a_100000694244_100000750033 [1,2,0,0,0,0|1,0,0]=4 7357 B11R1.167 C=C(C)c1cc(ccc1F)N 271570a_100000694244_100000760356 [1,2,0,0,0,0|1,0,0]=4 7358 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [1,2,0,0,0,0|1,0,0]=4 7359 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [1,2,0,0,0,0|1,0,0]=4 7360 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [1,2,0,0,0,0|1,0,0]=4 7361 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [1,2,0,0,0,0|1,0,0]=4 7362 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [1,2,0,0,0,0|1,0,0]=4 7363 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [1,2,0,0,0,0|1,0,0]=4 7364 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [1,2,0,0,0,0|1,0,0]=4 7365 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [1,2,0,0,0,0|1,0,0]=4 7366 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [1,2,0,0,0,0|1,0,0]=4 7367 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [1,2,0,0,0,0|1,0,0]=4 7368 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [1,2,0,0,0,0|1,0,0]=4 7369 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [1,2,0,0,0,0|1,0,0]=4 7370 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [1,2,0,0,0,0|1,0,0]=4 7371 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [1,2,0,0,0,0|0,0,0]=3 7372 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [1,2,0,0,0,0|0,0,0]=3 7373 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [1,2,0,0,0,0|0,0,0]=3 7374 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [1,2,0,0,0,0|0,0,0]=3 7375 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [1,2,0,0,0,0|0,0,0]=3 7376 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [1,2,0,0,0,0|0,0,0]=3 7377 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [1,2,0,0,0,0|0,0,0]=3 7378 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [1,2,0,0,0,0|0,0,0]=3 7379 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [1,2,0,0,0,0|0,0,0]=3 7380 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [1,2,0,0,0,0|0,0,0]=3 7381 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [1,2,0,0,0,0|0,0,0]=3 7382 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [1,2,0,0,0,0|0,0,0]=3 7383 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [1,2,0,0,0,0|0,0,0]=3 7384 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [1,2,0,0,0,0|0,0,0]=3 7385 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [1,2,0,0,0,0|0,0,0]=3 7386 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [1,2,0,0,0,0|0,0,0]=3 7387 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [1,2,0,0,0,0|0,0,0]=3 7388 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [1,2,0,0,0,0|0,0,0]=3 7389 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [1,2,0,0,0,0|0,0,0]=3 7390 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [1,2,0,0,0,0|0,0,0]=3 7391 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [1,2,0,0,0,0|0,0,0]=3 7392 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [1,2,0,0,0,0|0,0,0]=3 7393 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [1,2,0,0,0,0|0,0,0]=3 7394 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [1,2,0,0,0,0|0,0,0]=3 7395 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [1,2,0,0,0,0|0,0,0]=3 7396 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [1,2,0,0,0,0|0,0,0]=3 7397 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [1,2,0,0,0,0|0,0,0]=3 7398 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [1,2,0,0,0,0|0,0,0]=3 7399 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [1,2,0,0,0,0|0,0,0]=3 7400 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [1,2,0,0,0,0|0,0,0]=3 7401 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [1,2,0,0,0,0|0,0,0]=3 7402 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [1,2,0,0,0,0|0,0,0]=3 7403 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [1,2,0,0,0,0|0,0,0]=3 7404 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [1,2,0,0,0,0|0,0,0]=3 7405 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [1,2,0,0,0,0|0,0,0]=3 7406 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [1,2,0,0,0,0|0,0,0]=3 7407 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [1,2,0,0,0,0|0,0,0]=3 7408 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [1,2,0,0,0,0|0,0,0]=3 7409 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [1,2,0,0,0,0|0,0,0]=3 7410 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [1,2,0,0,0,0|0,0,0]=3 7411 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [1,2,0,0,0,0|0,0,0]=3 7412 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [1,2,0,0,0,0|0,0,0]=3 7413 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [1,2,0,0,0,0|0,0,0]=3 7414 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [1,2,0,0,0,0|0,0,0]=3 7415 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [1,2,0,0,0,0|0,0,0]=3 7416 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [1,2,0,0,0,0|1,0,0]=4 7417 B11R1.167 CC(=O)c1cc(cnc1F)O 271570a_203496583355_100010254234 [1,2,0,0,0,0|1,0,0]=4 7418 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [1,2,0,0,0,0|1,0,0]=4 7419 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [1,2,0,0,0,0|1,0,0]=4 7420 B11R1.167 CC(=O)c1cc(ncc1F)O 271570a_203496583355_100000697832 [1,2,0,0,0,0|1,0,0]=4 7421 B11R1.167 CC(=O)c1nc(ccc1F)O 271570a_203496583355_100009887703 [1,2,0,0,0,0|1,0,0]=4 7422 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [1,2,0,0,0,0|0,0,0]=3 7423 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [1,2,0,0,0,0|0,0,0]=3 7424 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [1,2,0,0,0,0|0,0,0]=3 7425 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [1,2,0,0,0,0|0,0,0]=3 7426 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [1,2,0,0,0,0|0,0,0]=3 7427 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [1,2,0,0,0,0|0,0,0]=3 7428 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [1,2,0,0,0,0|0,0,0]=3 7429 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [1,2,0,0,0,0|0,0,0]=3 7430 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [1,2,0,0,0,0|0,0,0]=3 7431 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [1,2,0,0,0,0|0,0,0]=3 7432 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [1,2,0,0,0,0|0,0,0]=3 7433 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [1,2,0,0,0,0|0,0,0]=3 7434 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [1,2,0,0,0,0|0,0,0]=3 7435 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [1,2,0,0,0,0|0,0,0]=3 7436 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [1,2,0,0,0,0|0,0,0]=3 7437 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [1,2,0,0,0,0|0,0,0]=3 7438 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [1,2,0,0,0,0|0,0,0]=3 7439 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [1,2,0,0,0,0|0,0,0]=3 7440 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [1,2,0,0,0,0|0,0,0]=3 7441 B11R1.167 NC(=O)c1cc(cnc1N)O 271570a_203496583355_100000701294 [1,2,0,0,0,0|1,0,0]=4 7442 B11R1.167 NC(=O)c1cc(cnc1O)F 271570a_203496583355_100012183597 [1,2,0,0,0,0|1,0,0]=4 7443 B11R1.167 NC(=O)c1cc(ncc1F)O 271570a_203496583355_100015943597 [1,2,0,0,0,0|1,0,0]=4 7444 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [1,2,0,0,0,0|1,0,0]=4 7445 B11R1.167 NC(=O)c1nc(ccc1N)O 271570a_203496583355_100000093116 [1,2,0,0,0,0|1,0,0]=4 7446 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [1,2,0,0,0,0|0,0,0]=3 7447 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [1,2,0,0,0,0|0,0,0]=3 7448 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [1,2,0,0,0,0|0,0,0]=3 7449 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [1,2,0,0,0,0|0,0,0]=3 7450 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [1,2,0,0,0,0|0,0,0]=3 7451 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [1,2,0,0,0,0|0,0,0]=3 7452 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [1,2,0,0,0,0|0,0,0]=3 7453 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [1,2,0,0,0,0|0,0,0]=3 7454 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [1,2,0,0,0,0|0,0,0]=3 7455 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [1,2,0,0,0,0|0,0,0]=3 7456 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [1,2,0,0,0,0|0,0,0]=3 7457 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [1,2,0,0,0,0|0,0,0]=3 7458 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [1,2,0,0,0,0|0,0,0]=3 7459 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [1,2,0,0,0,0|0,0,0]=3 7460 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [1,2,0,0,0,0|0,0,0]=3 7461 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [1,2,0,0,0,0|0,0,0]=3 7462 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [1,2,0,0,0,0|0,0,0]=3 7463 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [1,2,0,0,0,0|0,0,0]=3 7464 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [1,2,0,0,0,0|0,0,0]=3 7465 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [1,2,0,0,0,0|0,0,0]=3 7466 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [1,2,0,0,0,0|0,0,0]=3 7467 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [1,2,0,0,0,0|0,0,0]=3 7468 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [1,2,0,0,0,0|0,0,0]=3 7469 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [1,2,0,0,0,0|0,0,0]=3 7470 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [1,2,0,0,0,0|0,0,0]=3 7471 B11R1.74 C=C(C)c1cc(cc(c1)Br)Br 271570a_100000694244_100009814770 [1,2,0,0,0,0|1,0,0]=4 7472 B11R1.74 C=C(C)c1cc(cc(c1)Br)Cl 271570a_100000694244_100009814755 [1,2,0,0,0,0|1,0,0]=4 7473 B11R1.74 C=C(C)c1cc(cc(c1)Br)F 271570a_100000694244_100009814764 [1,2,0,0,0,0|1,0,0]=4 7474 B11R1.74 C=C(C)c1cc(cc(c1)Br)N 271570a_100000694244_100009814763 [1,2,0,0,0,0|1,0,0]=4 7475 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [1,2,0,0,0,0|1,0,0]=4 7476 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [1,2,0,0,0,0|1,0,0]=4 7477 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [1,2,0,0,0,0|1,0,0]=4 7478 B11R1.74 C=C(C)c1cc(cc(c1)Cl)Cl 271570a_100000694244_100000747138 [1,2,0,0,0,0|1,0,0]=4 7479 B11R1.74 C=C(C)c1cc(cc(c1)Cl)F 271570a_100000694244_100013859453 [1,2,0,0,0,0|1,0,0]=4 7480 B11R1.74 C=C(C)c1cc(cc(c1)Cl)N 271570a_100000694244_100010147676 [1,2,0,0,0,0|1,0,0]=4 7481 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [1,2,0,0,0,0|1,0,0]=4 7482 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [1,2,0,0,0,0|1,0,0]=4 7483 B11R1.74 C=C(C)c1cc(cc(c1)F)F 271570a_100000694244_100011218498 [1,2,0,0,0,0|1,0,0]=4 7484 B11R1.74 C=C(C)c1cc(cc(c1)F)N 271570a_100000694244_100011356972 [1,2,0,0,0,0|1,0,0]=4 7485 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [1,2,0,0,0,0|1,0,0]=4 7486 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [1,2,0,0,0,0|1,0,0]=4 7487 B11R1.74 C=C(C)c1cc(cc(c1)N)N 271570a_100000694244_100011999608 [1,2,0,0,0,0|1,0,0]=4 7488 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [1,2,0,0,0,0|1,0,0]=4 7489 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [1,2,0,0,0,0|1,0,0]=4 7490 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [1,2,0,0,0,0|0,0,0]=3 7491 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [1,2,0,0,0,0|0,0,0]=3 7492 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [1,2,0,0,0,0|0,0,0]=3 7493 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [1,2,0,0,0,0|0,0,0]=3 7494 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [1,2,0,0,0,0|0,0,0]=3 7495 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [1,2,0,0,0,0|0,0,0]=3 7496 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [1,2,0,0,0,0|0,0,0]=3 7497 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [1,2,0,0,0,0|0,0,0]=3 7498 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [1,2,0,0,0,0|0,0,0]=3 7499 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [1,2,0,0,0,0|0,0,0]=3 7500 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [1,2,0,0,0,0|0,0,0]=3 7501 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [1,2,0,0,0,0|0,0,0]=3 7502 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [1,2,0,0,0,0|0,0,0]=3 7503 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [1,2,0,0,0,0|0,0,0]=3 7504 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [1,2,0,0,0,0|0,0,0]=3 7505 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [1,2,0,0,0,0|0,0,0]=3 7506 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [1,2,0,0,0,0|0,0,0]=3 7507 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [1,2,0,0,0,0|0,0,0]=3 7508 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [1,2,0,0,0,0|0,0,0]=3 7509 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [1,2,0,0,0,0|0,0,0]=3 7510 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [1,2,0,0,0,0|0,0,0]=3 7511 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [1,2,0,0,0,0|0,0,0]=3 7512 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [1,2,0,0,0,0|1,0,0]=4 7513 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,2,0,0,0,0|0,0,0]=3 7514 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [1,2,0,0,0,0|0,0,0]=3 7515 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [1,2,0,0,0,0|0,0,0]=3 7516 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [1,2,0,0,0,0|0,0,0]=3 7517 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [1,2,0,0,0,0|0,0,0]=3 7518 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [1,2,0,0,0,0|0,0,0]=3 7519 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [1,2,0,0,0,0|0,0,0]=3 7520 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [1,2,0,0,0,0|0,0,0]=3 7521 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [1,2,0,0,0,0|0,0,0]=3 7522 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [1,2,0,0,0,0|0,0,0]=3 7523 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [1,2,0,0,0,0|0,0,0]=3 7524 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [1,2,0,0,0,0|0,0,0]=3 7525 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [1,2,0,0,0,0|0,0,0]=3 7526 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [1,2,0,0,0,0|0,0,0]=3 7527 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [1,2,0,0,0,0|0,0,0]=3 7528 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [1,2,0,0,0,0|0,0,0]=3 7529 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [1,2,0,0,0,0|0,0,0]=3 7530 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [1,2,0,0,0,0|0,0,0]=3 7531 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [1,2,0,0,0,0|0,0,0]=3 7532 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [1,2,0,0,0,0|0,0,0]=3 7533 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [1,2,0,0,0,0|0,0,0]=3 7534 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [1,2,0,0,0,0|0,0,0]=3 7535 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [1,2,0,0,0,0|0,0,0]=3 7536 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [1,2,0,0,0,0|0,0,0]=3 7537 B11R1.266 C=C(C)c1cccc(c1)C#N 271570a_100000694244_100000189340 [1,2,0,0,0,0|1,0,0]=4 7538 B11R1.266 C=C(C)c1cccc(c1)C=O 271570a_100000694244_100000014684 [1,2,0,0,0,0|1,0,0]=4 7539 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [1,2,0,0,0,0|1,0,0]=4 7540 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [1,2,0,0,0,0|1,0,0]=4 7541 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [1,2,0,0,0,0|1,0,0]=4 7542 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [1,2,0,0,0,0|1,0,0]=4 7543 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [1,2,0,0,0,0|1,0,0]=4 7544 B11R1.266 C=C(C)c1cccc(c1)NN 271570a_100000694244_100000217339 [1,2,0,0,0,0|1,0,0]=4 7545 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,2,0,0,0,0|1,0,0]=4 7546 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [1,2,0,0,0,0|1,0,0]=4 7547 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [1,2,0,0,0,0|1,0,0]=4 7548 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [1,2,0,0,0,0|1,0,0]=4 7549 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [1,2,0,0,0,0|1,0,0]=4 7550 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [1,2,0,0,0,0|1,0,0]=4 7551 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [1,2,0,0,0,0|1,0,0]=4 7552 B11R1.266 C=Cc1cc(ccn1)C(=O)N 271570a_100011290941_100000229836 [1,2,0,0,0,0|1,0,0]=4 7553 B11R1.266 C=Cc1cccc(c1)C(=C)C 271570a_100011290941_100012123953 [1,2,0,0,0,0|1,0,0]=4 7554 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [1,2,0,0,0,0|0,0,0]=3 7555 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [1,2,0,0,0,0|0,0,0]=3 7556 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [1,2,0,0,0,0|0,0,0]=3 7557 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [1,2,0,0,0,0|0,0,0]=3 7558 B11R1.266 C=Cc1cccc(c1)S(=O)C 271570a_100011290941_100009816267 [1,2,0,0,0,0|1,0,0]=4 7559 B11R1.266 C=Cc1cccc(n1)C(=O)C 271570a_100011290941_100009816502 [1,2,0,0,0,0|1,0,0]=4 7560 B11R1.266 C=Cc1cccc(n1)C(=O)N 271570a_100011290941_100011834053 [1,2,0,0,0,0|1,0,0]=4 7561 B11R1.266 C=Cc1ccnc(c1)C(=O)C 271570a_100011290941_100000709912 [1,2,0,0,0,0|1,0,0]=4 7562 B11R1.266 C=Cc1ccnc(c1)C(=O)N 271570a_100011290941_100000229564 [1,2,0,0,0,0|1,0,0]=4 7563 B11R1.266 C=Cc1cncc(c1)C(=O)C 271570a_100011290941_100011216243 [1,2,0,0,0,0|1,0,0]=4 7564 B11R1.266 C=Cc1cncc(c1)C(=O)N 271570a_100011290941_100000162242 [1,2,0,0,0,0|1,0,0]=4 7565 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_100000709912_200025704644 [1,2,0,0,0,0|1,0,0]=4 7566 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000709912 [1,2,0,0,0,0|1,0,0]=4 7567 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [1,2,0,0,0,0|0,0,0]=3 7568 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [1,2,0,0,0,0|0,0,0]=3 7569 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,2,0,0,0,0|0,0,0]=3 7570 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,2,0,0,0,0|0,0,0]=3 7571 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [1,2,0,0,0,0|0,0,0]=3 7572 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [1,2,0,0,0,0|0,0,0]=3 7573 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_100009816502_200025704644 [1,2,0,0,0,0|1,0,0]=4 7574 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100009816502 [1,2,0,0,0,0|1,0,0]=4 7575 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [1,2,0,0,0,0|1,0,0]=4 7576 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [1,2,0,0,0,0|1,0,0]=4 7577 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_100011216243_200025704644 [1,2,0,0,0,0|1,0,0]=4 7578 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100011216243 [1,2,0,0,0,0|1,0,0]=4 7579 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [1,2,0,0,0,0|0,0,0]=3 7580 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [1,2,0,0,0,0|0,0,0]=3 7581 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [1,2,0,0,0,0|0,0,0]=3 7582 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [1,2,0,0,0,0|1,0,0]=4 7583 B11R1.266 CNc1cccc(n1)C(=O)N 27a_100102657272_100011834053 [1,2,0,0,0,0|1,0,0]=4 7584 B11R1.266 CNc1ccnc(c1)C(=O)N 27a_100102657272_100000229564 [1,2,0,0,0,0|1,0,0]=4 7585 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,2,0,0,0,0|0,0,0]=3 7586 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,2,0,0,0,0|0,0,0]=3 7587 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,2,0,0,0,0|0,0,0]=3 7588 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,2,0,0,0,0|0,0,0]=3 7589 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,2,0,0,0,0|0,0,0]=3 7590 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,2,0,0,0,0|0,0,0]=3 7591 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,2,0,0,0,0|0,1,0]=4 7592 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [1,2,0,0,0,0|1,0,0]=4 7593 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [1,2,0,0,0,0|1,0,0]=4 7594 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [1,2,0,0,0,0|1,0,0]=4 7595 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [1,2,0,0,0,0|1,0,0]=4 7596 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [1,2,0,0,0,0|1,0,0]=4 7597 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_100000229836_200000210301 [1,2,0,0,0,0|1,0,0]=4 7598 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_200000210301_100000229836 [1,2,0,0,0,0|1,0,0]=4 7599 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [1,2,0,0,0,0|0,0,0]=3 7600 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [1,2,0,0,0,0|0,0,0]=3 7601 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [1,2,0,0,0,0|0,0,0]=3 7602 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [1,2,0,0,0,0|0,0,0]=3 7603 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [1,2,0,0,0,0|0,0,0]=3 7604 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [1,2,0,0,0,0|0,0,0]=3 7605 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [1,2,0,0,0,0|1,0,0]=4 7606 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [1,2,0,0,0,0|1,0,0]=4 7607 B11R1.266 CSc1cccc(n1)C(=O)C 62a_100009816502_200000210301 [1,2,0,0,0,0|1,0,0]=4 7608 B11R1.266 CSc1cccc(n1)C(=O)C 62a_200000210301_100009816502 [1,2,0,0,0,0|1,0,0]=4 7609 B11R1.266 CSc1cccc(n1)C(=O)N 62a_100011834053_200000210301 [1,2,0,0,0,0|1,0,0]=4 7610 B11R1.266 CSc1cccc(n1)C(=O)N 62a_200000210301_100011834053 [1,2,0,0,0,0|1,0,0]=4 7611 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_100000709912_200000210301 [1,2,0,0,0,0|1,0,0]=4 7612 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_200000210301_100000709912 [1,2,0,0,0,0|1,0,0]=4 7613 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_100000229564_200000210301 [1,2,0,0,0,0|1,0,0]=4 7614 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_200000210301_100000229564 [1,2,0,0,0,0|1,0,0]=4 7615 B11R1.266 CSc1cncc(c1)C(=O)C 62a_100011216243_200000210301 [1,2,0,0,0,0|1,0,0]=4 7616 B11R1.266 CSc1cncc(c1)C(=O)C 62a_200000210301_100011216243 [1,2,0,0,0,0|1,0,0]=4 7617 B11R1.266 CSc1cncc(c1)C(=O)N 62a_100000162242_200000210301 [1,2,0,0,0,0|1,0,0]=4 7618 B11R1.266 CSc1cncc(c1)C(=O)N 62a_200000210301_100000162242 [1,2,0,0,0,0|1,0,0]=4 7619 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [1,2,0,0,0,0|0,0,0]=3 7620 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [1,2,0,0,0,0|0,0,0]=3 7621 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [1,2,0,0,0,0|0,0,0]=3 7622 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,2,0,0,0,0|0,0,0]=3 7623 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,2,0,0,0,0|0,0,0]=3 7624 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,2,0,0,0,0|0,1,0]=4 7625 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [1,2,0,0,0,0|1,0,0]=4 7626 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_100000229836_200025704644 [1,2,0,0,0,0|1,0,0]=4 7627 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_200025704644_100000229836 [1,2,0,0,0,0|1,0,0]=4 7628 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [1,2,0,0,0,0|0,0,0]=3 7629 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [1,2,0,0,0,0|0,0,0]=3 7630 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_100011834053_200025704644 [1,2,0,0,0,0|1,0,0]=4 7631 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_200025704644_100011834053 [1,2,0,0,0,0|1,0,0]=4 7632 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_100000229564_200025704644 [1,2,0,0,0,0|1,0,0]=4 7633 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_200025704644_100000229564 [1,2,0,0,0,0|1,0,0]=4 7634 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_100000162242_200025704644 [1,2,0,0,0,0|1,0,0]=4 7635 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_200025704644_100000162242 [1,2,0,0,0,0|1,0,0]=4 7636 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [1,2,0,0,0,0|0,0,1]=4 7637 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [1,2,0,0,0,0|0,0,1]=4 7638 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [1,2,0,0,0,0|0,0,1]=4 7639 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [1,2,0,0,0,0|0,0,1]=4 7640 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [1,2,0,0,0,0|0,0,1]=4 7641 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [1,2,0,0,0,0|0,0,1]=4 7642 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [1,2,0,0,0,0|0,0,1]=4 7643 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [1,2,0,0,0,0|0,0,1]=4 7644 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [1,2,0,0,0,0|0,0,1]=4 7645 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [1,2,0,0,0,0|0,0,1]=4 7646 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [1,2,0,0,0,0|0,0,1]=4 7647 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [1,2,0,0,0,0|0,0,1]=4 7648 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [1,2,0,0,0,0|0,0,1]=4 7649 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [1,2,0,0,0,0|0,0,1]=4 7650 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [1,2,0,0,0,0|0,0,1]=4 7651 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [1,2,0,0,0,0|0,0,1]=4 7652 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [1,2,0,0,0,0|0,0,1]=4 7653 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [1,2,0,0,0,0|0,0,1]=4 7654 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [1,2,0,0,0,0|0,0,1]=4 7655 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [1,2,0,0,0,0|0,0,1]=4 7656 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [1,2,0,0,0,0|0,0,1]=4 7657 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [1,2,0,0,0,0|0,0,1]=4 7658 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [1,2,0,0,0,0|0,0,1]=4 7659 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [1,2,0,0,0,0|0,0,1]=4 7660 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [1,2,0,0,0,0|0,0,1]=4 7661 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [1,2,0,0,0,0|0,0,1]=4 7662 B11R1.1 CNCCc1ccc(cc1)Br 2230a_100000755846_200000210301 [1,2,0,0,0,0|0,0,1]=4 7663 B11R1.1 CNCCc1ccc(cc1)Br 2230a_106832991635_100011740612 [1,2,0,0,0,0|0,0,1]=4 7664 B11R1.1 CNCCc1ccc(cc1)Br 34a_100000755846_200000210301 [1,2,0,0,0,0|0,0,1]=4 7665 B11R1.1 CNCCc1ccc(cc1)Br 34a_100102657272_100011740612 [1,2,0,0,0,0|0,0,1]=4 7666 B11R1.1 CNCCc1ccc(cc1)Br 7a_106832991635_100011740612 [1,2,0,0,0,0|0,0,1]=4 7667 B11R1.1 CNCCc1ccc(cc1)C 2230a_100000705350_200000210301 [1,2,0,0,0,0|0,0,1]=4 7668 B11R1.1 CNCCc1ccc(cc1)C 2230a_106832991635_100011713686 [1,2,0,0,0,0|0,0,1]=4 7669 B11R1.1 CNCCc1ccc(cc1)C 34a_100000705350_200000210301 [1,2,0,0,0,0|0,0,1]=4 7670 B11R1.1 CNCCc1ccc(cc1)C 34a_100102657272_100011713686 [1,2,0,0,0,0|0,0,1]=4 7671 B11R1.1 CNCCc1ccc(cc1)C 7a_106832991635_100011713686 [1,2,0,0,0,0|0,0,1]=4 7672 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_100000185265_200000210301 [1,2,0,0,0,0|0,0,1]=4 7673 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_106832991635_100011713675 [1,2,0,0,0,0|0,0,1]=4 7674 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100000185265_200000210301 [1,2,0,0,0,0|0,0,1]=4 7675 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100102657272_100011713675 [1,2,0,0,0,0|0,0,1]=4 7676 B11R1.1 CNCCc1ccc(cc1)Cl 7a_106832991635_100011713675 [1,2,0,0,0,0|0,0,1]=4 7677 B11R1.1 CNCCc1ccc(cc1)F 2230a_100000199005_200000210301 [1,2,0,0,0,0|0,0,1]=4 7678 B11R1.1 CNCCc1ccc(cc1)F 2230a_106832991635_100011217392 [1,2,0,0,0,0|0,0,1]=4 7679 B11R1.1 CNCCc1ccc(cc1)F 34a_100000199005_200000210301 [1,2,0,0,0,0|0,0,1]=4 7680 B11R1.1 CNCCc1ccc(cc1)F 34a_100102657272_100011217392 [1,2,0,0,0,0|0,0,1]=4 7681 B11R1.1 CNCCc1ccc(cc1)F 7a_106832991635_100011217392 [1,2,0,0,0,0|0,0,1]=4 7682 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [1,2,0,0,0,0|0,0,1]=4 7683 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [1,2,0,0,0,0|0,0,1]=4 7684 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [1,2,0,0,0,0|0,0,1]=4 7685 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [1,2,0,0,0,0|0,0,1]=4 7686 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [1,2,0,0,0,0|1,0,0]=4 7687 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 2230a_100000705350_200025704644 [1,2,0,0,0,0|0,0,1]=4 7688 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 34a_100000705350_200025704644 [1,2,0,0,0,0|0,0,1]=4 7689 B11R1.1 Cc1ccc(cc1)CNCF 34a_100000174908_100015361967 [1,2,0,0,0,0|0,0,1]=4 7690 B11R1.1 FCNCc1ccc(cc1)Br 34a_100000174875_100015361967 [1,2,0,0,0,0|0,0,1]=4 7691 B11R1.1 FCNCc1ccc(cc1)Cl 34a_100000174871_100015361967 [1,2,0,0,0,0|0,0,1]=4 7692 B11R1.1 FCNCc1ccc(cc1)F 34a_100000174882_100015361967 [1,2,0,0,0,0|0,0,1]=4 7693 B11R1.1 FCNCc1ccc(cc1)I 34a_100016989417_100015361967 [1,2,0,0,0,0|0,0,1]=4 7694 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [1,2,0,0,0,0|0,0,1]=4 7695 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 2230a_100000755846_200025704644 [1,2,0,0,0,0|0,0,1]=4 7696 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 34a_100000755846_200025704644 [1,2,0,0,0,0|0,0,1]=4 7697 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 2230a_100000185265_200025704644 [1,2,0,0,0,0|0,0,1]=4 7698 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 34a_100000185265_200025704644 [1,2,0,0,0,0|0,0,1]=4 7699 B11R1.1 [13CH3]NCCc1ccc(cc1)F 2230a_100000199005_200025704644 [1,2,0,0,0,0|0,0,1]=4 7700 B11R1.1 [13CH3]NCCc1ccc(cc1)F 34a_100000199005_200025704644 [1,2,0,0,0,0|0,0,1]=4 7701 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [1,2,0,0,0,0|0,0,1]=4 7702 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [1,2,0,0,0,0|1,0,0]=4 7703 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [1,2,0,0,0,0|1,0,0]=4 7704 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [1,2,0,0,0,0|1,0,0]=4 7705 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [1,2,0,0,0,0|1,0,0]=4 7706 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [1,2,0,0,0,0|1,0,0]=4 7707 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,2,0,0,0,0|1,0,0]=4 7708 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [1,2,0,0,0,0|0,0,1]=4 7709 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [1,2,0,0,0,0|0,0,1]=4 7710 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [1,2,0,0,0,0|0,0,1]=4 7711 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [1,2,0,0,0,0|0,0,1]=4 7712 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [1,2,0,0,0,0|0,0,1]=4 7713 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [1,2,0,0,0,0|0,0,1]=4 7714 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [1,2,0,0,0,0|0,0,1]=4 7715 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [1,2,0,0,0,0|0,0,1]=4 7716 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [1,2,0,0,0,0|0,0,1]=4 7717 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [1,2,0,0,0,0|0,0,1]=4 7718 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [1,2,0,0,0,0|0,0,1]=4 7719 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [1,2,0,0,0,0|0,0,1]=4 7720 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [1,2,0,0,0,0|0,0,1]=4 7721 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [1,2,0,0,0,0|0,0,1]=4 7722 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [1,2,0,0,0,0|0,0,1]=4 7723 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [1,2,0,0,0,0|0,0,1]=4 7724 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [1,2,0,0,0,0|0,0,1]=4 7725 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [1,2,0,0,0,0|0,0,1]=4 7726 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [1,2,0,0,0,0|0,0,1]=4 7727 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,2,0,0,0,0|0,0,1]=4 7728 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,2,0,0,0,0|0,0,1]=4 7729 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,2,0,0,0,0|0,0,1]=4 7730 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [1,2,0,0,0,0|0,0,1]=4 7731 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [1,2,0,0,0,0|0,0,1]=4 7732 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [1,2,0,0,0,0|0,0,1]=4 7733 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [1,2,0,0,0,0|0,0,1]=4 7734 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [1,2,0,0,0,0|0,0,1]=4 7735 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [1,2,0,0,0,0|0,0,1]=4 7736 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [1,2,0,0,0,0|0,0,1]=4 7737 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [1,2,0,0,0,0|0,0,1]=4 7738 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,2,0,0,0,0|0,0,1]=4 7739 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,2,0,0,0,0|0,0,1]=4 7740 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [1,2,0,0,0,0|0,0,1]=4 7741 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [1,2,0,0,0,0|0,0,1]=4 7742 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [1,2,0,0,0,0|0,0,1]=4 7743 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [1,2,0,0,0,0|0,0,1]=4 7744 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [1,2,0,0,0,0|0,0,1]=4 7745 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [1,2,0,0,0,0|0,0,1]=4 7746 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [1,2,0,0,0,0|0,0,1]=4 7747 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [1,2,0,0,0,0|0,0,1]=4 7748 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [1,2,0,0,0,0|0,0,1]=4 7749 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [1,2,0,0,0,0|1,0,0]=4 7750 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [1,2,0,0,0,0|1,0,0]=4 7751 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [1,2,0,0,0,0|1,0,0]=4 7752 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [1,2,0,0,0,0|1,0,0]=4 7753 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [1,2,0,0,0,0|1,0,0]=4 7754 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [1,2,0,0,0,0|1,0,0]=4 7755 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [1,2,0,0,0,0|1,0,0]=4 7756 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [1,2,0,0,0,0|1,0,0]=4 7757 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [1,2,0,0,0,0|1,0,0]=4 7758 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [1,2,0,0,0,0|1,0,0]=4 7759 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [1,2,0,0,0,0|1,0,0]=4 7760 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [1,2,0,0,0,0|1,0,0]=4 7761 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [1,2,0,0,0,0|1,0,0]=4 7762 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [1,2,0,0,0,0|1,0,0]=4 7763 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [1,2,0,0,0,0|1,0,0]=4 7764 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [1,2,0,0,0,0|1,0,0]=4 7765 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [1,2,0,0,0,0|1,0,0]=4 7766 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [1,2,0,0,0,0|1,0,0]=4 7767 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [1,2,0,0,0,0|1,0,0]=4 7768 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [1,2,0,0,0,0|1,0,0]=4 7769 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [1,2,0,0,0,0|1,0,0]=4 7770 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [1,2,0,0,0,0|1,0,0]=4 7771 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [1,2,0,0,0,0|1,0,0]=4 7772 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [1,2,0,0,0,0|1,0,0]=4 7773 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [1,2,0,0,0,0|1,0,0]=4 7774 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [1,2,0,0,0,0|1,0,0]=4 7775 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [1,2,0,0,0,0|1,0,0]=4 7776 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [1,2,0,0,0,0|1,0,0]=4 7777 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [1,2,0,0,0,0|1,0,0]=4 7778 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [1,2,0,0,0,0|1,0,0]=4 7779 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [1,2,0,0,0,0|1,0,0]=4 7780 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [1,2,0,0,0,0|1,0,0]=4 7781 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [1,2,0,0,0,0|1,0,0]=4 7782 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [1,2,0,0,0,0|1,0,0]=4 7783 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [1,2,0,0,0,0|1,0,0]=4 7784 B11R1.81 CNCc1ccc(cc1Br)Br 207a_100102657272_100012351556 [1,2,0,0,0,0|0,0,1]=4 7785 B11R1.81 CNCc1ccc(cc1Br)Br 2230a_106832991635_200012351560 [1,2,0,0,0,0|0,0,1]=4 7786 B11R1.81 CNCc1ccc(cc1Br)Br 26a_100102657272_100000188717 [1,2,0,0,0,0|0,0,1]=4 7787 B11R1.81 CNCc1ccc(cc1Br)Br 270004a_106832991635_100012351556 [1,2,0,0,0,0|0,0,1]=4 7788 B11R1.81 CNCc1ccc(cc1Br)Br 34a_100102657272_200012351560 [1,2,0,0,0,0|0,0,1]=4 7789 B11R1.81 CNCc1ccc(cc1Br)Br 7a_106832991635_200012351560 [1,2,0,0,0,0|0,0,1]=4 7790 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [1,2,0,0,0,0|0,0,1]=4 7791 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [1,2,0,0,0,0|0,0,1]=4 7792 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [1,2,0,0,0,0|0,0,1]=4 7793 B11R1.81 CNCc1ccc(cc1Br)Cl 207a_100102657272_100000687667 [1,2,0,0,0,0|0,0,1]=4 7794 B11R1.81 CNCc1ccc(cc1Br)Cl 2230a_106832991635_100000755608 [1,2,0,0,0,0|0,0,1]=4 7795 B11R1.81 CNCc1ccc(cc1Br)Cl 26a_100102657272_100000211998 [1,2,0,0,0,0|0,0,1]=4 7796 B11R1.81 CNCc1ccc(cc1Br)Cl 270004a_106832991635_100000687667 [1,2,0,0,0,0|0,0,1]=4 7797 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102657272_100000755608 [1,2,0,0,0,0|0,0,1]=4 7798 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102692131_200000210301 [1,2,0,0,0,0|0,0,1]=4 7799 B11R1.81 CNCc1ccc(cc1Br)Cl 7a_106832991635_100000755608 [1,2,0,0,0,0|0,0,1]=4 7800 B11R1.81 CNCc1ccc(cc1Br)F 207a_100102657272_100000685661 [1,2,0,0,0,0|0,0,1]=4 7801 B11R1.81 CNCc1ccc(cc1Br)F 2230a_106832991635_100000243222 [1,2,0,0,0,0|0,0,1]=4 7802 B11R1.81 CNCc1ccc(cc1Br)F 26a_100102657272_100000211999 [1,2,0,0,0,0|0,0,1]=4 7803 B11R1.81 CNCc1ccc(cc1Br)F 270004a_106832991635_100000685661 [1,2,0,0,0,0|0,0,1]=4 7804 B11R1.81 CNCc1ccc(cc1Br)F 34a_100000708791_200000210301 [1,2,0,0,0,0|0,0,1]=4 7805 B11R1.81 CNCc1ccc(cc1Br)F 34a_100102657272_100000243222 [1,2,0,0,0,0|0,0,1]=4 7806 B11R1.81 CNCc1ccc(cc1Br)F 7a_106832991635_100000243222 [1,2,0,0,0,0|0,0,1]=4 7807 B11R1.81 CNCc1ccc(cc1Br)I 207a_100102657272_100010185650 [1,2,0,0,0,0|0,0,1]=4 7808 B11R1.81 CNCc1ccc(cc1Br)I 2230a_106832991635_100010146610 [1,2,0,0,0,0|0,0,1]=4 7809 B11R1.81 CNCc1ccc(cc1Br)I 26a_100102657272_100012361655 [1,2,0,0,0,0|0,0,1]=4 7810 B11R1.81 CNCc1ccc(cc1Br)I 34a_100102657272_100010146610 [1,2,0,0,0,0|0,0,1]=4 7811 B11R1.81 CNCc1ccc(cc1Br)I 7a_106832991635_100010146610 [1,2,0,0,0,0|0,0,1]=4 7812 B11R1.81 CNCc1ccc(cc1C)Br 207a_100102657272_100000687586 [1,2,0,0,0,0|0,0,1]=4 7813 B11R1.81 CNCc1ccc(cc1C)Br 2230a_106832991635_100000708836 [1,2,0,0,0,0|0,0,1]=4 7814 B11R1.81 CNCc1ccc(cc1C)Br 26a_100102657272_100000186361 [1,2,0,0,0,0|0,0,1]=4 7815 B11R1.81 CNCc1ccc(cc1C)Br 270004a_106832991635_100000687586 [1,2,0,0,0,0|0,0,1]=4 7816 B11R1.81 CNCc1ccc(cc1C)Br 34a_100000753881_200000210301 [1,2,0,0,0,0|0,0,1]=4 7817 B11R1.81 CNCc1ccc(cc1C)Br 34a_100102657272_100000708836 [1,2,0,0,0,0|0,0,1]=4 7818 B11R1.81 CNCc1ccc(cc1C)Br 7a_106832991635_100000708836 [1,2,0,0,0,0|0,0,1]=4 7819 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [1,2,0,0,0,0|0,0,1]=4 7820 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [1,2,0,0,0,0|0,0,1]=4 7821 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [1,2,0,0,0,0|0,0,1]=4 7822 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [1,2,0,0,0,0|0,0,1]=4 7823 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [1,2,0,0,0,0|0,0,1]=4 7824 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [1,2,0,0,0,0|0,0,1]=4 7825 B11R1.81 CNCc1ccc(cc1C)Cl 207a_100102657272_100000766358 [1,2,0,0,0,0|0,0,1]=4 7826 B11R1.81 CNCc1ccc(cc1C)Cl 2230a_106832991635_100012361307 [1,2,0,0,0,0|0,0,1]=4 7827 B11R1.81 CNCc1ccc(cc1C)Cl 270004a_106832991635_100000766358 [1,2,0,0,0,0|0,0,1]=4 7828 B11R1.81 CNCc1ccc(cc1C)Cl 34a_100102657272_100012361307 [1,2,0,0,0,0|0,0,1]=4 7829 B11R1.81 CNCc1ccc(cc1C)Cl 34a_103436540063_200000210301 [1,2,0,0,0,0|0,0,1]=4 7830 B11R1.81 CNCc1ccc(cc1C)Cl 7a_106832991635_100012361307 [1,2,0,0,0,0|0,0,1]=4 7831 B11R1.81 CNCc1ccc(cc1C)F 207a_100102657272_100000745986 [1,2,0,0,0,0|0,0,1]=4 7832 B11R1.81 CNCc1ccc(cc1C)F 2230a_106832991635_100000700533 [1,2,0,0,0,0|0,0,1]=4 7833 B11R1.81 CNCc1ccc(cc1C)F 270004a_106832991635_100000745986 [1,2,0,0,0,0|0,0,1]=4 7834 B11R1.81 CNCc1ccc(cc1C)F 34a_100102657272_100000700533 [1,2,0,0,0,0|0,0,1]=4 7835 B11R1.81 CNCc1ccc(cc1C)F 34a_100137329023_200000210301 [1,2,0,0,0,0|0,0,1]=4 7836 B11R1.81 CNCc1ccc(cc1C)F 7a_106832991635_100000700533 [1,2,0,0,0,0|0,0,1]=4 7837 B11R1.81 CNCc1ccc(cc1Cl)Br 207a_100102657272_100000764164 [1,2,0,0,0,0|0,0,1]=4 7838 B11R1.81 CNCc1ccc(cc1Cl)Br 2230a_106832991635_100011740631 [1,2,0,0,0,0|0,0,1]=4 7839 B11R1.81 CNCc1ccc(cc1Cl)Br 26a_100102657272_100000186472 [1,2,0,0,0,0|0,0,1]=4 7840 B11R1.81 CNCc1ccc(cc1Cl)Br 270004a_106832991635_100000764164 [1,2,0,0,0,0|0,0,1]=4 7841 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100020628970_200000210301 [1,2,0,0,0,0|0,0,1]=4 7842 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100102657272_100011740631 [1,2,0,0,0,0|0,0,1]=4 7843 B11R1.81 CNCc1ccc(cc1Cl)Br 7a_106832991635_100011740631 [1,2,0,0,0,0|0,0,1]=4 7844 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [1,2,0,0,0,0|0,0,1]=4 7845 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [1,2,0,0,0,0|0,0,1]=4 7846 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [1,2,0,0,0,0|0,0,1]=4 7847 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [1,2,0,0,0,0|0,0,1]=4 7848 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [1,2,0,0,0,0|0,0,1]=4 7849 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [1,2,0,0,0,0|0,0,1]=4 7850 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [1,2,0,0,0,0|0,0,1]=4 7851 B11R1.81 CNCc1ccc(cc1Cl)Cl 207a_100102657272_100000188887 [1,2,0,0,0,0|0,0,1]=4 7852 B11R1.81 CNCc1ccc(cc1Cl)Cl 2230a_106832991635_100000188473 [1,2,0,0,0,0|0,0,1]=4 7853 B11R1.81 CNCc1ccc(cc1Cl)Cl 26a_100102657272_100015191787 [1,2,0,0,0,0|0,0,1]=4 7854 B11R1.81 CNCc1ccc(cc1Cl)Cl 270004a_106832991635_100000188887 [1,2,0,0,0,0|0,0,1]=4 7855 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100000174880_200000210301 [1,2,0,0,0,0|0,0,1]=4 7856 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100102657272_100000188473 [1,2,0,0,0,0|0,0,1]=4 7857 B11R1.81 CNCc1ccc(cc1Cl)Cl 7a_106832991635_100000188473 [1,2,0,0,0,0|0,0,1]=4 7858 B11R1.81 CNCc1ccc(cc1Cl)F 207a_100102657272_100000752949 [1,2,0,0,0,0|0,0,1]=4 7859 B11R1.81 CNCc1ccc(cc1Cl)F 2230a_106832991635_100011216360 [1,2,0,0,0,0|0,0,1]=4 7860 B11R1.81 CNCc1ccc(cc1Cl)F 26a_100102657272_100000212004 [1,2,0,0,0,0|0,0,1]=4 7861 B11R1.81 CNCc1ccc(cc1Cl)F 270004a_106832991635_100000752949 [1,2,0,0,0,0|0,0,1]=4 7862 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100000174946_200000210301 [1,2,0,0,0,0|0,0,1]=4 7863 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100102657272_100011216360 [1,2,0,0,0,0|0,0,1]=4 7864 B11R1.81 CNCc1ccc(cc1Cl)F 7a_106832991635_100011216360 [1,2,0,0,0,0|0,0,1]=4 7865 B11R1.81 CNCc1ccc(cc1Cl)I 207a_100102657272_100000727542 [1,2,0,0,0,0|0,0,1]=4 7866 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [1,2,0,0,0,0|0,0,1]=4 7867 B11R1.81 CNCc1ccc(cc1F)Br 207a_100102657272_100000211676 [1,2,0,0,0,0|0,0,1]=4 7868 B11R1.81 CNCc1ccc(cc1F)Br 2230a_106832991635_100000211606 [1,2,0,0,0,0|0,0,1]=4 7869 B11R1.81 CNCc1ccc(cc1F)Br 26a_100102657272_100000185481 [1,2,0,0,0,0|0,0,1]=4 7870 B11R1.81 CNCc1ccc(cc1F)Br 270004a_106832991635_100000211676 [1,2,0,0,0,0|0,0,1]=4 7871 B11R1.81 CNCc1ccc(cc1F)Br 34a_100000754580_200000210301 [1,2,0,0,0,0|0,0,1]=4 7872 B11R1.81 CNCc1ccc(cc1F)Br 34a_100102657272_100000211606 [1,2,0,0,0,0|0,0,1]=4 7873 B11R1.81 CNCc1ccc(cc1F)Br 7a_106832991635_100000211606 [1,2,0,0,0,0|0,0,1]=4 7874 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [1,2,0,0,0,0|0,0,1]=4 7875 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [1,2,0,0,0,0|0,0,1]=4 7876 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [1,2,0,0,0,0|0,0,1]=4 7877 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [1,2,0,0,0,0|0,0,1]=4 7878 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [1,2,0,0,0,0|0,0,1]=4 7879 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [1,2,0,0,0,0|0,0,1]=4 7880 B11R1.81 CNCc1ccc(cc1F)Cl 207a_100102657272_100000697372 [1,2,0,0,0,0|0,0,1]=4 7881 B11R1.81 CNCc1ccc(cc1F)Cl 2230a_106832991635_100000709361 [1,2,0,0,0,0|0,0,1]=4 7882 B11R1.81 CNCc1ccc(cc1F)Cl 270004a_106832991635_100000697372 [1,2,0,0,0,0|0,0,1]=4 7883 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100000708496_200000210301 [1,2,0,0,0,0|0,0,1]=4 7884 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100102657272_100000709361 [1,2,0,0,0,0|0,0,1]=4 7885 B11R1.81 CNCc1ccc(cc1F)Cl 7a_106832991635_100000709361 [1,2,0,0,0,0|0,0,1]=4 7886 B11R1.81 CNCc1ccc(cc1F)F 207a_100102657272_100000211964 [1,2,0,0,0,0|0,0,1]=4 7887 B11R1.81 CNCc1ccc(cc1F)F 2230a_106832991635_100000748237 [1,2,0,0,0,0|0,0,1]=4 7888 B11R1.81 CNCc1ccc(cc1F)F 270004a_106832991635_100000211964 [1,2,0,0,0,0|0,0,1]=4 7889 B11R1.81 CNCc1ccc(cc1F)F 34a_100000737868_200000210301 [1,2,0,0,0,0|0,0,1]=4 7890 B11R1.81 CNCc1ccc(cc1F)F 34a_100102657272_100000748237 [1,2,0,0,0,0|0,0,1]=4 7891 B11R1.81 CNCc1ccc(cc1F)F 7a_106832991635_100000748237 [1,2,0,0,0,0|0,0,1]=4 7892 B11R1.81 CNCc1ccc(cc1F)I 207a_100102657272_100000050965 [1,2,0,0,0,0|0,0,1]=4 7893 B11R1.81 CNCc1ccc(cc1F)I 2230a_106832991635_100010244991 [1,2,0,0,0,0|0,0,1]=4 7894 B11R1.81 CNCc1ccc(cc1F)I 34a_100102657272_100010244991 [1,2,0,0,0,0|0,0,1]=4 7895 B11R1.81 CNCc1ccc(cc1F)I 7a_106832991635_100010244991 [1,2,0,0,0,0|0,0,1]=4 7896 B11R1.81 CNCc1ccc(cc1I)Br 207a_100102657272_100010146562 [1,2,0,0,0,0|0,0,1]=4 7897 B11R1.81 CNCc1ccc(cc1I)Br 2230a_106832991635_100010146615 [1,2,0,0,0,0|0,0,1]=4 7898 B11R1.81 CNCc1ccc(cc1I)Br 26a_100102657272_100012355227 [1,2,0,0,0,0|0,0,1]=4 7899 B11R1.81 CNCc1ccc(cc1I)Br 270004a_106832991635_100010146562 [1,2,0,0,0,0|0,0,1]=4 7900 B11R1.81 CNCc1ccc(cc1I)Br 34a_100102657272_100010146615 [1,2,0,0,0,0|0,0,1]=4 7901 B11R1.81 CNCc1ccc(cc1I)Br 7a_106832991635_100010146615 [1,2,0,0,0,0|0,0,1]=4 7902 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [1,2,0,0,0,0|0,0,1]=4 7903 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [1,2,0,0,0,0|0,0,1]=4 7904 B11R1.81 CNCc1ccc(cc1I)Cl 2230a_106832991635_100010254388 [1,2,0,0,0,0|0,0,1]=4 7905 B11R1.81 CNCc1ccc(cc1I)Cl 34a_100102657272_100010254388 [1,2,0,0,0,0|0,0,1]=4 7906 B11R1.81 CNCc1ccc(cc1I)Cl 7a_106832991635_100010254388 [1,2,0,0,0,0|0,0,1]=4 7907 B11R1.81 CNCc1ccc(cc1I)F 207a_100102657272_100010254405 [1,2,0,0,0,0|0,0,1]=4 7908 B11R1.81 CNCc1ccc(cc1I)F 2230a_106832991635_100012354799 [1,2,0,0,0,0|0,0,1]=4 7909 B11R1.81 CNCc1ccc(cc1I)F 34a_100102657272_100012354799 [1,2,0,0,0,0|0,0,1]=4 7910 B11R1.81 CNCc1ccc(cc1I)F 7a_106832991635_100012354799 [1,2,0,0,0,0|0,0,1]=4 7911 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [1,2,0,0,0,0|0,0,1]=4 7912 B11R1.81 Cc1cc(ccc1CN[13CH3])Br 34a_100000753881_200025704644 [1,2,0,0,0,0|0,0,1]=4 7913 B11R1.81 Cc1cc(ccc1CN[13CH3])Cl 34a_103436540063_200025704644 [1,2,0,0,0,0|0,0,1]=4 7914 B11R1.81 Cc1cc(ccc1CN[13CH3])F 34a_100137329023_200025704644 [1,2,0,0,0,0|0,0,1]=4 7915 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [1,2,0,0,0,0|0,0,1]=4 7916 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [1,2,0,0,0,0|0,0,1]=4 7917 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [1,2,0,0,0,0|0,0,1]=4 7918 B11R1.81 [13CH3]NCc1ccc(cc1Br)Cl 34a_100102692131_200025704644 [1,2,0,0,0,0|0,0,1]=4 7919 B11R1.81 [13CH3]NCc1ccc(cc1Br)F 34a_100000708791_200025704644 [1,2,0,0,0,0|0,0,1]=4 7920 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Br 34a_100020628970_200025704644 [1,2,0,0,0,0|0,0,1]=4 7921 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Cl 34a_100000174880_200025704644 [1,2,0,0,0,0|0,0,1]=4 7922 B11R1.81 [13CH3]NCc1ccc(cc1Cl)F 34a_100000174946_200025704644 [1,2,0,0,0,0|0,0,1]=4 7923 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [1,2,0,0,0,0|0,0,1]=4 7924 B11R1.81 [13CH3]NCc1ccc(cc1F)Br 34a_100000754580_200025704644 [1,2,0,0,0,0|0,0,1]=4 7925 B11R1.81 [13CH3]NCc1ccc(cc1F)Cl 34a_100000708496_200025704644 [1,2,0,0,0,0|0,0,1]=4 7926 B11R1.81 [13CH3]NCc1ccc(cc1F)F 34a_100000737868_200025704644 [1,2,0,0,0,0|0,0,1]=4 7927 B11R1.83 C#Cc1ccc(cc1)CNC 207a_100102657272_100011361452 [1,2,0,0,0,0|0,0,1]=4 7928 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_100015199678_200000210301 [1,2,0,0,0,0|0,0,1]=4 7929 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_106832991635_100000140223 [1,2,0,0,0,0|0,0,1]=4 7930 B11R1.83 C#Cc1ccc(cc1)CNC 270004a_106832991635_100011361452 [1,2,0,0,0,0|0,0,1]=4 7931 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100015199678_200000210301 [1,2,0,0,0,0|0,0,1]=4 7932 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100102657272_100000140223 [1,2,0,0,0,0|0,0,1]=4 7933 B11R1.83 C#Cc1ccc(cc1)CNC 7a_106832991635_100000140223 [1,2,0,0,0,0|0,0,1]=4 7934 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 2230a_100015199678_200025704644 [1,2,0,0,0,0|0,0,1]=4 7935 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 34a_100015199678_200025704644 [1,2,0,0,0,0|0,0,1]=4 7936 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [1,2,0,0,0,0|1,0,0]=4 7937 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [1,2,0,0,0,0|1,0,0]=4 7938 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [1,2,0,0,0,0|1,0,0]=4 7939 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [1,2,0,0,0,0|1,0,0]=4 7940 B11R1.83 C=Cc1ccc(cc1)/C=C/C 271570a_100011290941_100016259036 [1,2,0,0,0,0|1,0,0]=4 7941 B11R1.83 C=Cc1ccc(cc1)CNC 2230a_106832991635_100000034074 [1,2,0,0,0,0|0,0,1]=4 7942 B11R1.83 C=Cc1ccc(cc1)CNC 26a_100102657272_100000189437 [1,2,0,0,0,0|0,0,1]=4 7943 B11R1.83 C=Cc1ccc(cc1)CNC 270004a_106832991635_100011361436 [1,2,0,0,0,0|0,0,1]=4 7944 B11R1.83 C=Cc1ccc(cc1)CNC 271570a_100011290941_100000180866 [1,2,0,0,0,0|0,0,1]=4 7945 B11R1.83 C=Cc1ccc(cc1)CNC 34a_100102657272_100000034074 [1,2,0,0,0,0|0,0,1]=4 7946 B11R1.83 C=Cc1ccc(cc1)CNC 34a_200011934891_200000210301 [1,2,0,0,0,0|0,0,1]=4 7947 B11R1.83 C=Cc1ccc(cc1)CNC 7a_106832991635_100000034074 [1,2,0,0,0,0|0,0,1]=4 7948 B11R1.83 C=Cc1ccc(cc1)CN[13CH3] 34a_200011934891_200025704644 [1,2,0,0,0,0|0,0,1]=4 7949 B11R1.83 CC=Cc1ccc(cc1)C#N 271570a_100016259895_100000179745 [1,2,0,0,0,0|1,0,0]=4 7950 B11R1.83 CC=Cc1ccc(cc1)C=O 271570a_100016259895_100000186029 [1,2,0,0,0,0|1,0,0]=4 7951 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [1,2,0,0,0,0|1,0,0]=4 7952 B11R1.83 CC=Cc1ccc(cc1)CF 271570a_100016259895_100010268989 [1,2,0,0,0,0|1,0,0]=4 7953 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [1,2,0,0,0,0|1,0,0]=4 7954 B11R1.83 CC=Cc1ccc(cc1)CO 271570a_100016259895_100000690907 [1,2,0,0,0,0|1,0,0]=4 7955 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [1,2,0,0,0,0|1,0,0]=4 7956 B11R1.83 CC=Cc1ccc(cc1)NN 271570a_100016259895_100016988836 [1,2,0,0,0,0|1,0,0]=4 7957 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [1,2,0,0,0,0|1,0,0]=4 7958 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [1,2,0,0,0,0|1,0,0]=4 7959 B11R1.83 CCc1ccc(cc1)CNC 207a_100102657272_100000211036 [1,2,0,0,0,0|0,0,1]=4 7960 B11R1.83 CCc1ccc(cc1)CNC 2230a_100000721222_200000210301 [1,2,0,0,0,0|0,0,1]=4 7961 B11R1.83 CCc1ccc(cc1)CNC 2230a_106832991635_100000747183 [1,2,0,0,0,0|0,0,1]=4 7962 B11R1.83 CCc1ccc(cc1)CNC 26a_100102657272_100000211359 [1,2,0,0,0,0|0,0,1]=4 7963 B11R1.83 CCc1ccc(cc1)CNC 270004a_106832991635_100000211036 [1,2,0,0,0,0|0,0,1]=4 7964 B11R1.83 CCc1ccc(cc1)CNC 34a_100000721222_200000210301 [1,2,0,0,0,0|0,0,1]=4 7965 B11R1.83 CCc1ccc(cc1)CNC 34a_100102657272_100000747183 [1,2,0,0,0,0|0,0,1]=4 7966 B11R1.83 CCc1ccc(cc1)CNC 7a_106832991635_100000747183 [1,2,0,0,0,0|0,0,1]=4 7967 B11R1.83 CCc1ccc(cc1)CN[13CH3] 2230a_100000721222_200025704644 [1,2,0,0,0,0|0,0,1]=4 7968 B11R1.83 CCc1ccc(cc1)CN[13CH3] 34a_100000721222_200025704644 [1,2,0,0,0,0|0,0,1]=4 7969 B11R1.83 CNCc1ccc(cc1)C#N 207a_100102657272_100000211122 [1,2,0,0,0,0|0,0,1]=4 7970 B11R1.83 CNCc1ccc(cc1)C#N 2230a_106832991635_100000184898 [1,2,0,0,0,0|0,0,1]=4 7971 B11R1.83 CNCc1ccc(cc1)C#N 26a_100102657272_100000210344 [1,2,0,0,0,0|0,0,1]=4 7972 B11R1.83 CNCc1ccc(cc1)C#N 270004a_106832991635_100000211122 [1,2,0,0,0,0|0,0,1]=4 7973 B11R1.83 CNCc1ccc(cc1)C#N 34a_100015207190_200000210301 [1,2,0,0,0,0|0,0,1]=4 7974 B11R1.83 CNCc1ccc(cc1)C#N 34a_100102657272_100000184898 [1,2,0,0,0,0|0,0,1]=4 7975 B11R1.83 CNCc1ccc(cc1)C#N 7a_106832991635_100000184898 [1,2,0,0,0,0|0,0,1]=4 7976 B11R1.83 CNCc1ccc(cc1)C=O 2230a_106832991635_100009816848 [1,2,0,0,0,0|0,0,1]=4 7977 B11R1.83 CNCc1ccc(cc1)C=O 34a_100102657272_100009816848 [1,2,0,0,0,0|0,0,1]=4 7978 B11R1.83 CNCc1ccc(cc1)C=O 7a_106832991635_100009816848 [1,2,0,0,0,0|0,0,1]=4 7979 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [1,2,0,0,0,0|0,0,1]=4 7980 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [1,2,0,0,0,0|0,0,1]=4 7981 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [1,2,0,0,0,0|0,0,1]=4 7982 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [1,2,0,0,0,0|0,0,1]=4 7983 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [1,2,0,0,0,0|0,0,1]=4 7984 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [1,2,0,0,0,0|0,0,1]=4 7985 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [1,2,0,0,0,0|0,0,1]=4 7986 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [1,2,0,0,0,0|0,0,1]=4 7987 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [1,2,0,0,0,0|0,0,1]=4 7988 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [1,2,0,0,0,0|0,0,1]=4 7989 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [1,2,0,0,0,0|0,0,1]=4 7990 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [1,2,0,0,0,0|0,0,1]=4 7991 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [1,2,0,0,0,0|0,0,1]=4 7992 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [1,2,0,0,0,0|0,0,1]=4 7993 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [1,2,0,0,0,0|0,0,1]=4 7994 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [1,2,0,0,0,0|0,0,1]=4 7995 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [1,2,0,0,0,0|0,0,1]=4 7996 B11R1.83 CNCc1ccc(cc1)SC 207a_100102657272_100000211154 [1,2,0,0,0,0|0,0,1]=4 7997 B11R1.83 CNCc1ccc(cc1)SC 2230a_100000174980_200000210301 [1,2,0,0,0,0|0,0,1]=4 7998 B11R1.83 CNCc1ccc(cc1)SC 2230a_106832991635_100000181263 [1,2,0,0,0,0|0,0,1]=4 7999 B11R1.83 CNCc1ccc(cc1)SC 26a_100102657272_100000211864 [1,2,0,0,0,0|0,0,1]=4 8000 B11R1.83 CNCc1ccc(cc1)SC 270004a_106832991635_100000211154 [1,2,0,0,0,0|0,0,1]=4 8001 B11R1.83 CNCc1ccc(cc1)SC 34a_100000174980_200000210301 [1,2,0,0,0,0|0,0,1]=4 8002 B11R1.83 CNCc1ccc(cc1)SC 34a_100102657272_100000181263 [1,2,0,0,0,0|0,0,1]=4 8003 B11R1.83 CNCc1ccc(cc1)SC 62a_100000180866_200000210301 [1,2,0,0,0,0|0,0,1]=4 8004 B11R1.83 CNCc1ccc(cc1)SC 62a_200000210301_100000180866 [1,2,0,0,0,0|0,0,1]=4 8005 B11R1.83 CNCc1ccc(cc1)SC 7a_106832991635_100000181263 [1,2,0,0,0,0|0,0,1]=4 8006 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_100000180866_200025704644 [1,2,0,0,0,0|0,0,1]=4 8007 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000180866 [1,2,0,0,0,0|0,0,1]=4 8008 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [1,2,0,0,0,0|0,0,1]=4 8009 B11R1.83 CSc1ccc(cc1)CN[13CH3] 2230a_100000174980_200025704644 [1,2,0,0,0,0|0,0,1]=4 8010 B11R1.83 CSc1ccc(cc1)CN[13CH3] 34a_100000174980_200025704644 [1,2,0,0,0,0|0,0,1]=4 8011 B11R1.83 [13CH3]NCc1ccc(cc1)C#N 34a_100015207190_200025704644 [1,2,0,0,0,0|0,0,1]=4 8012 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [1,2,0,0,0,0|0,0,1]=4 8013 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [1,2,0,0,0,0|0,0,1]=4 8014 B11R1.192 CC=Cc1ccc(c(c1)Br)Br 271570a_100016259895_100012356285 [1,2,0,0,0,0|1,0,0]=4 8015 B11R1.192 CC=Cc1ccc(c(c1)Br)C 271570a_100016259895_100011847877 [1,2,0,0,0,0|1,0,0]=4 8016 B11R1.192 CC=Cc1ccc(c(c1)Br)Cl 271570a_100016259895_100012353702 [1,2,0,0,0,0|1,0,0]=4 8017 B11R1.192 CC=Cc1ccc(c(c1)Br)F 271570a_100016259895_100012047266 [1,2,0,0,0,0|1,0,0]=4 8018 B11R1.192 CC=Cc1ccc(c(c1)Br)N 271570a_100016259895_100000750455 [1,2,0,0,0,0|1,0,0]=4 8019 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,2,0,0,0,0|1,0,0]=4 8020 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,2,0,0,0,0|1,0,0]=4 8021 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,2,0,0,0,0|1,0,0]=4 8022 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,2,0,0,0,0|1,0,0]=4 8023 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,2,0,0,0,0|1,0,0]=4 8024 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,2,0,0,0,0|1,0,0]=4 8025 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,2,0,0,0,0|1,0,0]=4 8026 B11R1.192 CC=Cc1ccc(c(c1)Cl)Br 271570a_100016259895_100012047281 [1,2,0,0,0,0|1,0,0]=4 8027 B11R1.192 CC=Cc1ccc(c(c1)Cl)C 271570a_100016259895_100011216363 [1,2,0,0,0,0|1,0,0]=4 8028 B11R1.192 CC=Cc1ccc(c(c1)Cl)Cl 271570a_100016259895_100011214914 [1,2,0,0,0,0|1,0,0]=4 8029 B11R1.192 CC=Cc1ccc(c(c1)Cl)F 271570a_100016259895_100011215976 [1,2,0,0,0,0|1,0,0]=4 8030 B11R1.192 CC=Cc1ccc(c(c1)Cl)N 271570a_100016259895_100011218065 [1,2,0,0,0,0|1,0,0]=4 8031 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,2,0,0,0,0|1,0,0]=4 8032 B11R1.192 CC=Cc1ccc(c(c1)F)Br 271570a_100016259895_100000685389 [1,2,0,0,0,0|1,0,0]=4 8033 B11R1.192 CC=Cc1ccc(c(c1)F)C 271570a_100016259895_100000720648 [1,2,0,0,0,0|1,0,0]=4 8034 B11R1.192 CC=Cc1ccc(c(c1)F)Cl 271570a_100016259895_100011216805 [1,2,0,0,0,0|1,0,0]=4 8035 B11R1.192 CC=Cc1ccc(c(c1)F)F 271570a_100016259895_100000750028 [1,2,0,0,0,0|1,0,0]=4 8036 B11R1.192 CC=Cc1ccc(c(c1)F)N 271570a_100016259895_100011215594 [1,2,0,0,0,0|1,0,0]=4 8037 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,2,0,0,0,0|1,0,0]=4 8038 B11R1.192 CC=Cc1ccc(c(c1)N)Br 271570a_100016259895_100000750456 [1,2,0,0,0,0|1,0,0]=4 8039 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [1,2,0,0,0,0|1,0,0]=4 8040 B11R1.192 CC=Cc1ccc(c(c1)N)Cl 271570a_100016259895_200000761891 [1,2,0,0,0,0|1,0,0]=4 8041 B11R1.192 CC=Cc1ccc(c(c1)N)F 271570a_100016259895_100000740924 [1,2,0,0,0,0|1,0,0]=4 8042 B11R1.192 CC=Cc1ccc(c(c1)N)N 271570a_100016259895_100000741789 [1,2,0,0,0,0|1,0,0]=4 8043 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,2,0,0,0,0|1,0,0]=4 8044 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,2,0,0,0,0|1,0,0]=4 8045 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,2,0,0,0,0|1,0,0]=4 8046 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,2,0,0,0,0|1,0,0]=4 8047 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,2,0,0,0,0|1,0,0]=4 8048 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,2,0,0,0,0|1,0,0]=4 8049 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,2,0,0,0,0|1,0,0]=4 8050 B11R1.192 CNCc1ccc(c(c1)Br)Br 207a_100102657272_100011215943 [1,2,0,0,0,0|0,0,1]=4 8051 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_100012351559_200000210301 [1,2,0,0,0,0|0,0,1]=4 8052 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_106832991635_100012353900 [1,2,0,0,0,0|0,0,1]=4 8053 B11R1.192 CNCc1ccc(c(c1)Br)Br 270004a_106832991635_100011215943 [1,2,0,0,0,0|0,0,1]=4 8054 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100012351559_200000210301 [1,2,0,0,0,0|0,0,1]=4 8055 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100102657272_100012353900 [1,2,0,0,0,0|0,0,1]=4 8056 B11R1.192 CNCc1ccc(c(c1)Br)Br 7a_106832991635_100012353900 [1,2,0,0,0,0|0,0,1]=4 8057 B11R1.192 CNCc1ccc(c(c1)Br)C 207a_100102657272_100000695567 [1,2,0,0,0,0|0,0,1]=4 8058 B11R1.192 CNCc1ccc(c(c1)Br)C 2230a_106832991635_100012232412 [1,2,0,0,0,0|0,0,1]=4 8059 B11R1.192 CNCc1ccc(c(c1)Br)C 26a_100102657272_100011380479 [1,2,0,0,0,0|0,0,1]=4 8060 B11R1.192 CNCc1ccc(c(c1)Br)C 270004a_106832991635_100000695567 [1,2,0,0,0,0|0,0,1]=4 8061 B11R1.192 CNCc1ccc(c(c1)Br)C 34a_100102657272_100012232412 [1,2,0,0,0,0|0,0,1]=4 8062 B11R1.192 CNCc1ccc(c(c1)Br)C 7a_106832991635_100012232412 [1,2,0,0,0,0|0,0,1]=4 8063 B11R1.192 CNCc1ccc(c(c1)Br)Cl 207a_100102657272_100000693810 [1,2,0,0,0,0|0,0,1]=4 8064 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_100012349490_200000210301 [1,2,0,0,0,0|0,0,1]=4 8065 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_106832991635_100012353894 [1,2,0,0,0,0|0,0,1]=4 8066 B11R1.192 CNCc1ccc(c(c1)Br)Cl 26a_100102657272_100011933957 [1,2,0,0,0,0|0,0,1]=4 8067 B11R1.192 CNCc1ccc(c(c1)Br)Cl 270004a_106832991635_100000693810 [1,2,0,0,0,0|0,0,1]=4 8068 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100012349490_200000210301 [1,2,0,0,0,0|0,0,1]=4 8069 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100102657272_100012353894 [1,2,0,0,0,0|0,0,1]=4 8070 B11R1.192 CNCc1ccc(c(c1)Br)Cl 7a_106832991635_100012353894 [1,2,0,0,0,0|0,0,1]=4 8071 B11R1.192 CNCc1ccc(c(c1)Br)F 207a_100102657272_100000211747 [1,2,0,0,0,0|0,0,1]=4 8072 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_100015193890_200000210301 [1,2,0,0,0,0|0,0,1]=4 8073 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_106832991635_100011206884 [1,2,0,0,0,0|0,0,1]=4 8074 B11R1.192 CNCc1ccc(c(c1)Br)F 26a_100102657272_100000693481 [1,2,0,0,0,0|0,0,1]=4 8075 B11R1.192 CNCc1ccc(c(c1)Br)F 270004a_106832991635_100000211747 [1,2,0,0,0,0|0,0,1]=4 8076 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100015193890_200000210301 [1,2,0,0,0,0|0,0,1]=4 8077 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100102657272_100011206884 [1,2,0,0,0,0|0,0,1]=4 8078 B11R1.192 CNCc1ccc(c(c1)Br)F 7a_106832991635_100011206884 [1,2,0,0,0,0|0,0,1]=4 8079 B11R1.192 CNCc1ccc(c(c1)Br)I 26a_100102657272_100000701344 [1,2,0,0,0,0|0,0,1]=4 8080 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [1,2,0,0,0,0|0,0,1]=4 8081 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [1,2,0,0,0,0|0,0,1]=4 8082 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [1,2,0,0,0,0|0,0,1]=4 8083 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [1,2,0,0,0,0|0,0,1]=4 8084 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [1,2,0,0,0,0|0,0,1]=4 8085 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [1,2,0,0,0,0|0,0,1]=4 8086 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [1,2,0,0,0,0|0,0,1]=4 8087 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [1,2,0,0,0,0|0,0,1]=4 8088 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [1,2,0,0,0,0|0,0,1]=4 8089 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [1,2,0,0,0,0|0,0,1]=4 8090 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [1,2,0,0,0,0|0,0,1]=4 8091 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [1,2,0,0,0,0|0,0,1]=4 8092 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [1,2,0,0,0,0|0,0,1]=4 8093 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [1,2,0,0,0,0|0,0,1]=4 8094 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [1,2,0,0,0,0|0,0,1]=4 8095 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [1,2,0,0,0,0|0,0,1]=4 8096 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [1,2,0,0,0,0|0,0,1]=4 8097 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [1,2,0,0,0,0|0,0,1]=4 8098 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [1,2,0,0,0,0|0,0,1]=4 8099 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [1,2,0,0,0,0|0,0,1]=4 8100 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [1,2,0,0,0,0|0,0,1]=4 8101 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [1,2,0,0,0,0|0,0,1]=4 8102 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [1,2,0,0,0,0|0,0,1]=4 8103 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [1,2,0,0,0,0|0,0,1]=4 8104 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [1,2,0,0,0,0|0,0,1]=4 8105 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [1,2,0,0,0,0|0,0,1]=4 8106 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [1,2,0,0,0,0|0,0,1]=4 8107 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [1,2,0,0,0,0|0,0,1]=4 8108 B11R1.192 CNCc1ccc(c(c1)Cl)Br 207a_100102657272_100000690054 [1,2,0,0,0,0|0,0,1]=4 8109 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_100012362553_200000210301 [1,2,0,0,0,0|0,0,1]=4 8110 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_106832991635_100012353895 [1,2,0,0,0,0|0,0,1]=4 8111 B11R1.192 CNCc1ccc(c(c1)Cl)Br 26a_100102657272_100011215161 [1,2,0,0,0,0|0,0,1]=4 8112 B11R1.192 CNCc1ccc(c(c1)Cl)Br 270004a_106832991635_100000690054 [1,2,0,0,0,0|0,0,1]=4 8113 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100012362553_200000210301 [1,2,0,0,0,0|0,0,1]=4 8114 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100102657272_100012353895 [1,2,0,0,0,0|0,0,1]=4 8115 B11R1.192 CNCc1ccc(c(c1)Cl)Br 7a_106832991635_100012353895 [1,2,0,0,0,0|0,0,1]=4 8116 B11R1.192 CNCc1ccc(c(c1)Cl)C 207a_100102657272_100000760539 [1,2,0,0,0,0|0,0,1]=4 8117 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_102495364989_200000210301 [1,2,0,0,0,0|0,0,1]=4 8118 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_106832991635_100011823929 [1,2,0,0,0,0|0,0,1]=4 8119 B11R1.192 CNCc1ccc(c(c1)Cl)C 26a_100102657272_100011265682 [1,2,0,0,0,0|0,0,1]=4 8120 B11R1.192 CNCc1ccc(c(c1)Cl)C 270004a_106832991635_100000760539 [1,2,0,0,0,0|0,0,1]=4 8121 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_100102657272_100011823929 [1,2,0,0,0,0|0,0,1]=4 8122 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_102495364989_200000210301 [1,2,0,0,0,0|0,0,1]=4 8123 B11R1.192 CNCc1ccc(c(c1)Cl)C 7a_106832991635_100011823929 [1,2,0,0,0,0|0,0,1]=4 8124 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 207a_100102657272_100000188533 [1,2,0,0,0,0|0,0,1]=4 8125 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200000210301 [1,2,0,0,0,0|0,0,1]=4 8126 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100000184707 [1,2,0,0,0,0|0,0,1]=4 8127 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 26a_100102657272_100000211054 [1,2,0,0,0,0|0,0,1]=4 8128 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 270004a_106832991635_100000188533 [1,2,0,0,0,0|0,0,1]=4 8129 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100000174881_200000210301 [1,2,0,0,0,0|0,0,1]=4 8130 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100102657272_100000184707 [1,2,0,0,0,0|0,0,1]=4 8131 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 7a_106832991635_100000184707 [1,2,0,0,0,0|0,0,1]=4 8132 B11R1.192 CNCc1ccc(c(c1)Cl)F 207a_100102657272_100000742290 [1,2,0,0,0,0|0,0,1]=4 8133 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_100000749334_200000210301 [1,2,0,0,0,0|0,0,1]=4 8134 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_106832991635_100000717365 [1,2,0,0,0,0|0,0,1]=4 8135 B11R1.192 CNCc1ccc(c(c1)Cl)F 26a_100102657272_100000211030 [1,2,0,0,0,0|0,0,1]=4 8136 B11R1.192 CNCc1ccc(c(c1)Cl)F 270004a_106832991635_100000742290 [1,2,0,0,0,0|0,0,1]=4 8137 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100000749334_200000210301 [1,2,0,0,0,0|0,0,1]=4 8138 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100102657272_100011934319 [1,2,0,0,0,0|0,0,1]=4 8139 B11R1.192 CNCc1ccc(c(c1)Cl)F 7a_106832991635_100000717365 [1,2,0,0,0,0|0,0,1]=4 8140 B11R1.192 CNCc1ccc(c(c1)Cl)I 2230a_106832991635_100012349665 [1,2,0,0,0,0|0,0,1]=4 8141 B11R1.192 CNCc1ccc(c(c1)Cl)I 26a_100102657272_100000047559 [1,2,0,0,0,0|0,0,1]=4 8142 B11R1.192 CNCc1ccc(c(c1)Cl)I 34a_100102657272_100012349665 [1,2,0,0,0,0|0,0,1]=4 8143 B11R1.192 CNCc1ccc(c(c1)Cl)I 7a_106832991635_100012349665 [1,2,0,0,0,0|0,0,1]=4 8144 B11R1.192 CNCc1ccc(c(c1)F)Br 207a_100102657272_100000686674 [1,2,0,0,0,0|0,0,1]=4 8145 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_100000755036_200000210301 [1,2,0,0,0,0|0,0,1]=4 8146 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_106832991635_100000767054 [1,2,0,0,0,0|0,0,1]=4 8147 B11R1.192 CNCc1ccc(c(c1)F)Br 26a_100102657272_100000755031 [1,2,0,0,0,0|0,0,1]=4 8148 B11R1.192 CNCc1ccc(c(c1)F)Br 270004a_106832991635_100000686674 [1,2,0,0,0,0|0,0,1]=4 8149 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100000755036_200000210301 [1,2,0,0,0,0|0,0,1]=4 8150 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100102657272_100000767054 [1,2,0,0,0,0|0,0,1]=4 8151 B11R1.192 CNCc1ccc(c(c1)F)Br 7a_106832991635_100000767054 [1,2,0,0,0,0|0,0,1]=4 8152 B11R1.192 CNCc1ccc(c(c1)F)C 207a_100102657272_100000753222 [1,2,0,0,0,0|0,0,1]=4 8153 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_100102708794_200000210301 [1,2,0,0,0,0|0,0,1]=4 8154 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_106832991635_100011217369 [1,2,0,0,0,0|0,0,1]=4 8155 B11R1.192 CNCc1ccc(c(c1)F)C 270004a_106832991635_100000753222 [1,2,0,0,0,0|0,0,1]=4 8156 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102657272_100011217369 [1,2,0,0,0,0|0,0,1]=4 8157 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102708794_200000210301 [1,2,0,0,0,0|0,0,1]=4 8158 B11R1.192 CNCc1ccc(c(c1)F)C 7a_106832991635_100011217369 [1,2,0,0,0,0|0,0,1]=4 8159 B11R1.192 CNCc1ccc(c(c1)F)Cl 207a_100102657272_100000745630 [1,2,0,0,0,0|0,0,1]=4 8160 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_100011219866_200000210301 [1,2,0,0,0,0|0,0,1]=4 8161 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_106832991635_100000716492 [1,2,0,0,0,0|0,0,1]=4 8162 B11R1.192 CNCc1ccc(c(c1)F)Cl 26a_100102657272_100000691581 [1,2,0,0,0,0|0,0,1]=4 8163 B11R1.192 CNCc1ccc(c(c1)F)Cl 270004a_106832991635_100000745630 [1,2,0,0,0,0|0,0,1]=4 8164 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100011219866_200000210301 [1,2,0,0,0,0|0,0,1]=4 8165 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100102657272_100011519011 [1,2,0,0,0,0|0,0,1]=4 8166 B11R1.192 CNCc1ccc(c(c1)F)Cl 7a_106832991635_100000716492 [1,2,0,0,0,0|0,0,1]=4 8167 B11R1.192 CNCc1ccc(c(c1)F)F 207a_100102657272_100000211062 [1,2,0,0,0,0|0,0,1]=4 8168 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_100000737897_200000210301 [1,2,0,0,0,0|0,0,1]=4 8169 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_106832991635_100000757363 [1,2,0,0,0,0|0,0,1]=4 8170 B11R1.192 CNCc1ccc(c(c1)F)F 270004a_106832991635_100000211062 [1,2,0,0,0,0|0,0,1]=4 8171 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100000737897_200000210301 [1,2,0,0,0,0|0,0,1]=4 8172 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100102657272_100000757363 [1,2,0,0,0,0|0,0,1]=4 8173 B11R1.192 CNCc1ccc(c(c1)F)F 7a_106832991635_100000757363 [1,2,0,0,0,0|0,0,1]=4 8174 B11R1.192 CNCc1ccc(c(c1)F)I 207a_100102657272_100000050832 [1,2,0,0,0,0|0,0,1]=4 8175 B11R1.192 CNCc1ccc(c(c1)F)I 2230a_106832991635_100010149604 [1,2,0,0,0,0|0,0,1]=4 8176 B11R1.192 CNCc1ccc(c(c1)F)I 270004a_106832991635_100000050832 [1,2,0,0,0,0|0,0,1]=4 8177 B11R1.192 CNCc1ccc(c(c1)F)I 34a_100102657272_100010149604 [1,2,0,0,0,0|0,0,1]=4 8178 B11R1.192 CNCc1ccc(c(c1)F)I 7a_106832991635_100010149604 [1,2,0,0,0,0|0,0,1]=4 8179 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,2,0,0,0,0|0,0,1]=4 8180 B11R1.192 CNCc1ccc(c(c1)I)Br 207a_100102657272_100010146563 [1,2,0,0,0,0|0,0,1]=4 8181 B11R1.192 CNCc1ccc(c(c1)I)Br 2230a_106832991635_100010146616 [1,2,0,0,0,0|0,0,1]=4 8182 B11R1.192 CNCc1ccc(c(c1)I)Br 26a_100102657272_100012339312 [1,2,0,0,0,0|0,0,1]=4 8183 B11R1.192 CNCc1ccc(c(c1)I)Br 270004a_106832991635_100010146563 [1,2,0,0,0,0|0,0,1]=4 8184 B11R1.192 CNCc1ccc(c(c1)I)Br 34a_100102657272_100010146616 [1,2,0,0,0,0|0,0,1]=4 8185 B11R1.192 CNCc1ccc(c(c1)I)Br 7a_106832991635_100010146616 [1,2,0,0,0,0|0,0,1]=4 8186 B11R1.192 CNCc1ccc(c(c1)I)C 207a_100102657272_100010197721 [1,2,0,0,0,0|0,0,1]=4 8187 B11R1.192 CNCc1ccc(c(c1)I)C 2230a_106832991635_100010206137 [1,2,0,0,0,0|0,0,1]=4 8188 B11R1.192 CNCc1ccc(c(c1)I)C 270004a_106832991635_100010197721 [1,2,0,0,0,0|0,0,1]=4 8189 B11R1.192 CNCc1ccc(c(c1)I)C 34a_100102657272_100010206137 [1,2,0,0,0,0|0,0,1]=4 8190 B11R1.192 CNCc1ccc(c(c1)I)C 7a_106832991635_100010206137 [1,2,0,0,0,0|0,0,1]=4 8191 B11R1.192 CNCc1ccc(c(c1)I)Cl 207a_100102657272_100010209939 [1,2,0,0,0,0|0,0,1]=4 8192 B11R1.192 CNCc1ccc(c(c1)I)Cl 26a_100102657272_100000049588 [1,2,0,0,0,0|0,0,1]=4 8193 B11R1.192 CNCc1ccc(c(c1)I)Cl 270004a_106832991635_100010209939 [1,2,0,0,0,0|0,0,1]=4 8194 B11R1.192 CNCc1ccc(c(c1)I)F 207a_100102657272_100010188209 [1,2,0,0,0,0|0,0,1]=4 8195 B11R1.192 CNCc1ccc(c(c1)I)F 2230a_106832991635_100010188208 [1,2,0,0,0,0|0,0,1]=4 8196 B11R1.192 CNCc1ccc(c(c1)I)F 270004a_106832991635_100010188209 [1,2,0,0,0,0|0,0,1]=4 8197 B11R1.192 CNCc1ccc(c(c1)I)F 34a_100102657272_100010188208 [1,2,0,0,0,0|0,0,1]=4 8198 B11R1.192 CNCc1ccc(c(c1)I)F 7a_106832991635_100010188208 [1,2,0,0,0,0|0,0,1]=4 8199 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,2,0,0,0,0|0,0,1]=4 8200 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,2,0,0,0,0|0,0,1]=4 8201 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,2,0,0,0,0|0,0,1]=4 8202 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [1,2,0,0,0,0|0,0,1]=4 8203 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [1,2,0,0,0,0|0,0,1]=4 8204 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [1,2,0,0,0,0|0,0,1]=4 8205 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [1,2,0,0,0,0|0,0,1]=4 8206 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [1,2,0,0,0,0|0,0,1]=4 8207 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [1,2,0,0,0,0|0,0,1]=4 8208 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 2230a_102495364989_200025704644 [1,2,0,0,0,0|0,0,1]=4 8209 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 34a_102495364989_200025704644 [1,2,0,0,0,0|0,0,1]=4 8210 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 2230a_100102708794_200025704644 [1,2,0,0,0,0|0,0,1]=4 8211 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 34a_100102708794_200025704644 [1,2,0,0,0,0|0,0,1]=4 8212 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 2230a_100012351559_200025704644 [1,2,0,0,0,0|0,0,1]=4 8213 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 34a_100012351559_200025704644 [1,2,0,0,0,0|0,0,1]=4 8214 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 2230a_100012349490_200025704644 [1,2,0,0,0,0|0,0,1]=4 8215 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 34a_100012349490_200025704644 [1,2,0,0,0,0|0,0,1]=4 8216 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 2230a_100015193890_200025704644 [1,2,0,0,0,0|0,0,1]=4 8217 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 34a_100015193890_200025704644 [1,2,0,0,0,0|0,0,1]=4 8218 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 2230a_100012362553_200025704644 [1,2,0,0,0,0|0,0,1]=4 8219 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 34a_100012362553_200025704644 [1,2,0,0,0,0|0,0,1]=4 8220 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200025704644 [1,2,0,0,0,0|0,0,1]=4 8221 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 34a_100000174881_200025704644 [1,2,0,0,0,0|0,0,1]=4 8222 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 2230a_100000749334_200025704644 [1,2,0,0,0,0|0,0,1]=4 8223 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 34a_100000749334_200025704644 [1,2,0,0,0,0|0,0,1]=4 8224 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 2230a_100000755036_200025704644 [1,2,0,0,0,0|0,0,1]=4 8225 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 34a_100000755036_200025704644 [1,2,0,0,0,0|0,0,1]=4 8226 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 2230a_100011219866_200025704644 [1,2,0,0,0,0|0,0,1]=4 8227 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 34a_100011219866_200025704644 [1,2,0,0,0,0|0,0,1]=4 8228 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 2230a_100000737897_200025704644 [1,2,0,0,0,0|0,0,1]=4 8229 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 34a_100000737897_200025704644 [1,2,0,0,0,0|0,0,1]=4 8230 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,2,0,0,0,0|0,0,1]=4 8231 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,2,0,0,0,0|0,0,1]=4 8232 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,2,0,0,0,0|0,0,1]=4 8233 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,2,0,0,0,0|0,0,1]=4 8234 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,2,0,0,0,0|1,0,0]=4 8235 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [1,2,0,0,0,0|1,0,0]=4 8236 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [1,2,0,0,0,0|1,0,0]=4 8237 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [1,2,0,0,0,0|1,0,0]=4 8238 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [1,2,0,0,0,0|1,0,0]=4 8239 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [1,2,0,0,0,0|1,0,0]=4 8240 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,2,0,0,0,0|1,0,0]=4 8241 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [1,2,0,0,0,0|1,0,0]=4 8242 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [1,2,0,0,0,0|1,0,0]=4 8243 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [1,2,0,0,0,0|1,0,0]=4 8244 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [1,2,0,0,0,0|1,0,0]=4 8245 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,2,0,0,0,0|1,0,0]=4 8246 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [1,2,0,0,0,0|1,0,0]=4 8247 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [1,2,0,0,0,0|1,0,0]=4 8248 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [1,2,0,0,0,0|1,0,0]=4 8249 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [1,2,0,0,0,0|1,0,0]=4 8250 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [1,2,0,0,0,0|1,0,0]=4 8251 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,2,0,0,0,0|1,0,0]=4 8252 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [1,2,0,0,0,0|1,0,0]=4 8253 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [1,2,0,0,0,0|1,0,0]=4 8254 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [1,2,0,0,0,0|1,0,0]=4 8255 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [1,2,0,0,0,0|1,0,0]=4 8256 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [1,2,0,0,0,0|1,0,0]=4 8257 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,2,0,0,0,0|1,0,0]=4 8258 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [1,2,0,0,0,0|1,0,0]=4 8259 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [1,2,0,0,0,0|1,0,0]=4 8260 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [1,2,0,0,0,0|1,0,0]=4 8261 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [1,2,0,0,0,0|1,0,0]=4 8262 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [1,2,0,0,0,0|1,0,0]=4 8263 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,2,0,0,0,0|1,0,0]=4 8264 B11R1.13 CNCc1cccc(c1Br)Br 207a_100102657272_100010240334 [1,2,0,0,0,0|0,0,1]=4 8265 B11R1.13 CNCc1cccc(c1Br)Br 26a_100102657272_100010187966 [1,2,0,0,0,0|0,0,1]=4 8266 B11R1.13 CNCc1cccc(c1Br)Br 270004a_106832991635_100010240334 [1,2,0,0,0,0|0,0,1]=4 8267 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [1,2,0,0,0,0|0,0,1]=4 8268 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [1,2,0,0,0,0|0,0,1]=4 8269 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [1,2,0,0,0,0|0,0,1]=4 8270 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [1,2,0,0,0,0|0,0,1]=4 8271 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [1,2,0,0,0,0|0,0,1]=4 8272 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [1,2,0,0,0,0|0,0,1]=4 8273 B11R1.13 CNCc1cccc(c1Br)Cl 207a_100102657272_100010232083 [1,2,0,0,0,0|0,0,1]=4 8274 B11R1.13 CNCc1cccc(c1Br)Cl 2230a_106832991635_100010145525 [1,2,0,0,0,0|0,0,1]=4 8275 B11R1.13 CNCc1cccc(c1Br)Cl 26a_100102657272_100012348804 [1,2,0,0,0,0|0,0,1]=4 8276 B11R1.13 CNCc1cccc(c1Br)Cl 270004a_106832991635_100010232083 [1,2,0,0,0,0|0,0,1]=4 8277 B11R1.13 CNCc1cccc(c1Br)Cl 34a_100102657272_100010145525 [1,2,0,0,0,0|0,0,1]=4 8278 B11R1.13 CNCc1cccc(c1Br)Cl 7a_106832991635_100010145525 [1,2,0,0,0,0|0,0,1]=4 8279 B11R1.13 CNCc1cccc(c1Br)F 207a_100102657272_100011934749 [1,2,0,0,0,0|0,0,1]=4 8280 B11R1.13 CNCc1cccc(c1Br)F 2230a_100020638964_200000210301 [1,2,0,0,0,0|0,0,1]=4 8281 B11R1.13 CNCc1cccc(c1Br)F 2230a_106832991635_100012351116 [1,2,0,0,0,0|0,0,1]=4 8282 B11R1.13 CNCc1cccc(c1Br)F 26a_100102657272_100009820682 [1,2,0,0,0,0|0,0,1]=4 8283 B11R1.13 CNCc1cccc(c1Br)F 270004a_106832991635_100011934749 [1,2,0,0,0,0|0,0,1]=4 8284 B11R1.13 CNCc1cccc(c1Br)F 34a_100020638964_200000210301 [1,2,0,0,0,0|0,0,1]=4 8285 B11R1.13 CNCc1cccc(c1Br)F 34a_100102657272_100012351116 [1,2,0,0,0,0|0,0,1]=4 8286 B11R1.13 CNCc1cccc(c1Br)F 7a_106832991635_100012351116 [1,2,0,0,0,0|0,0,1]=4 8287 B11R1.13 CNCc1cccc(c1Br)I 2230a_106832991635_100010254545 [1,2,0,0,0,0|0,0,1]=4 8288 B11R1.13 CNCc1cccc(c1Br)I 26a_100102657272_100010187914 [1,2,0,0,0,0|0,0,1]=4 8289 B11R1.13 CNCc1cccc(c1Br)I 34a_100102657272_100010254545 [1,2,0,0,0,0|0,0,1]=4 8290 B11R1.13 CNCc1cccc(c1Br)I 7a_106832991635_100010254545 [1,2,0,0,0,0|0,0,1]=4 8291 B11R1.13 CNCc1cccc(c1C)Br 207a_100102657272_100012179384 [1,2,0,0,0,0|0,0,1]=4 8292 B11R1.13 CNCc1cccc(c1C)Br 2230a_106832991635_100000694682 [1,2,0,0,0,0|0,0,1]=4 8293 B11R1.13 CNCc1cccc(c1C)Br 26a_100102657272_100012002258 [1,2,0,0,0,0|0,0,1]=4 8294 B11R1.13 CNCc1cccc(c1C)Br 270004a_106832991635_100012179384 [1,2,0,0,0,0|0,0,1]=4 8295 B11R1.13 CNCc1cccc(c1C)Br 34a_100000724210_200000210301 [1,2,0,0,0,0|0,0,1]=4 8296 B11R1.13 CNCc1cccc(c1C)Br 34a_100102657272_100000694682 [1,2,0,0,0,0|0,0,1]=4 8297 B11R1.13 CNCc1cccc(c1C)Br 7a_106832991635_100000694682 [1,2,0,0,0,0|0,0,1]=4 8298 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [1,2,0,0,0,0|0,0,1]=4 8299 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [1,2,0,0,0,0|0,0,1]=4 8300 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [1,2,0,0,0,0|0,0,1]=4 8301 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [1,2,0,0,0,0|0,0,1]=4 8302 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [1,2,0,0,0,0|0,0,1]=4 8303 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [1,2,0,0,0,0|0,0,1]=4 8304 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [1,2,0,0,0,0|0,0,1]=4 8305 B11R1.13 CNCc1cccc(c1C)Cl 207a_100102657272_100012002129 [1,2,0,0,0,0|0,0,1]=4 8306 B11R1.13 CNCc1cccc(c1C)Cl 2230a_100020639605_200000210301 [1,2,0,0,0,0|0,0,1]=4 8307 B11R1.13 CNCc1cccc(c1C)Cl 2230a_106832991635_100012186920 [1,2,0,0,0,0|0,0,1]=4 8308 B11R1.13 CNCc1cccc(c1C)Cl 270004a_106832991635_100012002129 [1,2,0,0,0,0|0,0,1]=4 8309 B11R1.13 CNCc1cccc(c1C)Cl 34a_100020639605_200000210301 [1,2,0,0,0,0|0,0,1]=4 8310 B11R1.13 CNCc1cccc(c1C)Cl 34a_100102657272_100012186920 [1,2,0,0,0,0|0,0,1]=4 8311 B11R1.13 CNCc1cccc(c1C)Cl 7a_106832991635_100012186920 [1,2,0,0,0,0|0,0,1]=4 8312 B11R1.13 CNCc1cccc(c1C)F 207a_100102657272_100000037668 [1,2,0,0,0,0|0,0,1]=4 8313 B11R1.13 CNCc1cccc(c1C)F 2230a_100132306986_200000210301 [1,2,0,0,0,0|0,0,1]=4 8314 B11R1.13 CNCc1cccc(c1C)F 2230a_106832991635_100009813626 [1,2,0,0,0,0|0,0,1]=4 8315 B11R1.13 CNCc1cccc(c1C)F 270004a_106832991635_100000037668 [1,2,0,0,0,0|0,0,1]=4 8316 B11R1.13 CNCc1cccc(c1C)F 34a_100102657272_100009813626 [1,2,0,0,0,0|0,0,1]=4 8317 B11R1.13 CNCc1cccc(c1C)F 34a_100132306986_200000210301 [1,2,0,0,0,0|0,0,1]=4 8318 B11R1.13 CNCc1cccc(c1C)F 7a_106832991635_100009813626 [1,2,0,0,0,0|0,0,1]=4 8319 B11R1.13 CNCc1cccc(c1C)I 2230a_106832991635_100010150147 [1,2,0,0,0,0|0,0,1]=4 8320 B11R1.13 CNCc1cccc(c1C)I 34a_100102657272_100010150147 [1,2,0,0,0,0|0,0,1]=4 8321 B11R1.13 CNCc1cccc(c1C)I 7a_106832991635_100010150147 [1,2,0,0,0,0|0,0,1]=4 8322 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [1,2,0,0,0,0|0,0,1]=4 8323 B11R1.13 CNCc1cccc(c1Cl)Br 207a_100102657272_100012362481 [1,2,0,0,0,0|0,0,1]=4 8324 B11R1.13 CNCc1cccc(c1Cl)Br 2230a_106832991635_100012349491 [1,2,0,0,0,0|0,0,1]=4 8325 B11R1.13 CNCc1cccc(c1Cl)Br 26a_100102657272_100010187913 [1,2,0,0,0,0|0,0,1]=4 8326 B11R1.13 CNCc1cccc(c1Cl)Br 270004a_106832991635_100012362481 [1,2,0,0,0,0|0,0,1]=4 8327 B11R1.13 CNCc1cccc(c1Cl)Br 34a_100102657272_100012349491 [1,2,0,0,0,0|0,0,1]=4 8328 B11R1.13 CNCc1cccc(c1Cl)Br 7a_106832991635_100012349491 [1,2,0,0,0,0|0,0,1]=4 8329 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [1,2,0,0,0,0|0,0,1]=4 8330 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [1,2,0,0,0,0|0,0,1]=4 8331 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [1,2,0,0,0,0|0,0,1]=4 8332 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [1,2,0,0,0,0|0,0,1]=4 8333 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [1,2,0,0,0,0|0,0,1]=4 8334 B11R1.13 CNCc1cccc(c1Cl)Cl 207a_100102657272_100000210504 [1,2,0,0,0,0|0,0,1]=4 8335 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_100011211633_200000210301 [1,2,0,0,0,0|0,0,1]=4 8336 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_106832991635_100000723366 [1,2,0,0,0,0|0,0,1]=4 8337 B11R1.13 CNCc1cccc(c1Cl)Cl 26a_100102657272_100000211076 [1,2,0,0,0,0|0,0,1]=4 8338 B11R1.13 CNCc1cccc(c1Cl)Cl 270004a_106832991635_100000210504 [1,2,0,0,0,0|0,0,1]=4 8339 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100011211633_200000210301 [1,2,0,0,0,0|0,0,1]=4 8340 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100102657272_100000723366 [1,2,0,0,0,0|0,0,1]=4 8341 B11R1.13 CNCc1cccc(c1Cl)Cl 7a_106832991635_100000723366 [1,2,0,0,0,0|0,0,1]=4 8342 B11R1.13 CNCc1cccc(c1Cl)F 207a_100102657272_100011998484 [1,2,0,0,0,0|0,0,1]=4 8343 B11R1.13 CNCc1cccc(c1Cl)F 2230a_100012001614_200000210301 [1,2,0,0,0,0|0,0,1]=4 8344 B11R1.13 CNCc1cccc(c1Cl)F 2230a_106832991635_100000696688 [1,2,0,0,0,0|0,0,1]=4 8345 B11R1.13 CNCc1cccc(c1Cl)F 26a_100102657272_100000087408 [1,2,0,0,0,0|0,0,1]=4 8346 B11R1.13 CNCc1cccc(c1Cl)F 270004a_106832991635_100011998484 [1,2,0,0,0,0|0,0,1]=4 8347 B11R1.13 CNCc1cccc(c1Cl)F 34a_100012001614_200000210301 [1,2,0,0,0,0|0,0,1]=4 8348 B11R1.13 CNCc1cccc(c1Cl)F 34a_100102657272_100000696688 [1,2,0,0,0,0|0,0,1]=4 8349 B11R1.13 CNCc1cccc(c1Cl)F 7a_106832991635_100000696688 [1,2,0,0,0,0|0,0,1]=4 8350 B11R1.13 CNCc1cccc(c1Cl)I 26a_100102657272_100000049636 [1,2,0,0,0,0|0,0,1]=4 8351 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [1,2,0,0,0,0|0,0,1]=4 8352 B11R1.13 CNCc1cccc(c1F)Br 207a_100102657272_100011361543 [1,2,0,0,0,0|0,0,1]=4 8353 B11R1.13 CNCc1cccc(c1F)Br 2230a_100015189953_200000210301 [1,2,0,0,0,0|0,0,1]=4 8354 B11R1.13 CNCc1cccc(c1F)Br 2230a_106832991635_100012356506 [1,2,0,0,0,0|0,0,1]=4 8355 B11R1.13 CNCc1cccc(c1F)Br 26a_100102657272_100009817021 [1,2,0,0,0,0|0,0,1]=4 8356 B11R1.13 CNCc1cccc(c1F)Br 270004a_106832991635_100011361543 [1,2,0,0,0,0|0,0,1]=4 8357 B11R1.13 CNCc1cccc(c1F)Br 34a_100015189953_200000210301 [1,2,0,0,0,0|0,0,1]=4 8358 B11R1.13 CNCc1cccc(c1F)Br 34a_100102657272_100012356506 [1,2,0,0,0,0|0,0,1]=4 8359 B11R1.13 CNCc1cccc(c1F)Br 7a_106832991635_100012356506 [1,2,0,0,0,0|0,0,1]=4 8360 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [1,2,0,0,0,0|0,0,1]=4 8361 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [1,2,0,0,0,0|0,0,1]=4 8362 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [1,2,0,0,0,0|0,0,1]=4 8363 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [1,2,0,0,0,0|0,0,1]=4 8364 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [1,2,0,0,0,0|0,0,1]=4 8365 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [1,2,0,0,0,0|0,0,1]=4 8366 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [1,2,0,0,0,0|0,0,1]=4 8367 B11R1.13 CNCc1cccc(c1F)Cl 207a_100102657272_100000766533 [1,2,0,0,0,0|0,0,1]=4 8368 B11R1.13 CNCc1cccc(c1F)Cl 2230a_100000764326_200000210301 [1,2,0,0,0,0|0,0,1]=4 8369 B11R1.13 CNCc1cccc(c1F)Cl 2230a_106832991635_100000716733 [1,2,0,0,0,0|0,0,1]=4 8370 B11R1.13 CNCc1cccc(c1F)Cl 26a_100102657272_100000687438 [1,2,0,0,0,0|0,0,1]=4 8371 B11R1.13 CNCc1cccc(c1F)Cl 270004a_106832991635_100000766533 [1,2,0,0,0,0|0,0,1]=4 8372 B11R1.13 CNCc1cccc(c1F)Cl 34a_100000764326_200000210301 [1,2,0,0,0,0|0,0,1]=4 8373 B11R1.13 CNCc1cccc(c1F)Cl 34a_100102657272_100000716733 [1,2,0,0,0,0|0,0,1]=4 8374 B11R1.13 CNCc1cccc(c1F)Cl 7a_106832991635_100000716733 [1,2,0,0,0,0|0,0,1]=4 8375 B11R1.13 CNCc1cccc(c1F)F 207a_100102657272_100000753312 [1,2,0,0,0,0|0,0,1]=4 8376 B11R1.13 CNCc1cccc(c1F)F 2230a_100011199105_200000210301 [1,2,0,0,0,0|0,0,1]=4 8377 B11R1.13 CNCc1cccc(c1F)F 2230a_106832991635_100000217499 [1,2,0,0,0,0|0,0,1]=4 8378 B11R1.13 CNCc1cccc(c1F)F 270004a_106832991635_100000753312 [1,2,0,0,0,0|0,0,1]=4 8379 B11R1.13 CNCc1cccc(c1F)F 34a_100011199105_200000210301 [1,2,0,0,0,0|0,0,1]=4 8380 B11R1.13 CNCc1cccc(c1F)F 34a_100102657272_100000217499 [1,2,0,0,0,0|0,0,1]=4 8381 B11R1.13 CNCc1cccc(c1F)F 7a_106832991635_100000217499 [1,2,0,0,0,0|0,0,1]=4 8382 B11R1.13 CNCc1cccc(c1F)I 207a_100102657272_100010202174 [1,2,0,0,0,0|0,0,1]=4 8383 B11R1.13 CNCc1cccc(c1F)I 270004a_106832991635_100010202174 [1,2,0,0,0,0|0,0,1]=4 8384 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [1,2,0,0,0,0|0,0,1]=4 8385 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [1,2,0,0,0,0|0,0,1]=4 8386 B11R1.13 CNCc1cccc(c1I)Br 26a_100102657272_100010187912 [1,2,0,0,0,0|0,0,1]=4 8387 B11R1.13 CNCc1cccc(c1I)F 207a_100102657272_100010186293 [1,2,0,0,0,0|0,0,1]=4 8388 B11R1.13 CNCc1cccc(c1I)F 2230a_106832991635_100010149603 [1,2,0,0,0,0|0,0,1]=4 8389 B11R1.13 CNCc1cccc(c1I)F 270004a_106832991635_100010186293 [1,2,0,0,0,0|0,0,1]=4 8390 B11R1.13 CNCc1cccc(c1I)F 34a_100102657272_100010149603 [1,2,0,0,0,0|0,0,1]=4 8391 B11R1.13 CNCc1cccc(c1I)F 7a_106832991635_100010149603 [1,2,0,0,0,0|0,0,1]=4 8392 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [1,2,0,0,0,0|0,0,1]=4 8393 B11R1.13 Cc1c(cccc1CN[13CH3])Br 34a_100000724210_200025704644 [1,2,0,0,0,0|0,0,1]=4 8394 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 2230a_100020639605_200025704644 [1,2,0,0,0,0|0,0,1]=4 8395 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 34a_100020639605_200025704644 [1,2,0,0,0,0|0,0,1]=4 8396 B11R1.13 Cc1c(cccc1CN[13CH3])F 2230a_100132306986_200025704644 [1,2,0,0,0,0|0,0,1]=4 8397 B11R1.13 Cc1c(cccc1CN[13CH3])F 34a_100132306986_200025704644 [1,2,0,0,0,0|0,0,1]=4 8398 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [1,2,0,0,0,0|0,0,1]=4 8399 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [1,2,0,0,0,0|0,0,1]=4 8400 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [1,2,0,0,0,0|0,0,1]=4 8401 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [1,2,0,0,0,0|0,0,1]=4 8402 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [1,2,0,0,0,0|0,0,1]=4 8403 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [1,2,0,0,0,0|0,0,1]=4 8404 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [1,2,0,0,0,0|0,0,1]=4 8405 B11R1.13 [13CH3]NCc1cccc(c1Br)F 2230a_100020638964_200025704644 [1,2,0,0,0,0|0,0,1]=4 8406 B11R1.13 [13CH3]NCc1cccc(c1Br)F 34a_100020638964_200025704644 [1,2,0,0,0,0|0,0,1]=4 8407 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 2230a_100011211633_200025704644 [1,2,0,0,0,0|0,0,1]=4 8408 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 34a_100011211633_200025704644 [1,2,0,0,0,0|0,0,1]=4 8409 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 2230a_100012001614_200025704644 [1,2,0,0,0,0|0,0,1]=4 8410 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 34a_100012001614_200025704644 [1,2,0,0,0,0|0,0,1]=4 8411 B11R1.13 [13CH3]NCc1cccc(c1F)Br 2230a_100015189953_200025704644 [1,2,0,0,0,0|0,0,1]=4 8412 B11R1.13 [13CH3]NCc1cccc(c1F)Br 34a_100015189953_200025704644 [1,2,0,0,0,0|0,0,1]=4 8413 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 2230a_100000764326_200025704644 [1,2,0,0,0,0|0,0,1]=4 8414 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 34a_100000764326_200025704644 [1,2,0,0,0,0|0,0,1]=4 8415 B11R1.13 [13CH3]NCc1cccc(c1F)F 2230a_100011199105_200025704644 [1,2,0,0,0,0|0,0,1]=4 8416 B11R1.13 [13CH3]NCc1cccc(c1F)F 34a_100011199105_200025704644 [1,2,0,0,0,0|0,0,1]=4 8417 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [1,2,0,0,0,0|0,0,1]=4 8418 B11R1.17 CCNCc1ccccc1Br 207a_100015525214_100000211189 [1,2,0,0,0,0|0,0,1]=4 8419 B11R1.17 CCNCc1ccccc1Br 2230a_100000689332_100000210202 [1,2,0,0,0,0|0,0,1]=4 8420 B11R1.17 CCNCc1ccccc1Br 2230a_100015525214_100000184730 [1,2,0,0,0,0|0,0,1]=4 8421 B11R1.17 CCNCc1ccccc1Br 270004a_100015525214_100000211189 [1,2,0,0,0,0|0,0,1]=4 8422 B11R1.17 CCNCc1ccccc1Br 34a_100000689332_100000210202 [1,2,0,0,0,0|0,0,1]=4 8423 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [1,2,0,0,0,0|0,0,1]=4 8424 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [1,2,0,0,0,0|0,0,1]=4 8425 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [1,2,0,0,0,0|0,0,1]=4 8426 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [1,2,0,0,0,0|0,0,1]=4 8427 B11R1.17 CCNCc1ccccc1Cl 207a_100015525214_100000210073 [1,2,0,0,0,0|0,0,1]=4 8428 B11R1.17 CCNCc1ccccc1Cl 2230a_100000174879_100000210202 [1,2,0,0,0,0|0,0,1]=4 8429 B11R1.17 CCNCc1ccccc1Cl 2230a_100015525214_100000187162 [1,2,0,0,0,0|0,0,1]=4 8430 B11R1.17 CCNCc1ccccc1Cl 270004a_100015525214_100000210073 [1,2,0,0,0,0|0,0,1]=4 8431 B11R1.17 CCNCc1ccccc1Cl 34a_100000174879_100000210202 [1,2,0,0,0,0|0,0,1]=4 8432 B11R1.17 CCNCc1ccccc1F 207a_100015525214_100000210811 [1,2,0,0,0,0|0,0,1]=4 8433 B11R1.17 CCNCc1ccccc1F 2230a_100015525214_100000211605 [1,2,0,0,0,0|0,0,1]=4 8434 B11R1.17 CCNCc1ccccc1F 270004a_100015525214_100000210811 [1,2,0,0,0,0|0,0,1]=4 8435 B11R1.17 CCNCc1ccccc1F 34a_100000174869_100000210202 [1,2,0,0,0,0|0,0,1]=4 8436 B11R1.17 CCNCc1ccccc1I 207a_100015525214_100000010305 [1,2,0,0,0,0|0,0,1]=4 8437 B11R1.17 CCNCc1ccccc1I 2230a_100015525214_100011215278 [1,2,0,0,0,0|0,0,1]=4 8438 B11R1.17 CCNCc1ccccc1I 270004a_100015525214_100000010305 [1,2,0,0,0,0|0,0,1]=4 8439 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [1,2,0,0,0,0|0,0,1]=4 8440 B11R1.17 CNCCc1ccccc1Br 2230a_100000747383_200000210301 [1,2,0,0,0,0|0,0,1]=4 8441 B11R1.17 CNCCc1ccccc1Br 2230a_106832991635_100012161201 [1,2,0,0,0,0|0,0,1]=4 8442 B11R1.17 CNCCc1ccccc1Br 34a_100000747383_200000210301 [1,2,0,0,0,0|0,0,1]=4 8443 B11R1.17 CNCCc1ccccc1Br 34a_100102657272_100012161201 [1,2,0,0,0,0|0,0,1]=4 8444 B11R1.17 CNCCc1ccccc1Br 7a_106832991635_100012161201 [1,2,0,0,0,0|0,0,1]=4 8445 B11R1.17 CNCCc1ccccc1C 2230a_100000685071_200000210301 [1,2,0,0,0,0|0,0,1]=4 8446 B11R1.17 CNCCc1ccccc1C 2230a_106832991635_100011713688 [1,2,0,0,0,0|0,0,1]=4 8447 B11R1.17 CNCCc1ccccc1C 34a_100000685071_200000210301 [1,2,0,0,0,0|0,0,1]=4 8448 B11R1.17 CNCCc1ccccc1C 34a_100102657272_100011713688 [1,2,0,0,0,0|0,0,1]=4 8449 B11R1.17 CNCCc1ccccc1C 7a_106832991635_100011713688 [1,2,0,0,0,0|0,0,1]=4 8450 B11R1.17 CNCCc1ccccc1Cl 2230a_100011207228_200000210301 [1,2,0,0,0,0|0,0,1]=4 8451 B11R1.17 CNCCc1ccccc1Cl 2230a_106832991635_100011713703 [1,2,0,0,0,0|0,0,1]=4 8452 B11R1.17 CNCCc1ccccc1Cl 270004a_106832991635_200011713468 [1,2,0,0,0,0|0,0,1]=4 8453 B11R1.17 CNCCc1ccccc1Cl 34a_100011207228_200000210301 [1,2,0,0,0,0|0,0,1]=4 8454 B11R1.17 CNCCc1ccccc1Cl 34a_100102657272_100011713703 [1,2,0,0,0,0|0,0,1]=4 8455 B11R1.17 CNCCc1ccccc1Cl 7a_106832991635_100011713703 [1,2,0,0,0,0|0,0,1]=4 8456 B11R1.17 CNCCc1ccccc1F 2230a_100000185272_200000210301 [1,2,0,0,0,0|0,0,1]=4 8457 B11R1.17 CNCCc1ccccc1F 2230a_106832991635_100011713696 [1,2,0,0,0,0|0,0,1]=4 8458 B11R1.17 CNCCc1ccccc1F 34a_100000185272_200000210301 [1,2,0,0,0,0|0,0,1]=4 8459 B11R1.17 CNCCc1ccccc1F 34a_100102657272_100000720011 [1,2,0,0,0,0|0,0,1]=4 8460 B11R1.17 CNCCc1ccccc1F 7a_106832991635_100000720011 [1,2,0,0,0,0|0,0,1]=4 8461 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [1,2,0,0,0,0|0,0,1]=4 8462 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [1,2,0,0,0,0|0,0,1]=4 8463 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [1,2,0,0,0,0|0,0,1]=4 8464 B11R1.17 Cc1ccccc1CCN[13CH3] 2230a_100000685071_200025704644 [1,2,0,0,0,0|0,0,1]=4 8465 B11R1.17 Cc1ccccc1CCN[13CH3] 34a_100000685071_200025704644 [1,2,0,0,0,0|0,0,1]=4 8466 B11R1.17 Cc1ccccc1CNCF 34a_100000174972_100015361967 [1,2,0,0,0,0|0,0,1]=4 8467 B11R1.17 FCNCc1ccccc1Br 34a_100000689332_100015361967 [1,2,0,0,0,0|0,0,1]=4 8468 B11R1.17 FCNCc1ccccc1Cl 34a_100000174879_100015361967 [1,2,0,0,0,0|0,0,1]=4 8469 B11R1.17 FCNCc1ccccc1F 34a_100000174869_100015361967 [1,2,0,0,0,0|0,0,1]=4 8470 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [1,2,0,0,0,0|0,0,1]=4 8471 B11R1.17 [13CH3]NCCc1ccccc1Br 2230a_100000747383_200025704644 [1,2,0,0,0,0|0,0,1]=4 8472 B11R1.17 [13CH3]NCCc1ccccc1Br 34a_100000747383_200025704644 [1,2,0,0,0,0|0,0,1]=4 8473 B11R1.17 [13CH3]NCCc1ccccc1Cl 2230a_100011207228_200025704644 [1,2,0,0,0,0|0,0,1]=4 8474 B11R1.17 [13CH3]NCCc1ccccc1Cl 34a_100011207228_200025704644 [1,2,0,0,0,0|0,0,1]=4 8475 B11R1.17 [13CH3]NCCc1ccccc1F 2230a_100000185272_200025704644 [1,2,0,0,0,0|0,0,1]=4 8476 B11R1.17 [13CH3]NCCc1ccccc1F 34a_100000185272_200025704644 [1,2,0,0,0,0|0,0,1]=4 8477 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [1,2,0,0,0,0|0,0,1]=4 8478 B11R1.41 C#Cc1ccccc1CNC 34a_100020634229_200000210301 [1,2,0,0,0,0|0,0,1]=4 8479 B11R1.41 C#Cc1ccccc1CN[13CH3] 34a_100020634229_200025704644 [1,2,0,0,0,0|0,0,1]=4 8480 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [1,2,0,0,0,0|1,0,0]=4 8481 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [1,2,0,0,0,0|1,0,0]=4 8482 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [1,2,0,0,0,0|1,0,0]=4 8483 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [1,2,0,0,0,0|1,0,0]=4 8484 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [1,2,0,0,0,0|0,0,1]=4 8485 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [1,2,0,0,0,0|1,0,0]=4 8486 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [1,2,0,0,0,0|1,0,0]=4 8487 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [1,2,0,0,0,0|1,0,0]=4 8488 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [1,2,0,0,0,0|1,0,0]=4 8489 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [1,2,0,0,0,0|1,0,0]=4 8490 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [1,2,0,0,0,0|1,0,0]=4 8491 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [1,2,0,0,0,0|1,0,0]=4 8492 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [1,2,0,0,0,0|1,0,0]=4 8493 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [1,2,0,0,0,0|1,0,0]=4 8494 B11R1.41 CCc1ccccc1CNC 207a_100102657272_100011219594 [1,2,0,0,0,0|0,0,1]=4 8495 B11R1.41 CCc1ccccc1CNC 270004a_106832991635_100011219594 [1,2,0,0,0,0|0,0,1]=4 8496 B11R1.41 CNCc1ccccc1C#N 2230a_106832991635_100000181865 [1,2,0,0,0,0|0,0,1]=4 8497 B11R1.41 CNCc1ccccc1C#N 34a_100016989011_200000210301 [1,2,0,0,0,0|0,0,1]=4 8498 B11R1.41 CNCc1ccccc1C#N 34a_100102657272_100000181865 [1,2,0,0,0,0|0,0,1]=4 8499 B11R1.41 CNCc1ccccc1C#N 7a_106832991635_100000181865 [1,2,0,0,0,0|0,0,1]=4 8500 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [1,2,0,0,0,0|0,0,1]=4 8501 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [1,2,0,0,0,0|0,0,1]=4 8502 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [1,2,0,0,0,0|0,0,1]=4 8503 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [1,2,0,0,0,0|0,0,1]=4 8504 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [1,2,0,0,0,0|0,0,1]=4 8505 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [1,2,0,0,0,0|0,0,1]=4 8506 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [1,2,0,0,0,0|0,0,1]=4 8507 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [1,2,0,0,0,0|0,0,1]=4 8508 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [1,2,0,0,0,0|0,0,1]=4 8509 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [1,2,0,0,0,0|0,0,1]=4 8510 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [1,2,0,0,0,0|0,0,1]=4 8511 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [1,2,0,0,0,0|0,0,1]=4 8512 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [1,2,0,0,0,0|0,0,1]=4 8513 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [1,2,0,0,0,0|0,0,1]=4 8514 B11R1.41 CNCc1ccccc1SC 207a_100102657272_100011217347 [1,2,0,0,0,0|0,0,1]=4 8515 B11R1.41 CNCc1ccccc1SC 2230a_106832991635_100000699184 [1,2,0,0,0,0|0,0,1]=4 8516 B11R1.41 CNCc1ccccc1SC 270004a_106832991635_100011217347 [1,2,0,0,0,0|0,0,1]=4 8517 B11R1.41 CNCc1ccccc1SC 34a_100102657272_100000699184 [1,2,0,0,0,0|0,0,1]=4 8518 B11R1.41 CNCc1ccccc1SC 34a_102495365025_200000210301 [1,2,0,0,0,0|0,0,1]=4 8519 B11R1.41 CNCc1ccccc1SC 62a_100000184654_200000210301 [1,2,0,0,0,0|0,0,1]=4 8520 B11R1.41 CNCc1ccccc1SC 62a_200000210301_100000184654 [1,2,0,0,0,0|0,0,1]=4 8521 B11R1.41 CNCc1ccccc1SC 7a_106832991635_100000699184 [1,2,0,0,0,0|0,0,1]=4 8522 B11R1.41 CNCc1ccccc1S[13CH3] 62a_100000184654_200025704644 [1,2,0,0,0,0|0,0,1]=4 8523 B11R1.41 CNCc1ccccc1S[13CH3] 62a_200025704644_100000184654 [1,2,0,0,0,0|0,0,1]=4 8524 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [1,2,0,0,0,0|0,0,1]=4 8525 B11R1.41 CSc1ccccc1CN[13CH3] 34a_102495365025_200025704644 [1,2,0,0,0,0|0,0,1]=4 8526 B11R1.41 [13CH3]NCc1ccccc1C#N 34a_100016989011_200025704644 [1,2,0,0,0,0|0,0,1]=4 8527 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [1,2,0,0,0,0|1,0,0]=4 8528 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [1,2,0,0,0,0|1,0,0]=4 8529 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [1,2,0,0,0,0|1,0,0]=4 8530 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [1,2,0,0,0,0|1,0,0]=4 8531 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [1,2,0,0,0,0|1,0,0]=4 8532 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [1,2,0,0,0,0|1,0,0]=4 8533 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100000184654_200000210301 [1,2,0,0,0,0|0,0,1]=4 8534 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100102631434_100000184730 [1,2,0,0,0,0|0,0,1]=4 8535 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100000184654_200000210301 [1,2,0,0,0,0|0,0,1]=4 8536 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100102631434_100000184730 [1,2,0,0,0,0|0,0,1]=4 8537 B11R1.86 CN(C)Cc1ccccc1Br 270004a_100102631434_100000211189 [1,2,0,0,0,0|0,0,1]=4 8538 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100000184507_200000210301 [1,2,0,0,0,0|0,0,1]=4 8539 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100102631434_100000187162 [1,2,0,0,0,0|0,0,1]=4 8540 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100000184507_200000210301 [1,2,0,0,0,0|0,0,1]=4 8541 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100102631434_100000187162 [1,2,0,0,0,0|0,0,1]=4 8542 B11R1.86 CN(C)Cc1ccccc1Cl 270004a_100102631434_100000210073 [1,2,0,0,0,0|0,0,1]=4 8543 B11R1.86 CN(C)Cc1ccccc1F 2230a_100000742528_200000210301 [1,2,0,0,0,0|0,0,1]=4 8544 B11R1.86 CN(C)Cc1ccccc1F 2230a_100102631434_100000211605 [1,2,0,0,0,0|0,0,1]=4 8545 B11R1.86 CN(C)Cc1ccccc1F 269982a_100000742528_200000210301 [1,2,0,0,0,0|0,0,1]=4 8546 B11R1.86 CN(C)Cc1ccccc1F 269982a_100102631434_100000211605 [1,2,0,0,0,0|0,0,1]=4 8547 B11R1.86 CN(C)Cc1ccccc1F 270004a_100102631434_100000210811 [1,2,0,0,0,0|0,0,1]=4 8548 B11R1.86 CN(C)Cc1ccccc1F 34a_100000742528_200000210301 [1,2,0,0,0,0|0,0,1]=4 8549 B11R1.86 CN(C)Cc1ccccc1I 2230a_100102631434_100011215278 [1,2,0,0,0,0|0,0,1]=4 8550 B11R1.86 CN(C)Cc1ccccc1I 269982a_100102631434_100011215278 [1,2,0,0,0,0|0,0,1]=4 8551 B11R1.86 CN(C)Cc1ccccc1I 270004a_100102631434_100000010305 [1,2,0,0,0,0|0,0,1]=4 8552 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [1,2,0,0,0,0|0,0,1]=4 8553 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [1,2,0,0,0,0|0,0,1]=4 8554 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [1,2,0,0,0,0|0,0,1]=4 8555 B11R1.86 CN([13CH3])Cc1ccccc1Br 2230a_100000184654_200025704644 [1,2,0,0,0,0|0,0,1]=4 8556 B11R1.86 CN([13CH3])Cc1ccccc1Br 269982a_100000184654_200025704644 [1,2,0,0,0,0|0,0,1]=4 8557 B11R1.86 CN([13CH3])Cc1ccccc1Cl 2230a_100000184507_200025704644 [1,2,0,0,0,0|0,0,1]=4 8558 B11R1.86 CN([13CH3])Cc1ccccc1Cl 269982a_100000184507_200025704644 [1,2,0,0,0,0|0,0,1]=4 8559 B11R1.86 CN([13CH3])Cc1ccccc1F 2230a_100000742528_200025704644 [1,2,0,0,0,0|0,0,1]=4 8560 B11R1.86 CN([13CH3])Cc1ccccc1F 269982a_100000742528_200025704644 [1,2,0,0,0,0|0,0,1]=4 8561 B11R1.86 CN([13CH3])Cc1ccccc1F 34a_100000742528_200025704644 [1,2,0,0,0,0|0,0,1]=4 8562 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [1,2,0,0,0,0|0,0,1]=4 8563 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [1,2,0,0,0,0|0,0,1]=4 8564 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [1,2,0,0,0,0|0,0,1]=4 8565 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [1,2,0,0,0,0|0,0,1]=4 8566 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [1,2,0,0,0,0|0,0,1]=4 8567 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [1,2,0,0,0,0|0,0,1]=4 8568 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [1,2,0,0,0,0|0,0,1]=4 8569 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [1,2,0,0,0,0|0,0,1]=4 8570 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [1,2,0,0,0,0|0,0,1]=4 8571 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [1,2,0,0,0,0|1,0,0]=4 8572 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [1,2,0,0,0,0|1,0,0]=4 8573 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [1,2,0,0,0,0|1,0,0]=4 8574 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [1,2,0,0,0,0|1,0,0]=4 8575 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [1,2,0,0,0,0|1,0,0]=4 8576 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [1,2,0,0,0,0|1,0,0]=4 8577 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [1,2,0,0,0,0|1,0,0]=4 8578 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [1,2,0,0,0,0|1,0,0]=4 8579 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [1,2,0,0,0,0|1,0,0]=4 8580 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [1,2,0,0,0,0|1,0,0]=4 8581 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [1,2,0,0,0,0|1,0,0]=4 8582 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [1,2,0,0,0,0|1,0,0]=4 8583 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [1,2,0,0,0,0|1,0,0]=4 8584 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [1,2,0,0,0,0|1,0,0]=4 8585 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [1,2,0,0,0,0|1,0,0]=4 8586 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [1,2,0,0,0,0|1,0,0]=4 8587 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [1,2,0,0,0,0|1,0,0]=4 8588 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [1,2,0,0,0,0|1,0,0]=4 8589 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [1,2,0,0,0,0|1,0,0]=4 8590 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [1,2,0,0,0,0|1,0,0]=4 8591 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [1,2,0,0,0,0|1,0,0]=4 8592 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [1,2,0,0,0,0|1,0,0]=4 8593 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [1,2,0,0,0,0|1,0,0]=4 8594 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [1,2,0,0,0,0|1,0,0]=4 8595 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [1,2,0,0,0,0|1,0,0]=4 8596 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [1,2,0,0,0,0|1,0,0]=4 8597 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [1,2,0,0,0,0|1,0,0]=4 8598 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [1,2,0,0,0,0|1,0,0]=4 8599 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [1,2,0,0,0,0|1,0,0]=4 8600 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [1,2,0,0,0,0|1,0,0]=4 8601 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [1,2,0,0,0,0|1,0,0]=4 8602 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [1,2,0,0,0,0|1,0,0]=4 8603 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [1,2,0,0,0,0|1,0,0]=4 8604 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [1,2,0,0,0,0|1,0,0]=4 8605 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [1,2,0,0,0,0|1,0,0]=4 8606 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,2,0,0,0,0|1,0,0]=4 8607 B11R1.182 CNCc1cc(ccc1Br)Br 207a_100102657272_100011266429 [1,2,0,0,0,0|0,0,1]=4 8608 B11R1.182 CNCc1cc(ccc1Br)Br 2230a_106832991635_100011982794 [1,2,0,0,0,0|0,0,1]=4 8609 B11R1.182 CNCc1cc(ccc1Br)Br 26a_100102657272_100011220040 [1,2,0,0,0,0|0,0,1]=4 8610 B11R1.182 CNCc1cc(ccc1Br)Br 270004a_106832991635_100011266429 [1,2,0,0,0,0|0,0,1]=4 8611 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100000707832_200000210301 [1,2,0,0,0,0|0,0,1]=4 8612 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100102657272_100011982794 [1,2,0,0,0,0|0,0,1]=4 8613 B11R1.182 CNCc1cc(ccc1Br)Br 7a_106832991635_100011982794 [1,2,0,0,0,0|0,0,1]=4 8614 B11R1.182 CNCc1cc(ccc1Br)C 207a_100102657272_100011551863 [1,2,0,0,0,0|0,0,1]=4 8615 B11R1.182 CNCc1cc(ccc1Br)C 26a_100102657272_100012002257 [1,2,0,0,0,0|0,0,1]=4 8616 B11R1.182 CNCc1cc(ccc1Br)C 270004a_106832991635_100011551863 [1,2,0,0,0,0|0,0,1]=4 8617 B11R1.182 CNCc1cc(ccc1Br)Cl 207a_100102657272_100000746314 [1,2,0,0,0,0|0,0,1]=4 8618 B11R1.182 CNCc1cc(ccc1Br)Cl 2230a_106832991635_100000733903 [1,2,0,0,0,0|0,0,1]=4 8619 B11R1.182 CNCc1cc(ccc1Br)Cl 26a_100102657272_100012339455 [1,2,0,0,0,0|0,0,1]=4 8620 B11R1.182 CNCc1cc(ccc1Br)Cl 270004a_106832991635_100000746314 [1,2,0,0,0,0|0,0,1]=4 8621 B11R1.182 CNCc1cc(ccc1Br)Cl 34a_100102657272_100000733903 [1,2,0,0,0,0|0,0,1]=4 8622 B11R1.182 CNCc1cc(ccc1Br)Cl 7a_106832991635_100000733903 [1,2,0,0,0,0|0,0,1]=4 8623 B11R1.182 CNCc1cc(ccc1Br)F 207a_100102657272_100000766564 [1,2,0,0,0,0|0,0,1]=4 8624 B11R1.182 CNCc1cc(ccc1Br)F 2230a_100000742738_200000210301 [1,2,0,0,0,0|0,0,1]=4 8625 B11R1.182 CNCc1cc(ccc1Br)F 2230a_106832991635_100000736370 [1,2,0,0,0,0|0,0,1]=4 8626 B11R1.182 CNCc1cc(ccc1Br)F 26a_100102657272_100000690578 [1,2,0,0,0,0|0,0,1]=4 8627 B11R1.182 CNCc1cc(ccc1Br)F 270004a_106832991635_100000766564 [1,2,0,0,0,0|0,0,1]=4 8628 B11R1.182 CNCc1cc(ccc1Br)F 34a_100000742738_200000210301 [1,2,0,0,0,0|0,0,1]=4 8629 B11R1.182 CNCc1cc(ccc1Br)F 34a_100102657272_100000736370 [1,2,0,0,0,0|0,0,1]=4 8630 B11R1.182 CNCc1cc(ccc1Br)F 7a_106832991635_100000736370 [1,2,0,0,0,0|0,0,1]=4 8631 B11R1.182 CNCc1cc(ccc1Br)I 207a_100102657272_100010185652 [1,2,0,0,0,0|0,0,1]=4 8632 B11R1.182 CNCc1cc(ccc1Br)I 2230a_106832991635_100012355412 [1,2,0,0,0,0|0,0,1]=4 8633 B11R1.182 CNCc1cc(ccc1Br)I 26a_100102657272_100012356990 [1,2,0,0,0,0|0,0,1]=4 8634 B11R1.182 CNCc1cc(ccc1Br)I 34a_100102657272_100012355412 [1,2,0,0,0,0|0,0,1]=4 8635 B11R1.182 CNCc1cc(ccc1Br)I 7a_106832991635_100012355412 [1,2,0,0,0,0|0,0,1]=4 8636 B11R1.182 CNCc1cc(ccc1C)Br 207a_100102657272_100011361606 [1,2,0,0,0,0|0,0,1]=4 8637 B11R1.182 CNCc1cc(ccc1C)Br 26a_100102657272_100000685420 [1,2,0,0,0,0|0,0,1]=4 8638 B11R1.182 CNCc1cc(ccc1C)Br 270004a_106832991635_100011361606 [1,2,0,0,0,0|0,0,1]=4 8639 B11R1.182 CNCc1cc(ccc1C)C 207a_100102657272_100000211343 [1,2,0,0,0,0|0,0,1]=4 8640 B11R1.182 CNCc1cc(ccc1C)C 2230a_106832991635_100000184699 [1,2,0,0,0,0|0,0,1]=4 8641 B11R1.182 CNCc1cc(ccc1C)C 270004a_106832991635_100000211343 [1,2,0,0,0,0|0,0,1]=4 8642 B11R1.182 CNCc1cc(ccc1C)C 34a_100000174964_200000210301 [1,2,0,0,0,0|0,0,1]=4 8643 B11R1.182 CNCc1cc(ccc1C)C 34a_100102657272_100000184699 [1,2,0,0,0,0|0,0,1]=4 8644 B11R1.182 CNCc1cc(ccc1C)C 7a_106832991635_100000184699 [1,2,0,0,0,0|0,0,1]=4 8645 B11R1.182 CNCc1cc(ccc1C)Cl 207a_100102657272_100011551331 [1,2,0,0,0,0|0,0,1]=4 8646 B11R1.182 CNCc1cc(ccc1C)Cl 2230a_106832991635_100012186985 [1,2,0,0,0,0|0,0,1]=4 8647 B11R1.182 CNCc1cc(ccc1C)Cl 270004a_106832991635_100011551331 [1,2,0,0,0,0|0,0,1]=4 8648 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100000717755_200000210301 [1,2,0,0,0,0|0,0,1]=4 8649 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100102657272_100012186985 [1,2,0,0,0,0|0,0,1]=4 8650 B11R1.182 CNCc1cc(ccc1C)Cl 7a_106832991635_100012186985 [1,2,0,0,0,0|0,0,1]=4 8651 B11R1.182 CNCc1cc(ccc1C)F 207a_100102657272_100000697687 [1,2,0,0,0,0|0,0,1]=4 8652 B11R1.182 CNCc1cc(ccc1C)F 2230a_106832991635_100000709795 [1,2,0,0,0,0|0,0,1]=4 8653 B11R1.182 CNCc1cc(ccc1C)F 270004a_106832991635_100000697687 [1,2,0,0,0,0|0,0,1]=4 8654 B11R1.182 CNCc1cc(ccc1C)F 34a_100011217291_200000210301 [1,2,0,0,0,0|0,0,1]=4 8655 B11R1.182 CNCc1cc(ccc1C)F 34a_100102657272_100000709795 [1,2,0,0,0,0|0,0,1]=4 8656 B11R1.182 CNCc1cc(ccc1C)F 7a_106832991635_100000709795 [1,2,0,0,0,0|0,0,1]=4 8657 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [1,2,0,0,0,0|0,0,1]=4 8658 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [1,2,0,0,0,0|0,0,1]=4 8659 B11R1.182 CNCc1cc(ccc1Cl)Br 207a_100102657272_100000746309 [1,2,0,0,0,0|0,0,1]=4 8660 B11R1.182 CNCc1cc(ccc1Cl)Br 2230a_106832991635_100000763347 [1,2,0,0,0,0|0,0,1]=4 8661 B11R1.182 CNCc1cc(ccc1Cl)Br 26a_100102657272_100000738945 [1,2,0,0,0,0|0,0,1]=4 8662 B11R1.182 CNCc1cc(ccc1Cl)Br 270004a_106832991635_100000746309 [1,2,0,0,0,0|0,0,1]=4 8663 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100025772652_200000210301 [1,2,0,0,0,0|0,0,1]=4 8664 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100102657272_100000763347 [1,2,0,0,0,0|0,0,1]=4 8665 B11R1.182 CNCc1cc(ccc1Cl)Br 7a_106832991635_100000763347 [1,2,0,0,0,0|0,0,1]=4 8666 B11R1.182 CNCc1cc(ccc1Cl)C 207a_100102657272_100011551332 [1,2,0,0,0,0|0,0,1]=4 8667 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_100025705715_200000210301 [1,2,0,0,0,0|0,0,1]=4 8668 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_106832991635_100009871730 [1,2,0,0,0,0|0,0,1]=4 8669 B11R1.182 CNCc1cc(ccc1Cl)C 26a_100102657272_100000211493 [1,2,0,0,0,0|0,0,1]=4 8670 B11R1.182 CNCc1cc(ccc1Cl)C 270004a_106832991635_100011551332 [1,2,0,0,0,0|0,0,1]=4 8671 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100025705715_200000210301 [1,2,0,0,0,0|0,0,1]=4 8672 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100102657272_100009871730 [1,2,0,0,0,0|0,0,1]=4 8673 B11R1.182 CNCc1cc(ccc1Cl)C 7a_106832991635_100009871730 [1,2,0,0,0,0|0,0,1]=4 8674 B11R1.182 CNCc1cc(ccc1Cl)Cl 207a_100102657272_100000746308 [1,2,0,0,0,0|0,0,1]=4 8675 B11R1.182 CNCc1cc(ccc1Cl)Cl 2230a_106832991635_100000756322 [1,2,0,0,0,0|0,0,1]=4 8676 B11R1.182 CNCc1cc(ccc1Cl)Cl 26a_100102657272_100000211422 [1,2,0,0,0,0|0,0,1]=4 8677 B11R1.182 CNCc1cc(ccc1Cl)Cl 270004a_106832991635_100000746308 [1,2,0,0,0,0|0,0,1]=4 8678 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102657272_100000756322 [1,2,0,0,0,0|0,0,1]=4 8679 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102946428_200000210301 [1,2,0,0,0,0|0,0,1]=4 8680 B11R1.182 CNCc1cc(ccc1Cl)Cl 7a_106832991635_100000756322 [1,2,0,0,0,0|0,0,1]=4 8681 B11R1.182 CNCc1cc(ccc1Cl)F 207a_100102657272_100011218309 [1,2,0,0,0,0|0,0,1]=4 8682 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_100011830483_200000210301 [1,2,0,0,0,0|0,0,1]=4 8683 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_106832991635_100000709952 [1,2,0,0,0,0|0,0,1]=4 8684 B11R1.182 CNCc1cc(ccc1Cl)F 26a_100102657272_100000692107 [1,2,0,0,0,0|0,0,1]=4 8685 B11R1.182 CNCc1cc(ccc1Cl)F 270004a_106832991635_100011218309 [1,2,0,0,0,0|0,0,1]=4 8686 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100011830483_200000210301 [1,2,0,0,0,0|0,0,1]=4 8687 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100102657272_100000709952 [1,2,0,0,0,0|0,0,1]=4 8688 B11R1.182 CNCc1cc(ccc1Cl)F 7a_106832991635_100000709952 [1,2,0,0,0,0|0,0,1]=4 8689 B11R1.182 CNCc1cc(ccc1Cl)I 207a_100102657272_100010254384 [1,2,0,0,0,0|0,0,1]=4 8690 B11R1.182 CNCc1cc(ccc1Cl)I 2230a_106832991635_100010188191 [1,2,0,0,0,0|0,0,1]=4 8691 B11R1.182 CNCc1cc(ccc1Cl)I 34a_100102657272_100010188191 [1,2,0,0,0,0|0,0,1]=4 8692 B11R1.182 CNCc1cc(ccc1Cl)I 7a_106832991635_100010188191 [1,2,0,0,0,0|0,0,1]=4 8693 B11R1.182 CNCc1cc(ccc1F)Br 207a_100102657272_100000211465 [1,2,0,0,0,0|0,0,1]=4 8694 B11R1.182 CNCc1cc(ccc1F)Br 2230a_106832991635_100000736399 [1,2,0,0,0,0|0,0,1]=4 8695 B11R1.182 CNCc1cc(ccc1F)Br 26a_100102657272_100000686035 [1,2,0,0,0,0|0,0,1]=4 8696 B11R1.182 CNCc1cc(ccc1F)Br 270004a_106832991635_100000211465 [1,2,0,0,0,0|0,0,1]=4 8697 B11R1.182 CNCc1cc(ccc1F)Br 34a_100009815772_200000210301 [1,2,0,0,0,0|0,0,1]=4 8698 B11R1.182 CNCc1cc(ccc1F)Br 34a_100102657272_100000736399 [1,2,0,0,0,0|0,0,1]=4 8699 B11R1.182 CNCc1cc(ccc1F)Br 7a_106832991635_100000736399 [1,2,0,0,0,0|0,0,1]=4 8700 B11R1.182 CNCc1cc(ccc1F)C 207a_100102657272_100000756917 [1,2,0,0,0,0|0,0,1]=4 8701 B11R1.182 CNCc1cc(ccc1F)C 2230a_106832991635_100011260760 [1,2,0,0,0,0|0,0,1]=4 8702 B11R1.182 CNCc1cc(ccc1F)C 270004a_106832991635_100000756917 [1,2,0,0,0,0|0,0,1]=4 8703 B11R1.182 CNCc1cc(ccc1F)C 34a_100102657272_100011260760 [1,2,0,0,0,0|0,0,1]=4 8704 B11R1.182 CNCc1cc(ccc1F)C 34a_100102693586_200000210301 [1,2,0,0,0,0|0,0,1]=4 8705 B11R1.182 CNCc1cc(ccc1F)C 7a_106832991635_100011260760 [1,2,0,0,0,0|0,0,1]=4 8706 B11R1.182 CNCc1cc(ccc1F)Cl 207a_100102657272_100000745245 [1,2,0,0,0,0|0,0,1]=4 8707 B11R1.182 CNCc1cc(ccc1F)Cl 2230a_106832991635_100000716957 [1,2,0,0,0,0|0,0,1]=4 8708 B11R1.182 CNCc1cc(ccc1F)Cl 270004a_106832991635_100000745245 [1,2,0,0,0,0|0,0,1]=4 8709 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100011211646_200000210301 [1,2,0,0,0,0|0,0,1]=4 8710 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100102657272_100000716957 [1,2,0,0,0,0|0,0,1]=4 8711 B11R1.182 CNCc1cc(ccc1F)Cl 7a_106832991635_100000716957 [1,2,0,0,0,0|0,0,1]=4 8712 B11R1.182 CNCc1cc(ccc1F)F 207a_100102657272_100000740046 [1,2,0,0,0,0|0,0,1]=4 8713 B11R1.182 CNCc1cc(ccc1F)F 2230a_106832991635_100000741279 [1,2,0,0,0,0|0,0,1]=4 8714 B11R1.182 CNCc1cc(ccc1F)F 270004a_106832991635_100000740046 [1,2,0,0,0,0|0,0,1]=4 8715 B11R1.182 CNCc1cc(ccc1F)F 34a_100000752317_200000210301 [1,2,0,0,0,0|0,0,1]=4 8716 B11R1.182 CNCc1cc(ccc1F)F 34a_100102657272_100000741279 [1,2,0,0,0,0|0,0,1]=4 8717 B11R1.182 CNCc1cc(ccc1F)F 7a_106832991635_100000741279 [1,2,0,0,0,0|0,0,1]=4 8718 B11R1.182 CNCc1cc(ccc1F)I 207a_100102657272_100000050626 [1,2,0,0,0,0|0,0,1]=4 8719 B11R1.182 CNCc1cc(ccc1F)I 2230a_106832991635_200010149601 [1,2,0,0,0,0|0,0,1]=4 8720 B11R1.182 CNCc1cc(ccc1F)I 34a_100102657272_200010149601 [1,2,0,0,0,0|0,0,1]=4 8721 B11R1.182 CNCc1cc(ccc1F)I 7a_106832991635_200010149601 [1,2,0,0,0,0|0,0,1]=4 8722 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [1,2,0,0,0,0|0,0,1]=4 8723 B11R1.182 CNCc1cc(ccc1I)Br 207a_100102657272_100010185651 [1,2,0,0,0,0|0,0,1]=4 8724 B11R1.182 CNCc1cc(ccc1I)Br 2230a_106832991635_100012362523 [1,2,0,0,0,0|0,0,1]=4 8725 B11R1.182 CNCc1cc(ccc1I)Br 26a_100102657272_100012344904 [1,2,0,0,0,0|0,0,1]=4 8726 B11R1.182 CNCc1cc(ccc1I)Br 270004a_106832991635_100010185651 [1,2,0,0,0,0|0,0,1]=4 8727 B11R1.182 CNCc1cc(ccc1I)Br 34a_100102657272_100012362523 [1,2,0,0,0,0|0,0,1]=4 8728 B11R1.182 CNCc1cc(ccc1I)Br 7a_106832991635_100012362523 [1,2,0,0,0,0|0,0,1]=4 8729 B11R1.182 CNCc1cc(ccc1I)C 207a_100102657272_100010150105 [1,2,0,0,0,0|0,0,1]=4 8730 B11R1.182 CNCc1cc(ccc1I)C 270004a_106832991635_100010150105 [1,2,0,0,0,0|0,0,1]=4 8731 B11R1.182 CNCc1cc(ccc1I)Cl 207a_100102657272_100010254386 [1,2,0,0,0,0|0,0,1]=4 8732 B11R1.182 CNCc1cc(ccc1I)Cl 2230a_106832991635_100012348826 [1,2,0,0,0,0|0,0,1]=4 8733 B11R1.182 CNCc1cc(ccc1I)Cl 270004a_106832991635_100010254386 [1,2,0,0,0,0|0,0,1]=4 8734 B11R1.182 CNCc1cc(ccc1I)Cl 34a_100102657272_100012348826 [1,2,0,0,0,0|0,0,1]=4 8735 B11R1.182 CNCc1cc(ccc1I)Cl 7a_106832991635_100012348826 [1,2,0,0,0,0|0,0,1]=4 8736 B11R1.182 CNCc1cc(ccc1I)F 207a_100102657272_100010186294 [1,2,0,0,0,0|0,0,1]=4 8737 B11R1.182 CNCc1cc(ccc1I)F 2230a_106832991635_100010149606 [1,2,0,0,0,0|0,0,1]=4 8738 B11R1.182 CNCc1cc(ccc1I)F 270004a_106832991635_100010186294 [1,2,0,0,0,0|0,0,1]=4 8739 B11R1.182 CNCc1cc(ccc1I)F 34a_100102657272_100010149606 [1,2,0,0,0,0|0,0,1]=4 8740 B11R1.182 CNCc1cc(ccc1I)F 7a_106832991635_100010149606 [1,2,0,0,0,0|0,0,1]=4 8741 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [1,2,0,0,0,0|0,0,1]=4 8742 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [1,2,0,0,0,0|0,0,1]=4 8743 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [1,2,0,0,0,0|0,0,1]=4 8744 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [1,2,0,0,0,0|0,0,1]=4 8745 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,2,0,0,0,0|0,0,1]=4 8746 B11R1.182 Cc1ccc(c(c1)CN[13CH3])C 34a_100000174964_200025704644 [1,2,0,0,0,0|0,0,1]=4 8747 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 2230a_100025705715_200025704644 [1,2,0,0,0,0|0,0,1]=4 8748 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 34a_100025705715_200025704644 [1,2,0,0,0,0|0,0,1]=4 8749 B11R1.182 Cc1ccc(c(c1)CN[13CH3])F 34a_100102693586_200025704644 [1,2,0,0,0,0|0,0,1]=4 8750 B11R1.182 Cc1ccc(cc1CN[13CH3])Cl 34a_100000717755_200025704644 [1,2,0,0,0,0|0,0,1]=4 8751 B11R1.182 Cc1ccc(cc1CN[13CH3])F 34a_100011217291_200025704644 [1,2,0,0,0,0|0,0,1]=4 8752 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [1,2,0,0,0,0|0,0,1]=4 8753 B11R1.182 [13CH3]NCc1cc(ccc1Br)Br 34a_100000707832_200025704644 [1,2,0,0,0,0|0,0,1]=4 8754 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 2230a_100000742738_200025704644 [1,2,0,0,0,0|0,0,1]=4 8755 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 34a_100000742738_200025704644 [1,2,0,0,0,0|0,0,1]=4 8756 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Br 34a_100025772652_200025704644 [1,2,0,0,0,0|0,0,1]=4 8757 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Cl 34a_100102946428_200025704644 [1,2,0,0,0,0|0,0,1]=4 8758 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 2230a_100011830483_200025704644 [1,2,0,0,0,0|0,0,1]=4 8759 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 34a_100011830483_200025704644 [1,2,0,0,0,0|0,0,1]=4 8760 B11R1.182 [13CH3]NCc1cc(ccc1F)Br 34a_100009815772_200025704644 [1,2,0,0,0,0|0,0,1]=4 8761 B11R1.182 [13CH3]NCc1cc(ccc1F)Cl 34a_100011211646_200025704644 [1,2,0,0,0,0|0,0,1]=4 8762 B11R1.182 [13CH3]NCc1cc(ccc1F)F 34a_100000752317_200025704644 [1,2,0,0,0,0|0,0,1]=4 8763 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [1,2,0,0,0,0|0,0,1]=4 8764 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [1,2,0,0,0,0|0,0,1]=4 8765 B11R1.605 CC=Cc1c(cccc1Br)Br 271570a_100016259895_100009994525 [1,2,0,0,0,0|1,0,0]=4 8766 B11R1.605 CC=Cc1c(cccc1Br)Cl 271570a_100016259895_100010214488 [1,2,0,0,0,0|1,0,0]=4 8767 B11R1.605 CC=Cc1c(cccc1Br)F 271570a_100016259895_100011219512 [1,2,0,0,0,0|1,0,0]=4 8768 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [1,2,0,0,0,0|1,0,0]=4 8769 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [1,2,0,0,0,0|1,0,0]=4 8770 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [1,2,0,0,0,0|1,0,0]=4 8771 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [1,2,0,0,0,0|1,0,0]=4 8772 B11R1.605 CC=Cc1c(cccc1Cl)Cl 271570a_100016259895_100000034237 [1,2,0,0,0,0|1,0,0]=4 8773 B11R1.605 CC=Cc1c(cccc1Cl)F 271570a_100016259895_100000050007 [1,2,0,0,0,0|1,0,0]=4 8774 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [1,2,0,0,0,0|1,0,0]=4 8775 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [1,2,0,0,0,0|1,0,0]=4 8776 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [1,2,0,0,0,0|1,0,0]=4 8777 B11R1.605 CC=Cc1c(cccc1F)F 271570a_100016259895_100000693133 [1,2,0,0,0,0|1,0,0]=4 8778 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [1,2,0,0,0,0|1,0,0]=4 8779 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [1,2,0,0,0,0|1,0,0]=4 8780 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [1,2,0,0,0,0|1,0,0]=4 8781 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [1,2,0,0,0,0|1,0,0]=4 8782 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [1,2,0,0,0,0|1,0,0]=4 8783 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [1,2,0,0,0,0|1,0,0]=4 8784 B11R1.605 CNCc1c(cccc1Br)Br 207a_100102657272_100010233043 [1,2,0,0,0,0|0,0,1]=4 8785 B11R1.605 CNCc1c(cccc1Br)Br 26a_100102657272_100000736428 [1,2,0,0,0,0|0,0,1]=4 8786 B11R1.605 CNCc1c(cccc1Br)Br 270004a_106832991635_100010233043 [1,2,0,0,0,0|0,0,1]=4 8787 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [1,2,0,0,0,0|0,0,1]=4 8788 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [1,2,0,0,0,0|0,0,1]=4 8789 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [1,2,0,0,0,0|0,0,1]=4 8790 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [1,2,0,0,0,0|0,0,1]=4 8791 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [1,2,0,0,0,0|0,0,1]=4 8792 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [1,2,0,0,0,0|0,0,1]=4 8793 B11R1.605 CNCc1c(cccc1Br)Cl 207a_100102657272_100011249081 [1,2,0,0,0,0|0,0,1]=4 8794 B11R1.605 CNCc1c(cccc1Br)Cl 2230a_106832991635_100010138402 [1,2,0,0,0,0|0,0,1]=4 8795 B11R1.605 CNCc1c(cccc1Br)Cl 26a_100102657272_100010214474 [1,2,0,0,0,0|0,0,1]=4 8796 B11R1.605 CNCc1c(cccc1Br)Cl 270004a_106832991635_100011249081 [1,2,0,0,0,0|0,0,1]=4 8797 B11R1.605 CNCc1c(cccc1Br)Cl 34a_100102657272_100010138402 [1,2,0,0,0,0|0,0,1]=4 8798 B11R1.605 CNCc1c(cccc1Br)Cl 7a_106832991635_100010138402 [1,2,0,0,0,0|0,0,1]=4 8799 B11R1.605 CNCc1c(cccc1Br)F 207a_100102657272_100000752695 [1,2,0,0,0,0|0,0,1]=4 8800 B11R1.605 CNCc1c(cccc1Br)F 2230a_106832991635_100012145669 [1,2,0,0,0,0|0,0,1]=4 8801 B11R1.605 CNCc1c(cccc1Br)F 26a_100102657272_100009813666 [1,2,0,0,0,0|0,0,1]=4 8802 B11R1.605 CNCc1c(cccc1Br)F 270004a_106832991635_100000752695 [1,2,0,0,0,0|0,0,1]=4 8803 B11R1.605 CNCc1c(cccc1Br)F 34a_100012349121_200000210301 [1,2,0,0,0,0|0,0,1]=4 8804 B11R1.605 CNCc1c(cccc1Br)F 34a_100102657272_100012145669 [1,2,0,0,0,0|0,0,1]=4 8805 B11R1.605 CNCc1c(cccc1Br)F 7a_106832991635_100000696636 [1,2,0,0,0,0|0,0,1]=4 8806 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [1,2,0,0,0,0|0,0,1]=4 8807 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [1,2,0,0,0,0|0,0,1]=4 8808 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [1,2,0,0,0,0|0,0,1]=4 8809 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [1,2,0,0,0,0|0,0,1]=4 8810 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [1,2,0,0,0,0|0,0,1]=4 8811 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [1,2,0,0,0,0|0,0,1]=4 8812 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [1,2,0,0,0,0|0,0,1]=4 8813 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [1,2,0,0,0,0|0,0,1]=4 8814 B11R1.605 CNCc1c(cccc1Cl)Cl 207a_100102657272_100000189306 [1,2,0,0,0,0|0,0,1]=4 8815 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_100000174884_200000210301 [1,2,0,0,0,0|0,0,1]=4 8816 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_106832991635_100000187851 [1,2,0,0,0,0|0,0,1]=4 8817 B11R1.605 CNCc1c(cccc1Cl)Cl 26a_100102657272_100000211709 [1,2,0,0,0,0|0,0,1]=4 8818 B11R1.605 CNCc1c(cccc1Cl)Cl 270004a_106832991635_100000189306 [1,2,0,0,0,0|0,0,1]=4 8819 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100000174884_200000210301 [1,2,0,0,0,0|0,0,1]=4 8820 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100102657272_100000187851 [1,2,0,0,0,0|0,0,1]=4 8821 B11R1.605 CNCc1c(cccc1Cl)Cl 7a_106832991635_100000187851 [1,2,0,0,0,0|0,0,1]=4 8822 B11R1.605 CNCc1c(cccc1Cl)F 207a_100102657272_100000210083 [1,2,0,0,0,0|0,0,1]=4 8823 B11R1.605 CNCc1c(cccc1Cl)F 2230a_106832991635_100000187852 [1,2,0,0,0,0|0,0,1]=4 8824 B11R1.605 CNCc1c(cccc1Cl)F 270004a_106832991635_100000210083 [1,2,0,0,0,0|0,0,1]=4 8825 B11R1.605 CNCc1c(cccc1Cl)F 34a_100000174883_200000210301 [1,2,0,0,0,0|0,0,1]=4 8826 B11R1.605 CNCc1c(cccc1Cl)F 34a_100102657272_100000187852 [1,2,0,0,0,0|0,0,1]=4 8827 B11R1.605 CNCc1c(cccc1Cl)F 7a_106832991635_100000187852 [1,2,0,0,0,0|0,0,1]=4 8828 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [1,2,0,0,0,0|0,0,1]=4 8829 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [1,2,0,0,0,0|0,0,1]=4 8830 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [1,2,0,0,0,0|0,0,1]=4 8831 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [1,2,0,0,0,0|0,0,1]=4 8832 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [1,2,0,0,0,0|0,0,1]=4 8833 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [1,2,0,0,0,0|0,0,1]=4 8834 B11R1.605 CNCc1c(cccc1F)F 207a_100102657272_100000211061 [1,2,0,0,0,0|0,0,1]=4 8835 B11R1.605 CNCc1c(cccc1F)F 2230a_106832991635_100000698325 [1,2,0,0,0,0|0,0,1]=4 8836 B11R1.605 CNCc1c(cccc1F)F 270004a_106832991635_100000211061 [1,2,0,0,0,0|0,0,1]=4 8837 B11R1.605 CNCc1c(cccc1F)F 34a_100000688400_200000210301 [1,2,0,0,0,0|0,0,1]=4 8838 B11R1.605 CNCc1c(cccc1F)F 34a_100102657272_100000698325 [1,2,0,0,0,0|0,0,1]=4 8839 B11R1.605 CNCc1c(cccc1F)F 7a_106832991635_100000698325 [1,2,0,0,0,0|0,0,1]=4 8840 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [1,2,0,0,0,0|0,0,1]=4 8841 B11R1.605 CNCc1c(cccc1I)Br 2230a_106832991635_100010146611 [1,2,0,0,0,0|0,0,1]=4 8842 B11R1.605 CNCc1c(cccc1I)Br 26a_100102657272_100010084509 [1,2,0,0,0,0|0,0,1]=4 8843 B11R1.605 CNCc1c(cccc1I)Br 34a_100102657272_100010146611 [1,2,0,0,0,0|0,0,1]=4 8844 B11R1.605 CNCc1c(cccc1I)Br 7a_106832991635_100010146611 [1,2,0,0,0,0|0,0,1]=4 8845 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [1,2,0,0,0,0|0,0,1]=4 8846 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [1,2,0,0,0,0|0,0,1]=4 8847 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [1,2,0,0,0,0|0,0,1]=4 8848 B11R1.605 CNCc1c(cccc1I)Cl 207a_100102657272_100010147682 [1,2,0,0,0,0|0,0,1]=4 8849 B11R1.605 CNCc1c(cccc1I)Cl 270004a_106832991635_100010147682 [1,2,0,0,0,0|0,0,1]=4 8850 B11R1.605 CNCc1c(cccc1I)F 207a_100102657272_100010178011 [1,2,0,0,0,0|0,0,1]=4 8851 B11R1.605 CNCc1c(cccc1I)F 2230a_106832991635_100010149602 [1,2,0,0,0,0|0,0,1]=4 8852 B11R1.605 CNCc1c(cccc1I)F 270004a_106832991635_100010178011 [1,2,0,0,0,0|0,0,1]=4 8853 B11R1.605 CNCc1c(cccc1I)F 34a_100102657272_100010149602 [1,2,0,0,0,0|0,0,1]=4 8854 B11R1.605 CNCc1c(cccc1I)F 7a_106832991635_100010149602 [1,2,0,0,0,0|0,0,1]=4 8855 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [1,2,0,0,0,0|0,0,1]=4 8856 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [1,2,0,0,0,0|0,0,1]=4 8857 B11R1.605 [13CH3]NCc1c(cccc1Br)F 34a_100012349121_200025704644 [1,2,0,0,0,0|0,0,1]=4 8858 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 2230a_100000174884_200025704644 [1,2,0,0,0,0|0,0,1]=4 8859 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 34a_100000174884_200025704644 [1,2,0,0,0,0|0,0,1]=4 8860 B11R1.605 [13CH3]NCc1c(cccc1Cl)F 34a_100000174883_200025704644 [1,2,0,0,0,0|0,0,1]=4 8861 B11R1.605 [13CH3]NCc1c(cccc1F)F 34a_100000688400_200025704644 [1,2,0,0,0,0|0,0,1]=4 8862 B11R1.24 CCNCc1cccc(c1)Br 207a_100015525214_100000210085 [1,2,0,0,0,0|0,0,1]=4 8863 B11R1.24 CCNCc1cccc(c1)Br 2230a_100000174977_100000210202 [1,2,0,0,0,0|0,0,1]=4 8864 B11R1.24 CCNCc1cccc(c1)Br 2230a_100015525214_100000698116 [1,2,0,0,0,0|0,0,1]=4 8865 B11R1.24 CCNCc1cccc(c1)Br 270004a_100015525214_100000210085 [1,2,0,0,0,0|0,0,1]=4 8866 B11R1.24 CCNCc1cccc(c1)Br 34a_100000174977_100000210202 [1,2,0,0,0,0|0,0,1]=4 8867 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [1,2,0,0,0,0|0,0,1]=4 8868 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [1,2,0,0,0,0|0,0,1]=4 8869 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [1,2,0,0,0,0|0,0,1]=4 8870 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [1,2,0,0,0,0|0,0,1]=4 8871 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [1,2,0,0,0,0|0,0,1]=4 8872 B11R1.24 CCNCc1cccc(c1)Cl 207a_100015525214_100000210801 [1,2,0,0,0,0|0,0,1]=4 8873 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100000174878_100000210202 [1,2,0,0,0,0|0,0,1]=4 8874 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100015525214_100000181238 [1,2,0,0,0,0|0,0,1]=4 8875 B11R1.24 CCNCc1cccc(c1)Cl 270004a_100015525214_100000210801 [1,2,0,0,0,0|0,0,1]=4 8876 B11R1.24 CCNCc1cccc(c1)Cl 34a_100000174878_100000210202 [1,2,0,0,0,0|0,0,1]=4 8877 B11R1.24 CCNCc1cccc(c1)F 207a_100015525214_100000210812 [1,2,0,0,0,0|0,0,1]=4 8878 B11R1.24 CCNCc1cccc(c1)F 2230a_100000174948_100000210202 [1,2,0,0,0,0|0,0,1]=4 8879 B11R1.24 CCNCc1cccc(c1)F 2230a_100015525214_100000230114 [1,2,0,0,0,0|0,0,1]=4 8880 B11R1.24 CCNCc1cccc(c1)F 270004a_100015525214_100000210812 [1,2,0,0,0,0|0,0,1]=4 8881 B11R1.24 CCNCc1cccc(c1)F 34a_100000174948_100000210202 [1,2,0,0,0,0|0,0,1]=4 8882 B11R1.24 CCNCc1cccc(c1)I 207a_100015525214_100000014684 [1,2,0,0,0,0|0,0,1]=4 8883 B11R1.24 CCNCc1cccc(c1)I 2230a_100000106179_100000210202 [1,2,0,0,0,0|0,0,1]=4 8884 B11R1.24 CCNCc1cccc(c1)I 2230a_100015525214_100011218688 [1,2,0,0,0,0|0,0,1]=4 8885 B11R1.24 CCNCc1cccc(c1)I 270004a_100015525214_100000014684 [1,2,0,0,0,0|0,0,1]=4 8886 B11R1.24 CCNCc1cccc(c1)I 34a_100000106179_100000210202 [1,2,0,0,0,0|0,0,1]=4 8887 B11R1.24 CCNCc1cccc(c1)O 207a_100015525214_100000188321 [1,2,0,0,0,0|0,0,1]=4 8888 B11R1.24 CCNCc1cccc(c1)O 2230a_100000743036_100000210202 [1,2,0,0,0,0|0,0,1]=4 8889 B11R1.24 CCNCc1cccc(c1)O 2230a_100015525214_100011660834 [1,2,0,0,0,0|0,0,1]=4 8890 B11R1.24 CCNCc1cccc(c1)O 270004a_100015525214_100000188321 [1,2,0,0,0,0|0,0,1]=4 8891 B11R1.24 CCNCc1cccc(c1)O 271570a_203496583355_100000187426 [1,2,0,0,0,0|0,0,1]=4 8892 B11R1.24 CCNCc1cccc(c1)O 34a_100000743036_100000210202 [1,2,0,0,0,0|0,0,1]=4 8893 B11R1.24 CNCCc1cccc(c1)Br 2230a_100011207229_200000210301 [1,2,0,0,0,0|0,0,1]=4 8894 B11R1.24 CNCCc1cccc(c1)Br 2230a_106832991635_100011740638 [1,2,0,0,0,0|0,0,1]=4 8895 B11R1.24 CNCCc1cccc(c1)Br 34a_100011207229_200000210301 [1,2,0,0,0,0|0,0,1]=4 8896 B11R1.24 CNCCc1cccc(c1)Br 34a_100102657272_100011740638 [1,2,0,0,0,0|0,0,1]=4 8897 B11R1.24 CNCCc1cccc(c1)Br 7a_106832991635_100011740638 [1,2,0,0,0,0|0,0,1]=4 8898 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [1,2,0,0,0,0|0,0,1]=4 8899 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [1,2,0,0,0,0|0,0,1]=4 8900 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [1,2,0,0,0,0|0,0,1]=4 8901 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [1,2,0,0,0,0|0,0,1]=4 8902 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [1,2,0,0,0,0|0,0,1]=4 8903 B11R1.24 CNCCc1cccc(c1)Cl 2230a_100000185263_200000210301 [1,2,0,0,0,0|0,0,1]=4 8904 B11R1.24 CNCCc1cccc(c1)Cl 2230a_106832991635_100011713710 [1,2,0,0,0,0|0,0,1]=4 8905 B11R1.24 CNCCc1cccc(c1)Cl 34a_100000185263_200000210301 [1,2,0,0,0,0|0,0,1]=4 8906 B11R1.24 CNCCc1cccc(c1)Cl 34a_100102657272_100011713710 [1,2,0,0,0,0|0,0,1]=4 8907 B11R1.24 CNCCc1cccc(c1)Cl 7a_106832991635_100011713710 [1,2,0,0,0,0|0,0,1]=4 8908 B11R1.24 CNCCc1cccc(c1)F 2230a_100000205154_200000210301 [1,2,0,0,0,0|0,0,1]=4 8909 B11R1.24 CNCCc1cccc(c1)F 2230a_106832991635_100011217235 [1,2,0,0,0,0|0,0,1]=4 8910 B11R1.24 CNCCc1cccc(c1)F 34a_100000205154_200000210301 [1,2,0,0,0,0|0,0,1]=4 8911 B11R1.24 CNCCc1cccc(c1)F 34a_100102657272_100011217235 [1,2,0,0,0,0|0,0,1]=4 8912 B11R1.24 CNCCc1cccc(c1)F 7a_106832991635_100011217235 [1,2,0,0,0,0|0,0,1]=4 8913 B11R1.24 CNCCc1cccc(c1)O 2230a_100000747277_200000210301 [1,2,0,0,0,0|0,0,1]=4 8914 B11R1.24 CNCCc1cccc(c1)O 34a_100000747277_200000210301 [1,2,0,0,0,0|0,0,1]=4 8915 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [1,2,0,0,0,0|0,0,1]=4 8916 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [1,2,0,0,0,0|0,0,1]=4 8917 B11R1.24 Cc1cccc(c1)CNCF 34a_100000185548_100015361967 [1,2,0,0,0,0|0,0,1]=4 8918 B11R1.24 FCNCc1cccc(c1)Br 34a_100000174977_100015361967 [1,2,0,0,0,0|0,0,1]=4 8919 B11R1.24 FCNCc1cccc(c1)Cl 34a_100000174878_100015361967 [1,2,0,0,0,0|0,0,1]=4 8920 B11R1.24 FCNCc1cccc(c1)F 34a_100000174948_100015361967 [1,2,0,0,0,0|0,0,1]=4 8921 B11R1.24 FCNCc1cccc(c1)I 34a_100000106179_100015361967 [1,2,0,0,0,0|0,0,1]=4 8922 B11R1.24 Oc1cccc(c1)CNCF 34a_100000743036_100015361967 [1,2,0,0,0,0|0,0,1]=4 8923 B11R1.24 [13CH3]NCCc1cccc(c1)Br 2230a_100011207229_200025704644 [1,2,0,0,0,0|0,0,1]=4 8924 B11R1.24 [13CH3]NCCc1cccc(c1)Br 34a_100011207229_200025704644 [1,2,0,0,0,0|0,0,1]=4 8925 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 2230a_100000185263_200025704644 [1,2,0,0,0,0|0,0,1]=4 8926 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 34a_100000185263_200025704644 [1,2,0,0,0,0|0,0,1]=4 8927 B11R1.24 [13CH3]NCCc1cccc(c1)F 2230a_100000205154_200025704644 [1,2,0,0,0,0|0,0,1]=4 8928 B11R1.24 [13CH3]NCCc1cccc(c1)F 34a_100000205154_200025704644 [1,2,0,0,0,0|0,0,1]=4 8929 B11R1.24 [13CH3]NCCc1cccc(c1)O 2230a_100000747277_200025704644 [1,2,0,0,0,0|0,0,1]=4 8930 B11R1.24 [13CH3]NCCc1cccc(c1)O 34a_100000747277_200025704644 [1,2,0,0,0,0|0,0,1]=4 8931 B11R1.34 CC=Cc1cc(cc(c1)Br)Br 271570a_100016259895_100009814770 [1,2,0,0,0,0|1,0,0]=4 8932 B11R1.34 CC=Cc1cc(cc(c1)Br)Cl 271570a_100016259895_100009814755 [1,2,0,0,0,0|1,0,0]=4 8933 B11R1.34 CC=Cc1cc(cc(c1)Br)F 271570a_100016259895_100009814764 [1,2,0,0,0,0|1,0,0]=4 8934 B11R1.34 CC=Cc1cc(cc(c1)Br)N 271570a_100016259895_100009814763 [1,2,0,0,0,0|1,0,0]=4 8935 B11R1.34 CC=Cc1cc(cc(c1)Br)O 271570a_100016259895_100010068917 [1,2,0,0,0,0|1,0,0]=4 8936 B11R1.34 CC=Cc1cc(cc(c1)C)C 271570a_100016259895_100011215608 [1,2,0,0,0,0|1,0,0]=4 8937 B11R1.34 CC=Cc1cc(cc(c1)Cl)C 271570a_100016259895_100010172791 [1,2,0,0,0,0|1,0,0]=4 8938 B11R1.34 CC=Cc1cc(cc(c1)Cl)Cl 271570a_100016259895_100000747138 [1,2,0,0,0,0|1,0,0]=4 8939 B11R1.34 CC=Cc1cc(cc(c1)Cl)F 271570a_100016259895_100013859453 [1,2,0,0,0,0|1,0,0]=4 8940 B11R1.34 CC=Cc1cc(cc(c1)Cl)N 271570a_100016259895_100010147676 [1,2,0,0,0,0|1,0,0]=4 8941 B11R1.34 CC=Cc1cc(cc(c1)Cl)O 271570a_100016259895_100010068924 [1,2,0,0,0,0|1,0,0]=4 8942 B11R1.34 CC=Cc1cc(cc(c1)F)C 271570a_100016259895_100011356977 [1,2,0,0,0,0|1,0,0]=4 8943 B11R1.34 CC=Cc1cc(cc(c1)F)F 271570a_100016259895_100011218498 [1,2,0,0,0,0|1,0,0]=4 8944 B11R1.34 CC=Cc1cc(cc(c1)F)N 271570a_100016259895_100011356972 [1,2,0,0,0,0|1,0,0]=4 8945 B11R1.34 CC=Cc1cc(cc(c1)F)O 271570a_100016259895_100000717995 [1,2,0,0,0,0|1,0,0]=4 8946 B11R1.34 CC=Cc1cc(cc(c1)N)C 271570a_100016259895_100000695972 [1,2,0,0,0,0|1,0,0]=4 8947 B11R1.34 CC=Cc1cc(cc(c1)N)N 271570a_100016259895_100011999608 [1,2,0,0,0,0|1,0,0]=4 8948 B11R1.34 CC=Cc1cc(cc(c1)O)C 271570a_100016259895_100011999630 [1,2,0,0,0,0|1,0,0]=4 8949 B11R1.34 CC=Cc1cc(cc(c1)O)O 271570a_100016259895_100009868816 [1,2,0,0,0,0|1,0,0]=4 8950 B11R1.34 CNCc1cc(cc(c1)Br)Br 207a_100102657272_100000719502 [1,2,0,0,0,0|0,0,1]=4 8951 B11R1.34 CNCc1cc(cc(c1)Br)Br 2230a_100015211796_200000210301 [1,2,0,0,0,0|0,0,1]=4 8952 B11R1.34 CNCc1cc(cc(c1)Br)Br 2230a_106832991635_100011216082 [1,2,0,0,0,0|0,0,1]=4 8953 B11R1.34 CNCc1cc(cc(c1)Br)Br 269862a_106832991636_100000719502 [1,2,0,0,0,0|0,0,1]=4 8954 B11R1.34 CNCc1cc(cc(c1)Br)Br 26a_100102657272_100010167048 [1,2,0,0,0,0|0,0,1]=4 8955 B11R1.34 CNCc1cc(cc(c1)Br)Br 270004a_106832991635_100000719502 [1,2,0,0,0,0|0,0,1]=4 8956 B11R1.34 CNCc1cc(cc(c1)Br)Br 34a_100015211796_200000210301 [1,2,0,0,0,0|0,0,1]=4 8957 B11R1.34 CNCc1cc(cc(c1)Br)Br 34a_100102657272_100011216082 [1,2,0,0,0,0|0,0,1]=4 8958 B11R1.34 CNCc1cc(cc(c1)Br)Br 7a_106832991635_100011216082 [1,2,0,0,0,0|0,0,1]=4 8959 B11R1.34 CNCc1cc(cc(c1)Br)C 207a_100102657272_100000686105 [1,2,0,0,0,0|0,0,1]=4 8960 B11R1.34 CNCc1cc(cc(c1)Br)C 2230a_106832991635_100012348363 [1,2,0,0,0,0|0,0,1]=4 8961 B11R1.34 CNCc1cc(cc(c1)Br)C 269862a_106832991636_100000686105 [1,2,0,0,0,0|0,0,1]=4 8962 B11R1.34 CNCc1cc(cc(c1)Br)C 26a_100102657272_100011999630 [1,2,0,0,0,0|0,0,1]=4 8963 B11R1.34 CNCc1cc(cc(c1)Br)C 270004a_106832991635_100000686105 [1,2,0,0,0,0|0,0,1]=4 8964 B11R1.34 CNCc1cc(cc(c1)Br)C 34a_100102657272_100012348363 [1,2,0,0,0,0|0,0,1]=4 8965 B11R1.34 CNCc1cc(cc(c1)Br)C 7a_106832991635_100012348363 [1,2,0,0,0,0|0,0,1]=4 8966 B11R1.34 CNCc1cc(cc(c1)Br)Cl 207a_100102657272_100011934515 [1,2,0,0,0,0|0,0,1]=4 8967 B11R1.34 CNCc1cc(cc(c1)Br)Cl 269862a_106832991636_100011934515 [1,2,0,0,0,0|0,0,1]=4 8968 B11R1.34 CNCc1cc(cc(c1)Br)Cl 26a_100102657272_100010185897 [1,2,0,0,0,0|0,0,1]=4 8969 B11R1.34 CNCc1cc(cc(c1)Br)Cl 270004a_106832991635_100011934515 [1,2,0,0,0,0|0,0,1]=4 8970 B11R1.34 CNCc1cc(cc(c1)Br)F 207a_100102657272_100011794424 [1,2,0,0,0,0|0,0,1]=4 8971 B11R1.34 CNCc1cc(cc(c1)Br)F 2230a_100020611034_200000210301 [1,2,0,0,0,0|0,0,1]=4 8972 B11R1.34 CNCc1cc(cc(c1)Br)F 2230a_106832991635_100000766940 [1,2,0,0,0,0|0,0,1]=4 8973 B11R1.34 CNCc1cc(cc(c1)Br)F 269862a_106832991636_100011794424 [1,2,0,0,0,0|0,0,1]=4 8974 B11R1.34 CNCc1cc(cc(c1)Br)F 26a_100102657272_100000688818 [1,2,0,0,0,0|0,0,1]=4 8975 B11R1.34 CNCc1cc(cc(c1)Br)F 270004a_106832991635_100011794424 [1,2,0,0,0,0|0,0,1]=4 8976 B11R1.34 CNCc1cc(cc(c1)Br)F 34a_100020611034_200000210301 [1,2,0,0,0,0|0,0,1]=4 8977 B11R1.34 CNCc1cc(cc(c1)Br)F 34a_100102657272_100000766940 [1,2,0,0,0,0|0,0,1]=4 8978 B11R1.34 CNCc1cc(cc(c1)Br)F 7a_106832991635_100000766940 [1,2,0,0,0,0|0,0,1]=4 8979 B11R1.34 CNCc1cc(cc(c1)Br)O 207a_100102657272_100010176088 [1,2,0,0,0,0|0,0,1]=4 8980 B11R1.34 CNCc1cc(cc(c1)Br)O 270004a_106832991635_100010176088 [1,2,0,0,0,0|0,0,1]=4 8981 B11R1.34 CNCc1cc(cc(c1)C)C 207a_100102657272_100000745632 [1,2,0,0,0,0|0,0,1]=4 8982 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_100020591340_200000210301 [1,2,0,0,0,0|0,0,1]=4 8983 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_106832991635_100000181317 [1,2,0,0,0,0|0,0,1]=4 8984 B11R1.34 CNCc1cc(cc(c1)C)C 270004a_106832991635_100000745632 [1,2,0,0,0,0|0,0,1]=4 8985 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100020591340_200000210301 [1,2,0,0,0,0|0,0,1]=4 8986 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100102657272_100000181317 [1,2,0,0,0,0|0,0,1]=4 8987 B11R1.34 CNCc1cc(cc(c1)C)C 7a_106832991635_100000181317 [1,2,0,0,0,0|0,0,1]=4 8988 B11R1.34 CNCc1cc(cc(c1)Cl)C 207a_100102657272_100000684525 [1,2,0,0,0,0|0,0,1]=4 8989 B11R1.34 CNCc1cc(cc(c1)Cl)C 270004a_106832991635_100000684525 [1,2,0,0,0,0|0,0,1]=4 8990 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 207a_100102657272_100000741761 [1,2,0,0,0,0|0,0,1]=4 8991 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 2230a_100011211636_200000210301 [1,2,0,0,0,0|0,0,1]=4 8992 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 2230a_106832991635_100000685807 [1,2,0,0,0,0|0,0,1]=4 8993 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 26a_100102657272_100000181315 [1,2,0,0,0,0|0,0,1]=4 8994 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 270004a_106832991635_100000741761 [1,2,0,0,0,0|0,0,1]=4 8995 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 34a_100011211636_200000210301 [1,2,0,0,0,0|0,0,1]=4 8996 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 7a_106832991635_100011219208 [1,2,0,0,0,0|0,0,1]=4 8997 B11R1.34 CNCc1cc(cc(c1)Cl)F 207a_100102657272_100000703917 [1,2,0,0,0,0|0,0,1]=4 8998 B11R1.34 CNCc1cc(cc(c1)Cl)F 2230a_100137329012_200000210301 [1,2,0,0,0,0|0,0,1]=4 8999 B11R1.34 CNCc1cc(cc(c1)Cl)F 2230a_106832991635_100011219885 [1,2,0,0,0,0|0,0,1]=4 9000 B11R1.34 CNCc1cc(cc(c1)Cl)F 269862a_106832991636_100000703917 [1,2,0,0,0,0|0,0,1]=4 9001 B11R1.34 CNCc1cc(cc(c1)Cl)F 270004a_106832991635_100000703917 [1,2,0,0,0,0|0,0,1]=4 9002 B11R1.34 CNCc1cc(cc(c1)Cl)F 34a_100102657272_100011219885 [1,2,0,0,0,0|0,0,1]=4 9003 B11R1.34 CNCc1cc(cc(c1)Cl)F 34a_100137329012_200000210301 [1,2,0,0,0,0|0,0,1]=4 9004 B11R1.34 CNCc1cc(cc(c1)Cl)F 7a_106832991635_100011219885 [1,2,0,0,0,0|0,0,1]=4 9005 B11R1.34 CNCc1cc(cc(c1)Cl)O 207a_100102657272_100000050827 [1,2,0,0,0,0|0,0,1]=4 9006 B11R1.34 CNCc1cc(cc(c1)Cl)O 2230a_107254831445_200000210301 [1,2,0,0,0,0|0,0,1]=4 9007 B11R1.34 CNCc1cc(cc(c1)Cl)O 270004a_106832991635_100000050827 [1,2,0,0,0,0|0,0,1]=4 9008 B11R1.34 CNCc1cc(cc(c1)Cl)O 34a_107254831445_200000210301 [1,2,0,0,0,0|0,0,1]=4 9009 B11R1.34 CNCc1cc(cc(c1)F)C 207a_100102657272_100011217087 [1,2,0,0,0,0|0,0,1]=4 9010 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_100011830484_200000210301 [1,2,0,0,0,0|0,0,1]=4 9011 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_106832991635_100011219130 [1,2,0,0,0,0|0,0,1]=4 9012 B11R1.34 CNCc1cc(cc(c1)F)C 270004a_106832991635_100011217087 [1,2,0,0,0,0|0,0,1]=4 9013 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100011830484_200000210301 [1,2,0,0,0,0|0,0,1]=4 9014 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100102657272_100011219130 [1,2,0,0,0,0|0,0,1]=4 9015 B11R1.34 CNCc1cc(cc(c1)F)C 7a_106832991635_100011219130 [1,2,0,0,0,0|0,0,1]=4 9016 B11R1.34 CNCc1cc(cc(c1)F)F 207a_100102657272_100000743029 [1,2,0,0,0,0|0,0,1]=4 9017 B11R1.34 CNCc1cc(cc(c1)F)F 2230a_100000737602_200000210301 [1,2,0,0,0,0|0,0,1]=4 9018 B11R1.34 CNCc1cc(cc(c1)F)F 2230a_106832991635_100000697002 [1,2,0,0,0,0|0,0,1]=4 9019 B11R1.34 CNCc1cc(cc(c1)F)F 269862a_106832991636_100000743029 [1,2,0,0,0,0|0,0,1]=4 9020 B11R1.34 CNCc1cc(cc(c1)F)F 270004a_106832991635_100000743029 [1,2,0,0,0,0|0,0,1]=4 9021 B11R1.34 CNCc1cc(cc(c1)F)F 34a_100000737602_200000210301 [1,2,0,0,0,0|0,0,1]=4 9022 B11R1.34 CNCc1cc(cc(c1)F)F 34a_100102657272_100000697002 [1,2,0,0,0,0|0,0,1]=4 9023 B11R1.34 CNCc1cc(cc(c1)F)F 7a_106832991635_100000697002 [1,2,0,0,0,0|0,0,1]=4 9024 B11R1.34 CNCc1cc(cc(c1)F)O 207a_100102657272_100000703664 [1,2,0,0,0,0|0,0,1]=4 9025 B11R1.34 CNCc1cc(cc(c1)F)O 2230a_100160469513_200000210301 [1,2,0,0,0,0|0,0,1]=4 9026 B11R1.34 CNCc1cc(cc(c1)F)O 270004a_106832991635_100000703664 [1,2,0,0,0,0|0,0,1]=4 9027 B11R1.34 CNCc1cc(cc(c1)F)O 34a_100160469513_200000210301 [1,2,0,0,0,0|0,0,1]=4 9028 B11R1.34 CNCc1cc(cc(c1)I)Br 207a_100102657272_100010185649 [1,2,0,0,0,0|0,0,1]=4 9029 B11R1.34 CNCc1cc(cc(c1)I)Br 2230a_106832991635_100010146614 [1,2,0,0,0,0|0,0,1]=4 9030 B11R1.34 CNCc1cc(cc(c1)I)Br 269862a_106832991636_100010185649 [1,2,0,0,0,0|0,0,1]=4 9031 B11R1.34 CNCc1cc(cc(c1)I)Br 26a_100102657272_100010068917 [1,2,0,0,0,0|0,0,1]=4 9032 B11R1.34 CNCc1cc(cc(c1)I)Br 270004a_106832991635_100010185649 [1,2,0,0,0,0|0,0,1]=4 9033 B11R1.34 CNCc1cc(cc(c1)I)Br 34a_100102657272_100010146614 [1,2,0,0,0,0|0,0,1]=4 9034 B11R1.34 CNCc1cc(cc(c1)I)Br 7a_106832991635_100010146614 [1,2,0,0,0,0|0,0,1]=4 9035 B11R1.34 CNCc1cc(cc(c1)I)F 207a_100102657272_100010185655 [1,2,0,0,0,0|0,0,1]=4 9036 B11R1.34 CNCc1cc(cc(c1)I)F 2230a_106832991635_100010149605 [1,2,0,0,0,0|0,0,1]=4 9037 B11R1.34 CNCc1cc(cc(c1)I)F 269862a_106832991636_100010185655 [1,2,0,0,0,0|0,0,1]=4 9038 B11R1.34 CNCc1cc(cc(c1)I)F 270004a_106832991635_100010185655 [1,2,0,0,0,0|0,0,1]=4 9039 B11R1.34 CNCc1cc(cc(c1)I)F 34a_100102657272_100010149605 [1,2,0,0,0,0|0,0,1]=4 9040 B11R1.34 CNCc1cc(cc(c1)I)F 7a_106832991635_100010149605 [1,2,0,0,0,0|0,0,1]=4 9041 B11R1.34 CNCc1cc(cc(c1)I)I 207a_100102657272_100010185653 [1,2,0,0,0,0|0,0,1]=4 9042 B11R1.34 CNCc1cc(cc(c1)I)I 269862a_106832991636_100010185653 [1,2,0,0,0,0|0,0,1]=4 9043 B11R1.34 CNCc1cc(cc(c1)O)C 207a_100102657272_100009853434 [1,2,0,0,0,0|0,0,1]=4 9044 B11R1.34 CNCc1cc(cc(c1)O)C 270004a_106832991635_100009853434 [1,2,0,0,0,0|0,0,1]=4 9045 B11R1.34 CNCc1cc(cc(c1)O)O 207a_100102657272_100000043415 [1,2,0,0,0,0|0,0,1]=4 9046 B11R1.34 CNCc1cc(cc(c1)O)O 2230a_100159270720_200000210301 [1,2,0,0,0,0|0,0,1]=4 9047 B11R1.34 CNCc1cc(cc(c1)O)O 34a_100159270720_200000210301 [1,2,0,0,0,0|0,0,1]=4 9048 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 2230a_100020591340_200025704644 [1,2,0,0,0,0|0,0,1]=4 9049 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 34a_100020591340_200025704644 [1,2,0,0,0,0|0,0,1]=4 9050 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 2230a_100011830484_200025704644 [1,2,0,0,0,0|0,0,1]=4 9051 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 34a_100011830484_200025704644 [1,2,0,0,0,0|0,0,1]=4 9052 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)Br 2230a_100015211796_200025704644 [1,2,0,0,0,0|0,0,1]=4 9053 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)Br 34a_100015211796_200025704644 [1,2,0,0,0,0|0,0,1]=4 9054 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)F 2230a_100020611034_200025704644 [1,2,0,0,0,0|0,0,1]=4 9055 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)F 34a_100020611034_200025704644 [1,2,0,0,0,0|0,0,1]=4 9056 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)Cl 2230a_100011211636_200025704644 [1,2,0,0,0,0|0,0,1]=4 9057 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)Cl 34a_100011211636_200025704644 [1,2,0,0,0,0|0,0,1]=4 9058 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)F 2230a_100137329012_200025704644 [1,2,0,0,0,0|0,0,1]=4 9059 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)F 34a_100137329012_200025704644 [1,2,0,0,0,0|0,0,1]=4 9060 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 2230a_107254831445_200025704644 [1,2,0,0,0,0|0,0,1]=4 9061 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 34a_107254831445_200025704644 [1,2,0,0,0,0|0,0,1]=4 9062 B11R1.34 [13CH3]NCc1cc(cc(c1)F)F 2230a_100000737602_200025704644 [1,2,0,0,0,0|0,0,1]=4 9063 B11R1.34 [13CH3]NCc1cc(cc(c1)F)F 34a_100000737602_200025704644 [1,2,0,0,0,0|0,0,1]=4 9064 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 2230a_100160469513_200025704644 [1,2,0,0,0,0|0,0,1]=4 9065 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 34a_100160469513_200025704644 [1,2,0,0,0,0|0,0,1]=4 9066 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 2230a_100159270720_200025704644 [1,2,0,0,0,0|0,0,1]=4 9067 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 34a_100159270720_200025704644 [1,2,0,0,0,0|0,0,1]=4 9068 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [1,2,0,0,0,0|1,0,0]=4 9069 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [1,2,0,0,0,0|1,0,0]=4 9070 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [1,2,0,0,0,0|1,0,0]=4 9071 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [1,2,0,0,0,0|1,0,0]=4 9072 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [1,2,0,0,0,0|1,0,0]=4 9073 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [1,2,0,0,0,0|1,0,0]=4 9074 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [1,2,0,0,0,0|1,0,0]=4 9075 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [1,2,0,0,0,0|0,0,1]=4 9076 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [1,2,0,0,0,0|0,0,1]=4 9077 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [1,2,0,0,0,0|0,0,1]=4 9078 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [1,2,0,0,0,0|0,0,1]=4 9079 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [1,2,0,0,0,0|0,0,1]=4 9080 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [1,2,0,0,0,0|0,0,1]=4 9081 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [1,2,0,0,0,0|0,0,1]=4 9082 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [1,2,0,0,0,0|0,0,1]=4 9083 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [1,2,0,0,0,0|0,0,1]=4 9084 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [1,2,0,0,0,0|0,0,1]=4 9085 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [1,2,0,0,0,0|0,0,1]=4 9086 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [1,2,0,0,0,0|0,0,1]=4 9087 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [1,2,0,0,0,0|0,0,1]=4 9088 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [1,2,0,0,0,0|0,0,1]=4 9089 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [1,2,0,0,0,0|0,0,1]=4 9090 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [1,2,0,0,0,0|0,0,1]=4 9091 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [1,2,0,0,0,0|0,0,1]=4 9092 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [1,2,0,0,0,0|0,0,1]=4 9093 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [1,2,0,0,0,0|0,0,1]=4 9094 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [1,2,0,0,0,0|0,0,1]=4 9095 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [1,2,0,0,0,0|0,0,1]=4 9096 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [1,2,0,0,0,0|0,0,1]=4 9097 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [1,2,0,0,0,0|0,0,1]=4 9098 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [1,2,0,0,0,0|0,0,1]=4 9099 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [1,2,0,0,0,0|0,0,1]=4 9100 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [1,2,0,0,0,0|0,0,1]=4 9101 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [1,2,0,0,0,0|0,0,1]=4 9102 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [1,2,0,0,0,0|0,0,1]=4 9103 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [1,2,0,0,0,0|0,0,1]=4 9104 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [1,2,0,0,0,0|0,0,1]=4 9105 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [1,2,0,0,0,0|0,0,1]=4 9106 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [1,2,0,0,0,0|0,0,1]=4 9107 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [1,2,0,0,0,0|0,0,1]=4 9108 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [1,2,0,0,0,0|0,0,1]=4 9109 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [1,2,0,0,0,0|0,0,1]=4 9110 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [1,2,0,0,0,0|0,0,1]=4 9111 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [1,2,0,0,0,0|0,0,1]=4 9112 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [1,2,0,0,0,0|0,0,1]=4 9113 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [1,2,0,0,0,0|0,0,1]=4 9114 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [1,2,0,0,0,0|0,0,1]=4 9115 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [1,2,0,0,0,0|0,0,1]=4 9116 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [1,2,0,0,0,0|0,0,1]=4 9117 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [1,2,0,0,0,0|0,0,1]=4 9118 B11R1.189 C#Cc1cccc(c1)CNC 207a_100102657272_100011361529 [1,2,0,0,0,0|0,0,1]=4 9119 B11R1.189 C=Cc1cccc(c1)CNC 26a_100102657272_100011309434 [1,2,0,0,0,0|0,0,1]=4 9120 B11R1.189 C=Cc1cccc(c1)CNC 270004a_106832991635_100011218069 [1,2,0,0,0,0|0,0,1]=4 9121 B11R1.189 C=Cc1cccc(c1)CNC 271570a_100011290941_100000187585 [1,2,0,0,0,0|0,0,1]=4 9122 B11R1.189 CC=Cc1cccc(c1)C#N 271570a_100016259895_100000189340 [1,2,0,0,0,0|1,0,0]=4 9123 B11R1.189 CC=Cc1cccc(c1)C=O 271570a_100016259895_100000014684 [1,2,0,0,0,0|1,0,0]=4 9124 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,2,0,0,0,0|1,0,0]=4 9125 B11R1.189 CC=Cc1cccc(c1)CF 271570a_100016259895_100010878472 [1,2,0,0,0,0|1,0,0]=4 9126 B11R1.189 CC=Cc1cccc(c1)CN 271570a_100016259895_100000106179 [1,2,0,0,0,0|1,0,0]=4 9127 B11R1.189 CC=Cc1cccc(c1)CO 271570a_100016259895_100000687537 [1,2,0,0,0,0|1,0,0]=4 9128 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,2,0,0,0,0|1,0,0]=4 9129 B11R1.189 CC=Cc1cccc(c1)NN 271570a_100016259895_100000217339 [1,2,0,0,0,0|1,0,0]=4 9130 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,2,0,0,0,0|1,0,0]=4 9131 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,2,0,0,0,0|1,0,0]=4 9132 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,2,0,0,0,0|0,0,1]=4 9133 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,2,0,0,0,0|0,0,1]=4 9134 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,2,0,0,0,0|0,0,1]=4 9135 B11R1.189 CNCc1cccc(c1)C#N 207a_100102657272_100000241001 [1,2,0,0,0,0|0,0,1]=4 9136 B11R1.189 CNCc1cccc(c1)C#N 2230a_106832991635_100000233786 [1,2,0,0,0,0|0,0,1]=4 9137 B11R1.189 CNCc1cccc(c1)C#N 26a_100102657272_100000184713 [1,2,0,0,0,0|0,0,1]=4 9138 B11R1.189 CNCc1cccc(c1)C#N 270004a_106832991635_100000241001 [1,2,0,0,0,0|0,0,1]=4 9139 B11R1.189 CNCc1cccc(c1)C#N 34a_100000755147_200000210301 [1,2,0,0,0,0|0,0,1]=4 9140 B11R1.189 CNCc1cccc(c1)C#N 34a_100102657272_100000233786 [1,2,0,0,0,0|0,0,1]=4 9141 B11R1.189 CNCc1cccc(c1)C#N 7a_106832991635_100000233786 [1,2,0,0,0,0|0,0,1]=4 9142 B11R1.189 CNCc1cccc(c1)C=O 2230a_106832991635_100009816774 [1,2,0,0,0,0|0,0,1]=4 9143 B11R1.189 CNCc1cccc(c1)C=O 34a_100102657272_100009816774 [1,2,0,0,0,0|0,0,1]=4 9144 B11R1.189 CNCc1cccc(c1)C=O 7a_106832991635_100009816774 [1,2,0,0,0,0|0,0,1]=4 9145 B11R1.189 CNCc1cccc(c1)CBr 26a_100102657272_100011660834 [1,2,0,0,0,0|0,0,1]=4 9146 B11R1.189 CNCc1cccc(c1)CCl 26a_100102657272_100000084143 [1,2,0,0,0,0|0,0,1]=4 9147 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,2,0,0,0,0|0,0,1]=4 9148 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,2,0,0,0,0|0,0,1]=4 9149 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,2,0,0,0,0|0,0,1]=4 9150 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,2,0,0,0,0|0,0,1]=4 9151 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,2,0,0,0,0|0,0,1]=4 9152 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,2,0,0,0,0|0,0,1]=4 9153 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,2,0,0,0,0|0,0,1]=4 9154 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,2,0,0,0,0|0,0,1]=4 9155 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,2,0,0,0,0|0,0,1]=4 9156 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,2,0,0,0,0|0,0,1]=4 9157 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,2,0,0,0,0|0,0,1]=4 9158 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,2,0,0,0,0|0,0,1]=4 9159 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,2,0,0,0,0|0,0,1]=4 9160 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,2,0,0,0,0|0,0,1]=4 9161 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,2,0,0,0,0|0,0,1]=4 9162 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,2,0,0,0,0|0,0,1]=4 9163 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,2,0,0,0,0|0,0,1]=4 9164 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,2,0,0,0,0|0,0,1]=4 9165 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [1,2,0,0,0,0|0,0,1]=4 9166 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [1,2,0,0,0,0|0,0,1]=4 9167 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [1,2,0,0,0,0|0,0,1]=4 9168 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [1,2,0,0,0,0|0,0,1]=4 9169 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [1,2,0,0,0,0|0,0,1]=4 9170 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [1,2,0,0,0,0|0,0,1]=4 9171 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [1,2,0,0,0,0|0,0,1]=4 9172 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,2,0,0,0,0|0,0,1]=4 9173 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,2,0,0,0,0|0,0,1]=4 9174 B11R1.189 [13CH3]NCc1cccc(c1)C#N 34a_100000755147_200025704644 [1,2,0,0,0,0|0,0,1]=4 9175 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,2,0,0,0,0|0,0,1]=4 9176 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,2,0,0,0,0|0,0,1]=4 9177 B11R1.28 C#CCNCc1ccccc1 2230a_100015324214_100000038162 [1,2,0,0,0,0|0,0,1]=4 9178 B11R1.28 C#CCNCc1ccccc1 34a_100000212058_100015291786 [1,2,0,0,0,0|0,0,1]=4 9179 B11R1.28 C#CCNCc1ccccc1 34a_100015324214_100000184674 [1,2,0,0,0,0|0,0,1]=4 9180 B11R1.28 C/C=C/CNc1ccccc1 34a_100000106764_100102629194 [1,2,0,0,0,0|1,0,0]=4 9181 B11R1.28 C/C=C/COc1ccccc1 34a_100000210340_100102629194 [1,2,0,0,0,0|1,0,0]=4 9182 B11R1.28 C/C=C/COc1ccccc1 7a_100000210340_100102629194 [1,2,0,0,0,0|1,0,0]=4 9183 B11R1.28 C/C=C/CSc1ccccc1 62a_100000719477_100102629194 [1,2,0,0,0,0|1,0,0]=4 9184 B11R1.28 C/C=C/CSc1ccccc1 62a_100102629194_100000041952 [1,2,0,0,0,0|1,0,0]=4 9185 B11R1.28 C=CCNCc1ccccc1 2230a_100015324214_100000210623 [1,2,0,0,0,0|0,0,1]=4 9186 B11R1.28 C=CCNCc1ccccc1 2230a_100020586998_100015291786 [1,2,0,0,0,0|0,0,1]=4 9187 B11R1.28 C=CCNCc1ccccc1 270004a_100020586998_100015611070 [1,2,0,0,0,0|0,0,1]=4 9188 B11R1.28 C=CCNCc1ccccc1 34a_100015324214_100015514636 [1,2,0,0,0,0|0,0,1]=4 9189 B11R1.28 CC=CCNc1ccccc1 34a_100000106764_100000070051 [1,2,0,0,0,0|1,0,0]=4 9190 B11R1.28 CC=CCOc1ccccc1 34a_100000210340_100000070051 [1,2,0,0,0,0|1,0,0]=4 9191 B11R1.28 CC=CCOc1ccccc1 7a_100000210340_100000070051 [1,2,0,0,0,0|1,0,0]=4 9192 B11R1.28 CC=CCSc1ccccc1 62a_100000070051_100000041952 [1,2,0,0,0,0|1,0,0]=4 9193 B11R1.28 CC=CCSc1ccccc1 62a_100000719477_100000070051 [1,2,0,0,0,0|1,0,0]=4 9194 B11R1.28 CC=NNCc1ccccc1 4a_100000007032_200000210099 [1,2,0,0,0,0|0,0,1]=4 9195 B11R1.28 CCC=NNc1ccccc1 4a_100015195140_100000210100 [1,2,0,0,0,0|1,0,0]=4 9196 B11R1.28 CCCC=Cc1ccccc1 271570a_100016258520_100000210277 [1,2,0,0,0,0|1,0,0]=4 9197 B11R1.28 CCCNCc1ccccc1 207a_100020643023_100015611070 [1,2,0,0,0,0|0,0,1]=4 9198 B11R1.28 CCCNCc1ccccc1 2230a_100015324214_100000210303 [1,2,0,0,0,0|0,0,1]=4 9199 B11R1.28 CCCNCc1ccccc1 270004a_100020643023_100015611070 [1,2,0,0,0,0|0,0,1]=4 9200 B11R1.28 CCCNCc1ccccc1 34a_100015324214_100000210303 [1,2,0,0,0,0|0,0,1]=4 9201 B11R1.28 CCNCCc1ccccc1 2230a_100000106460_100000210202 [1,2,0,0,0,0|0,0,1]=4 9202 B11R1.28 CCNCCc1ccccc1 2230a_100015525214_100000765856 [1,2,0,0,0,0|0,0,1]=4 9203 B11R1.28 CCNCCc1ccccc1 34a_100000106460_100000210202 [1,2,0,0,0,0|0,0,1]=4 9204 B11R1.28 CCNCSc1ccccc1 2230a_100015525214_100011218342 [1,2,0,0,0,0|0,0,1]=4 9205 B11R1.28 CCNN=Cc1ccccc1 4a_100000756455_100015611070 [1,2,0,0,0,0|0,0,0]=3 9206 B11R1.28 CCNN=Cc1ccccn1 4a_100000756455_100000209966 [1,2,0,0,0,0|1,0,0]=4 9207 B11R1.28 CCNN=Cc1cccnc1 4a_100000756455_100000209961 [1,2,0,0,0,0|1,0,0]=4 9208 B11R1.28 CCNN=Cc1ccncc1 4a_100000756455_100000186114 [1,2,0,0,0,0|1,0,0]=4 9209 B11R1.28 CCOC=Cc1ccccc1 271570a_100016256518_100000210277 [1,2,0,0,0,0|1,0,0]=4 9210 B11R1.28 CNC/C=C/c1ccccc1 2230a_100020603302_200000210301 [1,2,0,0,0,0|0,0,0]=3 9211 B11R1.28 CNC/C=C/c1ccccc1 2230a_106832991635_100016265936 [1,2,0,0,0,0|0,0,0]=3 9212 B11R1.28 CNC/C=C/c1ccccc1 34a_100020603302_200000210301 [1,2,0,0,0,0|0,0,0]=3 9213 B11R1.28 CNC/C=C/c1ccccc1 34a_100102657272_100016265936 [1,2,0,0,0,0|0,0,0]=3 9214 B11R1.28 CNC/C=C/c1ccccc1 7a_106832991635_100016265936 [1,2,0,0,0,0|0,0,0]=3 9215 B11R1.28 CNCC#Cc1ccccc1 2230a_106832991635_100011352542 [1,2,0,0,0,0|0,0,1]=4 9216 B11R1.28 CNCC#Cc1ccccc1 34a_100000735379_200000210301 [1,2,0,0,0,0|0,0,1]=4 9217 B11R1.28 CNCC#Cc1ccccc1 34a_100102657272_100011352542 [1,2,0,0,0,0|0,0,1]=4 9218 B11R1.28 CNCC#Cc1ccccc1 7a_106832991635_100011352542 [1,2,0,0,0,0|0,0,1]=4 9219 B11R1.28 CNCC=Cc1ccccc1 270004a_106832991635_100000210105 [1,2,0,0,0,0|0,0,0]=3 9220 B11R1.28 CNCCCc1ccccc1 2230a_100000211184_200000210301 [1,2,0,0,0,0|0,0,1]=4 9221 B11R1.28 CNCCCc1ccccc1 2230a_106832991635_100000211621 [1,2,0,0,0,0|0,0,1]=4 9222 B11R1.28 CNCCCc1ccccc1 34a_100000211184_200000210301 [1,2,0,0,0,0|0,0,1]=4 9223 B11R1.28 CNCCCc1ccccc1 34a_100102657272_100000211621 [1,2,0,0,0,0|0,0,1]=4 9224 B11R1.28 CNCCCc1ccccc1 7a_106832991635_100000211621 [1,2,0,0,0,0|0,0,1]=4 9225 B11R1.28 CNCCOc1ccccc1 2230a_100000174943_200000210301 [1,2,0,0,0,0|0,0,1]=4 9226 B11R1.28 CNCCOc1ccccc1 2230a_106832991635_100000184471 [1,2,0,0,0,0|0,0,1]=4 9227 B11R1.28 CNCCOc1ccccc1 270004a_106832991635_100000758736 [1,2,0,0,0,0|0,0,1]=4 9228 B11R1.28 CNCCOc1ccccc1 34a_100000174943_200000210301 [1,2,0,0,0,0|0,0,1]=4 9229 B11R1.28 CNCCOc1ccccc1 34a_100102657272_100000184471 [1,2,0,0,0,0|0,0,1]=4 9230 B11R1.28 CNCCOc1ccccc1 7a_106832991635_100000184471 [1,2,0,0,0,0|0,0,1]=4 9231 B11R1.28 CNCCSc1ccccc1 2230a_100000189519_200000210301 [1,2,0,0,0,0|0,0,1]=4 9232 B11R1.28 CNCCSc1ccccc1 2230a_106832991635_100000246102 [1,2,0,0,0,0|0,0,1]=4 9233 B11R1.28 CNCCSc1ccccc1 34a_100102657272_100000246102 [1,2,0,0,0,0|0,0,1]=4 9234 B11R1.28 CNCCSc1ccccc1 7a_106832991635_100000246102 [1,2,0,0,0,0|0,0,1]=4 9235 B11R1.28 CNCOCc1ccccc1 2230a_106832991635_100000763385 [1,2,0,0,0,0|0,0,1]=4 9236 B11R1.28 CNCOCc1ccccc1 34a_100102657272_100000763385 [1,2,0,0,0,0|0,0,1]=4 9237 B11R1.28 CNCSCc1ccccc1 2230a_106832991635_200011217039 [1,2,0,0,0,0|0,0,1]=4 9238 B11R1.28 CNCSCc1ccccc1 34a_100102657272_200011217039 [1,2,0,0,0,0|0,0,1]=4 9239 B11R1.28 COC/C=C/c1ccccc1 34a_100000210256_200000210301 [1,2,0,0,0,0|1,0,0]=4 9240 B11R1.28 COC/C=C/c1ccccc1 34a_100138415774_100016265936 [1,2,0,0,0,0|1,0,0]=4 9241 B11R1.28 COCC=Cc1ccccc1 271570a_100016286323_100000210277 [1,2,0,0,0,0|1,0,0]=4 9242 B11R1.28 COCNCc1ccccc1 2230a_100015324214_100000766300 [1,2,0,0,0,0|0,0,1]=4 9243 B11R1.28 CSC/C=C/c1ccccc1 62a_100016265936_200000210301 [1,2,0,0,0,0|1,0,0]=4 9244 B11R1.28 CSC/C=C/c1ccccc1 62a_200000210301_100016265936 [1,2,0,0,0,0|1,0,0]=4 9245 B11R1.28 CSCNCc1ccccc1 2230a_100015324214_100011218213 [1,2,0,0,0,0|0,0,1]=4 9246 B11R1.28 CSCNCc1ccccc1 34a_100015324214_100011218213 [1,2,0,0,0,0|0,0,1]=4 9247 B11R1.28 FCCNCc1ccccc1 2230a_100015324214_100011217306 [1,2,0,0,0,0|0,0,1]=4 9248 B11R1.28 FCCNCc1ccccc1 34a_100000724931_100015291786 [1,2,0,0,0,0|0,0,1]=4 9249 B11R1.28 FCCNCc1ccccc1 34a_100015324214_100011217306 [1,2,0,0,0,0|0,0,1]=4 9250 B11R1.28 FCNCCc1ccccc1 34a_100000106460_100015361967 [1,2,0,0,0,0|0,0,1]=4 9251 B11R1.28 N#CCNCc1ccccc1 2230a_100015324214_100011215382 [1,2,0,0,0,0|0,0,1]=4 9252 B11R1.28 O=CCNCc1ccccc1 2230a_100015324214_200015260668 [1,2,0,0,0,0|0,0,1]=4 9253 B11R1.28 O=CCNCc1ccccc1 34a_100015324214_200009817547 [1,2,0,0,0,0|0,0,1]=4 9254 B11R1.28 OCCNCc1ccccc1 207a_100000210304_100015611070 [1,2,0,0,0,0|0,0,1]=4 9255 B11R1.28 OCCNCc1ccccc1 2230a_100015324214_100000211926 [1,2,0,0,0,0|0,0,1]=4 9256 B11R1.28 OCCNCc1ccccc1 2230a_100016997473_100015291786 [1,2,0,0,0,0|0,0,1]=4 9257 B11R1.28 OCCNCc1ccccc1 270004a_100000210304_100015611070 [1,2,0,0,0,0|0,0,1]=4 9258 B11R1.28 OCCNCc1ccccc1 34a_100015324214_100000211926 [1,2,0,0,0,0|0,0,1]=4 9259 B11R1.28 OCCNCc1ccccc1 34a_100016990907_100015291786 [1,2,0,0,0,0|0,0,1]=4 9260 B11R1.28 [13CH3]NC/C=C/c1ccccc1 2230a_100020603302_200025704644 [1,2,0,0,0,0|0,0,0]=3 9261 B11R1.28 [13CH3]NC/C=C/c1ccccc1 34a_100020603302_200025704644 [1,2,0,0,0,0|0,0,0]=3 9262 B11R1.28 [13CH3]NCC#Cc1ccccc1 34a_100000735379_200025704644 [1,2,0,0,0,0|0,0,1]=4 9263 B11R1.28 [13CH3]NCCCc1ccccc1 2230a_100000211184_200025704644 [1,2,0,0,0,0|0,0,1]=4 9264 B11R1.28 [13CH3]NCCCc1ccccc1 34a_100000211184_200025704644 [1,2,0,0,0,0|0,0,1]=4 9265 B11R1.28 [13CH3]NCCOc1ccccc1 2230a_100000174943_200025704644 [1,2,0,0,0,0|0,0,1]=4 9266 B11R1.28 [13CH3]NCCOc1ccccc1 34a_100000174943_200025704644 [1,2,0,0,0,0|0,0,1]=4 9267 B11R1.28 [13CH3]NCCSc1ccccc1 2230a_100000189519_200025704644 [1,2,0,0,0,0|0,0,1]=4 9268 B11R1.28 [13CH3]OC/C=C/c1ccccc1 34a_100000210256_200025704644 [1,2,0,0,0,0|1,0,0]=4 9269 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_100016265936_200025704644 [1,2,0,0,0,0|1,0,0]=4 9270 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_200025704644_100016265936 [1,2,0,0,0,0|1,0,0]=4 9271 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [1,2,0,0,0,0|1,0,0]=4 9272 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [1,2,0,0,0,0|0,0,1]=4 9273 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [1,2,0,0,0,0|0,0,1]=4 9274 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [1,2,0,0,0,0|0,0,1]=4 9275 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [1,2,0,0,0,0|0,0,1]=4 9276 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [1,2,0,0,0,0|1,0,0]=4 9277 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [1,2,0,0,0,0|1,0,0]=4 9278 B11R1.91 CC(C)NCc1ccccc1 207a_100138425928_100015611070 [1,2,0,0,0,0|0,0,1]=4 9279 B11R1.91 CC(C)NCc1ccccc1 2230a_100015324214_100000210206 [1,2,0,0,0,0|0,0,1]=4 9280 B11R1.91 CC(C)NCc1ccccc1 2230a_100138425928_100015291786 [1,2,0,0,0,0|0,0,1]=4 9281 B11R1.91 CC(C)NCc1ccccc1 34a_100015324214_100000210206 [1,2,0,0,0,0|0,0,1]=4 9282 B11R1.91 CC(C)NCc1ccccc1 34a_100138425928_100015291786 [1,2,0,0,0,0|0,0,1]=4 9283 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [1,2,0,0,0,0|1,0,0]=4 9284 B11R1.91 CN(C)CCc1ccccc1 2230a_100000207497_200000210301 [1,2,0,0,0,0|0,0,1]=4 9285 B11R1.91 CN(C)CCc1ccccc1 2230a_100102631434_100000765856 [1,2,0,0,0,0|0,0,1]=4 9286 B11R1.91 CN(C)CCc1ccccc1 269982a_100000207497_200000210301 [1,2,0,0,0,0|0,0,1]=4 9287 B11R1.91 CN(C)CCc1ccccc1 269982a_100102631434_100000765856 [1,2,0,0,0,0|0,0,1]=4 9288 B11R1.91 CN(C)CSc1ccccc1 2230a_100102631434_100011218342 [1,2,0,0,0,0|0,0,1]=4 9289 B11R1.91 CN(C)CSc1ccccc1 269982a_100102631434_100011218342 [1,2,0,0,0,0|0,0,1]=4 9290 B11R1.91 CN([13CH3])CCc1ccccc1 2230a_100000207497_200025704644 [1,2,0,0,0,0|0,0,1]=4 9291 B11R1.91 CN([13CH3])CCc1ccccc1 269982a_100000207497_200025704644 [1,2,0,0,0,0|0,0,1]=4 9292 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [1,2,0,0,0,0|1,0,0]=4 9293 B11R1.15 CCNC(=O)c1ccc(s1)O 271570a_203496583355_200000155171 [0,2,0,0,1,0|1,0,0]=4 9294 B11R1.15 CNCC(=O)c1ccc(s1)Br 2230a_106832991635_100000185163 [0,2,0,0,1,0|1,0,0]=4 9295 B11R1.15 CNCC(=O)c1ccc(s1)Br 7a_106832991635_100000185163 [0,2,0,0,1,0|1,0,0]=4 9296 B11R1.15 CNCC(=O)c1ccc(s1)C 2230a_106832991635_100011262362 [0,2,0,0,1,0|1,0,0]=4 9297 B11R1.15 CNCC(=O)c1ccc(s1)C 34a_100102657272_100011262362 [0,2,0,0,1,0|1,0,0]=4 9298 B11R1.15 CNCC(=O)c1ccc(s1)C 7a_106832991635_100011262362 [0,2,0,0,1,0|1,0,0]=4 9299 B11R1.15 CNCC(=O)c1ccc(s1)Cl 2230a_106832991635_100000185135 [0,2,0,0,1,0|1,0,0]=4 9300 B11R1.15 CNCC(=O)c1ccc(s1)Cl 7a_106832991635_100000185135 [0,2,0,0,1,0|1,0,0]=4 9301 B11R1.29 CC=NNC(=O)c1ccc[nH]1 4a_100000018271_200000210099 [0,2,0,0,1,0|1,0,0]=4 9302 B11R1.29 CC=NNC(=O)c1ccco1 4a_100000185077_200000210099 [0,2,0,0,1,0|1,0,0]=4 9303 B11R1.29 CC=NNC(=O)c1cccs1 4a_100000184746_200000210099 [0,2,0,0,1,0|1,0,0]=4 9304 B11R1.29 CC=NNC(=O)c1ccoc1 4a_100000233958_200000210099 [0,2,0,0,1,0|1,0,0]=4 9305 B11R1.29 CC=NNC(=O)c1ccsc1 4a_100000193922_200000210099 [0,2,0,0,1,0|1,0,0]=4 9306 B11R1.29 CCNCC(=O)c1cccs1 2230a_100015525214_100000211436 [0,2,0,0,1,0|1,0,0]=4 9307 B11R1.29 CCNCC(=O)c1ccsc1 2230a_100015525214_100011219462 [0,2,0,0,1,0|1,0,0]=4 9308 B11R1.29 CNCCC(=O)c1cccs1 2230a_106832991635_100011290775 [0,2,0,0,1,0|1,0,0]=4 9309 B11R1.29 CNCCC(=O)c1cccs1 7a_106832991635_100011290775 [0,2,0,0,1,0|1,0,0]=4 9310 B11R1.31 CNC(C)C(=O)c1cccs1 2230a_106832991635_100011262360 [0,2,0,0,1,0|1,0,0]=4 9311 B11R1.31 CNC(C)C(=O)c1cccs1 7a_106832991635_100011262360 [0,2,0,0,1,0|1,0,0]=4 9312 B11R1.77 CN(C)CC(=O)c1ccc[nH]1 269982a_100102631434_200011262396 [0,2,0,0,1,0|1,0,0]=4 9313 B11R1.77 CN(C)CC(=O)c1ccco1 269982a_100102631434_100000211439 [0,2,0,0,1,0|1,0,0]=4 9314 B11R1.77 CN(C)CC(=O)c1cccs1 2230a_100102631434_100000211436 [0,2,0,0,1,0|1,0,0]=4 9315 B11R1.77 CN(C)CC(=O)c1cccs1 269982a_100102631434_100000211436 [0,2,0,0,1,0|1,0,0]=4 9316 B11R1.77 CN(C)CC(=O)c1ccsc1 2230a_100102631434_100011219462 [0,2,0,0,1,0|1,0,0]=4 9317 B11R1.77 CN(C)CC(=O)c1ccsc1 269982a_100102631434_100011219462 [0,2,0,0,1,0|1,0,0]=4 9318 B11R1.199 CNCC(=O)c1cccn1C 2230a_106832991635_200011262399 [0,2,0,0,1,0|1,0,0]=4 9319 B11R1.199 CNCC(=O)c1cccn1C 34a_100102657272_200011262399 [0,2,0,0,1,0|1,0,0]=4 9320 B11R1.199 CNCC(=O)c1cccn1C 7a_106832991635_200011262399 [0,2,0,0,1,0|1,0,0]=4 9321 B11R1.199 CNCC(=O)c1sccc1Br 2230a_106832991635_100000740827 [0,2,0,0,1,0|1,0,0]=4 9322 B11R1.199 CNCC(=O)c1sccc1Br 34a_100102657272_100000740827 [0,2,0,0,1,0|1,0,0]=4 9323 B11R1.199 CNCC(=O)c1sccc1Br 7a_106832991635_100000740827 [0,2,0,0,1,0|1,0,0]=4 9324 B11R1.44 C=Cc1ccc(o1)C(=O)NC 271570a_100011290941_100000159859 [0,2,0,0,1,0|1,0,0]=4 9325 B11R1.44 C=Cc1ccc(s1)C(=O)NC 271570a_100011290941_200000155069 [0,2,0,0,1,0|1,0,0]=4 9326 B11R1.44 CNC(=O)c1ccc(o1)SC 62a_200000210301_100000159859 [0,2,0,0,1,0|1,0,0]=4 9327 B11R1.44 CNC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000159859 [0,2,0,0,1,0|1,0,0]=4 9328 B11R1.44 CNC(=O)c1ccc(s1)SC 62a_200000155069_200000210301 [0,2,0,0,1,0|1,0,0]=4 9329 B11R1.44 CNC(=O)c1ccc(s1)SC 62a_200000210301_200000155069 [0,2,0,0,1,0|1,0,0]=4 9330 B11R1.44 CNC(=O)c1ccc(s1)S[13CH3] 62a_200000155069_200025704644 [0,2,0,0,1,0|1,0,0]=4 9331 B11R1.44 CNC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000155069 [0,2,0,0,1,0|1,0,0]=4 9332 B11R1.314 CN(C)C(=O)c1ccc(s1)O 271570a_203496583355_200000159620 [0,2,0,0,1,0|1,0,0]=4 9333 B13R1.11 CCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000210202 [0,1,0,0,0,2|1,0,0]=4 9334 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747405 [0,1,0,0,0,2|1,0,0]=4 9335 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000210414_100000211460 [0,1,0,0,0,2|1,0,0]=4 9336 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210202 [0,1,0,0,0,2|1,0,0]=4 9337 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000210414_100000756946 [0,1,0,0,0,2|1,0,0]=4 9338 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000210414_100000185958 [0,1,0,0,0,2|1,0,0]=4 9339 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000210202 [0,1,0,0,0,2|1,0,0]=4 9340 B13R1.11 CCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000210202 [0,1,0,0,0,2|1,0,0]=4 9341 B13R1.11 CCC(=O)CN(C)c1ccccc1 269982a_100000210012_100000747405 [0,1,0,0,0,2|1,0,0]=4 9342 B13R1.11 CCC(=O)C[C@@H](O)c1ccccc1 1458a_100000210414_100011933945 [0,1,0,0,0,2|1,0,0]=4 9343 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000210414 [0,1,0,0,0,2|1,0,0]=4 9344 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000210414 [0,1,0,0,0,2|1,0,0]=4 9345 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000210414 [0,1,0,0,0,2|1,0,0]=4 9346 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000210414 [0,1,0,0,0,2|1,0,0]=4 9347 B13R1.11 CNC(=O)C=C(C)c1ccccc1 11a_106832991635_100000743005 [0,1,0,0,0,2|0,0,0]=3 9348 B13R1.11 CNC(=O)C=C(C)c1ccccc1 1626a_100102657272_100000743005 [0,1,0,0,0,2|0,0,0]=3 9349 B13R1.11 CNC(=O)C=C(C)c1ccccc1 240690a_100102657272_100000743005 [0,1,0,0,0,2|0,0,0]=3 9350 B13R1.11 CNC(=O)C=C(C)c1ccccc1 527a_100102657272_100000743005 [0,1,0,0,0,2|0,0,0]=3 9351 B13R1.11 CNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183359 [0,1,0,0,0,2|0,0,0]=3 9352 B13R1.11 CNC(=O)CC(C)c1ccccc1 11a_106832991635_100000183687 [0,1,0,0,0,2|0,0,0]=3 9353 B13R1.11 CNC(=O)CC(C)c1ccccc1 1626a_100102657272_100000183687 [0,1,0,0,0,2|0,0,0]=3 9354 B13R1.11 CNC(=O)CC(C)c1ccccc1 240690a_100102657272_100000183687 [0,1,0,0,0,2|0,0,0]=3 9355 B13R1.11 CNC(=O)CC(C)c1ccccc1 527a_100102657272_100000183687 [0,1,0,0,0,2|0,0,0]=3 9356 B13R1.11 CNC(=O)CC(O)c1ccccc1 240690a_100102657272_100000690199 [0,1,0,0,0,2|0,0,0]=3 9357 B13R1.11 CNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000183359 [0,1,0,0,0,2|0,0,0]=3 9358 B13R1.11 CNC(=O)CN(C)c1ccccc1 240690a_100102657272_100000745425 [0,1,0,0,0,2|0,0,0]=3 9359 B13R1.11 CNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000183359 [0,1,0,0,0,2|0,0,0]=3 9360 B13R1.11 CNC(=O)CN(C)c1ccccc1 34a_100000210012_100000183359 [0,1,0,0,0,2|0,0,0]=3 9361 B13R1.11 CNC(=O)CN(C)c1ccccc1 527a_100102657272_100000745425 [0,1,0,0,0,2|0,0,0]=3 9362 B13R1.11 CNC(=O)NC(C)c1ccccn1 2708a_100000181244_106832991635 [0,1,0,0,0,2|1,0,0]=4 9363 B13R1.11 CNC(=O)NC(C)c1ccccn1 2708a_100102657272_100000181244 [0,1,0,0,0,2|1,0,0]=4 9364 B13R1.11 CNC(=O)NC(C)c1ccccn1 273464a_100000181244_100102657272 [0,1,0,0,0,2|1,0,0]=4 9365 B13R1.11 CNC(=O)NC(C)c1ccccn1 273464a_100102657272_100000181244 [0,1,0,0,0,2|1,0,0]=4 9366 B13R1.11 CNC(=O)NC(C)c1ccccn1 512a_100000181244_100102657272 [0,1,0,0,0,2|1,0,0]=4 9367 B13R1.11 CNC(=O)NC(C)c1ccccn1 512a_106832991638_100000181244 [0,1,0,0,0,2|1,0,0]=4 9368 B13R1.11 CNC(=O)NC(C)c1cccnc1 2708a_100000195435_106832991635 [0,1,0,0,0,2|1,0,0]=4 9369 B13R1.11 CNC(=O)NC(C)c1cccnc1 2708a_100102657272_100000195435 [0,1,0,0,0,2|1,0,0]=4 9370 B13R1.11 CNC(=O)NC(C)c1cccnc1 273464a_100000195435_100102657272 [0,1,0,0,0,2|1,0,0]=4 9371 B13R1.11 CNC(=O)NC(C)c1cccnc1 273464a_100102657272_100000195435 [0,1,0,0,0,2|1,0,0]=4 9372 B13R1.11 CNC(=O)NC(C)c1cccnc1 512a_106832991638_100000195435 [0,1,0,0,0,2|1,0,0]=4 9373 B13R1.11 CNC(=O)NC(C)c1ccncc1 2708a_100000181269_106832991635 [0,1,0,0,0,2|1,0,0]=4 9374 B13R1.11 CNC(=O)NC(C)c1ccncc1 2708a_100102657272_100000181269 [0,1,0,0,0,2|1,0,0]=4 9375 B13R1.11 CNC(=O)NC(C)c1ccncc1 273464a_100000181269_100102657272 [0,1,0,0,0,2|1,0,0]=4 9376 B13R1.11 CNC(=O)NC(C)c1ccncc1 273464a_100102657272_100000181269 [0,1,0,0,0,2|1,0,0]=4 9377 B13R1.11 CNC(=O)NC(C)c1ccncc1 512a_100000181269_100102657272 [0,1,0,0,0,2|1,0,0]=4 9378 B13R1.11 CNC(=O)NC(C)c1ccncc1 512a_106832991638_100000181269 [0,1,0,0,0,2|1,0,0]=4 9379 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_106832991635 [0,1,0,0,0,2|0,0,0]=3 9380 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100102657272_100000751104 [0,1,0,0,0,2|0,0,0]=3 9381 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100102657272 [0,1,0,0,0,2|0,0,0]=3 9382 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100102657272_100000751104 [0,1,0,0,0,2|0,0,0]=3 9383 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100102657272 [0,1,0,0,0,2|0,0,0]=3 9384 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_106832991638_100000751104 [0,1,0,0,0,2|0,0,0]=3 9385 B13R1.11 COC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747449 [0,1,0,0,0,2|1,0,0]=4 9386 B13R1.11 COC(=O)CN(C)c1ccccc1 2230a_100000210012_100000747449 [0,1,0,0,0,2|1,0,0]=4 9387 B13R1.11 COC(=O)CN(C)c1ccccc1 2230a_100000757779_200000210301 [0,1,0,0,0,2|1,0,0]=4 9388 B13R1.11 COC(=O)CN(C)c1ccccc1 269982a_100000210012_100000747449 [0,1,0,0,0,2|1,0,0]=4 9389 B13R1.11 COC(=O)CN(C)c1ccccc1 269982a_100000757779_200000210301 [0,1,0,0,0,2|1,0,0]=4 9390 B13R1.11 COC(=O)CN(C)c1ccccc1 34a_100000210012_100000747449 [0,1,0,0,0,2|1,0,0]=4 9391 B13R1.11 COC(=O)CN([13CH3])c1ccccc1 2230a_100000757779_200025704644 [0,1,0,0,0,2|1,0,0]=4 9392 B13R1.11 COC(=O)CN([13CH3])c1ccccc1 269982a_100000757779_200025704644 [0,1,0,0,0,2|1,0,0]=4 9393 B13R1.14 CCC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_100000210202 [0,1,0,0,0,2|1,0,0]=4 9394 B13R1.14 CCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000210202 [0,1,0,0,0,2|1,0,0]=4 9395 B13R1.14 CCC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_100000210202 [0,1,0,0,0,2|1,0,0]=4 9396 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_100000210202 [0,1,0,0,0,2|1,0,0]=4 9397 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Br 6a_100000186029_100000211110 [0,1,0,0,0,2|1,0,0]=4 9398 B13R1.14 CCC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_100000210202 [0,1,0,0,0,2|1,0,0]=4 9399 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000210202 [0,1,0,0,0,2|1,0,0]=4 9400 B13R1.14 CCC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_100000210202 [0,1,0,0,0,2|1,0,0]=4 9401 B13R1.14 CCC(=O)C=Cc1ccc(cc1)F 6a_100000210084_100000211110 [0,1,0,0,0,2|1,0,0]=4 9402 B13R1.14 CCC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_100000210202 [0,1,0,0,0,2|1,0,0]=4 9403 B13R1.14 CCC(=O)C=Cc1ccc(cc1)I 6a_100000188517_100000211110 [0,1,0,0,0,2|1,0,0]=4 9404 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000210414_100011740612 [0,1,0,0,0,2|1,0,0]=4 9405 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000210202 [0,1,0,0,0,2|1,0,0]=4 9406 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000210414_100011713686 [0,1,0,0,0,2|1,0,0]=4 9407 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000210202 [0,1,0,0,0,2|1,0,0]=4 9408 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000210414_100011713675 [0,1,0,0,0,2|1,0,0]=4 9409 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210202 [0,1,0,0,0,2|1,0,0]=4 9410 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000210202 [0,1,0,0,0,2|1,0,0]=4 9411 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000210414_100011217392 [0,1,0,0,0,2|1,0,0]=4 9412 B13R1.14 CCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000210202 [0,1,0,0,0,2|1,0,0]=4 9413 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000210414_100009816426 [0,1,0,0,0,2|1,0,0]=4 9414 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210202 [0,1,0,0,0,2|1,0,0]=4 9415 B13R1.14 CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210202 [0,1,0,0,0,2|1,0,0]=4 9416 B13R1.14 CCC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747405 [0,1,0,0,0,2|1,0,0]=4 9417 B13R1.14 CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210202 [0,1,0,0,0,2|1,0,0]=4 9418 B13R1.14 CCC(=O)COc1ccc(cc1)C 7a_100000210336_100000747405 [0,1,0,0,0,2|1,0,0]=4 9419 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210202 [0,1,0,0,0,2|1,0,0]=4 9420 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747405 [0,1,0,0,0,2|1,0,0]=4 9421 B13R1.14 CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210202 [0,1,0,0,0,2|1,0,0]=4 9422 B13R1.14 CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210202 [0,1,0,0,0,2|1,0,0]=4 9423 B13R1.14 CCC(=O)COc1ccc(cc1)I 7a_100000212066_100000747405 [0,1,0,0,0,2|1,0,0]=4 9424 B13R1.14 CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210202 [0,1,0,0,0,2|1,0,0]=4 9425 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000210202 [0,1,0,0,0,2|1,0,0]=4 9426 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000747405_100000752885 [0,1,0,0,0,2|1,0,0]=4 9427 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747405 [0,1,0,0,0,2|1,0,0]=4 9428 B13R1.14 CCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000210202 [0,1,0,0,0,2|1,0,0]=4 9429 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747405 [0,1,0,0,0,2|1,0,0]=4 9430 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000747405_100000186775 [0,1,0,0,0,2|1,0,0]=4 9431 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210202 [0,1,0,0,0,2|1,0,0]=4 9432 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000747405_100000755918 [0,1,0,0,0,2|1,0,0]=4 9433 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747405 [0,1,0,0,0,2|1,0,0]=4 9434 B13R1.14 CCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000210202 [0,1,0,0,0,2|1,0,0]=4 9435 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747405 [0,1,0,0,0,2|1,0,0]=4 9436 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000747405_100000211213 [0,1,0,0,0,2|1,0,0]=4 9437 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747405 [0,1,0,0,0,2|1,0,0]=4 9438 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000747405_100000185761 [0,1,0,0,0,2|1,0,0]=4 9439 B13R1.14 CCC(=O)CSc1ccc(cc1)O 62a_100000747405_100000185759 [0,1,0,0,0,2|1,0,0]=4 9440 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000210414 [0,1,0,0,0,2|1,0,0]=4 9441 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000210414 [0,1,0,0,0,2|1,0,0]=4 9442 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000210414 [0,1,0,0,0,2|1,0,0]=4 9443 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000210414 [0,1,0,0,0,2|1,0,0]=4 9444 B13R1.14 CCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000210414 [0,1,0,0,0,2|1,0,0]=4 9445 B13R1.14 CCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000210414 [0,1,0,0,0,2|1,0,0]=4 9446 B13R1.14 CCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000210414 [0,1,0,0,0,2|1,0,0]=4 9447 B13R1.14 CCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000210414 [0,1,0,0,0,2|1,0,0]=4 9448 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000210414 [0,1,0,0,0,2|1,0,0]=4 9449 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000210414 [0,1,0,0,0,2|1,0,0]=4 9450 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000210414 [0,1,0,0,0,2|1,0,0]=4 9451 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000210414 [0,1,0,0,0,2|1,0,0]=4 9452 B13R1.14 CCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000210414 [0,1,0,0,0,2|1,0,0]=4 9453 B13R1.14 CCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000210414 [0,1,0,0,0,2|1,0,0]=4 9454 B13R1.14 CCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000210414 [0,1,0,0,0,2|1,0,0]=4 9455 B13R1.14 CCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000210414 [0,1,0,0,0,2|1,0,0]=4 9456 B13R1.14 CCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000210414 [0,1,0,0,0,2|1,0,0]=4 9457 B13R1.14 CCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000210414 [0,1,0,0,0,2|1,0,0]=4 9458 B13R1.14 CCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000210414 [0,1,0,0,0,2|1,0,0]=4 9459 B13R1.14 CCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000210414 [0,1,0,0,0,2|1,0,0]=4 9460 B13R1.14 CCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210414 [0,1,0,0,0,2|1,0,0]=4 9461 B13R1.14 CCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000210414 [0,1,0,0,0,2|1,0,0]=4 9462 B13R1.14 CCC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000210414 [0,1,0,0,0,2|1,0,0]=4 9463 B13R1.14 CCC(=O)NNc1ccc(cc1)C 22a_100000683527_100000210414 [0,1,0,0,0,2|1,0,0]=4 9464 B13R1.14 CCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000210414 [0,1,0,0,0,2|1,0,0]=4 9465 B13R1.14 CCC(=O)NNc1ccc(cc1)F 22a_100000728448_100000210414 [0,1,0,0,0,2|1,0,0]=4 9466 B13R1.14 CCC(=O)NNc1ccc(cc1)I 22a_100016988836_100000210414 [0,1,0,0,0,2|1,0,0]=4 9467 B13R1.14 CNC(=O)C#Cc1ccc(cc1)Cl 240690a_100102657272_100011892723 [0,1,0,0,0,2|0,0,0]=3 9468 B13R1.14 CNC(=O)C#Cc1ccc(cc1)F 240690a_100102657272_100000238512 [0,1,0,0,0,2|0,0,0]=3 9469 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br 11a_106832991635_100016267368 [0,1,0,0,0,2|0,0,0]=3 9470 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br 1626a_100102657272_100016267368 [0,1,0,0,0,2|0,0,0]=3 9471 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 11a_106832991635_100000716854 [0,1,0,0,0,2|0,0,0]=3 9472 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 1626a_100102657272_100000716854 [0,1,0,0,0,2|0,0,0]=3 9473 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 240690a_100102657272_100000716854 [0,1,0,0,0,2|0,0,0]=3 9474 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 11a_106832991635_100000184863 [0,1,0,0,0,2|0,0,0]=3 9475 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 1626a_100102657272_100000184863 [0,1,0,0,0,2|0,0,0]=3 9476 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 240690a_100102657272_100000184863 [0,1,0,0,0,2|0,0,0]=3 9477 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 11a_106832991635_100000182136 [0,1,0,0,0,2|0,0,0]=3 9478 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 1626a_100102657272_100000182136 [0,1,0,0,0,2|0,0,0]=3 9479 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 240690a_100102657272_100000182136 [0,1,0,0,0,2|0,0,0]=3 9480 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 11a_106832991635_100102526154 [0,1,0,0,0,2|0,0,0]=3 9481 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 1626a_100102657272_100102526154 [0,1,0,0,0,2|0,0,0]=3 9482 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 240690a_100102657272_100102526154 [0,1,0,0,0,2|0,0,0]=3 9483 B13R1.14 CNC(=O)C=Cc1ccc(cc1)O 240690a_100102657272_100016269017 [0,1,0,0,0,2|0,0,0]=3 9484 B13R1.14 CNC(=O)C=Cc1ccc(cn1)F 11a_106832991635_100020630499 [0,1,0,0,0,2|1,0,0]=4 9485 B13R1.14 CNC(=O)C=Cc1ccc(cn1)F 1626a_100102657272_100020630499 [0,1,0,0,0,2|1,0,0]=4 9486 B13R1.14 CNC(=O)C=Cc1ccc(cn1)F 240690a_100102657272_100020630499 [0,1,0,0,0,2|1,0,0]=4 9487 B13R1.14 CNC(=O)C=Cc1ccc(nc1)Br 11a_106832991635_100020588214 [0,1,0,0,0,2|1,0,0]=4 9488 B13R1.14 CNC(=O)C=Cc1ccc(nc1)Br 1626a_100102657272_100020588214 [0,1,0,0,0,2|1,0,0]=4 9489 B13R1.14 CNC(=O)C=Cc1ccc(nc1)Br 240690a_100102657272_100020588214 [0,1,0,0,0,2|1,0,0]=4 9490 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 11a_106832991635_100000217147 [0,1,0,0,0,2|0,0,0]=3 9491 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 1626a_100102657272_100000217147 [0,1,0,0,0,2|0,0,0]=3 9492 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 240690a_100102657272_100000217147 [0,1,0,0,0,2|0,0,0]=3 9493 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 527a_100102657272_100000217147 [0,1,0,0,0,2|0,0,0]=3 9494 B13R1.14 CNC(=O)CCc1ccc(cc1)C 11a_106832991635_100000234883 [0,1,0,0,0,2|0,0,0]=3 9495 B13R1.14 CNC(=O)CCc1ccc(cc1)C 1626a_100102657272_100000234883 [0,1,0,0,0,2|0,0,0]=3 9496 B13R1.14 CNC(=O)CCc1ccc(cc1)C 240690a_100102657272_100000234883 [0,1,0,0,0,2|0,0,0]=3 9497 B13R1.14 CNC(=O)CCc1ccc(cc1)C 527a_100102657272_100000234883 [0,1,0,0,0,2|0,0,0]=3 9498 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 11a_106832991635_100000235379 [0,1,0,0,0,2|0,0,0]=3 9499 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 1626a_100102657272_100000235379 [0,1,0,0,0,2|0,0,0]=3 9500 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 240690a_100102657272_100000235379 [0,1,0,0,0,2|0,0,0]=3 9501 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 527a_100102657272_100000235379 [0,1,0,0,0,2|0,0,0]=3 9502 B13R1.14 CNC(=O)CCc1ccc(cc1)F 11a_106832991635_100000198493 [0,1,0,0,0,2|0,0,0]=3 9503 B13R1.14 CNC(=O)CCc1ccc(cc1)F 1626a_100102657272_100000198493 [0,1,0,0,0,2|0,0,0]=3 9504 B13R1.14 CNC(=O)CCc1ccc(cc1)F 240690a_100102657272_100000198493 [0,1,0,0,0,2|0,0,0]=3 9505 B13R1.14 CNC(=O)CCc1ccc(cc1)F 527a_100102657272_100000198493 [0,1,0,0,0,2|0,0,0]=3 9506 B13R1.14 CNC(=O)CCc1ccc(cc1)I 11a_106832991635_100011217499 [0,1,0,0,0,2|0,0,0]=3 9507 B13R1.14 CNC(=O)CCc1ccc(cc1)I 1626a_100102657272_100011217499 [0,1,0,0,0,2|0,0,0]=3 9508 B13R1.14 CNC(=O)CCc1ccc(cc1)I 240690a_100102657272_100011217499 [0,1,0,0,0,2|0,0,0]=3 9509 B13R1.14 CNC(=O)CCc1ccc(cc1)I 527a_100102657272_100011217499 [0,1,0,0,0,2|0,0,0]=3 9510 B13R1.14 CNC(=O)CCc1ccc(cc1)O 240690a_100102657272_100000742835 [0,1,0,0,0,2|0,0,0]=3 9511 B13R1.14 CNC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010273138 [0,1,0,0,0,2|0,0,0]=3 9512 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183359 [0,1,0,0,0,2|0,0,0]=3 9513 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000183359 [0,1,0,0,0,2|0,0,0]=3 9514 B13R1.14 CNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000183359 [0,1,0,0,0,2|0,0,0]=3 9515 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183359 [0,1,0,0,0,2|0,0,0]=3 9516 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000183359 [0,1,0,0,0,2|0,0,0]=3 9517 B13R1.14 CNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000183359 [0,1,0,0,0,2|0,0,0]=3 9518 B13R1.14 CNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000183359 [0,1,0,0,0,2|0,0,0]=3 9519 B13R1.14 CNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000183359 [0,1,0,0,0,2|0,0,0]=3 9520 B13R1.14 CNC(=O)CNc1ccc(cn1)Br 27a_100000693194_100000686858 [0,1,0,0,0,2|1,0,0]=4 9521 B13R1.14 CNC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000183359 [0,1,0,0,0,2|1,0,0]=4 9522 B13R1.14 CNC(=O)COc1ccc(cc1)Br 11a_106832991635_100000182358 [0,1,0,0,0,2|0,0,0]=3 9523 B13R1.14 CNC(=O)COc1ccc(cc1)Br 1626a_100102657272_100000182358 [0,1,0,0,0,2|0,0,0]=3 9524 B13R1.14 CNC(=O)COc1ccc(cc1)Br 240690a_100102657272_100000182358 [0,1,0,0,0,2|0,0,0]=3 9525 B13R1.14 CNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183359 [0,1,0,0,0,2|0,0,0]=3 9526 B13R1.14 CNC(=O)COc1ccc(cc1)Br 527a_100102657272_100000182358 [0,1,0,0,0,2|0,0,0]=3 9527 B13R1.14 CNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183359 [0,1,0,0,0,2|0,0,0]=3 9528 B13R1.14 CNC(=O)COc1ccc(cc1)C 11a_106832991635_100000182360 [0,1,0,0,0,2|0,0,0]=3 9529 B13R1.14 CNC(=O)COc1ccc(cc1)C 1626a_100102657272_100000182360 [0,1,0,0,0,2|0,0,0]=3 9530 B13R1.14 CNC(=O)COc1ccc(cc1)C 240690a_100102657272_100000182360 [0,1,0,0,0,2|0,0,0]=3 9531 B13R1.14 CNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183359 [0,1,0,0,0,2|0,0,0]=3 9532 B13R1.14 CNC(=O)COc1ccc(cc1)C 527a_100102657272_100000182360 [0,1,0,0,0,2|0,0,0]=3 9533 B13R1.14 CNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183359 [0,1,0,0,0,2|0,0,0]=3 9534 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 11a_106832991635_100016990877 [0,1,0,0,0,2|0,0,0]=3 9535 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 1626a_100102657272_100016990877 [0,1,0,0,0,2|0,0,0]=3 9536 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 240690a_100102657272_100016990877 [0,1,0,0,0,2|0,0,0]=3 9537 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183359 [0,1,0,0,0,2|0,0,0]=3 9538 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 527a_100102657272_100016990877 [0,1,0,0,0,2|0,0,0]=3 9539 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183359 [0,1,0,0,0,2|0,0,0]=3 9540 B13R1.14 CNC(=O)COc1ccc(cc1)F 11a_106832991635_100000184765 [0,1,0,0,0,2|0,0,0]=3 9541 B13R1.14 CNC(=O)COc1ccc(cc1)F 1626a_100102657272_100000184765 [0,1,0,0,0,2|0,0,0]=3 9542 B13R1.14 CNC(=O)COc1ccc(cc1)F 240690a_100102657272_100000184765 [0,1,0,0,0,2|0,0,0]=3 9543 B13R1.14 CNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183359 [0,1,0,0,0,2|0,0,0]=3 9544 B13R1.14 CNC(=O)COc1ccc(cc1)F 527a_100102657272_100000184765 [0,1,0,0,0,2|0,0,0]=3 9545 B13R1.14 CNC(=O)COc1ccc(cc1)I 11a_106832991635_100000184369 [0,1,0,0,0,2|0,0,0]=3 9546 B13R1.14 CNC(=O)COc1ccc(cc1)I 1626a_100102657272_100000184369 [0,1,0,0,0,2|0,0,0]=3 9547 B13R1.14 CNC(=O)COc1ccc(cc1)I 240690a_100102657272_100000184369 [0,1,0,0,0,2|0,0,0]=3 9548 B13R1.14 CNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183359 [0,1,0,0,0,2|0,0,0]=3 9549 B13R1.14 CNC(=O)COc1ccc(cc1)I 527a_100102657272_100000184369 [0,1,0,0,0,2|0,0,0]=3 9550 B13R1.14 CNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183359 [0,1,0,0,0,2|0,0,0]=3 9551 B13R1.14 CNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183359 [0,1,0,0,0,2|0,0,0]=3 9552 B13R1.14 CNC(=O)COc1ccc(cc1)O 240690a_100102657272_100000031633 [0,1,0,0,0,2|0,0,0]=3 9553 B13R1.14 CNC(=O)COc1ccc(cc1)O 271570a_203496583355_200000150405 [0,1,0,0,0,2|0,0,0]=3 9554 B13R1.14 CNC(=O)COc1ccc(cc1)O 527a_100102657272_100000031633 [0,1,0,0,0,2|0,0,0]=3 9555 B13R1.14 CNC(=O)COc1ccc(cn1)C 34a_100000759353_100000183359 [0,1,0,0,0,2|1,0,0]=4 9556 B13R1.14 CNC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000183359 [0,1,0,0,0,2|1,0,0]=4 9557 B13R1.14 CNC(=O)COc1ccc(cn1)F 34a_100000742473_100000183359 [0,1,0,0,0,2|1,0,0]=4 9558 B13R1.14 CNC(=O)COc1ccc(cn1)N 34a_100000729260_100000183359 [0,1,0,0,0,2|1,0,0]=4 9559 B13R1.14 CNC(=O)COc1ccc(nc1)Br 34a_100000685995_100000183359 [0,1,0,0,0,2|1,0,0]=4 9560 B13R1.14 CNC(=O)COc1ccc(nc1)Br 7a_100000685995_100000183359 [0,1,0,0,0,2|1,0,0]=4 9561 B13R1.14 CNC(=O)COc1ccc(nc1)C 34a_100000745506_100000183359 [0,1,0,0,0,2|1,0,0]=4 9562 B13R1.14 CNC(=O)COc1ccc(nc1)C 7a_100000745506_100000183359 [0,1,0,0,0,2|1,0,0]=4 9563 B13R1.14 CNC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000183359 [0,1,0,0,0,2|1,0,0]=4 9564 B13R1.14 CNC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000183359 [0,1,0,0,0,2|1,0,0]=4 9565 B13R1.14 CNC(=O)COc1ccc(nc1)F 34a_100000688820_100000183359 [0,1,0,0,0,2|1,0,0]=4 9566 B13R1.14 CNC(=O)COc1ccc(nc1)F 7a_100000688820_100000183359 [0,1,0,0,0,2|1,0,0]=4 9567 B13R1.14 CNC(=O)COc1ccc(nc1)I 34a_100000687607_100000183359 [0,1,0,0,0,2|1,0,0]=4 9568 B13R1.14 CNC(=O)COc1ccc(nc1)I 7a_100000687607_100000183359 [0,1,0,0,0,2|1,0,0]=4 9569 B13R1.14 CNC(=O)COc1ccc(nc1)N 34a_100015188713_100000183359 [0,1,0,0,0,2|1,0,0]=4 9570 B13R1.14 CNC(=O)COc1ccc(nc1)N 7a_100015188713_100000183359 [0,1,0,0,0,2|1,0,0]=4 9571 B13R1.14 CNC(=O)CSc1cc[n+](cc1)[O-] 62a_100000183359_100000039755 [0,1,0,0,0,2|1,0,0]=4 9572 B13R1.14 CNC(=O)CSc1ccc(=O)[nH]c1 62a_100000183359_100000212171 [0,1,0,0,0,2|1,0,0]=4 9573 B13R1.14 CNC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000183359 [0,1,0,0,0,2|1,0,0]=4 9574 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 11a_106832991635_100000179496 [0,1,0,0,0,2|0,0,0]=3 9575 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 1626a_100102657272_100000179496 [0,1,0,0,0,2|0,0,0]=3 9576 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 240690a_100102657272_100000179496 [0,1,0,0,0,2|0,0,0]=3 9577 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 527a_100102657272_100000179496 [0,1,0,0,0,2|0,0,0]=3 9578 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000183359_100000752885 [0,1,0,0,0,2|0,0,0]=3 9579 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183359 [0,1,0,0,0,2|0,0,0]=3 9580 B13R1.14 CNC(=O)CSc1ccc(cc1)C 11a_106832991635_100000179497 [0,1,0,0,0,2|0,0,0]=3 9581 B13R1.14 CNC(=O)CSc1ccc(cc1)C 1626a_100102657272_100000179497 [0,1,0,0,0,2|0,0,0]=3 9582 B13R1.14 CNC(=O)CSc1ccc(cc1)C 240690a_100102657272_100000179497 [0,1,0,0,0,2|0,0,0]=3 9583 B13R1.14 CNC(=O)CSc1ccc(cc1)C 527a_100102657272_100000179497 [0,1,0,0,0,2|0,0,0]=3 9584 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000183359_100000186775 [0,1,0,0,0,2|0,0,0]=3 9585 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183359 [0,1,0,0,0,2|0,0,0]=3 9586 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 11a_106832991635_100000178402 [0,1,0,0,0,2|0,0,0]=3 9587 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 1626a_100102657272_100000178402 [0,1,0,0,0,2|0,0,0]=3 9588 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 240690a_100102657272_100000178402 [0,1,0,0,0,2|0,0,0]=3 9589 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 527a_100102657272_100000178402 [0,1,0,0,0,2|0,0,0]=3 9590 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000183359_100000755918 [0,1,0,0,0,2|0,0,0]=3 9591 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183359 [0,1,0,0,0,2|0,0,0]=3 9592 B13R1.14 CNC(=O)CSc1ccc(cc1)F 11a_106832991635_100000691584 [0,1,0,0,0,2|0,0,0]=3 9593 B13R1.14 CNC(=O)CSc1ccc(cc1)F 1626a_100102657272_100000691584 [0,1,0,0,0,2|0,0,0]=3 9594 B13R1.14 CNC(=O)CSc1ccc(cc1)F 240690a_100102657272_100000691584 [0,1,0,0,0,2|0,0,0]=3 9595 B13R1.14 CNC(=O)CSc1ccc(cc1)F 527a_100102657272_100000691584 [0,1,0,0,0,2|0,0,0]=3 9596 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000183359_100000211213 [0,1,0,0,0,2|0,0,0]=3 9597 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183359 [0,1,0,0,0,2|0,0,0]=3 9598 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000183359_100000185761 [0,1,0,0,0,2|0,0,0]=3 9599 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183359 [0,1,0,0,0,2|0,0,0]=3 9600 B13R1.14 CNC(=O)CSc1ccc(cc1)O 62a_100000183359_100000185759 [0,1,0,0,0,2|0,0,0]=3 9601 B13R1.14 CNC(=O)CSc1ccc(cn1)Br 62a_100000183359_100000686858 [0,1,0,0,0,2|1,0,0]=4 9602 B13R1.14 CNC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000183359 [0,1,0,0,0,2|1,0,0]=4 9603 B13R1.14 CNC(=O)CSc1ccc(cn1)C 62a_100000183359_100000754016 [0,1,0,0,0,2|1,0,0]=4 9604 B13R1.14 CNC(=O)CSc1ccc(cn1)C 62a_100011192072_100000183359 [0,1,0,0,0,2|1,0,0]=4 9605 B13R1.14 CNC(=O)CSc1ccc(cn1)Cl 62a_100000183359_100011356976 [0,1,0,0,0,2|1,0,0]=4 9606 B13R1.14 CNC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000183359 [0,1,0,0,0,2|1,0,0]=4 9607 B13R1.14 CNC(=O)CSc1ccc(cn1)F 62a_100000183359_100000744514 [0,1,0,0,0,2|1,0,0]=4 9608 B13R1.14 CNC(=O)CSc1ccc(cn1)F 62a_100000744514_100000183359 [0,1,0,0,0,2|1,0,0]=4 9609 B13R1.14 CNC(=O)CSc1ccc(cn1)N 62a_100000183359_100000737798 [0,1,0,0,0,2|1,0,0]=4 9610 B13R1.14 CNC(=O)CSc1ccc(cn1)N 62a_100000737798_100000183359 [0,1,0,0,0,2|1,0,0]=4 9611 B13R1.14 CNC(=O)CSc1ccc(cn1)O 62a_100000183359_100000744096 [0,1,0,0,0,2|1,0,0]=4 9612 B13R1.14 CNC(=O)CSc1ccc(cn1)O 62a_100000685995_100000183359 [0,1,0,0,0,2|1,0,0]=4 9613 B13R1.14 CNC(=O)CSc1ccc(nc1)Br 62a_100000183359_100009814638 [0,1,0,0,0,2|1,0,0]=4 9614 B13R1.14 CNC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000183359 [0,1,0,0,0,2|1,0,0]=4 9615 B13R1.14 CNC(=O)CSc1ccc(nc1)C 62a_100000183359_100000751577 [0,1,0,0,0,2|1,0,0]=4 9616 B13R1.14 CNC(=O)CSc1ccc(nc1)C 62a_100000751577_100000183359 [0,1,0,0,0,2|1,0,0]=4 9617 B13R1.14 CNC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000183359 [0,1,0,0,0,2|1,0,0]=4 9618 B13R1.14 CNC(=O)CSc1ccc(nc1)Cl 62a_100000183359_100000034144 [0,1,0,0,0,2|1,0,0]=4 9619 B13R1.14 CNC(=O)CSc1ccc(nc1)F 62a_100000042367_100000183359 [0,1,0,0,0,2|1,0,0]=4 9620 B13R1.14 CNC(=O)CSc1ccc(nc1)F 62a_100000183359_100000042367 [0,1,0,0,0,2|1,0,0]=4 9621 B13R1.14 CNC(=O)CSc1ccc(nc1)N 62a_100000183359_100000187370 [0,1,0,0,0,2|1,0,0]=4 9622 B13R1.14 CNC(=O)CSc1ccc(nc1)N 62a_100000187370_100000183359 [0,1,0,0,0,2|1,0,0]=4 9623 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_106832991635 [0,1,0,0,0,2|0,0,0]=3 9624 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100102657272_100000174875 [0,1,0,0,0,2|0,0,0]=3 9625 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100102657272 [0,1,0,0,0,2|0,0,0]=3 9626 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100102657272_100000174875 [0,1,0,0,0,2|0,0,0]=3 9627 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100102657272 [0,1,0,0,0,2|0,0,0]=3 9628 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_106832991638_100000174875 [0,1,0,0,0,2|0,0,0]=3 9629 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100000174908_106832991635 [0,1,0,0,0,2|0,0,0]=3 9630 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100102657272_100000174908 [0,1,0,0,0,2|0,0,0]=3 9631 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100102657272 [0,1,0,0,0,2|0,0,0]=3 9632 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100102657272_100000174908 [0,1,0,0,0,2|0,0,0]=3 9633 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_100000174908_100102657272 [0,1,0,0,0,2|0,0,0]=3 9634 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_106832991638_100000174908 [0,1,0,0,0,2|0,0,0]=3 9635 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_106832991635 [0,1,0,0,0,2|0,0,0]=3 9636 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100102657272_100000174871 [0,1,0,0,0,2|0,0,0]=3 9637 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100102657272 [0,1,0,0,0,2|0,0,0]=3 9638 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100102657272_100000174871 [0,1,0,0,0,2|0,0,0]=3 9639 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 512a_106832991638_100000174871 [0,1,0,0,0,2|0,0,0]=3 9640 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100000174882_106832991635 [0,1,0,0,0,2|0,0,0]=3 9641 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100102657272_100000174882 [0,1,0,0,0,2|0,0,0]=3 9642 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100102657272 [0,1,0,0,0,2|0,0,0]=3 9643 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100102657272_100000174882 [0,1,0,0,0,2|0,0,0]=3 9644 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_100000174882_100102657272 [0,1,0,0,0,2|0,0,0]=3 9645 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_106832991638_100000174882 [0,1,0,0,0,2|0,0,0]=3 9646 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100016989417_106832991635 [0,1,0,0,0,2|0,0,0]=3 9647 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100102657272_100016989417 [0,1,0,0,0,2|0,0,0]=3 9648 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100102657272 [0,1,0,0,0,2|0,0,0]=3 9649 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100102657272_100016989417 [0,1,0,0,0,2|0,0,0]=3 9650 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_100016989417_100102657272 [0,1,0,0,0,2|0,0,0]=3 9651 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_106832991638_100016989417 [0,1,0,0,0,2|0,0,0]=3 9652 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100000185549_106832991635 [0,1,0,0,0,2|0,0,0]=3 9653 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100102657272_100000185549 [0,1,0,0,0,2|0,0,0]=3 9654 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100102657272 [0,1,0,0,0,2|0,0,0]=3 9655 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100102657272_100000185549 [0,1,0,0,0,2|0,0,0]=3 9656 B13R1.14 CNC(=O)NCc1ccc(cc1)O 512a_106832991638_100000185549 [0,1,0,0,0,2|0,0,0]=3 9657 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 2708a_100015188789_106832991635 [0,1,0,0,0,2|1,0,0]=4 9658 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 2708a_100102657272_100015188789 [0,1,0,0,0,2|1,0,0]=4 9659 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 273464a_100015188789_100102657272 [0,1,0,0,0,2|1,0,0]=4 9660 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 273464a_100102657272_100015188789 [0,1,0,0,0,2|1,0,0]=4 9661 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 512a_100015188789_100102657272 [0,1,0,0,0,2|1,0,0]=4 9662 B13R1.14 CNC(=O)NCc1ccc(cn1)Br 512a_106832991638_100015188789 [0,1,0,0,0,2|1,0,0]=4 9663 B13R1.14 CNC(=O)NCc1ccc(cn1)C 2708a_100015187455_106832991635 [0,1,0,0,0,2|1,0,0]=4 9664 B13R1.14 CNC(=O)NCc1ccc(cn1)C 2708a_100102657272_100015187455 [0,1,0,0,0,2|1,0,0]=4 9665 B13R1.14 CNC(=O)NCc1ccc(cn1)C 273464a_100015187455_100102657272 [0,1,0,0,0,2|1,0,0]=4 9666 B13R1.14 CNC(=O)NCc1ccc(cn1)C 273464a_100102657272_100015187455 [0,1,0,0,0,2|1,0,0]=4 9667 B13R1.14 CNC(=O)NCc1ccc(cn1)C 512a_100015187455_100102657272 [0,1,0,0,0,2|1,0,0]=4 9668 B13R1.14 CNC(=O)NCc1ccc(cn1)C 512a_106832991638_100015187455 [0,1,0,0,0,2|1,0,0]=4 9669 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 2708a_100000697193_106832991635 [0,1,0,0,0,2|1,0,0]=4 9670 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 2708a_100102657272_100000697193 [0,1,0,0,0,2|1,0,0]=4 9671 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 273464a_100000697193_100102657272 [0,1,0,0,0,2|1,0,0]=4 9672 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 273464a_100102657272_100000697193 [0,1,0,0,0,2|1,0,0]=4 9673 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 512a_100000697193_100102657272 [0,1,0,0,0,2|1,0,0]=4 9674 B13R1.14 CNC(=O)NCc1ccc(cn1)Cl 512a_106832991638_100000697193 [0,1,0,0,0,2|1,0,0]=4 9675 B13R1.14 CNC(=O)NCc1ccc(cn1)F 2708a_100020620131_106832991635 [0,1,0,0,0,2|1,0,0]=4 9676 B13R1.14 CNC(=O)NCc1ccc(cn1)F 2708a_100102657272_100020620131 [0,1,0,0,0,2|1,0,0]=4 9677 B13R1.14 CNC(=O)NCc1ccc(cn1)F 273464a_100020620131_100102657272 [0,1,0,0,0,2|1,0,0]=4 9678 B13R1.14 CNC(=O)NCc1ccc(cn1)F 273464a_100102657272_100020620131 [0,1,0,0,0,2|1,0,0]=4 9679 B13R1.14 CNC(=O)NCc1ccc(cn1)F 512a_100020620131_100102657272 [0,1,0,0,0,2|1,0,0]=4 9680 B13R1.14 CNC(=O)NCc1ccc(cn1)F 512a_106832991638_100020620131 [0,1,0,0,0,2|1,0,0]=4 9681 B13R1.14 CNC(=O)NCc1ccc(cn1)O 2708a_100020605196_106832991635 [0,1,0,0,0,2|1,0,0]=4 9682 B13R1.14 CNC(=O)NCc1ccc(cn1)O 2708a_100102657272_100020605196 [0,1,0,0,0,2|1,0,0]=4 9683 B13R1.14 CNC(=O)NCc1ccc(cn1)O 273464a_100020605196_100102657272 [0,1,0,0,0,2|1,0,0]=4 9684 B13R1.14 CNC(=O)NCc1ccc(cn1)O 273464a_100102657272_100020605196 [0,1,0,0,0,2|1,0,0]=4 9685 B13R1.14 CNC(=O)NCc1ccc(cn1)O 512a_106832991638_100020605196 [0,1,0,0,0,2|1,0,0]=4 9686 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 2708a_100009817727_106832991635 [0,1,0,0,0,2|1,0,0]=4 9687 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 2708a_100102657272_100009817727 [0,1,0,0,0,2|1,0,0]=4 9688 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 273464a_100009817727_100102657272 [0,1,0,0,0,2|1,0,0]=4 9689 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 273464a_100102657272_100009817727 [0,1,0,0,0,2|1,0,0]=4 9690 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 512a_100009817727_100102657272 [0,1,0,0,0,2|1,0,0]=4 9691 B13R1.14 CNC(=O)NCc1ccc(nc1)Br 512a_106832991638_100009817727 [0,1,0,0,0,2|1,0,0]=4 9692 B13R1.14 CNC(=O)NCc1ccc(nc1)C 2708a_100000740942_106832991635 [0,1,0,0,0,2|1,0,0]=4 9693 B13R1.14 CNC(=O)NCc1ccc(nc1)C 2708a_100102657272_100000740942 [0,1,0,0,0,2|1,0,0]=4 9694 B13R1.14 CNC(=O)NCc1ccc(nc1)C 273464a_100000740942_100102657272 [0,1,0,0,0,2|1,0,0]=4 9695 B13R1.14 CNC(=O)NCc1ccc(nc1)C 273464a_100102657272_100000740942 [0,1,0,0,0,2|1,0,0]=4 9696 B13R1.14 CNC(=O)NCc1ccc(nc1)C 512a_100000740942_100102657272 [0,1,0,0,0,2|1,0,0]=4 9697 B13R1.14 CNC(=O)NCc1ccc(nc1)C 512a_106832991638_100000740942 [0,1,0,0,0,2|1,0,0]=4 9698 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 2708a_100000735879_106832991635 [0,1,0,0,0,2|1,0,0]=4 9699 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 2708a_100102657272_100000735879 [0,1,0,0,0,2|1,0,0]=4 9700 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 273464a_100000735879_100102657272 [0,1,0,0,0,2|1,0,0]=4 9701 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 273464a_100102657272_100000735879 [0,1,0,0,0,2|1,0,0]=4 9702 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 512a_100000735879_100102657272 [0,1,0,0,0,2|1,0,0]=4 9703 B13R1.14 CNC(=O)NCc1ccc(nc1)Cl 512a_106832991638_100000735879 [0,1,0,0,0,2|1,0,0]=4 9704 B13R1.14 CNC(=O)NCc1ccc(nc1)F 2708a_100000101913_106832991635 [0,1,0,0,0,2|1,0,0]=4 9705 B13R1.14 CNC(=O)NCc1ccc(nc1)F 2708a_100102657272_100000101913 [0,1,0,0,0,2|1,0,0]=4 9706 B13R1.14 CNC(=O)NCc1ccc(nc1)F 273464a_100000101913_100102657272 [0,1,0,0,0,2|1,0,0]=4 9707 B13R1.14 CNC(=O)NCc1ccc(nc1)F 273464a_100102657272_100000101913 [0,1,0,0,0,2|1,0,0]=4 9708 B13R1.14 CNC(=O)NCc1ccc(nc1)F 512a_100000101913_100102657272 [0,1,0,0,0,2|1,0,0]=4 9709 B13R1.14 CNC(=O)NCc1ccc(nc1)F 512a_106832991638_100000101913 [0,1,0,0,0,2|1,0,0]=4 9710 B13R1.14 CNC(=O)NCc1ccc(nc1)O 2708a_100000757128_106832991635 [0,1,0,0,0,2|1,0,0]=4 9711 B13R1.14 CNC(=O)NCc1ccc(nc1)O 2708a_100102657272_100000757128 [0,1,0,0,0,2|1,0,0]=4 9712 B13R1.14 CNC(=O)NCc1ccc(nc1)O 273464a_100000757128_100102657272 [0,1,0,0,0,2|1,0,0]=4 9713 B13R1.14 CNC(=O)NCc1ccc(nc1)O 273464a_100102657272_100000757128 [0,1,0,0,0,2|1,0,0]=4 9714 B13R1.14 CNC(=O)NCc1ccc(nc1)O 512a_106832991638_100000757128 [0,1,0,0,0,2|1,0,0]=4 9715 B13R1.14 CNC(=O)NNc1ccc(cc1)Br 273464a_100102657272_100000735608 [0,1,0,0,0,2|0,0,0]=3 9716 B13R1.14 CNC(=O)NNc1ccc(cc1)Br 512a_106832991638_100000735608 [0,1,0,0,0,2|0,0,0]=3 9717 B13R1.14 CNC(=O)NNc1ccc(cc1)C 273464a_100102657272_100000683527 [0,1,0,0,0,2|0,0,0]=3 9718 B13R1.14 CNC(=O)NNc1ccc(cc1)C 512a_106832991638_100000683527 [0,1,0,0,0,2|0,0,0]=3 9719 B13R1.14 CNC(=O)NNc1ccc(cc1)Cl 273464a_100102657272_100000683521 [0,1,0,0,0,2|0,0,0]=3 9720 B13R1.14 CNC(=O)NNc1ccc(cc1)Cl 512a_106832991638_100000683521 [0,1,0,0,0,2|0,0,0]=3 9721 B13R1.14 CNC(=O)NNc1ccc(cc1)F 273464a_100102657272_100000728448 [0,1,0,0,0,2|0,0,0]=3 9722 B13R1.14 CNC(=O)NNc1ccc(cc1)F 512a_106832991638_100000728448 [0,1,0,0,0,2|0,0,0]=3 9723 B13R1.14 CNC(=O)NNc1ccc(cc1)I 273464a_100102657272_100016988836 [0,1,0,0,0,2|0,0,0]=3 9724 B13R1.14 CNC(=O)NNc1ccc(cc1)I 512a_106832991638_100016988836 [0,1,0,0,0,2|0,0,0]=3 9725 B13R1.14 CNC(=O)NNc1ccc(cn1)Br 273464a_100102657272_100000750576 [0,1,0,0,0,2|1,0,0]=4 9726 B13R1.14 CNC(=O)NNc1ccc(cn1)Br 512a_106832991638_100000750576 [0,1,0,0,0,2|1,0,0]=4 9727 B13R1.14 CNC(=O)NNc1ccc(cn1)C 273464a_100102657272_100000746693 [0,1,0,0,0,2|1,0,0]=4 9728 B13R1.14 CNC(=O)NNc1ccc(cn1)C 512a_106832991638_100000746693 [0,1,0,0,0,2|1,0,0]=4 9729 B13R1.14 CNC(=O)NNc1ccc(cn1)Cl 273464a_100102657272_100011206499 [0,1,0,0,0,2|1,0,0]=4 9730 B13R1.14 CNC(=O)NNc1ccc(cn1)Cl 512a_106832991638_100011206499 [0,1,0,0,0,2|1,0,0]=4 9731 B13R1.14 CNC(=O)NNc1ccc(cn1)F 273464a_100102657272_100000753838 [0,1,0,0,0,2|1,0,0]=4 9732 B13R1.14 CNC(=O)NNc1ccc(cn1)F 512a_106832991638_100000753838 [0,1,0,0,0,2|1,0,0]=4 9733 B13R1.14 CNC(=O)NNc1ccc(cn1)I 273464a_100102657272_100010221006 [0,1,0,0,0,2|1,0,0]=4 9734 B13R1.14 CNC(=O)NNc1ccc(cn1)I 512a_106832991638_100010221006 [0,1,0,0,0,2|1,0,0]=4 9735 B13R1.14 CNC(=O)NNc1ccc(nc1)Br 273464a_100102657272_100000755011 [0,1,0,0,0,2|1,0,0]=4 9736 B13R1.14 CNC(=O)NNc1ccc(nc1)Br 512a_106832991638_100000755011 [0,1,0,0,0,2|1,0,0]=4 9737 B13R1.14 CNC(=O)NNc1ccc(nc1)C 273464a_100102657272_100020639869 [0,1,0,0,0,2|1,0,0]=4 9738 B13R1.14 CNC(=O)NNc1ccc(nc1)C 512a_106832991638_100020639869 [0,1,0,0,0,2|1,0,0]=4 9739 B13R1.14 CNC(=O)NNc1ccc(nc1)Cl 273464a_100102657272_100000119030 [0,1,0,0,0,2|1,0,0]=4 9740 B13R1.14 CNC(=O)NNc1ccc(nc1)Cl 512a_106832991638_100000119030 [0,1,0,0,0,2|1,0,0]=4 9741 B13R1.14 CNC(=O)NNc1ccc(nc1)F 273464a_100102657272_100000120849 [0,1,0,0,0,2|1,0,0]=4 9742 B13R1.14 CNC(=O)NNc1ccc(nc1)F 512a_106832991638_100000120849 [0,1,0,0,0,2|1,0,0]=4 9743 B13R1.14 COC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_100000148628 [0,1,0,0,0,2|1,0,0]=4 9744 B13R1.14 COC(=O)C#Cc1ccc(cc1)O 271570a_203496583355_100012100070 [0,1,0,0,0,2|1,0,0]=4 9745 B13R1.14 COC(=O)CCc1ccc(cc1)O 271570a_203496583355_100012357364 [0,1,0,0,0,2|1,0,0]=4 9746 B13R1.14 COC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747449 [0,1,0,0,0,2|1,0,0]=4 9747 B13R1.14 COC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000747449 [0,1,0,0,0,2|1,0,0]=4 9748 B13R1.14 COC(=O)CNc1ccc(cc1)C 34a_100000124888_100000747449 [0,1,0,0,0,2|1,0,0]=4 9749 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747449 [0,1,0,0,0,2|1,0,0]=4 9750 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000747449 [0,1,0,0,0,2|1,0,0]=4 9751 B13R1.14 COC(=O)CNc1ccc(cc1)F 34a_100000185862_100000747449 [0,1,0,0,0,2|1,0,0]=4 9752 B13R1.14 COC(=O)CNc1ccc(cc1)I 34a_100000185761_100000747449 [0,1,0,0,0,2|1,0,0]=4 9753 B13R1.14 COC(=O)CNc1ccc(cc1)O 34a_100000185829_100000747449 [0,1,0,0,0,2|1,0,0]=4 9754 B13R1.14 COC(=O)COc1ccc(cc1)Br 34a_100000185759_100000747449 [0,1,0,0,0,2|1,0,0]=4 9755 B13R1.14 COC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747449 [0,1,0,0,0,2|1,0,0]=4 9756 B13R1.14 COC(=O)COc1ccc(cc1)C 34a_100000210336_100000747449 [0,1,0,0,0,2|1,0,0]=4 9757 B13R1.14 COC(=O)COc1ccc(cc1)C 7a_100000210336_100000747449 [0,1,0,0,0,2|1,0,0]=4 9758 B13R1.14 COC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000747449 [0,1,0,0,0,2|1,0,0]=4 9759 B13R1.14 COC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747449 [0,1,0,0,0,2|1,0,0]=4 9760 B13R1.14 COC(=O)COc1ccc(cc1)F 34a_100000210339_100000747449 [0,1,0,0,0,2|1,0,0]=4 9761 B13R1.14 COC(=O)COc1ccc(cc1)I 34a_100000212066_100000747449 [0,1,0,0,0,2|1,0,0]=4 9762 B13R1.14 COC(=O)COc1ccc(cc1)I 7a_100000212066_100000747449 [0,1,0,0,0,2|1,0,0]=4 9763 B13R1.14 COC(=O)COc1ccc(cc1)N 34a_100000185829_100000747449 [0,1,0,0,0,2|1,0,0]=4 9764 B13R1.14 COC(=O)COc1ccc(cc1)O 271570a_203496583355_100000149925 [0,1,0,0,0,2|1,0,0]=4 9765 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000747449_100000752885 [0,1,0,0,0,2|1,0,0]=4 9766 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747449 [0,1,0,0,0,2|1,0,0]=4 9767 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747449 [0,1,0,0,0,2|1,0,0]=4 9768 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000747449_100000186775 [0,1,0,0,0,2|1,0,0]=4 9769 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000747449_100000755918 [0,1,0,0,0,2|1,0,0]=4 9770 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747449 [0,1,0,0,0,2|1,0,0]=4 9771 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747449 [0,1,0,0,0,2|1,0,0]=4 9772 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000747449_100000211213 [0,1,0,0,0,2|1,0,0]=4 9773 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747449 [0,1,0,0,0,2|1,0,0]=4 9774 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000747449_100000185761 [0,1,0,0,0,2|1,0,0]=4 9775 B13R1.14 COC(=O)CSc1ccc(cc1)O 62a_100000747449_100000185759 [0,1,0,0,0,2|1,0,0]=4 9776 B13R1.14 NNC(=O)COc1ccc(cc1)O 271570a_203496583355_100000182278 [0,1,0,0,0,2|1,0,0]=4 9777 B13R1.15 CCC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_100000210202 [0,1,0,0,0,2|1,0,0]=4 9778 B13R1.15 CCC(=O)C#Cc1cccc(c1)C 1458a_100011892726_100000210202 [0,1,0,0,0,2|1,0,0]=4 9779 B13R1.15 CCC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_100000210202 [0,1,0,0,0,2|1,0,0]=4 9780 B13R1.15 CCC(=O)C#Cc1cccc(c1)F 1458a_100011892744_100000210202 [0,1,0,0,0,2|1,0,0]=4 9781 B13R1.15 CCC(=O)C#Cc1cccc(c1)O 1458a_200009909484_100000210202 [0,1,0,0,0,2|1,0,0]=4 9782 B13R1.15 CCC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_100000210202 [0,1,0,0,0,2|1,0,0]=4 9783 B13R1.15 CCC(=O)C=Cc1cccc(c1)Br 6a_100000210085_100000211110 [0,1,0,0,0,2|1,0,0]=4 9784 B13R1.15 CCC(=O)C=Cc1cccc(c1)C 1458a_100000690095_100000210202 [0,1,0,0,0,2|1,0,0]=4 9785 B13R1.15 CCC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_100000210202 [0,1,0,0,0,2|1,0,0]=4 9786 B13R1.15 CCC(=O)C=Cc1cccc(c1)F 1458a_100000718793_100000210202 [0,1,0,0,0,2|1,0,0]=4 9787 B13R1.15 CCC(=O)C=Cc1cccc(c1)F 6a_100000210812_100000211110 [0,1,0,0,0,2|1,0,0]=4 9788 B13R1.15 CCC(=O)C=Cc1cccc(c1)I 1458a_100020647043_100000210202 [0,1,0,0,0,2|1,0,0]=4 9789 B13R1.15 CCC(=O)C=Cc1cccc(c1)I 6a_100000014684_100000211110 [0,1,0,0,0,2|1,0,0]=4 9790 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000210202 [0,1,0,0,0,2|1,0,0]=4 9791 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000210414_100011740638 [0,1,0,0,0,2|1,0,0]=4 9792 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000210414_100011713685 [0,1,0,0,0,2|1,0,0]=4 9793 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000210202 [0,1,0,0,0,2|1,0,0]=4 9794 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000210414_100011713710 [0,1,0,0,0,2|1,0,0]=4 9795 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000210202 [0,1,0,0,0,2|1,0,0]=4 9796 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000210414_100011217235 [0,1,0,0,0,2|1,0,0]=4 9797 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000210202 [0,1,0,0,0,2|1,0,0]=4 9798 B13R1.15 CCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000210202 [0,1,0,0,0,2|1,0,0]=4 9799 B13R1.15 CCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000210202 [0,1,0,0,0,2|1,0,0]=4 9800 B13R1.15 CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210202 [0,1,0,0,0,2|1,0,0]=4 9801 B13R1.15 CCC(=O)COc1cccc(c1)Br 7a_100000210342_100000747405 [0,1,0,0,0,2|1,0,0]=4 9802 B13R1.15 CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210202 [0,1,0,0,0,2|1,0,0]=4 9803 B13R1.15 CCC(=O)COc1cccc(c1)C 7a_100000210337_100000747405 [0,1,0,0,0,2|1,0,0]=4 9804 B13R1.15 CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210202 [0,1,0,0,0,2|1,0,0]=4 9805 B13R1.15 CCC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747405 [0,1,0,0,0,2|1,0,0]=4 9806 B13R1.15 CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210202 [0,1,0,0,0,2|1,0,0]=4 9807 B13R1.15 CCC(=O)COc1cccc(c1)F 7a_100000210426_100000747405 [0,1,0,0,0,2|1,0,0]=4 9808 B13R1.15 CCC(=O)COc1cccc(c1)I 7a_100000211634_100000747405 [0,1,0,0,0,2|1,0,0]=4 9809 B13R1.15 CCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000210202 [0,1,0,0,0,2|1,0,0]=4 9810 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747405 [0,1,0,0,0,2|1,0,0]=4 9811 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000747405_100000691529 [0,1,0,0,0,2|1,0,0]=4 9812 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100000747405_100011215228 [0,1,0,0,0,2|1,0,0]=4 9813 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100011215228_100000747405 [0,1,0,0,0,2|1,0,0]=4 9814 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747405 [0,1,0,0,0,2|1,0,0]=4 9815 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000747405_100000699651 [0,1,0,0,0,2|1,0,0]=4 9816 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000685547_100000747405 [0,1,0,0,0,2|1,0,0]=4 9817 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000747405_100000685547 [0,1,0,0,0,2|1,0,0]=4 9818 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000210019_100000747405 [0,1,0,0,0,2|1,0,0]=4 9819 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000747405_100000210019 [0,1,0,0,0,2|1,0,0]=4 9820 B13R1.15 CCC(=O)CSc1cccc(c1)O 62a_100000747405_100000211634 [0,1,0,0,0,2|1,0,0]=4 9821 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_100000747405_114929384022 [0,1,0,0,0,2|1,0,0]=4 9822 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747405 [0,1,0,0,0,2|1,0,0]=4 9823 B13R1.15 CCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000210414 [0,1,0,0,0,2|1,0,0]=4 9824 B13R1.15 CCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000210414 [0,1,0,0,0,2|1,0,0]=4 9825 B13R1.15 CCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000210414 [0,1,0,0,0,2|1,0,0]=4 9826 B13R1.15 CCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000210414 [0,1,0,0,0,2|1,0,0]=4 9827 B13R1.15 CCC(=O)NCc1cccc(c1)C 11a_100000185548_100000210414 [0,1,0,0,0,2|1,0,0]=4 9828 B13R1.15 CCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000210414 [0,1,0,0,0,2|1,0,0]=4 9829 B13R1.15 CCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000210414 [0,1,0,0,0,2|1,0,0]=4 9830 B13R1.15 CCC(=O)NCc1cccc(c1)C 527a_100000185548_100000210414 [0,1,0,0,0,2|1,0,0]=4 9831 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000210414 [0,1,0,0,0,2|1,0,0]=4 9832 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000210414 [0,1,0,0,0,2|1,0,0]=4 9833 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000210414 [0,1,0,0,0,2|1,0,0]=4 9834 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000210414 [0,1,0,0,0,2|1,0,0]=4 9835 B13R1.15 CCC(=O)NCc1cccc(c1)F 11a_100000174948_100000210414 [0,1,0,0,0,2|1,0,0]=4 9836 B13R1.15 CCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000210414 [0,1,0,0,0,2|1,0,0]=4 9837 B13R1.15 CCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000210414 [0,1,0,0,0,2|1,0,0]=4 9838 B13R1.15 CCC(=O)NCc1cccc(c1)F 527a_100000174948_100000210414 [0,1,0,0,0,2|1,0,0]=4 9839 B13R1.15 CCC(=O)NCc1cccc(c1)I 11a_100000106179_100000210414 [0,1,0,0,0,2|1,0,0]=4 9840 B13R1.15 CCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000210414 [0,1,0,0,0,2|1,0,0]=4 9841 B13R1.15 CCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000210414 [0,1,0,0,0,2|1,0,0]=4 9842 B13R1.15 CCC(=O)NCc1cccc(c1)I 527a_100000106179_100000210414 [0,1,0,0,0,2|1,0,0]=4 9843 B13R1.15 CCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210414 [0,1,0,0,0,2|1,0,0]=4 9844 B13R1.15 CCC(=O)NCc1cccc(c1)O 271570a_203496583355_200011236840 [0,1,0,0,0,2|1,0,0]=4 9845 B13R1.15 CCC(=O)NCc1cccc(c1)O 527a_100000743036_100000210414 [0,1,0,0,0,2|1,0,0]=4 9846 B13R1.15 CCC(=O)NNc1cccc(c1)Br 22a_100000217339_100000210414 [0,1,0,0,0,2|1,0,0]=4 9847 B13R1.15 CCC(=O)NNc1cccc(c1)C 22a_100000681630_100000210414 [0,1,0,0,0,2|1,0,0]=4 9848 B13R1.15 CCC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000210414 [0,1,0,0,0,2|1,0,0]=4 9849 B13R1.15 CCC(=O)NNc1cccc(c1)F 22a_100000745080_100000210414 [0,1,0,0,0,2|1,0,0]=4 9850 B13R1.15 CCC(=O)NNc1cccc(c1)I 22a_100020605690_100000210414 [0,1,0,0,0,2|1,0,0]=4 9851 B13R1.15 CNC(=O)C#Cc1cccc(c1)C 240690a_100102657272_100011892726 [0,1,0,0,0,2|0,0,0]=3 9852 B13R1.15 CNC(=O)C#Cc1cccc(c1)Cl 240690a_100102657272_100011892777 [0,1,0,0,0,2|0,0,0]=3 9853 B13R1.15 CNC(=O)C#Cc1cccc(c1)F 240690a_100102657272_100011892744 [0,1,0,0,0,2|0,0,0]=3 9854 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 11a_106832991635_100016258244 [0,1,0,0,0,2|0,0,0]=3 9855 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 1626a_100102657272_100016258244 [0,1,0,0,0,2|0,0,0]=3 9856 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 240690a_100102657272_100016258244 [0,1,0,0,0,2|0,0,0]=3 9857 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 11a_106832991635_100000690095 [0,1,0,0,0,2|0,0,0]=3 9858 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 1626a_100102657272_100000690095 [0,1,0,0,0,2|0,0,0]=3 9859 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 240690a_100102657272_100000690095 [0,1,0,0,0,2|0,0,0]=3 9860 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 11a_106832991635_100000184502 [0,1,0,0,0,2|0,0,0]=3 9861 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 1626a_100102657272_100000184502 [0,1,0,0,0,2|0,0,0]=3 9862 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 240690a_100102657272_100000184502 [0,1,0,0,0,2|0,0,0]=3 9863 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 11a_106832991635_100000718793 [0,1,0,0,0,2|0,0,0]=3 9864 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 1626a_100102657272_100000718793 [0,1,0,0,0,2|0,0,0]=3 9865 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 240690a_100102657272_100000718793 [0,1,0,0,0,2|0,0,0]=3 9866 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 11a_106832991635_100020647043 [0,1,0,0,0,2|0,0,0]=3 9867 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 1626a_100102657272_100020647043 [0,1,0,0,0,2|0,0,0]=3 9868 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 240690a_100102657272_100020647043 [0,1,0,0,0,2|0,0,0]=3 9869 B13R1.15 CNC(=O)CCc1cccc(c1)Br 11a_106832991635_100000184314 [0,1,0,0,0,2|0,0,0]=3 9870 B13R1.15 CNC(=O)CCc1cccc(c1)Br 1626a_100102657272_100000184314 [0,1,0,0,0,2|0,0,0]=3 9871 B13R1.15 CNC(=O)CCc1cccc(c1)Br 240690a_100102657272_100000184314 [0,1,0,0,0,2|0,0,0]=3 9872 B13R1.15 CNC(=O)CCc1cccc(c1)Br 527a_100102657272_100000184314 [0,1,0,0,0,2|0,0,0]=3 9873 B13R1.15 CNC(=O)CCc1cccc(c1)C 11a_106832991635_100000234952 [0,1,0,0,0,2|0,0,0]=3 9874 B13R1.15 CNC(=O)CCc1cccc(c1)C 1626a_100102657272_100000234952 [0,1,0,0,0,2|0,0,0]=3 9875 B13R1.15 CNC(=O)CCc1cccc(c1)C 240690a_100102657272_100000234952 [0,1,0,0,0,2|0,0,0]=3 9876 B13R1.15 CNC(=O)CCc1cccc(c1)C 527a_100102657272_100000234952 [0,1,0,0,0,2|0,0,0]=3 9877 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 11a_106832991635_100000235675 [0,1,0,0,0,2|0,0,0]=3 9878 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 1626a_100102657272_100000235675 [0,1,0,0,0,2|0,0,0]=3 9879 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 240690a_100102657272_100000235675 [0,1,0,0,0,2|0,0,0]=3 9880 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 527a_100102657272_100000235675 [0,1,0,0,0,2|0,0,0]=3 9881 B13R1.15 CNC(=O)CCc1cccc(c1)F 11a_106832991635_100000235673 [0,1,0,0,0,2|0,0,0]=3 9882 B13R1.15 CNC(=O)CCc1cccc(c1)F 1626a_100102657272_100000235673 [0,1,0,0,0,2|0,0,0]=3 9883 B13R1.15 CNC(=O)CCc1cccc(c1)F 240690a_100102657272_100000235673 [0,1,0,0,0,2|0,0,0]=3 9884 B13R1.15 CNC(=O)CCc1cccc(c1)F 527a_100102657272_100000235673 [0,1,0,0,0,2|0,0,0]=3 9885 B13R1.15 CNC(=O)CCc1cccc(c1)I 11a_106832991635_100010007846 [0,1,0,0,0,2|0,0,0]=3 9886 B13R1.15 CNC(=O)CCc1cccc(c1)I 1626a_100102657272_100010007846 [0,1,0,0,0,2|0,0,0]=3 9887 B13R1.15 CNC(=O)CCc1cccc(c1)I 240690a_100102657272_100010007846 [0,1,0,0,0,2|0,0,0]=3 9888 B13R1.15 CNC(=O)CCc1cccc(c1)I 527a_100102657272_100010007846 [0,1,0,0,0,2|0,0,0]=3 9889 B13R1.15 CNC(=O)CCc1cccc(c1)O 240690a_100102657272_100011216126 [0,1,0,0,0,2|0,0,0]=3 9890 B13R1.15 CNC(=O)CCc1cccc(c1)O 527a_100102657272_100011216126 [0,1,0,0,0,2|0,0,0]=3 9891 B13R1.15 CNC(=O)CNc1cc(ccn1)F 27a_100000693194_100000764206 [0,1,0,0,0,2|1,0,0]=4 9892 B13R1.15 CNC(=O)CNc1cc[nH]c(=O)c1 27a_100000693194_100000061649 [0,1,0,0,0,2|1,0,0]=4 9893 B13R1.15 CNC(=O)CNc1cccc(c1)Br 34a_100000210019_100000183359 [0,1,0,0,0,2|0,0,0]=3 9894 B13R1.15 CNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000183359 [0,1,0,0,0,2|0,0,0]=3 9895 B13R1.15 CNC(=O)CNc1cccc(c1)C 34a_100000188690_100000183359 [0,1,0,0,0,2|0,0,0]=3 9896 B13R1.15 CNC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000183359 [0,1,0,0,0,2|0,0,0]=3 9897 B13R1.15 CNC(=O)CNc1cccc(c1)F 34a_100000210047_100000183359 [0,1,0,0,0,2|0,0,0]=3 9898 B13R1.15 CNC(=O)CNc1cccc(c1)I 34a_100000211102_100000183359 [0,1,0,0,0,2|0,0,0]=3 9899 B13R1.15 CNC(=O)CNc1cccc(c1)O 34a_100000210217_100000183359 [0,1,0,0,0,2|0,0,0]=3 9900 B13R1.15 CNC(=O)CNc1cccc(n1)F 27a_100000693194_100009815982 [0,1,0,0,0,2|1,0,0]=4 9901 B13R1.15 CNC(=O)CNc1ccnc(c1)C 27a_100000693194_100000758586 [0,1,0,0,0,2|1,0,0]=4 9902 B13R1.15 CNC(=O)CNc1ccnc(c1)F 27a_100000693194_100009816116 [0,1,0,0,0,2|1,0,0]=4 9903 B13R1.15 CNC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000183359 [0,1,0,0,0,2|1,0,0]=4 9904 B13R1.15 CNC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000183359 [0,1,0,0,0,2|1,0,0]=4 9905 B13R1.15 CNC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000183359 [0,1,0,0,0,2|1,0,0]=4 9906 B13R1.15 CNC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000183359 [0,1,0,0,0,2|1,0,0]=4 9907 B13R1.15 CNC(=O)COc1cccc(c1)Br 11a_106832991635_100000182359 [0,1,0,0,0,2|0,0,0]=3 9908 B13R1.15 CNC(=O)COc1cccc(c1)Br 1626a_100102657272_100000182359 [0,1,0,0,0,2|0,0,0]=3 9909 B13R1.15 CNC(=O)COc1cccc(c1)Br 240690a_100102657272_100000182359 [0,1,0,0,0,2|0,0,0]=3 9910 B13R1.15 CNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183359 [0,1,0,0,0,2|0,0,0]=3 9911 B13R1.15 CNC(=O)COc1cccc(c1)Br 527a_100102657272_100000182359 [0,1,0,0,0,2|0,0,0]=3 9912 B13R1.15 CNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183359 [0,1,0,0,0,2|0,0,0]=3 9913 B13R1.15 CNC(=O)COc1cccc(c1)C 11a_106832991635_100000183606 [0,1,0,0,0,2|0,0,0]=3 9914 B13R1.15 CNC(=O)COc1cccc(c1)C 1626a_100102657272_100000183606 [0,1,0,0,0,2|0,0,0]=3 9915 B13R1.15 CNC(=O)COc1cccc(c1)C 240690a_100102657272_100000183606 [0,1,0,0,0,2|0,0,0]=3 9916 B13R1.15 CNC(=O)COc1cccc(c1)C 34a_100000210337_100000183359 [0,1,0,0,0,2|0,0,0]=3 9917 B13R1.15 CNC(=O)COc1cccc(c1)C 527a_100102657272_100000183606 [0,1,0,0,0,2|0,0,0]=3 9918 B13R1.15 CNC(=O)COc1cccc(c1)C 7a_100000210337_100000183359 [0,1,0,0,0,2|0,0,0]=3 9919 B13R1.15 CNC(=O)COc1cccc(c1)Cl 11a_106832991635_100000184978 [0,1,0,0,0,2|0,0,0]=3 9920 B13R1.15 CNC(=O)COc1cccc(c1)Cl 1626a_100102657272_100000184978 [0,1,0,0,0,2|0,0,0]=3 9921 B13R1.15 CNC(=O)COc1cccc(c1)Cl 240690a_100102657272_100000184978 [0,1,0,0,0,2|0,0,0]=3 9922 B13R1.15 CNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183359 [0,1,0,0,0,2|0,0,0]=3 9923 B13R1.15 CNC(=O)COc1cccc(c1)Cl 527a_100102657272_100000184978 [0,1,0,0,0,2|0,0,0]=3 9924 B13R1.15 CNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183359 [0,1,0,0,0,2|0,0,0]=3 9925 B13R1.15 CNC(=O)COc1cccc(c1)F 11a_106832991635_100000182781 [0,1,0,0,0,2|0,0,0]=3 9926 B13R1.15 CNC(=O)COc1cccc(c1)F 1626a_100102657272_100000182781 [0,1,0,0,0,2|0,0,0]=3 9927 B13R1.15 CNC(=O)COc1cccc(c1)F 240690a_100102657272_100000182781 [0,1,0,0,0,2|0,0,0]=3 9928 B13R1.15 CNC(=O)COc1cccc(c1)F 34a_100000210426_100000183359 [0,1,0,0,0,2|0,0,0]=3 9929 B13R1.15 CNC(=O)COc1cccc(c1)F 527a_100102657272_100000182781 [0,1,0,0,0,2|0,0,0]=3 9930 B13R1.15 CNC(=O)COc1cccc(c1)F 7a_100000210426_100000183359 [0,1,0,0,0,2|0,0,0]=3 9931 B13R1.15 CNC(=O)COc1cccc(c1)I 34a_100000211634_100000183359 [0,1,0,0,0,2|0,0,0]=3 9932 B13R1.15 CNC(=O)COc1cccc(c1)I 7a_100000211634_100000183359 [0,1,0,0,0,2|0,0,0]=3 9933 B13R1.15 CNC(=O)COc1cccc(c1)N 34a_100000210217_100000183359 [0,1,0,0,0,2|0,0,0]=3 9934 B13R1.15 CNC(=O)COc1cccc(c1)O 271570a_203496583355_200000150594 [0,1,0,0,0,2|0,0,0]=3 9935 B13R1.15 CNC(=O)COc1cccc(n1)F 34a_100011432558_100000183359 [0,1,0,0,0,2|1,0,0]=4 9936 B13R1.15 CNC(=O)COc1ccnc(c1)C 34a_100000688365_100000183359 [0,1,0,0,0,2|1,0,0]=4 9937 B13R1.15 CNC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000183359 [0,1,0,0,0,2|1,0,0]=4 9938 B13R1.15 CNC(=O)COc1ccnc(c1)F 34a_100000732698_100000183359 [0,1,0,0,0,2|1,0,0]=4 9939 B13R1.15 CNC(=O)COc1ccnc(c1)N 34a_100011834064_100000183359 [0,1,0,0,0,2|1,0,0]=4 9940 B13R1.15 CNC(=O)COc1cncc(c1)Br 34a_100000754920_100000183359 [0,1,0,0,0,2|1,0,0]=4 9941 B13R1.15 CNC(=O)COc1cncc(c1)Br 7a_100000754920_100000183359 [0,1,0,0,0,2|1,0,0]=4 9942 B13R1.15 CNC(=O)COc1cncc(c1)C 34a_100011830280_100000183359 [0,1,0,0,0,2|1,0,0]=4 9943 B13R1.15 CNC(=O)COc1cncc(c1)C 7a_100011830280_100000183359 [0,1,0,0,0,2|1,0,0]=4 9944 B13R1.15 CNC(=O)COc1cncc(c1)Cl 7a_100000032511_100000183359 [0,1,0,0,0,2|1,0,0]=4 9945 B13R1.15 CNC(=O)COc1cncc(c1)F 34a_100011830296_100000183359 [0,1,0,0,0,2|1,0,0]=4 9946 B13R1.15 CNC(=O)COc1cncc(c1)F 7a_100011830296_100000183359 [0,1,0,0,0,2|1,0,0]=4 9947 B13R1.15 CNC(=O)COc1cncc(c1)N 34a_100011997051_100000183359 [0,1,0,0,0,2|1,0,0]=4 9948 B13R1.15 CNC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000183359 [0,1,0,0,0,2|1,0,0]=4 9949 B13R1.15 CNC(=O)CSc1cc(ccn1)C 62a_100000183359_100000750283 [0,1,0,0,0,2|1,0,0]=4 9950 B13R1.15 CNC(=O)CSc1cc(ccn1)C 62a_100000750283_100000183359 [0,1,0,0,0,2|1,0,0]=4 9951 B13R1.15 CNC(=O)CSc1cc(ccn1)Cl 62a_100000183359_100010167805 [0,1,0,0,0,2|1,0,0]=4 9952 B13R1.15 CNC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000183359 [0,1,0,0,0,2|1,0,0]=4 9953 B13R1.15 CNC(=O)CSc1cc(ccn1)F 62a_100000183359_100000764206 [0,1,0,0,0,2|1,0,0]=4 9954 B13R1.15 CNC(=O)CSc1cc(ccn1)F 62a_100000764206_100000183359 [0,1,0,0,0,2|1,0,0]=4 9955 B13R1.15 CNC(=O)CSc1cc(ccn1)N 62a_100000183359_100009814236 [0,1,0,0,0,2|1,0,0]=4 9956 B13R1.15 CNC(=O)CSc1cc(ccn1)N 62a_100009814236_100000183359 [0,1,0,0,0,2|1,0,0]=4 9957 B13R1.15 CNC(=O)CSc1cc(ccn1)O 62a_100000183359_100000762945 [0,1,0,0,0,2|1,0,0]=4 9958 B13R1.15 CNC(=O)CSc1cc[nH]c(=O)c1 62a_100000183359_100009816521 [0,1,0,0,0,2|1,0,0]=4 9959 B13R1.15 CNC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000183359 [0,1,0,0,0,2|1,0,0]=4 9960 B13R1.15 CNC(=O)CSc1ccc[n+](c1)C 62a_100000183359_100009996589 [0,1,0,0,0,2|1,0,0]=4 9961 B13R1.15 CNC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000183359 [0,1,0,0,0,2|1,0,0]=4 9962 B13R1.15 CNC(=O)CSc1ccc[n+](c1)[O-] 62a_100000183359_100009815978 [0,1,0,0,0,2|1,0,0]=4 9963 B13R1.15 CNC(=O)CSc1cccc(=O)[nH]1 62a_100000183359_100000752884 [0,1,0,0,0,2|1,0,0]=4 9964 B13R1.15 CNC(=O)CSc1cccc(c1)Br 11a_106832991635_100000760868 [0,1,0,0,0,2|0,0,0]=3 9965 B13R1.15 CNC(=O)CSc1cccc(c1)Br 1626a_100102657272_100000760868 [0,1,0,0,0,2|0,0,0]=3 9966 B13R1.15 CNC(=O)CSc1cccc(c1)Br 240690a_100102657272_100000760868 [0,1,0,0,0,2|0,0,0]=3 9967 B13R1.15 CNC(=O)CSc1cccc(c1)Br 527a_100102657272_100000760868 [0,1,0,0,0,2|0,0,0]=3 9968 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000183359_100000691529 [0,1,0,0,0,2|0,0,0]=3 9969 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000183359 [0,1,0,0,0,2|0,0,0]=3 9970 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100000183359_100011215228 [0,1,0,0,0,2|0,0,0]=3 9971 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100011215228_100000183359 [0,1,0,0,0,2|0,0,0]=3 9972 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000183359_100000699651 [0,1,0,0,0,2|0,0,0]=3 9973 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000183359 [0,1,0,0,0,2|0,0,0]=3 9974 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000183359_100000685547 [0,1,0,0,0,2|0,0,0]=3 9975 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000685547_100000183359 [0,1,0,0,0,2|0,0,0]=3 9976 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000183359_100000210019 [0,1,0,0,0,2|0,0,0]=3 9977 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000210019_100000183359 [0,1,0,0,0,2|0,0,0]=3 9978 B13R1.15 CNC(=O)CSc1cccc(c1)O 62a_100000183359_100000211634 [0,1,0,0,0,2|0,0,0]=3 9979 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_100000183359_114929384022 [0,1,0,0,0,2|0,0,0]=3 9980 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000183359 [0,1,0,0,0,2|0,0,0]=3 9981 B13R1.15 CNC(=O)CSc1cccc(n1)Br 62a_100000183359_100000684672 [0,1,0,0,0,2|1,0,0]=4 9982 B13R1.15 CNC(=O)CSc1cccc(n1)Br 62a_100000684672_100000183359 [0,1,0,0,0,2|1,0,0]=4 9983 B13R1.15 CNC(=O)CSc1cccc(n1)C 62a_100000183359_100000742759 [0,1,0,0,0,2|1,0,0]=4 9984 B13R1.15 CNC(=O)CSc1cccc(n1)C 62a_100000742759_100000183359 [0,1,0,0,0,2|1,0,0]=4 9985 B13R1.15 CNC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000183359 [0,1,0,0,0,2|1,0,0]=4 9986 B13R1.15 CNC(=O)CSc1cccc(n1)Cl 62a_100000183359_100000051397 [0,1,0,0,0,2|1,0,0]=4 9987 B13R1.15 CNC(=O)CSc1cccc(n1)F 62a_100000183359_100009815982 [0,1,0,0,0,2|1,0,0]=4 9988 B13R1.15 CNC(=O)CSc1cccc(n1)F 62a_100009815982_100000183359 [0,1,0,0,0,2|1,0,0]=4 9989 B13R1.15 CNC(=O)CSc1cccc(n1)N 62a_100000183359_100000740741 [0,1,0,0,0,2|1,0,0]=4 9990 B13R1.15 CNC(=O)CSc1cccc(n1)N 62a_100000740741_100000183359 [0,1,0,0,0,2|1,0,0]=4 9991 B13R1.15 CNC(=O)CSc1ccnc(c1)Br 62a_100000183359_100009814637 [0,1,0,0,0,2|1,0,0]=4 9992 B13R1.15 CNC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000183359 [0,1,0,0,0,2|1,0,0]=4 9993 B13R1.15 CNC(=O)CSc1ccnc(c1)C 62a_100000183359_100000758586 [0,1,0,0,0,2|1,0,0]=4 9994 B13R1.15 CNC(=O)CSc1ccnc(c1)C 62a_100000758586_100000183359 [0,1,0,0,0,2|1,0,0]=4 9995 B13R1.15 CNC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000183359 [0,1,0,0,0,2|1,0,0]=4 9996 B13R1.15 CNC(=O)CSc1ccnc(c1)Cl 62a_100000183359_100000035001 [0,1,0,0,0,2|1,0,0]=4 9997 B13R1.15 CNC(=O)CSc1ccnc(c1)F 62a_100000183359_100009816116 [0,1,0,0,0,2|1,0,0]=4 9998 B13R1.15 CNC(=O)CSc1ccnc(c1)F 62a_100009816116_100000183359 [0,1,0,0,0,2|1,0,0]=4 9999 B13R1.15 CNC(=O)CSc1ccnc(c1)N 62a_100000049665_100000183359 [0,1,0,0,0,2|1,0,0]=4 10000 B13R1.15 CNC(=O)CSc1ccnc(c1)N 62a_100000183359_100000049665 [0,1,0,0,0,2|1,0,0]=4 10001 B13R1.15 CNC(=O)CSc1cncc(c1)Br 62a_100000183359_100000728054 [0,1,0,0,0,2|1,0,0]=4 10002 B13R1.15 CNC(=O)CSc1cncc(c1)Br 62a_100000728054_100000183359 [0,1,0,0,0,2|1,0,0]=4 10003 B13R1.15 CNC(=O)CSc1cncc(c1)C 62a_100000183359_100000760492 [0,1,0,0,0,2|1,0,0]=4 10004 B13R1.15 CNC(=O)CSc1cncc(c1)C 62a_100000760492_100000183359 [0,1,0,0,0,2|1,0,0]=4 10005 B13R1.15 CNC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000183359 [0,1,0,0,0,2|1,0,0]=4 10006 B13R1.15 CNC(=O)CSc1cncc(c1)Cl 62a_100000183359_100000049639 [0,1,0,0,0,2|1,0,0]=4 10007 B13R1.15 CNC(=O)CSc1cncc(c1)F 62a_100000183359_100000744099 [0,1,0,0,0,2|1,0,0]=4 10008 B13R1.15 CNC(=O)CSc1cncc(c1)F 62a_100000744099_100000183359 [0,1,0,0,0,2|1,0,0]=4 10009 B13R1.15 CNC(=O)CSc1cncc(c1)N 62a_100000183359_100000687067 [0,1,0,0,0,2|1,0,0]=4 10010 B13R1.15 CNC(=O)CSc1cncc(c1)N 62a_100000687067_100000183359 [0,1,0,0,0,2|1,0,0]=4 10011 B13R1.15 CNC(=O)CSc1cncc(c1)O 62a_100000183359_100000754920 [0,1,0,0,0,2|1,0,0]=4 10012 B13R1.15 CNC(=O)CSc1cncc(c1)O 62a_100000754920_100000183359 [0,1,0,0,0,2|1,0,0]=4 10013 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 2708a_100009818019_106832991635 [0,1,0,0,0,2|1,0,0]=4 10014 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 2708a_100102657272_100009818019 [0,1,0,0,0,2|1,0,0]=4 10015 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 273464a_100009818019_100102657272 [0,1,0,0,0,2|1,0,0]=4 10016 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 273464a_100102657272_100009818019 [0,1,0,0,0,2|1,0,0]=4 10017 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 512a_100009818019_100102657272 [0,1,0,0,0,2|1,0,0]=4 10018 B13R1.15 CNC(=O)NCc1cc(ccn1)Br 512a_106832991638_100009818019 [0,1,0,0,0,2|1,0,0]=4 10019 B13R1.15 CNC(=O)NCc1cc(ccn1)C 2708a_100011934573_106832991635 [0,1,0,0,0,2|1,0,0]=4 10020 B13R1.15 CNC(=O)NCc1cc(ccn1)C 2708a_100102657272_100011934573 [0,1,0,0,0,2|1,0,0]=4 10021 B13R1.15 CNC(=O)NCc1cc(ccn1)C 273464a_100011934573_100102657272 [0,1,0,0,0,2|1,0,0]=4 10022 B13R1.15 CNC(=O)NCc1cc(ccn1)C 273464a_100102657272_100011934573 [0,1,0,0,0,2|1,0,0]=4 10023 B13R1.15 CNC(=O)NCc1cc(ccn1)C 512a_100011934573_100102657272 [0,1,0,0,0,2|1,0,0]=4 10024 B13R1.15 CNC(=O)NCc1cc(ccn1)C 512a_106832991638_100011934573 [0,1,0,0,0,2|1,0,0]=4 10025 B13R1.15 CNC(=O)NCc1cc(ccn1)Cl 2708a_100102657272_100000085674 [0,1,0,0,0,2|1,0,0]=4 10026 B13R1.15 CNC(=O)NCc1cc(ccn1)Cl 273464a_100102657272_100000085674 [0,1,0,0,0,2|1,0,0]=4 10027 B13R1.15 CNC(=O)NCc1cc(ccn1)Cl 512a_100000085674_100102657272 [0,1,0,0,0,2|1,0,0]=4 10028 B13R1.15 CNC(=O)NCc1cc(ccn1)Cl 512a_106832991638_100000085674 [0,1,0,0,0,2|1,0,0]=4 10029 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 2708a_100000696482_106832991635 [0,1,0,0,0,2|1,0,0]=4 10030 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 2708a_100102657272_100000696482 [0,1,0,0,0,2|1,0,0]=4 10031 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 273464a_100000696482_100102657272 [0,1,0,0,0,2|1,0,0]=4 10032 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 273464a_100102657272_100000696482 [0,1,0,0,0,2|1,0,0]=4 10033 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 512a_100000696482_100102657272 [0,1,0,0,0,2|1,0,0]=4 10034 B13R1.15 CNC(=O)NCc1cccc(=O)[nH]1 512a_106832991638_100000696482 [0,1,0,0,0,2|1,0,0]=4 10035 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100000174977_106832991635 [0,1,0,0,0,2|0,0,0]=3 10036 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100102657272_100000174977 [0,1,0,0,0,2|0,0,0]=3 10037 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100102657272 [0,1,0,0,0,2|0,0,0]=3 10038 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100102657272_100000174977 [0,1,0,0,0,2|0,0,0]=3 10039 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_100000174977_100102657272 [0,1,0,0,0,2|0,0,0]=3 10040 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_106832991638_100000174977 [0,1,0,0,0,2|0,0,0]=3 10041 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100000185548_106832991635 [0,1,0,0,0,2|0,0,0]=3 10042 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100102657272_100000185548 [0,1,0,0,0,2|0,0,0]=3 10043 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100000185548_100102657272 [0,1,0,0,0,2|0,0,0]=3 10044 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100102657272_100000185548 [0,1,0,0,0,2|0,0,0]=3 10045 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_100000185548_100102657272 [0,1,0,0,0,2|0,0,0]=3 10046 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_106832991638_100000185548 [0,1,0,0,0,2|0,0,0]=3 10047 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_106832991635 [0,1,0,0,0,2|0,0,0]=3 10048 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100102657272_100000174878 [0,1,0,0,0,2|0,0,0]=3 10049 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100102657272 [0,1,0,0,0,2|0,0,0]=3 10050 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100102657272_100000174878 [0,1,0,0,0,2|0,0,0]=3 10051 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100102657272 [0,1,0,0,0,2|0,0,0]=3 10052 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_106832991638_100000174878 [0,1,0,0,0,2|0,0,0]=3 10053 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100000174948_106832991635 [0,1,0,0,0,2|0,0,0]=3 10054 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100102657272_100000174948 [0,1,0,0,0,2|0,0,0]=3 10055 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100000174948_100102657272 [0,1,0,0,0,2|0,0,0]=3 10056 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100102657272_100000174948 [0,1,0,0,0,2|0,0,0]=3 10057 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_100000174948_100102657272 [0,1,0,0,0,2|0,0,0]=3 10058 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_106832991638_100000174948 [0,1,0,0,0,2|0,0,0]=3 10059 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100000106179_106832991635 [0,1,0,0,0,2|0,0,0]=3 10060 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100102657272_100000106179 [0,1,0,0,0,2|0,0,0]=3 10061 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100000106179_100102657272 [0,1,0,0,0,2|0,0,0]=3 10062 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100102657272_100000106179 [0,1,0,0,0,2|0,0,0]=3 10063 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_100000106179_100102657272 [0,1,0,0,0,2|0,0,0]=3 10064 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_106832991638_100000106179 [0,1,0,0,0,2|0,0,0]=3 10065 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100000743036_106832991635 [0,1,0,0,0,2|0,0,0]=3 10066 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100102657272_100000743036 [0,1,0,0,0,2|0,0,0]=3 10067 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100000743036_100102657272 [0,1,0,0,0,2|0,0,0]=3 10068 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100102657272_100000743036 [0,1,0,0,0,2|0,0,0]=3 10069 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_100000743036_100102657272 [0,1,0,0,0,2|0,0,0]=3 10070 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_106832991638_100000743036 [0,1,0,0,0,2|0,0,0]=3 10071 B13R1.15 CNC(=O)NCc1cccc(n1)Br 2708a_100016987751_106832991635 [0,1,0,0,0,2|1,0,0]=4 10072 B13R1.15 CNC(=O)NCc1cccc(n1)Br 2708a_100102657272_100016987751 [0,1,0,0,0,2|1,0,0]=4 10073 B13R1.15 CNC(=O)NCc1cccc(n1)Br 273464a_100016987751_100102657272 [0,1,0,0,0,2|1,0,0]=4 10074 B13R1.15 CNC(=O)NCc1cccc(n1)Br 273464a_100102657272_100016987751 [0,1,0,0,0,2|1,0,0]=4 10075 B13R1.15 CNC(=O)NCc1cccc(n1)Br 512a_100016987751_100102657272 [0,1,0,0,0,2|1,0,0]=4 10076 B13R1.15 CNC(=O)NCc1cccc(n1)Br 512a_106832991638_100016987751 [0,1,0,0,0,2|1,0,0]=4 10077 B13R1.15 CNC(=O)NCc1cccc(n1)C 2708a_100000701342_106832991635 [0,1,0,0,0,2|1,0,0]=4 10078 B13R1.15 CNC(=O)NCc1cccc(n1)C 2708a_100102657272_100000701342 [0,1,0,0,0,2|1,0,0]=4 10079 B13R1.15 CNC(=O)NCc1cccc(n1)C 273464a_100000701342_100102657272 [0,1,0,0,0,2|1,0,0]=4 10080 B13R1.15 CNC(=O)NCc1cccc(n1)C 273464a_100102657272_100000701342 [0,1,0,0,0,2|1,0,0]=4 10081 B13R1.15 CNC(=O)NCc1cccc(n1)C 512a_100000701342_100102657272 [0,1,0,0,0,2|1,0,0]=4 10082 B13R1.15 CNC(=O)NCc1cccc(n1)C 512a_106832991638_100000701342 [0,1,0,0,0,2|1,0,0]=4 10083 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 2708a_100016990191_106832991635 [0,1,0,0,0,2|1,0,0]=4 10084 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 2708a_100102657272_100016990191 [0,1,0,0,0,2|1,0,0]=4 10085 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 273464a_100016990191_100102657272 [0,1,0,0,0,2|1,0,0]=4 10086 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 273464a_100102657272_100016990191 [0,1,0,0,0,2|1,0,0]=4 10087 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 512a_100016990191_100102657272 [0,1,0,0,0,2|1,0,0]=4 10088 B13R1.15 CNC(=O)NCc1cccc(n1)Cl 512a_106832991638_100016990191 [0,1,0,0,0,2|1,0,0]=4 10089 B13R1.15 CNC(=O)NCc1cccc(n1)F 2708a_100015188798_106832991635 [0,1,0,0,0,2|1,0,0]=4 10090 B13R1.15 CNC(=O)NCc1cccc(n1)F 2708a_100102657272_100015188798 [0,1,0,0,0,2|1,0,0]=4 10091 B13R1.15 CNC(=O)NCc1cccc(n1)F 273464a_100015188798_100102657272 [0,1,0,0,0,2|1,0,0]=4 10092 B13R1.15 CNC(=O)NCc1cccc(n1)F 273464a_100102657272_100015188798 [0,1,0,0,0,2|1,0,0]=4 10093 B13R1.15 CNC(=O)NCc1cccc(n1)F 512a_100015188798_100102657272 [0,1,0,0,0,2|1,0,0]=4 10094 B13R1.15 CNC(=O)NCc1cccc(n1)F 512a_106832991638_100015188798 [0,1,0,0,0,2|1,0,0]=4 10095 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 2708a_100025757509_106832991635 [0,1,0,0,0,2|1,0,0]=4 10096 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 2708a_100102657272_100025757509 [0,1,0,0,0,2|1,0,0]=4 10097 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 273464a_100025757509_100102657272 [0,1,0,0,0,2|1,0,0]=4 10098 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 273464a_100102657272_100025757509 [0,1,0,0,0,2|1,0,0]=4 10099 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 512a_100025757509_100102657272 [0,1,0,0,0,2|1,0,0]=4 10100 B13R1.15 CNC(=O)NCc1ccnc(c1)Br 512a_106832991638_100025757509 [0,1,0,0,0,2|1,0,0]=4 10101 B13R1.15 CNC(=O)NCc1ccnc(c1)C 2708a_100011934566_106832991635 [0,1,0,0,0,2|1,0,0]=4 10102 B13R1.15 CNC(=O)NCc1ccnc(c1)C 2708a_100102657272_100011934566 [0,1,0,0,0,2|1,0,0]=4 10103 B13R1.15 CNC(=O)NCc1ccnc(c1)C 273464a_100011934566_100102657272 [0,1,0,0,0,2|1,0,0]=4 10104 B13R1.15 CNC(=O)NCc1ccnc(c1)C 273464a_100102657272_100011934566 [0,1,0,0,0,2|1,0,0]=4 10105 B13R1.15 CNC(=O)NCc1ccnc(c1)C 512a_100011934566_100102657272 [0,1,0,0,0,2|1,0,0]=4 10106 B13R1.15 CNC(=O)NCc1ccnc(c1)C 512a_106832991638_100011934566 [0,1,0,0,0,2|1,0,0]=4 10107 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 2708a_100015205668_106832991635 [0,1,0,0,0,2|1,0,0]=4 10108 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 2708a_100102657272_100015205668 [0,1,0,0,0,2|1,0,0]=4 10109 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 273464a_100015205668_100102657272 [0,1,0,0,0,2|1,0,0]=4 10110 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 273464a_100102657272_100015205668 [0,1,0,0,0,2|1,0,0]=4 10111 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 512a_100015205668_100102657272 [0,1,0,0,0,2|1,0,0]=4 10112 B13R1.15 CNC(=O)NCc1ccnc(c1)Cl 512a_106832991638_100015205668 [0,1,0,0,0,2|1,0,0]=4 10113 B13R1.15 CNC(=O)NCc1ccnc(c1)F 2708a_100015188774_106832991635 [0,1,0,0,0,2|1,0,0]=4 10114 B13R1.15 CNC(=O)NCc1ccnc(c1)F 2708a_100102657272_100015188774 [0,1,0,0,0,2|1,0,0]=4 10115 B13R1.15 CNC(=O)NCc1ccnc(c1)F 273464a_100015188774_100102657272 [0,1,0,0,0,2|1,0,0]=4 10116 B13R1.15 CNC(=O)NCc1ccnc(c1)F 273464a_100102657272_100015188774 [0,1,0,0,0,2|1,0,0]=4 10117 B13R1.15 CNC(=O)NCc1ccnc(c1)F 512a_100015188774_100102657272 [0,1,0,0,0,2|1,0,0]=4 10118 B13R1.15 CNC(=O)NCc1ccnc(c1)F 512a_106832991638_100015188774 [0,1,0,0,0,2|1,0,0]=4 10119 B13R1.15 CNC(=O)NCc1ccnc(c1)O 2708a_100000748557_106832991635 [0,1,0,0,0,2|1,0,0]=4 10120 B13R1.15 CNC(=O)NCc1ccnc(c1)O 2708a_100102657272_100000748557 [0,1,0,0,0,2|1,0,0]=4 10121 B13R1.15 CNC(=O)NCc1ccnc(c1)O 273464a_100000748557_100102657272 [0,1,0,0,0,2|1,0,0]=4 10122 B13R1.15 CNC(=O)NCc1ccnc(c1)O 273464a_100102657272_100000748557 [0,1,0,0,0,2|1,0,0]=4 10123 B13R1.15 CNC(=O)NCc1ccnc(c1)O 512a_100000748557_100102657272 [0,1,0,0,0,2|1,0,0]=4 10124 B13R1.15 CNC(=O)NCc1ccnc(c1)O 512a_106832991638_100000748557 [0,1,0,0,0,2|1,0,0]=4 10125 B13R1.15 CNC(=O)NCc1cncc(c1)Br 2708a_100011249555_106832991635 [0,1,0,0,0,2|1,0,0]=4 10126 B13R1.15 CNC(=O)NCc1cncc(c1)Br 2708a_100102657272_100011249555 [0,1,0,0,0,2|1,0,0]=4 10127 B13R1.15 CNC(=O)NCc1cncc(c1)Br 273464a_100011249555_100102657272 [0,1,0,0,0,2|1,0,0]=4 10128 B13R1.15 CNC(=O)NCc1cncc(c1)Br 273464a_100102657272_100011249555 [0,1,0,0,0,2|1,0,0]=4 10129 B13R1.15 CNC(=O)NCc1cncc(c1)Br 512a_100011249555_100102657272 [0,1,0,0,0,2|1,0,0]=4 10130 B13R1.15 CNC(=O)NCc1cncc(c1)Br 512a_106832991638_100011249555 [0,1,0,0,0,2|1,0,0]=4 10131 B13R1.15 CNC(=O)NCc1cncc(c1)C 2708a_100000692839_106832991635 [0,1,0,0,0,2|1,0,0]=4 10132 B13R1.15 CNC(=O)NCc1cncc(c1)C 2708a_100102657272_100000692839 [0,1,0,0,0,2|1,0,0]=4 10133 B13R1.15 CNC(=O)NCc1cncc(c1)C 273464a_100000692839_100102657272 [0,1,0,0,0,2|1,0,0]=4 10134 B13R1.15 CNC(=O)NCc1cncc(c1)C 273464a_100102657272_100000692839 [0,1,0,0,0,2|1,0,0]=4 10135 B13R1.15 CNC(=O)NCc1cncc(c1)C 512a_100000692839_100102657272 [0,1,0,0,0,2|1,0,0]=4 10136 B13R1.15 CNC(=O)NCc1cncc(c1)C 512a_106832991638_100000692839 [0,1,0,0,0,2|1,0,0]=4 10137 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 2708a_100102657272_200020614424 [0,1,0,0,0,2|1,0,0]=4 10138 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 2708a_200020614424_106832991635 [0,1,0,0,0,2|1,0,0]=4 10139 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 273464a_100102657272_200020614424 [0,1,0,0,0,2|1,0,0]=4 10140 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 273464a_200020614424_100102657272 [0,1,0,0,0,2|1,0,0]=4 10141 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 512a_106832991638_200020614424 [0,1,0,0,0,2|1,0,0]=4 10142 B13R1.15 CNC(=O)NCc1cncc(c1)Cl 512a_200020614424_100102657272 [0,1,0,0,0,2|1,0,0]=4 10143 B13R1.15 CNC(=O)NCc1cncc(c1)F 2708a_100011962886_106832991635 [0,1,0,0,0,2|1,0,0]=4 10144 B13R1.15 CNC(=O)NCc1cncc(c1)F 2708a_100102657272_100011962886 [0,1,0,0,0,2|1,0,0]=4 10145 B13R1.15 CNC(=O)NCc1cncc(c1)F 273464a_100011962886_100102657272 [0,1,0,0,0,2|1,0,0]=4 10146 B13R1.15 CNC(=O)NCc1cncc(c1)F 273464a_100102657272_100011962886 [0,1,0,0,0,2|1,0,0]=4 10147 B13R1.15 CNC(=O)NCc1cncc(c1)F 512a_100011962886_100102657272 [0,1,0,0,0,2|1,0,0]=4 10148 B13R1.15 CNC(=O)NCc1cncc(c1)F 512a_106832991638_100011962886 [0,1,0,0,0,2|1,0,0]=4 10149 B13R1.15 CNC(=O)NNc1cc(ccn1)Br 273464a_100102657272_100000764631 [0,1,0,0,0,2|1,0,0]=4 10150 B13R1.15 CNC(=O)NNc1cc(ccn1)Br 512a_100000764631_100102657272 [0,1,0,0,0,2|1,0,0]=4 10151 B13R1.15 CNC(=O)NNc1cc(ccn1)Br 512a_106832991638_100000764631 [0,1,0,0,0,2|1,0,0]=4 10152 B13R1.15 CNC(=O)NNc1cc(ccn1)C 273464a_100102657272_100000746014 [0,1,0,0,0,2|1,0,0]=4 10153 B13R1.15 CNC(=O)NNc1cc(ccn1)C 512a_106832991638_100000746014 [0,1,0,0,0,2|1,0,0]=4 10154 B13R1.15 CNC(=O)NNc1cc(ccn1)Cl 273464a_100102657272_100102524961 [0,1,0,0,0,2|1,0,0]=4 10155 B13R1.15 CNC(=O)NNc1cc(ccn1)Cl 512a_106832991638_100102524961 [0,1,0,0,0,2|1,0,0]=4 10156 B13R1.15 CNC(=O)NNc1cc(ccn1)I 273464a_100102657272_100010221011 [0,1,0,0,0,2|1,0,0]=4 10157 B13R1.15 CNC(=O)NNc1cc(ccn1)I 512a_100010221011_100102657272 [0,1,0,0,0,2|1,0,0]=4 10158 B13R1.15 CNC(=O)NNc1cc(ccn1)I 512a_106832991638_100010221011 [0,1,0,0,0,2|1,0,0]=4 10159 B13R1.15 CNC(=O)NNc1cc[nH]c(=O)c1 273464a_100102657272_100000120847 [0,1,0,0,0,2|1,0,0]=4 10160 B13R1.15 CNC(=O)NNc1cc[nH]c(=O)c1 512a_106832991638_100000120847 [0,1,0,0,0,2|1,0,0]=4 10161 B13R1.15 CNC(=O)NNc1cccc(c1)Br 273464a_100102657272_100000217339 [0,1,0,0,0,2|0,0,0]=3 10162 B13R1.15 CNC(=O)NNc1cccc(c1)Br 512a_100000217339_100102657272 [0,1,0,0,0,2|0,0,0]=3 10163 B13R1.15 CNC(=O)NNc1cccc(c1)Br 512a_106832991638_100000217339 [0,1,0,0,0,2|0,0,0]=3 10164 B13R1.15 CNC(=O)NNc1cccc(c1)C 273464a_100102657272_100000681630 [0,1,0,0,0,2|0,0,0]=3 10165 B13R1.15 CNC(=O)NNc1cccc(c1)C 512a_100000681630_100102657272 [0,1,0,0,0,2|0,0,0]=3 10166 B13R1.15 CNC(=O)NNc1cccc(c1)C 512a_106832991638_100000681630 [0,1,0,0,0,2|0,0,0]=3 10167 B13R1.15 CNC(=O)NNc1cccc(c1)Cl 273464a_100102657272_100000184277 [0,1,0,0,0,2|0,0,0]=3 10168 B13R1.15 CNC(=O)NNc1cccc(c1)Cl 512a_106832991638_100000184277 [0,1,0,0,0,2|0,0,0]=3 10169 B13R1.15 CNC(=O)NNc1cccc(c1)F 273464a_100102657272_100000745080 [0,1,0,0,0,2|0,0,0]=3 10170 B13R1.15 CNC(=O)NNc1cccc(c1)F 512a_100000745080_100102657272 [0,1,0,0,0,2|0,0,0]=3 10171 B13R1.15 CNC(=O)NNc1cccc(c1)F 512a_106832991638_100000745080 [0,1,0,0,0,2|0,0,0]=3 10172 B13R1.15 CNC(=O)NNc1cccc(c1)I 273464a_100102657272_100020605690 [0,1,0,0,0,2|0,0,0]=3 10173 B13R1.15 CNC(=O)NNc1cccc(c1)I 512a_100020605690_100102657272 [0,1,0,0,0,2|0,0,0]=3 10174 B13R1.15 CNC(=O)NNc1cccc(c1)I 512a_106832991638_100020605690 [0,1,0,0,0,2|0,0,0]=3 10175 B13R1.15 CNC(=O)NNc1cccc(n1)Br 273464a_100102657272_100009817029 [0,1,0,0,0,2|1,0,0]=4 10176 B13R1.15 CNC(=O)NNc1cccc(n1)Br 512a_106832991638_100009817029 [0,1,0,0,0,2|1,0,0]=4 10177 B13R1.15 CNC(=O)NNc1cccc(n1)C 273464a_100102657272_100011363444 [0,1,0,0,0,2|1,0,0]=4 10178 B13R1.15 CNC(=O)NNc1cccc(n1)C 512a_106832991638_100011363444 [0,1,0,0,0,2|1,0,0]=4 10179 B13R1.15 CNC(=O)NNc1cccc(n1)Cl 273464a_100102657272_100102524919 [0,1,0,0,0,2|1,0,0]=4 10180 B13R1.15 CNC(=O)NNc1cccc(n1)Cl 512a_106832991638_100102524919 [0,1,0,0,0,2|1,0,0]=4 10181 B13R1.15 CNC(=O)NNc1cccc(n1)F 273464a_100102657272_100000075452 [0,1,0,0,0,2|1,0,0]=4 10182 B13R1.15 CNC(=O)NNc1cccc(n1)F 512a_106832991638_100000075452 [0,1,0,0,0,2|1,0,0]=4 10183 B13R1.15 CNC(=O)NNc1ccnc(c1)Cl 273464a_100102657272_100000089018 [0,1,0,0,0,2|1,0,0]=4 10184 B13R1.15 CNC(=O)NNc1ccnc(c1)Cl 512a_106832991638_100000089018 [0,1,0,0,0,2|1,0,0]=4 10185 B13R1.15 CNC(=O)NNc1cncc(c1)Br 273464a_100102657272_100000727789 [0,1,0,0,0,2|1,0,0]=4 10186 B13R1.15 CNC(=O)NNc1cncc(c1)Br 512a_100000727789_100102657272 [0,1,0,0,0,2|1,0,0]=4 10187 B13R1.15 CNC(=O)NNc1cncc(c1)Br 512a_106832991638_100000727789 [0,1,0,0,0,2|1,0,0]=4 10188 B13R1.15 CNC(=O)NNc1cncc(c1)F 273464a_100102657272_200011955905 [0,1,0,0,0,2|1,0,0]=4 10189 B13R1.15 CNC(=O)NNc1cncc(c1)F 512a_106832991638_200011955905 [0,1,0,0,0,2|1,0,0]=4 10190 B13R1.15 CNC(=O)NNc1cncc(c1)F 512a_200011955905_100102657272 [0,1,0,0,0,2|1,0,0]=4 10191 B13R1.15 COC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_100000149372 [0,1,0,0,0,2|1,0,0]=4 10192 B13R1.15 COC(=O)CCc1cccc(c1)O 271570a_203496583355_100000151591 [0,1,0,0,0,2|1,0,0]=4 10193 B13R1.15 COC(=O)CNc1cccc(c1)Br 34a_100000210019_100000747449 [0,1,0,0,0,2|1,0,0]=4 10194 B13R1.15 COC(=O)CNc1cccc(c1)C 2230a_100000188690_100000747449 [0,1,0,0,0,2|1,0,0]=4 10195 B13R1.15 COC(=O)CNc1cccc(c1)C 34a_100000188690_100000747449 [0,1,0,0,0,2|1,0,0]=4 10196 B13R1.15 COC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000747449 [0,1,0,0,0,2|1,0,0]=4 10197 B13R1.15 COC(=O)CNc1cccc(c1)F 34a_100000210047_100000747449 [0,1,0,0,0,2|1,0,0]=4 10198 B13R1.15 COC(=O)CNc1cccc(c1)I 34a_100000211102_100000747449 [0,1,0,0,0,2|1,0,0]=4 10199 B13R1.15 COC(=O)CNc1cccc(c1)O 34a_100000210217_100000747449 [0,1,0,0,0,2|1,0,0]=4 10200 B13R1.15 COC(=O)COc1cccc(c1)Br 34a_100000210342_100000747449 [0,1,0,0,0,2|1,0,0]=4 10201 B13R1.15 COC(=O)COc1cccc(c1)Br 7a_100000210342_100000747449 [0,1,0,0,0,2|1,0,0]=4 10202 B13R1.15 COC(=O)COc1cccc(c1)C 34a_100000210337_100000747449 [0,1,0,0,0,2|1,0,0]=4 10203 B13R1.15 COC(=O)COc1cccc(c1)C 7a_100000210337_100000747449 [0,1,0,0,0,2|1,0,0]=4 10204 B13R1.15 COC(=O)COc1cccc(c1)Cl 34a_100000210295_100000747449 [0,1,0,0,0,2|1,0,0]=4 10205 B13R1.15 COC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747449 [0,1,0,0,0,2|1,0,0]=4 10206 B13R1.15 COC(=O)COc1cccc(c1)F 34a_100000210426_100000747449 [0,1,0,0,0,2|1,0,0]=4 10207 B13R1.15 COC(=O)COc1cccc(c1)F 7a_100000210426_100000747449 [0,1,0,0,0,2|1,0,0]=4 10208 B13R1.15 COC(=O)COc1cccc(c1)I 34a_100000211634_100000747449 [0,1,0,0,0,2|1,0,0]=4 10209 B13R1.15 COC(=O)COc1cccc(c1)I 7a_100000211634_100000747449 [0,1,0,0,0,2|1,0,0]=4 10210 B13R1.15 COC(=O)COc1cccc(c1)N 34a_100000210217_100000747449 [0,1,0,0,0,2|1,0,0]=4 10211 B13R1.15 COC(=O)COc1cccc(c1)O 271570a_203496583355_200000148702 [0,1,0,0,0,2|1,0,0]=4 10212 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747449 [0,1,0,0,0,2|1,0,0]=4 10213 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000747449_100000691529 [0,1,0,0,0,2|1,0,0]=4 10214 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100000747449_100011215228 [0,1,0,0,0,2|1,0,0]=4 10215 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100011215228_100000747449 [0,1,0,0,0,2|1,0,0]=4 10216 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747449 [0,1,0,0,0,2|1,0,0]=4 10217 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000747449_100000699651 [0,1,0,0,0,2|1,0,0]=4 10218 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000685547_100000747449 [0,1,0,0,0,2|1,0,0]=4 10219 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000747449_100000685547 [0,1,0,0,0,2|1,0,0]=4 10220 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000210019_100000747449 [0,1,0,0,0,2|1,0,0]=4 10221 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000747449_100000210019 [0,1,0,0,0,2|1,0,0]=4 10222 B13R1.15 COC(=O)CSc1cccc(c1)O 271570a_203496583355_100011756034 [0,1,0,0,0,2|1,0,0]=4 10223 B13R1.15 COC(=O)CSc1cccc(c1)O 62a_100000747449_100000211634 [0,1,0,0,0,2|1,0,0]=4 10224 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_100000747449_114929384022 [0,1,0,0,0,2|1,0,0]=4 10225 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747449 [0,1,0,0,0,2|1,0,0]=4 10226 B13R1.15 NNC(=O)COc1cccc(c1)O 271570a_203496583355_100000184228 [0,1,0,0,0,2|1,0,0]=4 10227 B13R1.42 CC#CC(=O)CCc1ccccc1 1458a_100000763181_100000765856 [0,1,0,0,0,2|1,0,0]=4 10228 B13R1.42 CC#CC(=O)NNc1ccccc1 22a_100015195140_100000763181 [0,1,0,0,0,2|1,0,0]=4 10229 B13R1.42 CC=CC(=O)CCc1ccccc1 1458a_100000210699_100000765856 [0,1,0,0,0,2|1,0,0]=4 10230 B13R1.42 CC=CC(=O)NCc1ccccc1 11a_100015324214_100000210699 [0,1,0,0,0,2|1,0,0]=4 10231 B13R1.42 CC=CC(=O)NCc1ccccc1 1626a_100015324214_100000210699 [0,1,0,0,0,2|1,0,0]=4 10232 B13R1.42 CC=CC(=O)NCc1ccccc1 240690a_100015324214_100000210699 [0,1,0,0,0,2|1,0,0]=4 10233 B13R1.42 CC=CC(=O)NNc1ccccc1 22a_100015195140_100000210699 [0,1,0,0,0,2|1,0,0]=4 10234 B13R1.42 CCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210303 [0,1,0,0,0,2|1,0,0]=4 10235 B13R1.42 CCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210303 [0,1,0,0,0,2|1,0,0]=4 10236 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000185753_100000210303 [0,1,0,0,0,2|1,0,0]=4 10237 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000211992_100000765856 [0,1,0,0,0,2|1,0,0]=4 10238 B13R1.42 CCCC(=O)COc1ccccc1 1458a_100000186222_100000210303 [0,1,0,0,0,2|1,0,0]=4 10239 B13R1.42 CCCC(=O)COc1ccccc1 7a_100000210340_100000747444 [0,1,0,0,0,2|1,0,0]=4 10240 B13R1.42 CCCC(=O)CSc1ccccc1 1458a_100000211596_100000210303 [0,1,0,0,0,2|1,0,0]=4 10241 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000719477_100000747444 [0,1,0,0,0,2|1,0,0]=4 10242 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000747444_100000041952 [0,1,0,0,0,2|1,0,0]=4 10243 B13R1.42 CCCC(=O)NCc1ccccc1 11a_100015324214_100000211992 [0,1,0,0,0,2|1,0,0]=4 10244 B13R1.42 CCCC(=O)NCc1ccccc1 1626a_100015324214_100000211992 [0,1,0,0,0,2|1,0,0]=4 10245 B13R1.42 CCCC(=O)NCc1ccccc1 240690a_100015324214_100000211992 [0,1,0,0,0,2|1,0,0]=4 10246 B13R1.42 CCCC(=O)NCc1ccccc1 527a_100015324214_100000211992 [0,1,0,0,0,2|1,0,0]=4 10247 B13R1.42 CCCC(=O)NNc1ccccc1 22a_100015195140_100000211992 [0,1,0,0,0,2|1,0,0]=4 10248 B13R1.42 CCNC(=O)C#Cc1ccccc1 240690a_100015525214_100000736102 [0,1,0,0,0,2|0,0,0]=3 10249 B13R1.42 CCNC(=O)C=Cc1ccccc1 11a_100015525214_100000210462 [0,1,0,0,0,2|0,0,0]=3 10250 B13R1.42 CCNC(=O)C=Cc1ccccn1 11a_100015525214_100000740811 [0,1,0,0,0,2|1,0,0]=4 10251 B13R1.42 CCNC(=O)C=Cc1ccccn1 240690a_100015525214_100000740811 [0,1,0,0,0,2|1,0,0]=4 10252 B13R1.42 CCNC(=O)C=Cc1cccnc1 11a_100015525214_100000735890 [0,1,0,0,0,2|1,0,0]=4 10253 B13R1.42 CCNC(=O)C=Cc1cccnc1 240690a_100015525214_100000735890 [0,1,0,0,0,2|1,0,0]=4 10254 B13R1.42 CCNC(=O)C=Cc1ccncc1 240690a_100015525214_100000682801 [0,1,0,0,0,2|1,0,0]=4 10255 B13R1.42 CCNC(=O)CCc1ccccc1 11a_100015525214_100000185753 [0,1,0,0,0,2|0,0,0]=3 10256 B13R1.42 CCNC(=O)CCc1ccccc1 240690a_100015525214_100000185753 [0,1,0,0,0,2|0,0,0]=3 10257 B13R1.42 CCNC(=O)CCc1ccccc1 527a_100015525214_100000185753 [0,1,0,0,0,2|0,0,0]=3 10258 B13R1.42 CCNC(=O)CCc1ccccn1 11a_100015525214_100015195070 [0,1,0,0,0,2|1,0,0]=4 10259 B13R1.42 CCNC(=O)CCc1ccccn1 240690a_100015525214_100015195070 [0,1,0,0,0,2|1,0,0]=4 10260 B13R1.42 CCNC(=O)CCc1ccccn1 527a_100015525214_100015195070 [0,1,0,0,0,2|1,0,0]=4 10261 B13R1.42 CCNC(=O)CCc1cccnc1 11a_100015525214_100000198484 [0,1,0,0,0,2|1,0,0]=4 10262 B13R1.42 CCNC(=O)CCc1cccnc1 240690a_100015525214_100000198484 [0,1,0,0,0,2|1,0,0]=4 10263 B13R1.42 CCNC(=O)CCc1cccnc1 527a_100015525214_100000198484 [0,1,0,0,0,2|1,0,0]=4 10264 B13R1.42 CCNC(=O)CCc1ccncc1 11a_100015525214_100011225043 [0,1,0,0,0,2|1,0,0]=4 10265 B13R1.42 CCNC(=O)CCc1ccncc1 240690a_100015525214_100011225043 [0,1,0,0,0,2|1,0,0]=4 10266 B13R1.42 CCNC(=O)CCc1ccncc1 527a_100015525214_100011225043 [0,1,0,0,0,2|1,0,0]=4 10267 B13R1.42 CCNC(=O)CNc1ccccc1 34a_100000106764_100000183381 [0,1,0,0,0,2|0,0,0]=3 10268 B13R1.42 CCNC(=O)COc1ccccc1 11a_100015525214_100000186222 [0,1,0,0,0,2|0,0,0]=3 10269 B13R1.42 CCNC(=O)COc1ccccc1 240690a_100015525214_100000186222 [0,1,0,0,0,2|0,0,0]=3 10270 B13R1.42 CCNC(=O)COc1ccccc1 34a_100000210340_100000183381 [0,1,0,0,0,2|0,0,0]=3 10271 B13R1.42 CCNC(=O)COc1ccccc1 527a_100015525214_100000186222 [0,1,0,0,0,2|0,0,0]=3 10272 B13R1.42 CCNC(=O)COc1ccccc1 7a_100000210340_100000183381 [0,1,0,0,0,2|0,0,0]=3 10273 B13R1.42 CCNC(=O)COc1ccccn1 240690a_100015525214_100102699861 [0,1,0,0,0,2|1,0,0]=4 10274 B13R1.42 CCNC(=O)COc1ccccn1 527a_100015525214_100102699861 [0,1,0,0,0,2|1,0,0]=4 10275 B13R1.42 CCNC(=O)COc1cccnc1 11a_100015525214_100015207166 [0,1,0,0,0,2|1,0,0]=4 10276 B13R1.42 CCNC(=O)COc1cccnc1 240690a_100015525214_100015207166 [0,1,0,0,0,2|1,0,0]=4 10277 B13R1.42 CCNC(=O)COc1cccnc1 34a_100000210849_100000183381 [0,1,0,0,0,2|1,0,0]=4 10278 B13R1.42 CCNC(=O)COc1cccnc1 527a_100015525214_100015207166 [0,1,0,0,0,2|1,0,0]=4 10279 B13R1.42 CCNC(=O)COc1cccnc1 7a_100000210849_100000183381 [0,1,0,0,0,2|1,0,0]=4 10280 B13R1.42 CCNC(=O)COc1ccncc1 34a_100000212176_100000183381 [0,1,0,0,0,2|1,0,0]=4 10281 B13R1.42 CCNC(=O)CSc1ccccc1 11a_100015525214_100000211596 [0,1,0,0,0,2|0,0,0]=3 10282 B13R1.42 CCNC(=O)CSc1ccccc1 240690a_100015525214_100000211596 [0,1,0,0,0,2|0,0,0]=3 10283 B13R1.42 CCNC(=O)CSc1ccccc1 527a_100015525214_100000211596 [0,1,0,0,0,2|0,0,0]=3 10284 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000183381_100000041952 [0,1,0,0,0,2|0,0,0]=3 10285 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000719477_100000183381 [0,1,0,0,0,2|0,0,0]=3 10286 B13R1.42 CCNC(=O)CSc1ccccn1 11a_100015525214_100000156281 [0,1,0,0,0,2|1,0,0]=4 10287 B13R1.42 CCNC(=O)CSc1ccccn1 240690a_100015525214_100000156281 [0,1,0,0,0,2|1,0,0]=4 10288 B13R1.42 CCNC(=O)CSc1ccccn1 527a_100015525214_100000156281 [0,1,0,0,0,2|1,0,0]=4 10289 B13R1.42 CCNC(=O)CSc1ccccn1 62a_100000183381_100011216584 [0,1,0,0,0,2|1,0,0]=4 10290 B13R1.42 CCNC(=O)CSc1ccccn1 62a_100011216584_100000183381 [0,1,0,0,0,2|1,0,0]=4 10291 B13R1.42 CCNC(=O)CSc1cccnc1 62a_100000183381_100000210063 [0,1,0,0,0,2|1,0,0]=4 10292 B13R1.42 CCNC(=O)CSc1cccnc1 62a_100000210063_100000183381 [0,1,0,0,0,2|1,0,0]=4 10293 B13R1.42 CCNC(=O)CSc1ccncc1 11a_100015525214_100000211328 [0,1,0,0,0,2|1,0,0]=4 10294 B13R1.42 CCNC(=O)CSc1ccncc1 240690a_100015525214_100000211328 [0,1,0,0,0,2|1,0,0]=4 10295 B13R1.42 CCNC(=O)CSc1ccncc1 527a_100015525214_100000211328 [0,1,0,0,0,2|1,0,0]=4 10296 B13R1.42 CCNC(=O)CSc1ccncc1 62a_100000183381_100000728582 [0,1,0,0,0,2|1,0,0]=4 10297 B13R1.42 CCNC(=O)CSc1ccncc1 62a_100000728582_100000183381 [0,1,0,0,0,2|1,0,0]=4 10298 B13R1.42 CCNC(=O)NCc1ccccc1 2708a_100015324214_100015525214 [0,1,0,0,0,2|0,0,0]=3 10299 B13R1.42 CCNC(=O)NCc1ccccc1 2708a_100015525214_100015324214 [0,1,0,0,0,2|0,0,0]=3 10300 B13R1.42 CCNC(=O)NCc1ccccc1 273464a_100015324214_100015525214 [0,1,0,0,0,2|0,0,0]=3 10301 B13R1.42 CCNC(=O)NCc1ccccc1 273464a_100015525214_100015324214 [0,1,0,0,0,2|0,0,0]=3 10302 B13R1.42 CCNC(=O)NCc1ccccc1 512a_100015324214_100015525214 [0,1,0,0,0,2|0,0,0]=3 10303 B13R1.42 CCNC(=O)NCc1ccccc1 512a_100015525214_100015324214 [0,1,0,0,0,2|0,0,0]=3 10304 B13R1.42 CCNC(=O)NCc1ccccn1 2708a_100000210449_100015525214 [0,1,0,0,0,2|1,0,0]=4 10305 B13R1.42 CCNC(=O)NCc1ccccn1 2708a_100015525214_100000210449 [0,1,0,0,0,2|1,0,0]=4 10306 B13R1.42 CCNC(=O)NCc1ccccn1 273464a_100000210449_100015525214 [0,1,0,0,0,2|1,0,0]=4 10307 B13R1.42 CCNC(=O)NCc1ccccn1 273464a_100015525214_100000210449 [0,1,0,0,0,2|1,0,0]=4 10308 B13R1.42 CCNC(=O)NCc1ccccn1 512a_100015525214_100000210449 [0,1,0,0,0,2|1,0,0]=4 10309 B13R1.42 CCNC(=O)NCc1cccnc1 2708a_100000210453_100015525214 [0,1,0,0,0,2|1,0,0]=4 10310 B13R1.42 CCNC(=O)NCc1cccnc1 2708a_100015525214_100000210453 [0,1,0,0,0,2|1,0,0]=4 10311 B13R1.42 CCNC(=O)NCc1cccnc1 273464a_100000210453_100015525214 [0,1,0,0,0,2|1,0,0]=4 10312 B13R1.42 CCNC(=O)NCc1cccnc1 273464a_100015525214_100000210453 [0,1,0,0,0,2|1,0,0]=4 10313 B13R1.42 CCNC(=O)NCc1cccnc1 512a_100000210453_100015525214 [0,1,0,0,0,2|1,0,0]=4 10314 B13R1.42 CCNC(=O)NCc1cccnc1 512a_100015525214_100000210453 [0,1,0,0,0,2|1,0,0]=4 10315 B13R1.42 CCNC(=O)NCc1ccncc1 2708a_100000210450_100015525214 [0,1,0,0,0,2|1,0,0]=4 10316 B13R1.42 CCNC(=O)NCc1ccncc1 2708a_100015525214_100000210450 [0,1,0,0,0,2|1,0,0]=4 10317 B13R1.42 CCNC(=O)NCc1ccncc1 273464a_100000210450_100015525214 [0,1,0,0,0,2|1,0,0]=4 10318 B13R1.42 CCNC(=O)NCc1ccncc1 273464a_100015525214_100000210450 [0,1,0,0,0,2|1,0,0]=4 10319 B13R1.42 CCNC(=O)NCc1ccncc1 512a_100015525214_100000210450 [0,1,0,0,0,2|1,0,0]=4 10320 B13R1.42 CCNC(=O)NNc1ccccc1 273464a_100015525214_100015195140 [0,1,0,0,0,2|0,0,0]=3 10321 B13R1.42 CCNC(=O)NNc1ccccc1 512a_100015525214_100015195140 [0,1,0,0,0,2|0,0,0]=3 10322 B13R1.42 CCNC(=O)NNc1ccccn1 273464a_100015525214_100000183288 [0,1,0,0,0,2|1,0,0]=4 10323 B13R1.42 CCNC(=O)NNc1ccccn1 512a_100015525214_100000183288 [0,1,0,0,0,2|1,0,0]=4 10324 B13R1.42 CCNC(=O)NNc1cccnc1 273464a_100015525214_100000728903 [0,1,0,0,0,2|1,0,0]=4 10325 B13R1.42 CCNC(=O)NNc1cccnc1 512a_100015525214_100000728903 [0,1,0,0,0,2|1,0,0]=4 10326 B13R1.42 CCNC(=O)NNc1ccncc1 273464a_100015525214_100000698918 [0,1,0,0,0,2|1,0,0]=4 10327 B13R1.42 CCNC(=O)NNc1ccncc1 512a_100015525214_100000698918 [0,1,0,0,0,2|1,0,0]=4 10328 B13R1.42 CCOC(=O)C=Cc1ccccc1 271570a_100010199719_100000210277 [0,1,0,0,0,2|1,0,0]=4 10329 B13R1.42 CCOC(=O)CNc1ccccc1 34a_100000106764_100000188475 [0,1,0,0,0,2|1,0,0]=4 10330 B13R1.42 CCOC(=O)COc1ccccc1 34a_100000210340_100000188475 [0,1,0,0,0,2|1,0,0]=4 10331 B13R1.42 CCOC(=O)COc1ccccc1 7a_100000210340_100000188475 [0,1,0,0,0,2|1,0,0]=4 10332 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000188475_100000041952 [0,1,0,0,0,2|1,0,0]=4 10333 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000719477_100000188475 [0,1,0,0,0,2|1,0,0]=4 10334 B13R1.42 CNCC(=O)CCc1ccccc1 2230a_106832991635_100012361361 [0,1,0,0,0,2|0,0,0]=3 10335 B13R1.42 CNCC(=O)CCc1ccccc1 34a_100102657272_100012361361 [0,1,0,0,0,2|0,0,0]=3 10336 B13R1.42 CNCC(=O)CCc1ccccc1 7a_106832991635_100012361361 [0,1,0,0,0,2|0,0,0]=3 10337 B13R1.42 CNCC(=O)NCc1ccccc1 2230a_100000739245_200000210301 [0,1,0,0,0,2|0,0,0]=3 10338 B13R1.42 CNCC(=O)NCc1ccccc1 2230a_106832991635_100000183539 [0,1,0,0,0,2|0,0,0]=3 10339 B13R1.42 CNCC(=O)NCc1ccccc1 34a_100102657272_100000183539 [0,1,0,0,0,2|0,0,0]=3 10340 B13R1.42 CNCC(=O)NCc1ccccc1 7a_106832991635_100000183539 [0,1,0,0,0,2|0,0,0]=3 10341 B13R1.42 CNCC(=O)NCc1ccccn1 2230a_106832991635_100000684169 [0,1,0,0,0,2|1,0,0]=4 10342 B13R1.42 CNCC(=O)NCc1ccccn1 34a_100102657272_100000684169 [0,1,0,0,0,2|1,0,0]=4 10343 B13R1.42 CNCC(=O)NCc1ccccn1 7a_106832991635_100000684169 [0,1,0,0,0,2|1,0,0]=4 10344 B13R1.42 CNCC(=O)NCc1cccnc1 2230a_106832991635_100000752408 [0,1,0,0,0,2|1,0,0]=4 10345 B13R1.42 CNCC(=O)NCc1cccnc1 7a_106832991635_100000752408 [0,1,0,0,0,2|1,0,0]=4 10346 B13R1.42 CNCC(=O)NCc1ccncc1 2230a_106832991635_100011243468 [0,1,0,0,0,2|1,0,0]=4 10347 B13R1.42 CNCC(=O)NCc1ccncc1 7a_106832991635_100011243468 [0,1,0,0,0,2|1,0,0]=4 10348 B13R1.42 CNCC(=O)OCc1ccccc1 2230a_106832991635_100000753625 [0,1,0,0,0,2|0,0,0]=3 10349 B13R1.42 CNCC(=O)OCc1ccccc1 34a_100102657272_100000753625 [0,1,0,0,0,2|0,0,0]=3 10350 B13R1.42 CNCC(=O)OCc1ccccc1 7a_106832991635_100000753625 [0,1,0,0,0,2|0,0,0]=3 10351 B13R1.42 CNNC(=O)C#Cc1ccccc1 22a_100016993582_100000736102 [0,1,0,0,0,2|0,0,0]=3 10352 B13R1.42 CNNC(=O)C#Cc1ccccn1 22a_100016993582_102125277312 [0,1,0,0,0,2|1,0,0]=4 10353 B13R1.42 CNNC(=O)C=Cc1ccccc1 22a_100016993582_100000210462 [0,1,0,0,0,2|0,0,0]=3 10354 B13R1.42 CNNC(=O)C=Cc1ccccn1 22a_100016993582_100000740811 [0,1,0,0,0,2|1,0,0]=4 10355 B13R1.42 CNNC(=O)C=Cc1cccnc1 22a_100016993582_100000735890 [0,1,0,0,0,2|1,0,0]=4 10356 B13R1.42 CNNC(=O)C=Cc1ccncc1 22a_100016993582_100000682801 [0,1,0,0,0,2|1,0,0]=4 10357 B13R1.42 CNNC(=O)CCc1ccccc1 22a_100016993582_100000185753 [0,1,0,0,0,2|0,0,0]=3 10358 B13R1.42 CNNC(=O)CCc1ccccn1 22a_100016993582_100015195070 [0,1,0,0,0,2|1,0,0]=4 10359 B13R1.42 CNNC(=O)CCc1cccnc1 22a_100016993582_100000198484 [0,1,0,0,0,2|1,0,0]=4 10360 B13R1.42 CNNC(=O)CCc1ccncc1 22a_100016993582_100011225043 [0,1,0,0,0,2|1,0,0]=4 10361 B13R1.42 CNNC(=O)COc1ccccc1 22a_100016993582_100000186222 [0,1,0,0,0,2|0,0,0]=3 10362 B13R1.42 CNNC(=O)COc1ccccn1 22a_100016993582_100102699861 [0,1,0,0,0,2|1,0,0]=4 10363 B13R1.42 CNNC(=O)COc1cccnc1 22a_100016993582_100015207166 [0,1,0,0,0,2|1,0,0]=4 10364 B13R1.42 CNNC(=O)CSc1ccccc1 22a_100016993582_100000211596 [0,1,0,0,0,2|0,0,0]=3 10365 B13R1.42 CNNC(=O)CSc1ccccn1 22a_100016993582_100000156281 [0,1,0,0,0,2|1,0,0]=4 10366 B13R1.42 CNNC(=O)CSc1ccncc1 22a_100016993582_100000211328 [0,1,0,0,0,2|1,0,0]=4 10367 B13R1.42 CNNC(=O)NCc1ccccc1 273464a_100015324214_100016993582 [0,1,0,0,0,2|0,0,0]=3 10368 B13R1.42 CNNC(=O)NCc1ccccc1 512a_100015324214_100016993582 [0,1,0,0,0,2|0,0,0]=3 10369 B13R1.42 CNNC(=O)NCc1ccccc1 512a_100016993582_100015324214 [0,1,0,0,0,2|0,0,0]=3 10370 B13R1.42 CNNC(=O)NCc1ccccn1 273464a_100000210449_100016993582 [0,1,0,0,0,2|1,0,0]=4 10371 B13R1.42 CNNC(=O)NCc1ccccn1 512a_100016993582_100000210449 [0,1,0,0,0,2|1,0,0]=4 10372 B13R1.42 CNNC(=O)NCc1cccnc1 273464a_100000210453_100016993582 [0,1,0,0,0,2|1,0,0]=4 10373 B13R1.42 CNNC(=O)NCc1cccnc1 512a_100000210453_100016993582 [0,1,0,0,0,2|1,0,0]=4 10374 B13R1.42 CNNC(=O)NCc1cccnc1 512a_100016993582_100000210453 [0,1,0,0,0,2|1,0,0]=4 10375 B13R1.42 CNNC(=O)NCc1ccncc1 273464a_100000210450_100016993582 [0,1,0,0,0,2|1,0,0]=4 10376 B13R1.42 CNNC(=O)NCc1ccncc1 512a_100016993582_100000210450 [0,1,0,0,0,2|1,0,0]=4 10377 B13R1.42 CNNC(=O)NNc1ccccc1 512a_100016993582_100015195140 [0,1,0,0,0,2|0,0,0]=3 10378 B13R1.42 CNNC(=O)NNc1ccccn1 512a_100016993582_100000183288 [0,1,0,0,0,2|1,0,0]=4 10379 B13R1.42 CNNC(=O)NNc1cccnc1 512a_100016993582_100000728903 [0,1,0,0,0,2|1,0,0]=4 10380 B13R1.42 CNNC(=O)NNc1ccncc1 512a_100016993582_100000698918 [0,1,0,0,0,2|1,0,0]=4 10381 B13R1.42 COCC(=O)CCc1ccccc1 1458a_100000210968_100000765856 [0,1,0,0,0,2|1,0,0]=4 10382 B13R1.42 COCC(=O)CCc1ccccc1 34a_100138415774_100012361361 [0,1,0,0,0,2|1,0,0]=4 10383 B13R1.42 COCC(=O)NCc1ccccc1 11a_100015324214_100000210968 [0,1,0,0,0,2|1,0,0]=4 10384 B13R1.42 COCC(=O)NCc1ccccc1 1626a_100015324214_100000210968 [0,1,0,0,0,2|1,0,0]=4 10385 B13R1.42 COCC(=O)NCc1ccccc1 240690a_100015324214_100000210968 [0,1,0,0,0,2|1,0,0]=4 10386 B13R1.42 COCC(=O)NCc1ccccc1 34a_100138415774_100000183539 [0,1,0,0,0,2|1,0,0]=4 10387 B13R1.42 COCC(=O)NCc1ccccc1 527a_100015324214_100000210968 [0,1,0,0,0,2|1,0,0]=4 10388 B13R1.42 COCC(=O)NNc1ccccc1 22a_100015195140_100000210968 [0,1,0,0,0,2|1,0,0]=4 10389 B13R1.42 COCC(=O)OCc1ccccc1 34a_100138415774_100000753625 [0,1,0,0,0,2|1,0,0]=4 10390 B13R1.42 CSCC(=O)CCc1ccccc1 1458a_100000184570_100000765856 [0,1,0,0,0,2|1,0,0]=4 10391 B13R1.42 CSCC(=O)CCc1ccccc1 62a_100012361361_200000210301 [0,1,0,0,0,2|1,0,0]=4 10392 B13R1.42 CSCC(=O)CCc1ccccc1 62a_200000210301_100012361361 [0,1,0,0,0,2|1,0,0]=4 10393 B13R1.42 CSCC(=O)NCc1ccccc1 11a_100015324214_100000184570 [0,1,0,0,0,2|1,0,0]=4 10394 B13R1.42 CSCC(=O)NCc1ccccc1 1626a_100015324214_100000184570 [0,1,0,0,0,2|1,0,0]=4 10395 B13R1.42 CSCC(=O)NCc1ccccc1 240690a_100015324214_100000184570 [0,1,0,0,0,2|1,0,0]=4 10396 B13R1.42 CSCC(=O)NCc1ccccc1 527a_100015324214_100000184570 [0,1,0,0,0,2|1,0,0]=4 10397 B13R1.42 CSCC(=O)NCc1ccccc1 62a_100000183539_200000210301 [0,1,0,0,0,2|1,0,0]=4 10398 B13R1.42 CSCC(=O)NCc1ccccc1 62a_200000210301_100000183539 [0,1,0,0,0,2|1,0,0]=4 10399 B13R1.42 CSCC(=O)NNc1ccccc1 22a_100015195140_100000184570 [0,1,0,0,0,2|1,0,0]=4 10400 B13R1.42 CSCC(=O)OCc1ccccc1 62a_100000753625_200000210301 [0,1,0,0,0,2|1,0,0]=4 10401 B13R1.42 CSCC(=O)OCc1ccccc1 62a_200000210301_100000753625 [0,1,0,0,0,2|1,0,0]=4 10402 B13R1.42 O=C(C#Cc1ccccc1)CCF 1458a_100000736102_100011217306 [0,1,0,0,0,2|1,0,0]=4 10403 B13R1.42 O=C(C#Cc1ccccc1)CCO 1458a_100000736102_100000211926 [0,1,0,0,0,2|1,0,0]=4 10404 B13R1.42 O=C(C=Cc1ccccc1)CCF 1458a_100000210462_100011217306 [0,1,0,0,0,2|1,0,0]=4 10405 B13R1.42 O=C(C=Cc1ccccc1)CCO 1458a_100000210462_100000211926 [0,1,0,0,0,2|1,0,0]=4 10406 B13R1.42 O=C(CCF)CCc1ccccc1 1458a_100000185753_100011217306 [0,1,0,0,0,2|1,0,0]=4 10407 B13R1.42 O=C(CCF)COc1ccccc1 1458a_100000186222_100011217306 [0,1,0,0,0,2|1,0,0]=4 10408 B13R1.42 O=C(CCF)CSc1ccccc1 1458a_100000211596_100011217306 [0,1,0,0,0,2|1,0,0]=4 10409 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100000185753_100000211926 [0,1,0,0,0,2|1,0,0]=4 10410 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100011216618_100000765856 [0,1,0,0,0,2|1,0,0]=4 10411 B13R1.42 O=C(CCO)COc1ccccc1 1458a_100000186222_100000211926 [0,1,0,0,0,2|1,0,0]=4 10412 B13R1.42 O=C(CCO)CSc1ccccc1 1458a_100000211596_100000211926 [0,1,0,0,0,2|1,0,0]=4 10413 B13R1.42 O=C(CCO)NCc1ccccc1 240690a_100015324214_100011216618 [0,1,0,0,0,2|1,0,0]=4 10414 B13R1.42 O=C(CCO)NNc1ccccc1 22a_100015195140_100011216618 [0,1,0,0,0,2|1,0,0]=4 10415 B13R1.42 O=C(CNc1ccccc1)NCO 34a_100000106764_100000185155 [0,1,0,0,0,2|0,0,0]=3 10416 B13R1.42 O=C(COc1ccccc1)NCO 34a_100000210340_100000185155 [0,1,0,0,0,2|0,0,0]=3 10417 B13R1.42 O=C(COc1ccccc1)NCO 7a_100000210340_100000185155 [0,1,0,0,0,2|0,0,0]=3 10418 B13R1.42 O=C(COc1cccnc1)NCO 34a_100000210849_100000185155 [0,1,0,0,0,2|1,0,0]=4 10419 B13R1.42 O=C(COc1cccnc1)NCO 7a_100000210849_100000185155 [0,1,0,0,0,2|1,0,0]=4 10420 B13R1.42 O=C(COc1ccncc1)NCO 34a_100000212176_100000185155 [0,1,0,0,0,2|1,0,0]=4 10421 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000185155_100000041952 [0,1,0,0,0,2|0,0,0]=3 10422 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000719477_100000185155 [0,1,0,0,0,2|0,0,0]=3 10423 B13R1.42 O=C(CSc1ccccn1)NCO 62a_100000185155_100011216584 [0,1,0,0,0,2|1,0,0]=4 10424 B13R1.42 O=C(CSc1ccccn1)NCO 62a_100011216584_100000185155 [0,1,0,0,0,2|1,0,0]=4 10425 B13R1.42 O=C(CSc1cccnc1)NCO 62a_100000185155_100000210063 [0,1,0,0,0,2|1,0,0]=4 10426 B13R1.42 O=C(CSc1cccnc1)NCO 62a_100000210063_100000185155 [0,1,0,0,0,2|1,0,0]=4 10427 B13R1.42 O=C(CSc1ccncc1)NCO 62a_100000185155_100000728582 [0,1,0,0,0,2|1,0,0]=4 10428 B13R1.42 O=C(CSc1ccncc1)NCO 62a_100000728582_100000185155 [0,1,0,0,0,2|1,0,0]=4 10429 B13R1.42 [13CH3]NCC(=O)NCc1ccccc1 2230a_100000739245_200025704644 [0,1,0,0,0,2|0,0,0]=3 10430 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_100012361361_200025704644 [0,1,0,0,0,2|1,0,0]=4 10431 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_200025704644_100012361361 [0,1,0,0,0,2|1,0,0]=4 10432 B13R1.42 [13CH3]SCC(=O)NCc1ccccc1 62a_100000183539_200025704644 [0,1,0,0,0,2|1,0,0]=4 10433 B13R1.42 [13CH3]SCC(=O)NCc1ccccc1 62a_200025704644_100000183539 [0,1,0,0,0,2|1,0,0]=4 10434 B13R1.42 [13CH3]SCC(=O)OCc1ccccc1 62a_100000753625_200025704644 [0,1,0,0,0,2|1,0,0]=4 10435 B13R1.42 [13CH3]SCC(=O)OCc1ccccc1 62a_200025704644_100000753625 [0,1,0,0,0,2|1,0,0]=4 10436 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 11a_106832991635_100000066491 [0,1,0,0,0,2|0,0,0]=3 10437 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 1626a_100102657272_100000066491 [0,1,0,0,0,2|0,0,0]=3 10438 B13R1.135 CCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210202 [0,1,0,0,0,2|1,0,0]=4 10439 B13R1.135 CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210202 [0,1,0,0,0,2|1,0,0]=4 10440 B13R1.135 CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210202 [0,1,0,0,0,2|1,0,0]=4 10441 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210202 [0,1,0,0,0,2|1,0,0]=4 10442 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000210414_200011218536 [0,1,0,0,0,2|1,0,0]=4 10443 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210202 [0,1,0,0,0,2|1,0,0]=4 10444 B13R1.135 CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210202 [0,1,0,0,0,2|1,0,0]=4 10445 B13R1.135 CCC(=O)C(C)Oc1ccccc1 7a_100000210340_100000742827 [0,1,0,0,0,2|1,0,0]=4 10446 B13R1.135 CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210202 [0,1,0,0,0,2|1,0,0]=4 10447 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000719477_100000742827 [0,1,0,0,0,2|1,0,0]=4 10448 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000742827_100000041952 [0,1,0,0,0,2|1,0,0]=4 10449 B13R1.135 CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210414 [0,1,0,0,0,2|1,0,0]=4 10450 B13R1.135 CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210414 [0,1,0,0,0,2|1,0,0]=4 10451 B13R1.135 CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210414 [0,1,0,0,0,2|1,0,0]=4 10452 B13R1.135 CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210414 [0,1,0,0,0,2|1,0,0]=4 10453 B13R1.135 CCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210202 [0,1,0,0,0,2|1,0,0]=4 10454 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 11a_106832991635_100016990649 [0,1,0,0,0,2|0,0,0]=3 10455 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 1626a_100102657272_100016990649 [0,1,0,0,0,2|0,0,0]=3 10456 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 527a_100102657272_100016990649 [0,1,0,0,0,2|0,0,0]=3 10457 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 11a_106832991635_200020598536 [0,1,0,0,0,2|0,0,0]=3 10458 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 1626a_100102657272_200020598536 [0,1,0,0,0,2|0,0,0]=3 10459 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100102657272_200020598536 [0,1,0,0,0,2|0,0,0]=3 10460 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 527a_100102657272_200020598536 [0,1,0,0,0,2|0,0,0]=3 10461 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 11a_106832991635_100025712827 [0,1,0,0,0,2|1,0,0]=4 10462 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 1626a_100102657272_100025712827 [0,1,0,0,0,2|1,0,0]=4 10463 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 527a_100102657272_100025712827 [0,1,0,0,0,2|1,0,0]=4 10464 B13R1.135 CNC(=O)/C(=C\c1ccccc1)/F 11a_106832991635_100020889036 [0,1,0,0,0,2|0,0,0]=3 10465 B13R1.135 CNC(=O)/C(=C\c1ccccc1)/F 527a_100102657272_100020889036 [0,1,0,0,0,2|0,0,0]=3 10466 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 11a_106832991635_100000731744 [0,1,0,0,0,2|1,0,0]=4 10467 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 240690a_100102657272_100000731744 [0,1,0,0,0,2|1,0,0]=4 10468 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 527a_100102657272_100000731744 [0,1,0,0,0,2|1,0,0]=4 10469 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 1458a_100011218921_100015291786 [0,1,0,0,0,2|0,0,0]=3 10470 B13R1.135 CNC(=O)C(=O)Cc1ccccn1 1458a_100011218921_100000721315 [0,1,0,0,0,2|1,0,0]=4 10471 B13R1.135 CNC(=O)C(=O)Cc1cccnc1 1458a_100011218921_100000733263 [0,1,0,0,0,2|1,0,0]=4 10472 B13R1.135 CNC(=O)C(=O)Cc1ccncc1 1458a_100011218921_100000705612 [0,1,0,0,0,2|1,0,0]=4 10473 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100011218921 [0,1,0,0,0,2|0,0,0]=3 10474 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011218921 [0,1,0,0,0,2|0,0,0]=3 10475 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 240690a_100102657272_100000738435 [0,1,0,0,0,2|0,0,0]=3 10476 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 527a_100000106764_100011218921 [0,1,0,0,0,2|0,0,0]=3 10477 B13R1.135 CNC(=O)C(C)Cc1ccccc1 11a_106832991635_100000754839 [0,1,0,0,0,2|0,0,0]=3 10478 B13R1.135 CNC(=O)C(C)Cc1ccccc1 1626a_100102657272_100000754839 [0,1,0,0,0,2|0,0,0]=3 10479 B13R1.135 CNC(=O)C(C)Cc1ccccc1 240690a_100102657272_100000754839 [0,1,0,0,0,2|0,0,0]=3 10480 B13R1.135 CNC(=O)C(C)Cc1ccccc1 527a_100102657272_100000754839 [0,1,0,0,0,2|0,0,0]=3 10481 B13R1.135 CNC(=O)C(C)Cc1ccccn1 1626a_100102657272_100012000792 [0,1,0,0,0,2|1,0,0]=4 10482 B13R1.135 CNC(=O)C(C)Cc1ccccn1 240690a_100102657272_100012000792 [0,1,0,0,0,2|1,0,0]=4 10483 B13R1.135 CNC(=O)C(C)Cc1ccccn1 527a_100102657272_100012000792 [0,1,0,0,0,2|1,0,0]=4 10484 B13R1.135 CNC(=O)C(C)Nc1ccccc1 34a_100000106764_100000731044 [0,1,0,0,0,2|0,0,0]=3 10485 B13R1.135 CNC(=O)C(C)Oc1ccccc1 11a_106832991635_100000188414 [0,1,0,0,0,2|0,0,0]=3 10486 B13R1.135 CNC(=O)C(C)Oc1ccccc1 1626a_100102657272_100000188414 [0,1,0,0,0,2|0,0,0]=3 10487 B13R1.135 CNC(=O)C(C)Oc1ccccc1 240690a_100102657272_100000188414 [0,1,0,0,0,2|0,0,0]=3 10488 B13R1.135 CNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000731044 [0,1,0,0,0,2|0,0,0]=3 10489 B13R1.135 CNC(=O)C(C)Oc1ccccc1 527a_100102657272_100000188414 [0,1,0,0,0,2|0,0,0]=3 10490 B13R1.135 CNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000209862 [0,1,0,0,0,2|0,0,0]=3 10491 B13R1.135 CNC(=O)C(C)Oc1cccnc1 34a_100000210849_100000731044 [0,1,0,0,0,2|1,0,0]=4 10492 B13R1.135 CNC(=O)C(C)Oc1cccnc1 7a_100000210849_100000209862 [0,1,0,0,0,2|1,0,0]=4 10493 B13R1.135 CNC(=O)C(C)Oc1ccncc1 34a_100000212176_100000731044 [0,1,0,0,0,2|1,0,0]=4 10494 B13R1.135 CNC(=O)C(C)Sc1ccccc1 11a_106832991635_100000199063 [0,1,0,0,0,2|0,0,0]=3 10495 B13R1.135 CNC(=O)C(C)Sc1ccccc1 1626a_100102657272_100000199063 [0,1,0,0,0,2|0,0,0]=3 10496 B13R1.135 CNC(=O)C(C)Sc1ccccc1 240690a_100102657272_100000199063 [0,1,0,0,0,2|0,0,0]=3 10497 B13R1.135 CNC(=O)C(C)Sc1ccccc1 527a_100102657272_100000199063 [0,1,0,0,0,2|0,0,0]=3 10498 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000209862_100000041952 [0,1,0,0,0,2|0,0,0]=3 10499 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000731044 [0,1,0,0,0,2|0,0,0]=3 10500 B13R1.135 CNC(=O)C(C)Sc1ccccn1 11a_106832991635_100000156770 [0,1,0,0,0,2|1,0,0]=4 10501 B13R1.135 CNC(=O)C(C)Sc1ccccn1 1626a_100102657272_100000156770 [0,1,0,0,0,2|1,0,0]=4 10502 B13R1.135 CNC(=O)C(C)Sc1ccccn1 240690a_100102657272_100000156770 [0,1,0,0,0,2|1,0,0]=4 10503 B13R1.135 CNC(=O)C(C)Sc1ccccn1 527a_100102657272_100000156770 [0,1,0,0,0,2|1,0,0]=4 10504 B13R1.135 CNC(=O)C(C)Sc1ccccn1 62a_100000209862_100011216584 [0,1,0,0,0,2|1,0,0]=4 10505 B13R1.135 CNC(=O)C(C)Sc1ccccn1 62a_100011216584_100000731044 [0,1,0,0,0,2|1,0,0]=4 10506 B13R1.135 CNC(=O)C(C)Sc1cccnc1 62a_100000209862_100000210063 [0,1,0,0,0,2|1,0,0]=4 10507 B13R1.135 CNC(=O)C(C)Sc1cccnc1 62a_100000210063_100000731044 [0,1,0,0,0,2|1,0,0]=4 10508 B13R1.135 CNC(=O)C(C)Sc1ccncc1 62a_100000209862_100000728582 [0,1,0,0,0,2|1,0,0]=4 10509 B13R1.135 CNC(=O)C(C)Sc1ccncc1 62a_100000728582_100000731044 [0,1,0,0,0,2|1,0,0]=4 10510 B13R1.135 CNC(=O)C(F)Nc1ccccc1 34a_100000106764_100009813575 [0,1,0,0,0,2|0,0,0]=3 10511 B13R1.135 CNC(=O)C(F)Oc1ccccc1 34a_100000210340_100009813575 [0,1,0,0,0,2|0,0,0]=3 10512 B13R1.135 CNC(=O)C(F)Oc1ccccc1 7a_100000210340_100009813575 [0,1,0,0,0,2|0,0,0]=3 10513 B13R1.135 CNC(=O)C(F)Oc1cccnc1 34a_100000210849_100009813575 [0,1,0,0,0,2|1,0,0]=4 10514 B13R1.135 CNC(=O)C(F)Oc1cccnc1 7a_100000210849_100009813575 [0,1,0,0,0,2|1,0,0]=4 10515 B13R1.135 CNC(=O)C(F)Oc1ccncc1 34a_100000212176_100009813575 [0,1,0,0,0,2|1,0,0]=4 10516 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100000719477_100009813575 [0,1,0,0,0,2|0,0,0]=3 10517 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100009813575_100000041952 [0,1,0,0,0,2|0,0,0]=3 10518 B13R1.135 CNC(=O)C(F)Sc1ccccn1 62a_100009813575_100011216584 [0,1,0,0,0,2|1,0,0]=4 10519 B13R1.135 CNC(=O)C(F)Sc1ccccn1 62a_100011216584_100009813575 [0,1,0,0,0,2|1,0,0]=4 10520 B13R1.135 CNC(=O)C(F)Sc1cccnc1 62a_100000210063_100009813575 [0,1,0,0,0,2|1,0,0]=4 10521 B13R1.135 CNC(=O)C(F)Sc1cccnc1 62a_100009813575_100000210063 [0,1,0,0,0,2|1,0,0]=4 10522 B13R1.135 CNC(=O)C(F)Sc1ccncc1 62a_100000728582_100009813575 [0,1,0,0,0,2|1,0,0]=4 10523 B13R1.135 CNC(=O)C(F)Sc1ccncc1 62a_100009813575_100000728582 [0,1,0,0,0,2|1,0,0]=4 10524 B13R1.135 CNC(=O)N(C)Cc1ccccc1 2708a_100102657272_100000186898 [0,1,0,0,0,2|0,0,0]=3 10525 B13R1.135 CNC(=O)N(C)Cc1ccccc1 273464a_100102657272_100000186898 [0,1,0,0,0,2|0,0,0]=3 10526 B13R1.135 CNC(=O)N(C)Cc1ccccn1 2708a_100102657272_100000207498 [0,1,0,0,0,2|1,0,0]=4 10527 B13R1.135 CNC(=O)N(C)Cc1ccccn1 273464a_100102657272_100000207498 [0,1,0,0,0,2|1,0,0]=4 10528 B13R1.135 CNC(=O)N(C)Cc1cccnc1 2708a_100102657272_100000184577 [0,1,0,0,0,2|1,0,0]=4 10529 B13R1.135 CNC(=O)N(C)Cc1cccnc1 273464a_100102657272_100000184577 [0,1,0,0,0,2|1,0,0]=4 10530 B13R1.135 CNC(=O)N(C)Cc1ccncc1 2708a_100102657272_100000187231 [0,1,0,0,0,2|1,0,0]=4 10531 B13R1.135 CNC(=O)N(C)Cc1ccncc1 273464a_100102657272_100000187231 [0,1,0,0,0,2|1,0,0]=4 10532 B13R1.135 CNC(=O)[C@H](O)Cc1ccccc1 240690a_100102657272_100009816399 [0,1,0,0,0,2|0,0,0]=3 10533 B13R1.135 COC(=O)C(=O)Nc1ccccc1 11a_100000106764_100000024059 [0,1,0,0,0,2|1,0,0]=4 10534 B13R1.135 COC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100000024059 [0,1,0,0,0,2|1,0,0]=4 10535 B13R1.135 COC(=O)C(=O)Nc1ccccc1 527a_100000106764_100000024059 [0,1,0,0,0,2|1,0,0]=4 10536 B13R1.135 COC(=O)C(C)Nc1ccccc1 34a_100000106764_100000211248 [0,1,0,0,0,2|1,0,0]=4 10537 B13R1.135 COC(=O)C(C)Oc1ccccc1 34a_100000210340_100000211248 [0,1,0,0,0,2|1,0,0]=4 10538 B13R1.135 COC(=O)C(C)Oc1ccccc1 7a_100000210340_100000211248 [0,1,0,0,0,2|1,0,0]=4 10539 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000211248_100000041952 [0,1,0,0,0,2|1,0,0]=4 10540 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000719477_100000211248 [0,1,0,0,0,2|1,0,0]=4 10541 B13R1.254 CNS(=O)(=O)C=Cc1ccccc1 40a_100102657272_100011098038 [0,1,0,0,0,2|1,0,0]=4 10542 B13R1.254 CNS(=O)(=O)CCc1ccccc1 270084a_100102657272_100000738789 [0,1,0,0,0,2|1,0,0]=4 10543 B13R1.254 CNS(=O)(=O)CCc1ccccc1 274078a_100102657272_100000738789 [0,1,0,0,0,2|1,0,0]=4 10544 B13R1.351 C=C(C)C(=O)CCc1ccccc1 1458a_100000185857_100000765856 [0,1,0,0,0,2|1,0,0]=4 10545 B13R1.351 C=C(C)C(=O)NCc1ccccc1 11a_100015324214_100000185857 [0,1,0,0,0,2|1,0,0]=4 10546 B13R1.351 C=C(C)C(=O)NCc1ccccc1 1626a_100015324214_100000185857 [0,1,0,0,0,2|1,0,0]=4 10547 B13R1.351 C=C(C)C(=O)NNc1ccccc1 22a_100015195140_100000185857 [0,1,0,0,0,2|1,0,0]=4 10548 B13R1.351 CC(=O)C(=O)CNc1ccccc1 34a_100000106764_100011261029 [0,1,0,0,0,2|1,0,0]=4 10549 B13R1.351 CC(=O)C(=O)COc1ccccc1 34a_100000210340_100011261029 [0,1,0,0,0,2|1,0,0]=4 10550 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100000719477_100011261029 [0,1,0,0,0,2|1,0,0]=4 10551 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100011261029_100000041952 [0,1,0,0,0,2|1,0,0]=4 10552 B13R1.351 CC(C)C(=O)C#Cc1ccccc1 1458a_100000736102_100000210206 [0,1,0,0,0,2|1,0,0]=4 10553 B13R1.351 CC(C)C(=O)C=Cc1ccccc1 1458a_100000210462_100000210206 [0,1,0,0,0,2|1,0,0]=4 10554 B13R1.351 CC(C)C(=O)CCc1ccccc1 1458a_100000185753_100000210206 [0,1,0,0,0,2|1,0,0]=4 10555 B13R1.351 CC(C)C(=O)CCc1ccccc1 1458a_100000210198_100000765856 [0,1,0,0,0,2|1,0,0]=4 10556 B13R1.351 CC(C)C(=O)CNc1ccccc1 34a_100000106764_100000753385 [0,1,0,0,0,2|1,0,0]=4 10557 B13R1.351 CC(C)C(=O)COc1ccccc1 1458a_100000186222_100000210206 [0,1,0,0,0,2|1,0,0]=4 10558 B13R1.351 CC(C)C(=O)COc1ccccc1 34a_100000210340_100000753385 [0,1,0,0,0,2|1,0,0]=4 10559 B13R1.351 CC(C)C(=O)COc1ccccc1 7a_100000210340_100000753385 [0,1,0,0,0,2|1,0,0]=4 10560 B13R1.351 CC(C)C(=O)CSc1ccccc1 1458a_100000211596_100000210206 [0,1,0,0,0,2|1,0,0]=4 10561 B13R1.351 CC(C)C(=O)CSc1ccccc1 62a_100000719477_100000753385 [0,1,0,0,0,2|1,0,0]=4 10562 B13R1.351 CC(C)C(=O)CSc1ccccc1 62a_100000753385_100000041952 [0,1,0,0,0,2|1,0,0]=4 10563 B13R1.351 CC(C)C(=O)NCc1ccccc1 11a_100015324214_100000210198 [0,1,0,0,0,2|1,0,0]=4 10564 B13R1.351 CC(C)C(=O)NCc1ccccc1 1626a_100015324214_100000210198 [0,1,0,0,0,2|1,0,0]=4 10565 B13R1.351 CC(C)C(=O)NCc1ccccc1 240690a_100015324214_100000210198 [0,1,0,0,0,2|1,0,0]=4 10566 B13R1.351 CC(C)C(=O)NCc1ccccc1 527a_100015324214_100000210198 [0,1,0,0,0,2|1,0,0]=4 10567 B13R1.351 CC(C)C(=O)NNc1ccccc1 22a_100015195140_100000210198 [0,1,0,0,0,2|1,0,0]=4 10568 B13R1.351 CC(F)C(=O)CCc1ccccc1 1458a_100000062450_100000765856 [0,1,0,0,0,2|1,0,0]=4 10569 B13R1.351 CC(F)C(=O)NCc1ccccc1 11a_100015324214_100000062450 [0,1,0,0,0,2|1,0,0]=4 10570 B13R1.351 CC(F)C(=O)NCc1ccccc1 1626a_100015324214_100000062450 [0,1,0,0,0,2|1,0,0]=4 10571 B13R1.351 CC(F)C(=O)NCc1ccccc1 240690a_100015324214_100000062450 [0,1,0,0,0,2|1,0,0]=4 10572 B13R1.351 CC(F)C(=O)NCc1ccccc1 527a_100015324214_100000062450 [0,1,0,0,0,2|1,0,0]=4 10573 B13R1.351 CC(F)C(=O)NNc1ccccc1 22a_100015195140_100000062450 [0,1,0,0,0,2|1,0,0]=4 10574 B13R1.351 CN(C)C(=O)C#Cc1ccccc1 240690a_100102631434_100000736102 [0,1,0,0,0,2|0,0,0]=3 10575 B13R1.351 CN(C)C(=O)C=Cc1ccccc1 11a_100102631434_100000210462 [0,1,0,0,0,2|0,0,0]=3 10576 B13R1.351 CN(C)C(=O)C=Cc1ccccc1 1626a_100102631434_100000210462 [0,1,0,0,0,2|0,0,0]=3 10577 B13R1.351 CN(C)C(=O)C=Cc1ccccn1 11a_100102631434_100000740811 [0,1,0,0,0,2|1,0,0]=4 10578 B13R1.351 CN(C)C(=O)C=Cc1ccccn1 240690a_100102631434_100000740811 [0,1,0,0,0,2|1,0,0]=4 10579 B13R1.351 CN(C)C(=O)C=Cc1cccnc1 11a_100102631434_100000735890 [0,1,0,0,0,2|1,0,0]=4 10580 B13R1.351 CN(C)C(=O)C=Cc1cccnc1 240690a_100102631434_100000735890 [0,1,0,0,0,2|1,0,0]=4 10581 B13R1.351 CN(C)C(=O)C=Cc1ccncc1 240690a_100102631434_100000682801 [0,1,0,0,0,2|1,0,0]=4 10582 B13R1.351 CN(C)C(=O)CCc1ccccc1 11a_100102631434_100000185753 [0,1,0,0,0,2|0,0,0]=3 10583 B13R1.351 CN(C)C(=O)CCc1ccccc1 1626a_100102631434_100000185753 [0,1,0,0,0,2|0,0,0]=3 10584 B13R1.351 CN(C)C(=O)CCc1ccccc1 240690a_100102631434_100000185753 [0,1,0,0,0,2|0,0,0]=3 10585 B13R1.351 CN(C)C(=O)CCc1ccccc1 271570a_200010232142_100000210277 [0,1,0,0,0,2|0,0,0]=3 10586 B13R1.351 CN(C)C(=O)CCc1ccccc1 527a_100102631434_100000185753 [0,1,0,0,0,2|0,0,0]=3 10587 B13R1.351 CN(C)C(=O)CCc1ccccn1 11a_100102631434_100015195070 [0,1,0,0,0,2|1,0,0]=4 10588 B13R1.351 CN(C)C(=O)CCc1ccccn1 240690a_100102631434_100015195070 [0,1,0,0,0,2|1,0,0]=4 10589 B13R1.351 CN(C)C(=O)CCc1ccccn1 271570a_200010232142_100011216584 [0,1,0,0,0,2|1,0,0]=4 10590 B13R1.351 CN(C)C(=O)CCc1ccccn1 527a_100102631434_100015195070 [0,1,0,0,0,2|1,0,0]=4 10591 B13R1.351 CN(C)C(=O)CCc1cccnc1 11a_100102631434_100000198484 [0,1,0,0,0,2|1,0,0]=4 10592 B13R1.351 CN(C)C(=O)CCc1cccnc1 1626a_100102631434_100000198484 [0,1,0,0,0,2|1,0,0]=4 10593 B13R1.351 CN(C)C(=O)CCc1cccnc1 240690a_100102631434_100000198484 [0,1,0,0,0,2|1,0,0]=4 10594 B13R1.351 CN(C)C(=O)CCc1cccnc1 271570a_200010232142_100000752921 [0,1,0,0,0,2|1,0,0]=4 10595 B13R1.351 CN(C)C(=O)CCc1cccnc1 527a_100102631434_100000198484 [0,1,0,0,0,2|1,0,0]=4 10596 B13R1.351 CN(C)C(=O)CCc1ccncc1 11a_100102631434_100011225043 [0,1,0,0,0,2|1,0,0]=4 10597 B13R1.351 CN(C)C(=O)CCc1ccncc1 240690a_100102631434_100011225043 [0,1,0,0,0,2|1,0,0]=4 10598 B13R1.351 CN(C)C(=O)CCc1ccncc1 271570a_200010232142_100000035832 [0,1,0,0,0,2|1,0,0]=4 10599 B13R1.351 CN(C)C(=O)CCc1ccncc1 527a_100102631434_100011225043 [0,1,0,0,0,2|1,0,0]=4 10600 B13R1.351 CN(C)C(=O)CNc1ccccc1 34a_100000106764_100000692301 [0,1,0,0,0,2|0,0,0]=3 10601 B13R1.351 CN(C)C(=O)COc1ccccc1 11a_100102631434_100000186222 [0,1,0,0,0,2|0,0,0]=3 10602 B13R1.351 CN(C)C(=O)COc1ccccc1 1626a_100102631434_100000186222 [0,1,0,0,0,2|0,0,0]=3 10603 B13R1.351 CN(C)C(=O)COc1ccccc1 240690a_100102631434_100000186222 [0,1,0,0,0,2|0,0,0]=3 10604 B13R1.351 CN(C)C(=O)COc1ccccc1 34a_100000210340_100000692301 [0,1,0,0,0,2|0,0,0]=3 10605 B13R1.351 CN(C)C(=O)COc1ccccc1 527a_100102631434_100000186222 [0,1,0,0,0,2|0,0,0]=3 10606 B13R1.351 CN(C)C(=O)COc1ccccc1 7a_100000210340_100000692301 [0,1,0,0,0,2|0,0,0]=3 10607 B13R1.351 CN(C)C(=O)COc1ccccn1 1626a_100102631434_100102699861 [0,1,0,0,0,2|1,0,0]=4 10608 B13R1.351 CN(C)C(=O)COc1ccccn1 240690a_100102631434_100102699861 [0,1,0,0,0,2|1,0,0]=4 10609 B13R1.351 CN(C)C(=O)COc1ccccn1 527a_100102631434_100102699861 [0,1,0,0,0,2|1,0,0]=4 10610 B13R1.351 CN(C)C(=O)COc1cccnc1 11a_100102631434_100015207166 [0,1,0,0,0,2|1,0,0]=4 10611 B13R1.351 CN(C)C(=O)COc1cccnc1 1626a_100102631434_100015207166 [0,1,0,0,0,2|1,0,0]=4 10612 B13R1.351 CN(C)C(=O)COc1cccnc1 240690a_100102631434_100015207166 [0,1,0,0,0,2|1,0,0]=4 10613 B13R1.351 CN(C)C(=O)COc1cccnc1 34a_100000210849_100000692301 [0,1,0,0,0,2|1,0,0]=4 10614 B13R1.351 CN(C)C(=O)COc1cccnc1 527a_100102631434_100015207166 [0,1,0,0,0,2|1,0,0]=4 10615 B13R1.351 CN(C)C(=O)COc1cccnc1 7a_100000210849_100000692301 [0,1,0,0,0,2|1,0,0]=4 10616 B13R1.351 CN(C)C(=O)COc1ccncc1 34a_100000212176_100000692301 [0,1,0,0,0,2|1,0,0]=4 10617 B13R1.351 CN(C)C(=O)CSc1ccccc1 11a_100102631434_100000211596 [0,1,0,0,0,2|0,0,0]=3 10618 B13R1.351 CN(C)C(=O)CSc1ccccc1 1626a_100102631434_100000211596 [0,1,0,0,0,2|0,0,0]=3 10619 B13R1.351 CN(C)C(=O)CSc1ccccc1 240690a_100102631434_100000211596 [0,1,0,0,0,2|0,0,0]=3 10620 B13R1.351 CN(C)C(=O)CSc1ccccc1 527a_100102631434_100000211596 [0,1,0,0,0,2|0,0,0]=3 10621 B13R1.351 CN(C)C(=O)CSc1ccccc1 62a_100000692301_100000041952 [0,1,0,0,0,2|0,0,0]=3 10622 B13R1.351 CN(C)C(=O)CSc1ccccc1 62a_100000719477_100000692301 [0,1,0,0,0,2|0,0,0]=3 10623 B13R1.351 CN(C)C(=O)CSc1ccccn1 11a_100102631434_100000156281 [0,1,0,0,0,2|1,0,0]=4 10624 B13R1.351 CN(C)C(=O)CSc1ccccn1 240690a_100102631434_100000156281 [0,1,0,0,0,2|1,0,0]=4 10625 B13R1.351 CN(C)C(=O)CSc1ccccn1 527a_100102631434_100000156281 [0,1,0,0,0,2|1,0,0]=4 10626 B13R1.351 CN(C)C(=O)CSc1ccccn1 62a_100000692301_100011216584 [0,1,0,0,0,2|1,0,0]=4 10627 B13R1.351 CN(C)C(=O)CSc1ccccn1 62a_100011216584_100000692301 [0,1,0,0,0,2|1,0,0]=4 10628 B13R1.351 CN(C)C(=O)CSc1cccnc1 62a_100000210063_100000692301 [0,1,0,0,0,2|1,0,0]=4 10629 B13R1.351 CN(C)C(=O)CSc1cccnc1 62a_100000692301_100000210063 [0,1,0,0,0,2|1,0,0]=4 10630 B13R1.351 CN(C)C(=O)CSc1ccncc1 11a_100102631434_100000211328 [0,1,0,0,0,2|1,0,0]=4 10631 B13R1.351 CN(C)C(=O)CSc1ccncc1 1626a_100102631434_100000211328 [0,1,0,0,0,2|1,0,0]=4 10632 B13R1.351 CN(C)C(=O)CSc1ccncc1 240690a_100102631434_100000211328 [0,1,0,0,0,2|1,0,0]=4 10633 B13R1.351 CN(C)C(=O)CSc1ccncc1 527a_100102631434_100000211328 [0,1,0,0,0,2|1,0,0]=4 10634 B13R1.351 CN(C)C(=O)CSc1ccncc1 62a_100000692301_100000728582 [0,1,0,0,0,2|1,0,0]=4 10635 B13R1.351 CN(C)C(=O)CSc1ccncc1 62a_100000728582_100000692301 [0,1,0,0,0,2|1,0,0]=4 10636 B13R1.351 CN(C)C(=O)NCc1ccccc1 2708a_100015324214_100102631434 [0,1,0,0,0,2|0,0,0]=3 10637 B13R1.351 CN(C)C(=O)NCc1ccccn1 2708a_100000210449_100102631434 [0,1,0,0,0,2|1,0,0]=4 10638 B13R1.351 CN(C)C(=O)NCc1cccnc1 2708a_100000210453_100102631434 [0,1,0,0,0,2|1,0,0]=4 10639 B13R1.351 CN(C)C(=O)NCc1ccncc1 2708a_100000210450_100102631434 [0,1,0,0,0,2|1,0,0]=4 10640 B13R1.351 C[C@@H](O)C(=O)CCc1ccccc1 1458a_100000717761_100000765856 [0,1,0,0,0,2|1,0,0]=4 10641 B13R1.351 C[C@@H](O)C(=O)NCc1ccccc1 240690a_100015324214_100000717761 [0,1,0,0,0,2|1,0,0]=4 10642 B13R1.351 C[C@@H](O)C(=O)NNc1ccccc1 22a_100015195140_100000717761 [0,1,0,0,0,2|1,0,0]=4 10643 B13R1.351 C[C@H](O)C(=O)CCc1ccccc1 1458a_217856618621_100000765856 [0,1,0,0,0,2|1,0,0]=4 10644 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 1626a_100015324214_217856618621 [0,1,0,0,0,2|1,0,0]=4 10645 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 240690a_100015324214_217856618621 [0,1,0,0,0,2|1,0,0]=4 10646 B13R1.351 C[C@H](O)C(=O)NNc1ccccc1 22a_100015195140_217856618621 [0,1,0,0,0,2|1,0,0]=4 10647 B13R1.528 CCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000210202 [0,1,0,0,0,2|1,0,0]=4 10648 B13R1.528 CCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000210202 [0,1,0,0,0,2|1,0,0]=4 10649 B13R1.528 CCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000210202 [0,1,0,0,0,2|1,0,0]=4 10650 B13R1.528 CCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000210202 [0,1,0,0,0,2|1,0,0]=4 10651 B13R1.528 CCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210202 [0,1,0,0,0,2|1,0,0]=4 10652 B13R1.528 CCC(=O)CCc1ccccc1Br 1458a_100000210414_100012161201 [0,1,0,0,0,2|1,0,0]=4 10653 B13R1.528 CCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210202 [0,1,0,0,0,2|1,0,0]=4 10654 B13R1.528 CCC(=O)CCc1ccccc1C 1458a_100000210414_100011713688 [0,1,0,0,0,2|1,0,0]=4 10655 B13R1.528 CCC(=O)CCc1ccccc1C 1458a_100000748742_100000210202 [0,1,0,0,0,2|1,0,0]=4 10656 B13R1.528 CCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210202 [0,1,0,0,0,2|1,0,0]=4 10657 B13R1.528 CCC(=O)CCc1ccccc1Cl 1458a_100000210414_100011713703 [0,1,0,0,0,2|1,0,0]=4 10658 B13R1.528 CCC(=O)CCc1ccccc1F 1458a_100000189703_100000210202 [0,1,0,0,0,2|1,0,0]=4 10659 B13R1.528 CCC(=O)CCc1ccccc1F 1458a_100000210414_100000720011 [0,1,0,0,0,2|1,0,0]=4 10660 B13R1.528 CCC(=O)CCc1ccccc1I 1458a_100000037306_100000210202 [0,1,0,0,0,2|1,0,0]=4 10661 B13R1.528 CCC(=O)CCc1ccccc1O 1458a_100000181328_100000210202 [0,1,0,0,0,2|1,0,0]=4 10662 B13R1.528 CCC(=O)CCc1ccccc1O 1458a_100000210414_100000722297 [0,1,0,0,0,2|1,0,0]=4 10663 B13R1.528 CCC(=O)COc1ccccc1Br 1458a_100000216496_100000210202 [0,1,0,0,0,2|1,0,0]=4 10664 B13R1.528 CCC(=O)COc1ccccc1Br 7a_100000181306_100000747405 [0,1,0,0,0,2|1,0,0]=4 10665 B13R1.528 CCC(=O)COc1ccccc1C 1458a_100000182418_100000210202 [0,1,0,0,0,2|1,0,0]=4 10666 B13R1.528 CCC(=O)COc1ccccc1C 7a_100000210338_100000747405 [0,1,0,0,0,2|1,0,0]=4 10667 B13R1.528 CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210202 [0,1,0,0,0,2|1,0,0]=4 10668 B13R1.528 CCC(=O)COc1ccccc1Cl 7a_100000210172_100000747405 [0,1,0,0,0,2|1,0,0]=4 10669 B13R1.528 CCC(=O)COc1ccccc1F 1458a_100000182486_100000210202 [0,1,0,0,0,2|1,0,0]=4 10670 B13R1.528 CCC(=O)COc1ccccc1F 7a_100000210171_100000747405 [0,1,0,0,0,2|1,0,0]=4 10671 B13R1.528 CCC(=O)COc1ccccc1I 7a_100000739446_100000747405 [0,1,0,0,0,2|1,0,0]=4 10672 B13R1.528 CCC(=O)COc1ccccc1N 7a_100000185747_100000747405 [0,1,0,0,0,2|1,0,0]=4 10673 B13R1.528 CCC(=O)COc1ccccc1O 1458a_100000183020_100000210202 [0,1,0,0,0,2|1,0,0]=4 10674 B13R1.528 CCC(=O)CSc1ccccc1Br 62a_100000695589_100000747405 [0,1,0,0,0,2|1,0,0]=4 10675 B13R1.528 CCC(=O)CSc1ccccc1Br 62a_100000747405_100000695589 [0,1,0,0,0,2|1,0,0]=4 10676 B13R1.528 CCC(=O)CSc1ccccc1C 1458a_100000183026_100000210202 [0,1,0,0,0,2|1,0,0]=4 10677 B13R1.528 CCC(=O)CSc1ccccc1C 62a_100000210755_100000747405 [0,1,0,0,0,2|1,0,0]=4 10678 B13R1.528 CCC(=O)CSc1ccccc1C 62a_100000747405_100000210755 [0,1,0,0,0,2|1,0,0]=4 10679 B13R1.528 CCC(=O)CSc1ccccc1Cl 62a_100000747405_100000764095 [0,1,0,0,0,2|1,0,0]=4 10680 B13R1.528 CCC(=O)CSc1ccccc1Cl 62a_100000764095_100000747405 [0,1,0,0,0,2|1,0,0]=4 10681 B13R1.528 CCC(=O)CSc1ccccc1F 1458a_100000179528_100000210202 [0,1,0,0,0,2|1,0,0]=4 10682 B13R1.528 CCC(=O)CSc1ccccc1F 62a_100000747405_100011215700 [0,1,0,0,0,2|1,0,0]=4 10683 B13R1.528 CCC(=O)CSc1ccccc1F 62a_100011215700_100000747405 [0,1,0,0,0,2|1,0,0]=4 10684 B13R1.528 CCC(=O)CSc1ccccc1N 62a_100000210017_100000747405 [0,1,0,0,0,2|1,0,0]=4 10685 B13R1.528 CCC(=O)CSc1ccccc1N 62a_100000747405_100000210017 [0,1,0,0,0,2|1,0,0]=4 10686 B13R1.528 CCC(=O)CSc1ccccc1O 1458a_100000695322_100000210202 [0,1,0,0,0,2|1,0,0]=4 10687 B13R1.528 CCC(=O)CSc1ccccc1O 62a_100000739446_100000747405 [0,1,0,0,0,2|1,0,0]=4 10688 B13R1.528 CCC(=O)CSc1ccccc1O 62a_100000747405_100000739446 [0,1,0,0,0,2|1,0,0]=4 10689 B13R1.528 CCC(=O)NCc1ccccc1Br 11a_100000689332_100000210414 [0,1,0,0,0,2|1,0,0]=4 10690 B13R1.528 CCC(=O)NCc1ccccc1Br 1626a_100000689332_100000210414 [0,1,0,0,0,2|1,0,0]=4 10691 B13R1.528 CCC(=O)NCc1ccccc1Br 240690a_100000689332_100000210414 [0,1,0,0,0,2|1,0,0]=4 10692 B13R1.528 CCC(=O)NCc1ccccc1Br 527a_100000689332_100000210414 [0,1,0,0,0,2|1,0,0]=4 10693 B13R1.528 CCC(=O)NCc1ccccc1C 11a_100000174972_100000210414 [0,1,0,0,0,2|1,0,0]=4 10694 B13R1.528 CCC(=O)NCc1ccccc1C 1626a_100000174972_100000210414 [0,1,0,0,0,2|1,0,0]=4 10695 B13R1.528 CCC(=O)NCc1ccccc1C 240690a_100000174972_100000210414 [0,1,0,0,0,2|1,0,0]=4 10696 B13R1.528 CCC(=O)NCc1ccccc1C 527a_100000174972_100000210414 [0,1,0,0,0,2|1,0,0]=4 10697 B13R1.528 CCC(=O)NCc1ccccc1Cl 11a_100000174879_100000210414 [0,1,0,0,0,2|1,0,0]=4 10698 B13R1.528 CCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000210414 [0,1,0,0,0,2|1,0,0]=4 10699 B13R1.528 CCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000210414 [0,1,0,0,0,2|1,0,0]=4 10700 B13R1.528 CCC(=O)NCc1ccccc1Cl 527a_100000174879_100000210414 [0,1,0,0,0,2|1,0,0]=4 10701 B13R1.528 CCC(=O)NCc1ccccc1F 11a_100000174869_100000210414 [0,1,0,0,0,2|1,0,0]=4 10702 B13R1.528 CCC(=O)NCc1ccccc1F 1626a_100000174869_100000210414 [0,1,0,0,0,2|1,0,0]=4 10703 B13R1.528 CCC(=O)NCc1ccccc1F 240690a_100000174869_100000210414 [0,1,0,0,0,2|1,0,0]=4 10704 B13R1.528 CCC(=O)NCc1ccccc1F 527a_100000174869_100000210414 [0,1,0,0,0,2|1,0,0]=4 10705 B13R1.528 CCC(=O)NCc1ccccc1I 11a_100015347259_100000210414 [0,1,0,0,0,2|1,0,0]=4 10706 B13R1.528 CCC(=O)NCc1ccccc1I 1626a_100015347259_100000210414 [0,1,0,0,0,2|1,0,0]=4 10707 B13R1.528 CCC(=O)NCc1ccccc1I 240690a_100015347259_100000210414 [0,1,0,0,0,2|1,0,0]=4 10708 B13R1.528 CCC(=O)NCc1ccccc1I 527a_100015347259_100000210414 [0,1,0,0,0,2|1,0,0]=4 10709 B13R1.528 CCC(=O)NCc1ccccc1O 240690a_100000185550_100000210414 [0,1,0,0,0,2|1,0,0]=4 10710 B13R1.528 CCC(=O)NCc1ccccc1O 527a_100000185550_100000210414 [0,1,0,0,0,2|1,0,0]=4 10711 B13R1.528 CCC(=O)NNc1ccccc1Br 22a_100000241748_100000210414 [0,1,0,0,0,2|1,0,0]=4 10712 B13R1.528 CCC(=O)NNc1ccccc1C 22a_100000184220_100000210414 [0,1,0,0,0,2|1,0,0]=4 10713 B13R1.528 CCC(=O)NNc1ccccc1Cl 22a_100000683529_100000210414 [0,1,0,0,0,2|1,0,0]=4 10714 B13R1.528 CCC(=O)NNc1ccccc1F 22a_100000239246_100000210414 [0,1,0,0,0,2|1,0,0]=4 10715 B13R1.528 CCC(=O)NNc1ccccc1I 22a_100011218156_100000210414 [0,1,0,0,0,2|1,0,0]=4 10716 B13R1.528 CNC(=O)C=Cc1ccccc1Br 11a_106832991635_100000719032 [0,1,0,0,0,2|0,0,0]=3 10717 B13R1.528 CNC(=O)C=Cc1ccccc1Br 1626a_100102657272_100000719032 [0,1,0,0,0,2|0,0,0]=3 10718 B13R1.528 CNC(=O)C=Cc1ccccc1Br 240690a_100102657272_100000719032 [0,1,0,0,0,2|0,0,0]=3 10719 B13R1.528 CNC(=O)C=Cc1ccccc1C 1626a_100102657272_100016266485 [0,1,0,0,0,2|0,0,0]=3 10720 B13R1.528 CNC(=O)C=Cc1ccccc1Cl 11a_106832991635_100000720304 [0,1,0,0,0,2|0,0,0]=3 10721 B13R1.528 CNC(=O)C=Cc1ccccc1Cl 1626a_100102657272_100000720304 [0,1,0,0,0,2|0,0,0]=3 10722 B13R1.528 CNC(=O)C=Cc1ccccc1Cl 240690a_100102657272_100000720304 [0,1,0,0,0,2|0,0,0]=3 10723 B13R1.528 CNC(=O)C=Cc1ccccc1F 11a_106832991635_100016256065 [0,1,0,0,0,2|0,0,0]=3 10724 B13R1.528 CNC(=O)C=Cc1ccccc1F 1626a_100102657272_100016256065 [0,1,0,0,0,2|0,0,0]=3 10725 B13R1.528 CNC(=O)C=Cc1ccccc1F 240690a_100102657272_100016256065 [0,1,0,0,0,2|0,0,0]=3 10726 B13R1.528 CNC(=O)CCc1ccccc1Br 11a_106832991635_100000740810 [0,1,0,0,0,2|0,0,0]=3 10727 B13R1.528 CNC(=O)CCc1ccccc1Br 1626a_100102657272_100000740810 [0,1,0,0,0,2|0,0,0]=3 10728 B13R1.528 CNC(=O)CCc1ccccc1Br 240690a_100102657272_100000740810 [0,1,0,0,0,2|0,0,0]=3 10729 B13R1.528 CNC(=O)CCc1ccccc1Br 527a_100102657272_100000740810 [0,1,0,0,0,2|0,0,0]=3 10730 B13R1.528 CNC(=O)CCc1ccccc1C 11a_106832991635_100000748742 [0,1,0,0,0,2|0,0,0]=3 10731 B13R1.528 CNC(=O)CCc1ccccc1C 1626a_100102657272_100000748742 [0,1,0,0,0,2|0,0,0]=3 10732 B13R1.528 CNC(=O)CCc1ccccc1C 240690a_100102657272_100000748742 [0,1,0,0,0,2|0,0,0]=3 10733 B13R1.528 CNC(=O)CCc1ccccc1C 527a_100102657272_100000748742 [0,1,0,0,0,2|0,0,0]=3 10734 B13R1.528 CNC(=O)CCc1ccccc1Cl 11a_106832991635_100000184300 [0,1,0,0,0,2|0,0,0]=3 10735 B13R1.528 CNC(=O)CCc1ccccc1Cl 1626a_100102657272_100000184300 [0,1,0,0,0,2|0,0,0]=3 10736 B13R1.528 CNC(=O)CCc1ccccc1Cl 240690a_100102657272_100000184300 [0,1,0,0,0,2|0,0,0]=3 10737 B13R1.528 CNC(=O)CCc1ccccc1Cl 527a_100102657272_100000184300 [0,1,0,0,0,2|0,0,0]=3 10738 B13R1.528 CNC(=O)CCc1ccccc1F 11a_106832991635_100000189703 [0,1,0,0,0,2|0,0,0]=3 10739 B13R1.528 CNC(=O)CCc1ccccc1F 1626a_100102657272_100000189703 [0,1,0,0,0,2|0,0,0]=3 10740 B13R1.528 CNC(=O)CCc1ccccc1F 240690a_100102657272_100000189703 [0,1,0,0,0,2|0,0,0]=3 10741 B13R1.528 CNC(=O)CCc1ccccc1F 527a_100102657272_100000189703 [0,1,0,0,0,2|0,0,0]=3 10742 B13R1.528 CNC(=O)CCc1ccccc1I 11a_106832991635_100000037306 [0,1,0,0,0,2|0,0,0]=3 10743 B13R1.528 CNC(=O)CCc1ccccc1I 1626a_100102657272_100000037306 [0,1,0,0,0,2|0,0,0]=3 10744 B13R1.528 CNC(=O)CCc1ccccc1I 240690a_100102657272_100000037306 [0,1,0,0,0,2|0,0,0]=3 10745 B13R1.528 CNC(=O)CCc1ccccc1I 527a_100102657272_100000037306 [0,1,0,0,0,2|0,0,0]=3 10746 B13R1.528 CNC(=O)CCc1ccccc1O 11a_106832991635_100000181328 [0,1,0,0,0,2|0,0,0]=3 10747 B13R1.528 CNC(=O)CCc1ccccc1O 240690a_100102657272_100000181328 [0,1,0,0,0,2|0,0,0]=3 10748 B13R1.528 CNC(=O)CCc1ccccc1O 527a_100102657272_100000181328 [0,1,0,0,0,2|0,0,0]=3 10749 B13R1.528 CNC(=O)CCn1ccccc1=O 11a_106832991635_100000738505 [0,1,0,0,0,2|1,0,0]=4 10750 B13R1.528 CNC(=O)CCn1ccccc1=O 1626a_100102657272_100000738505 [0,1,0,0,0,2|1,0,0]=4 10751 B13R1.528 CNC(=O)CCn1ccccc1=O 240690a_100102657272_100000738505 [0,1,0,0,0,2|1,0,0]=4 10752 B13R1.528 CNC(=O)CCn1ccccc1=O 527a_100102657272_100000738505 [0,1,0,0,0,2|1,0,0]=4 10753 B13R1.528 CNC(=O)CNc1ccccc1Br 34a_100000210017_100000183359 [0,1,0,0,0,2|0,0,0]=3 10754 B13R1.528 CNC(=O)CNc1ccccc1C 34a_100015192222_100000183359 [0,1,0,0,0,2|0,0,0]=3 10755 B13R1.528 CNC(=O)CNc1ccccc1Cl 34a_100000185783_100000183359 [0,1,0,0,0,2|0,0,0]=3 10756 B13R1.528 CNC(=O)CNc1ccccc1F 34a_100000210422_100000183359 [0,1,0,0,0,2|0,0,0]=3 10757 B13R1.528 CNC(=O)CNc1ccccc1I 34a_100000210053_100000183359 [0,1,0,0,0,2|0,0,0]=3 10758 B13R1.528 CNC(=O)CNc1ccccc1O 34a_100000185747_100000183359 [0,1,0,0,0,2|0,0,0]=3 10759 B13R1.528 CNC(=O)CNc1ccncc1Br 27a_100000693194_100000726257 [0,1,0,0,0,2|1,0,0]=4 10760 B13R1.528 CNC(=O)CNc1ccncc1C 27a_100000693194_100000765111 [0,1,0,0,0,2|1,0,0]=4 10761 B13R1.528 CNC(=O)CNc1ccncc1F 27a_100000693194_100000035921 [0,1,0,0,0,2|1,0,0]=4 10762 B13R1.528 CNC(=O)CNc1ncccc1Br 27a_100000693194_100000696092 [0,1,0,0,0,2|1,0,0]=4 10763 B13R1.528 CNC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000183359 [0,1,0,0,0,2|1,0,0]=4 10764 B13R1.528 CNC(=O)COc1ccccc1Br 11a_106832991635_100000216496 [0,1,0,0,0,2|0,0,0]=3 10765 B13R1.528 CNC(=O)COc1ccccc1Br 1626a_100102657272_100000216496 [0,1,0,0,0,2|0,0,0]=3 10766 B13R1.528 CNC(=O)COc1ccccc1Br 240690a_100102657272_100000216496 [0,1,0,0,0,2|0,0,0]=3 10767 B13R1.528 CNC(=O)COc1ccccc1Br 34a_100000181306_100000183359 [0,1,0,0,0,2|0,0,0]=3 10768 B13R1.528 CNC(=O)COc1ccccc1Br 527a_100102657272_100000216496 [0,1,0,0,0,2|0,0,0]=3 10769 B13R1.528 CNC(=O)COc1ccccc1Br 7a_100000181306_100000183359 [0,1,0,0,0,2|0,0,0]=3 10770 B13R1.528 CNC(=O)COc1ccccc1C 11a_106832991635_100000182418 [0,1,0,0,0,2|0,0,0]=3 10771 B13R1.528 CNC(=O)COc1ccccc1C 1626a_100102657272_100000182418 [0,1,0,0,0,2|0,0,0]=3 10772 B13R1.528 CNC(=O)COc1ccccc1C 240690a_100102657272_100000182418 [0,1,0,0,0,2|0,0,0]=3 10773 B13R1.528 CNC(=O)COc1ccccc1C 34a_100000210338_100000183359 [0,1,0,0,0,2|0,0,0]=3 10774 B13R1.528 CNC(=O)COc1ccccc1C 527a_100102657272_100000182418 [0,1,0,0,0,2|0,0,0]=3 10775 B13R1.528 CNC(=O)COc1ccccc1C 7a_100000210338_100000183359 [0,1,0,0,0,2|0,0,0]=3 10776 B13R1.528 CNC(=O)COc1ccccc1Cl 11a_106832991635_100000185159 [0,1,0,0,0,2|0,0,0]=3 10777 B13R1.528 CNC(=O)COc1ccccc1Cl 1626a_100102657272_100000185159 [0,1,0,0,0,2|0,0,0]=3 10778 B13R1.528 CNC(=O)COc1ccccc1Cl 240690a_100102657272_100000185159 [0,1,0,0,0,2|0,0,0]=3 10779 B13R1.528 CNC(=O)COc1ccccc1Cl 34a_100000210172_100000183359 [0,1,0,0,0,2|0,0,0]=3 10780 B13R1.528 CNC(=O)COc1ccccc1Cl 527a_100102657272_100000185159 [0,1,0,0,0,2|0,0,0]=3 10781 B13R1.528 CNC(=O)COc1ccccc1Cl 7a_100000210172_100000183359 [0,1,0,0,0,2|0,0,0]=3 10782 B13R1.528 CNC(=O)COc1ccccc1F 11a_106832991635_100000182486 [0,1,0,0,0,2|0,0,0]=3 10783 B13R1.528 CNC(=O)COc1ccccc1F 1626a_100102657272_100000182486 [0,1,0,0,0,2|0,0,0]=3 10784 B13R1.528 CNC(=O)COc1ccccc1F 240690a_100102657272_100000182486 [0,1,0,0,0,2|0,0,0]=3 10785 B13R1.528 CNC(=O)COc1ccccc1F 34a_100000210171_100000183359 [0,1,0,0,0,2|0,0,0]=3 10786 B13R1.528 CNC(=O)COc1ccccc1F 527a_100102657272_100000182486 [0,1,0,0,0,2|0,0,0]=3 10787 B13R1.528 CNC(=O)COc1ccccc1F 7a_100000210171_100000183359 [0,1,0,0,0,2|0,0,0]=3 10788 B13R1.528 CNC(=O)COc1ccccc1I 34a_100000739446_100000183359 [0,1,0,0,0,2|0,0,0]=3 10789 B13R1.528 CNC(=O)COc1ccccc1I 7a_100000739446_100000183359 [0,1,0,0,0,2|0,0,0]=3 10790 B13R1.528 CNC(=O)COc1ccccc1N 34a_100000185747_100000183359 [0,1,0,0,0,2|0,0,0]=3 10791 B13R1.528 CNC(=O)COc1ccccc1N 7a_100000185747_100000183359 [0,1,0,0,0,2|0,0,0]=3 10792 B13R1.528 CNC(=O)COc1ccccc1O 240690a_100102657272_100000183020 [0,1,0,0,0,2|0,0,0]=3 10793 B13R1.528 CNC(=O)COc1ccccc1O 271570a_203496583355_200000148481 [0,1,0,0,0,2|0,0,0]=3 10794 B13R1.528 CNC(=O)COc1ccccc1O 527a_100102657272_100000183020 [0,1,0,0,0,2|0,0,0]=3 10795 B13R1.528 CNC(=O)COc1cccnc1Br 34a_100000744436_100000183359 [0,1,0,0,0,2|1,0,0]=4 10796 B13R1.528 CNC(=O)COc1cccnc1Br 7a_100000744436_100000183359 [0,1,0,0,0,2|1,0,0]=4 10797 B13R1.528 CNC(=O)COc1cccnc1C 34a_100000745507_100000183359 [0,1,0,0,0,2|1,0,0]=4 10798 B13R1.528 CNC(=O)COc1cccnc1C 7a_100000745507_100000183359 [0,1,0,0,0,2|1,0,0]=4 10799 B13R1.528 CNC(=O)COc1cccnc1Cl 34a_100000757616_100000183359 [0,1,0,0,0,2|1,0,0]=4 10800 B13R1.528 CNC(=O)COc1cccnc1Cl 7a_100000757616_100000183359 [0,1,0,0,0,2|1,0,0]=4 10801 B13R1.528 CNC(=O)COc1cccnc1F 34a_100000061740_100000183359 [0,1,0,0,0,2|1,0,0]=4 10802 B13R1.528 CNC(=O)COc1cccnc1F 7a_100000061740_100000183359 [0,1,0,0,0,2|1,0,0]=4 10803 B13R1.528 CNC(=O)COc1cccnc1I 34a_100000034122_100000183359 [0,1,0,0,0,2|1,0,0]=4 10804 B13R1.528 CNC(=O)COc1cccnc1I 7a_100000034122_100000183359 [0,1,0,0,0,2|1,0,0]=4 10805 B13R1.528 CNC(=O)COc1cccnc1N 34a_100000211975_100000183359 [0,1,0,0,0,2|1,0,0]=4 10806 B13R1.528 CNC(=O)COc1cccnc1N 7a_100000211975_100000183359 [0,1,0,0,0,2|1,0,0]=4 10807 B13R1.528 CNC(=O)COc1cccoc1=O 34a_100000077404_100000183359 [0,1,0,0,0,2|1,0,0]=4 10808 B13R1.528 CNC(=O)COc1cccoc1=O 7a_100000077404_100000183359 [0,1,0,0,0,2|1,0,0]=4 10809 B13R1.528 CNC(=O)COc1ccncc1Br 34a_100011996408_100000183359 [0,1,0,0,0,2|1,0,0]=4 10810 B13R1.528 CNC(=O)COc1ccncc1C 34a_100000694293_100000183359 [0,1,0,0,0,2|1,0,0]=4 10811 B13R1.528 CNC(=O)COc1ccncc1Cl 34a_100011997054_100000183359 [0,1,0,0,0,2|1,0,0]=4 10812 B13R1.528 CNC(=O)COc1ccncc1F 34a_200000081243_100000183359 [0,1,0,0,0,2|1,0,0]=4 10813 B13R1.528 CNC(=O)COc1cnccc1C 34a_100011997053_100000183359 [0,1,0,0,0,2|1,0,0]=4 10814 B13R1.528 CNC(=O)COc1cnccc1C 7a_100011997053_100000183359 [0,1,0,0,0,2|1,0,0]=4 10815 B13R1.528 CNC(=O)COc1cnccc1Cl 34a_100011996695_100000183359 [0,1,0,0,0,2|1,0,0]=4 10816 B13R1.528 CNC(=O)COc1cnccc1I 34a_100000050107_100000183359 [0,1,0,0,0,2|1,0,0]=4 10817 B13R1.528 CNC(=O)COc1cnccc1N 34a_100000753702_100000183359 [0,1,0,0,0,2|1,0,0]=4 10818 B13R1.528 CNC(=O)COc1coccc1=O 34a_100000060831_100000183359 [0,1,0,0,0,2|1,0,0]=4 10819 B13R1.528 CNC(=O)COc1ncccc1Cl 34a_100011290957_100000183359 [0,1,0,0,0,2|1,0,0]=4 10820 B13R1.528 CNC(=O)COc1ncccc1F 34a_100011219419_100000183359 [0,1,0,0,0,2|1,0,0]=4 10821 B13R1.528 CNC(=O)COc1ncccc1N 34a_100000746358_100000183359 [0,1,0,0,0,2|1,0,0]=4 10822 B13R1.528 CNC(=O)CSc1c[nH]ccc1=O 62a_100000183359_100009998708 [0,1,0,0,0,2|1,0,0]=4 10823 B13R1.528 CNC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000183359 [0,1,0,0,0,2|1,0,0]=4 10824 B13R1.528 CNC(=O)CSc1c[nH]ccc1=S 62a_100000183359_200012280681 [0,1,0,0,0,2|1,0,0]=4 10825 B13R1.528 CNC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000183359 [0,1,0,0,0,2|1,0,0]=4 10826 B13R1.528 CNC(=O)CSc1cccc[n+]1C 62a_100000183359_100000212160 [0,1,0,0,0,2|1,0,0]=4 10827 B13R1.528 CNC(=O)CSc1cccc[n+]1[O-] 62a_100000183359_200000042595 [0,1,0,0,0,2|1,0,0]=4 10828 B13R1.528 CNC(=O)CSc1ccccc1Br 62a_100000183359_100000695589 [0,1,0,0,0,2|0,0,0]=3 10829 B13R1.528 CNC(=O)CSc1ccccc1Br 62a_100000695589_100000183359 [0,1,0,0,0,2|0,0,0]=3 10830 B13R1.528 CNC(=O)CSc1ccccc1C 11a_106832991635_100000183026 [0,1,0,0,0,2|0,0,0]=3 10831 B13R1.528 CNC(=O)CSc1ccccc1C 1626a_100102657272_100000183026 [0,1,0,0,0,2|0,0,0]=3 10832 B13R1.528 CNC(=O)CSc1ccccc1C 240690a_100102657272_100000183026 [0,1,0,0,0,2|0,0,0]=3 10833 B13R1.528 CNC(=O)CSc1ccccc1C 527a_100102657272_100000183026 [0,1,0,0,0,2|0,0,0]=3 10834 B13R1.528 CNC(=O)CSc1ccccc1C 62a_100000183359_100000210755 [0,1,0,0,0,2|0,0,0]=3 10835 B13R1.528 CNC(=O)CSc1ccccc1C 62a_100000210755_100000183359 [0,1,0,0,0,2|0,0,0]=3 10836 B13R1.528 CNC(=O)CSc1ccccc1Cl 62a_100000183359_100000764095 [0,1,0,0,0,2|0,0,0]=3 10837 B13R1.528 CNC(=O)CSc1ccccc1Cl 62a_100000764095_100000183359 [0,1,0,0,0,2|0,0,0]=3 10838 B13R1.528 CNC(=O)CSc1ccccc1F 11a_106832991635_100000179528 [0,1,0,0,0,2|0,0,0]=3 10839 B13R1.528 CNC(=O)CSc1ccccc1F 1626a_100102657272_100000179528 [0,1,0,0,0,2|0,0,0]=3 10840 B13R1.528 CNC(=O)CSc1ccccc1F 240690a_100102657272_100000179528 [0,1,0,0,0,2|0,0,0]=3 10841 B13R1.528 CNC(=O)CSc1ccccc1F 62a_100000183359_100011215700 [0,1,0,0,0,2|0,0,0]=3 10842 B13R1.528 CNC(=O)CSc1ccccc1F 62a_100011215700_100000183359 [0,1,0,0,0,2|0,0,0]=3 10843 B13R1.528 CNC(=O)CSc1ccccc1N 62a_100000183359_100000210017 [0,1,0,0,0,2|0,0,0]=3 10844 B13R1.528 CNC(=O)CSc1ccccc1N 62a_100000210017_100000183359 [0,1,0,0,0,2|0,0,0]=3 10845 B13R1.528 CNC(=O)CSc1ccccc1O 240690a_100102657272_100000695322 [0,1,0,0,0,2|0,0,0]=3 10846 B13R1.528 CNC(=O)CSc1ccccc1O 527a_100102657272_100000695322 [0,1,0,0,0,2|0,0,0]=3 10847 B13R1.528 CNC(=O)CSc1ccccc1O 62a_100000183359_100000739446 [0,1,0,0,0,2|0,0,0]=3 10848 B13R1.528 CNC(=O)CSc1ccccc1O 62a_100000739446_100000183359 [0,1,0,0,0,2|0,0,0]=3 10849 B13R1.528 CNC(=O)CSc1cccnc1Br 62a_100000183359_100010202626 [0,1,0,0,0,2|1,0,0]=4 10850 B13R1.528 CNC(=O)CSc1cccnc1Br 62a_100010202626_100000183359 [0,1,0,0,0,2|1,0,0]=4 10851 B13R1.528 CNC(=O)CSc1cccnc1C 62a_100000183359_100000751574 [0,1,0,0,0,2|1,0,0]=4 10852 B13R1.528 CNC(=O)CSc1cccnc1C 62a_100000751574_100000183359 [0,1,0,0,0,2|1,0,0]=4 10853 B13R1.528 CNC(=O)CSc1cccnc1Cl 62a_100000036424_100000183359 [0,1,0,0,0,2|1,0,0]=4 10854 B13R1.528 CNC(=O)CSc1cccnc1Cl 62a_100000183359_100000036424 [0,1,0,0,0,2|1,0,0]=4 10855 B13R1.528 CNC(=O)CSc1cccnc1F 62a_100000183359_100009816115 [0,1,0,0,0,2|1,0,0]=4 10856 B13R1.528 CNC(=O)CSc1cccnc1F 62a_100009816115_100000183359 [0,1,0,0,0,2|1,0,0]=4 10857 B13R1.528 CNC(=O)CSc1cccnc1N 62a_100000045569_100000183359 [0,1,0,0,0,2|1,0,0]=4 10858 B13R1.528 CNC(=O)CSc1cccnc1N 62a_100000183359_100000045569 [0,1,0,0,0,2|1,0,0]=4 10859 B13R1.528 CNC(=O)CSc1cccnc1O 62a_100000183359_100000760158 [0,1,0,0,0,2|1,0,0]=4 10860 B13R1.528 CNC(=O)CSc1cccnc1O 62a_100000760158_100000183359 [0,1,0,0,0,2|1,0,0]=4 10861 B13R1.528 CNC(=O)CSc1ccncc1Br 62a_100000183359_100000726257 [0,1,0,0,0,2|1,0,0]=4 10862 B13R1.528 CNC(=O)CSc1ccncc1Br 62a_100000726257_100000183359 [0,1,0,0,0,2|1,0,0]=4 10863 B13R1.528 CNC(=O)CSc1ccncc1C 62a_100000183359_100000765111 [0,1,0,0,0,2|1,0,0]=4 10864 B13R1.528 CNC(=O)CSc1ccncc1C 62a_100000765111_100000183359 [0,1,0,0,0,2|1,0,0]=4 10865 B13R1.528 CNC(=O)CSc1ccncc1Cl 62a_100000183359_100000708259 [0,1,0,0,0,2|1,0,0]=4 10866 B13R1.528 CNC(=O)CSc1ccncc1Cl 62a_100000708259_100000183359 [0,1,0,0,0,2|1,0,0]=4 10867 B13R1.528 CNC(=O)CSc1ccncc1F 62a_100000047030_100000183359 [0,1,0,0,0,2|1,0,0]=4 10868 B13R1.528 CNC(=O)CSc1ccncc1F 62a_100000183359_100000047030 [0,1,0,0,0,2|1,0,0]=4 10869 B13R1.528 CNC(=O)CSc1ccncc1N 62a_100000183359_100000756074 [0,1,0,0,0,2|1,0,0]=4 10870 B13R1.528 CNC(=O)CSc1ccncc1N 62a_100000756074_100000183359 [0,1,0,0,0,2|1,0,0]=4 10871 B13R1.528 CNC(=O)CSc1ccncc1O 62a_100000183359_100009817591 [0,1,0,0,0,2|1,0,0]=4 10872 B13R1.528 CNC(=O)CSc1ccncc1O 62a_100009817591_100000183359 [0,1,0,0,0,2|1,0,0]=4 10873 B13R1.528 CNC(=O)CSc1cnccc1Br 62a_100000183359_100010138639 [0,1,0,0,0,2|1,0,0]=4 10874 B13R1.528 CNC(=O)CSc1cnccc1Br 62a_100010138639_100000183359 [0,1,0,0,0,2|1,0,0]=4 10875 B13R1.528 CNC(=O)CSc1cnccc1C 62a_100000183359_100000761580 [0,1,0,0,0,2|1,0,0]=4 10876 B13R1.528 CNC(=O)CSc1cnccc1C 62a_100000761580_100000183359 [0,1,0,0,0,2|1,0,0]=4 10877 B13R1.528 CNC(=O)CSc1cnccc1Cl 62a_100000183359_100009995489 [0,1,0,0,0,2|1,0,0]=4 10878 B13R1.528 CNC(=O)CSc1cnccc1Cl 62a_100009995489_100000183359 [0,1,0,0,0,2|1,0,0]=4 10879 B13R1.528 CNC(=O)CSc1cnccc1F 62a_100000183359_100009820683 [0,1,0,0,0,2|1,0,0]=4 10880 B13R1.528 CNC(=O)CSc1cnccc1F 62a_100009820683_100000183359 [0,1,0,0,0,2|1,0,0]=4 10881 B13R1.528 CNC(=O)CSc1cnccc1N 62a_100000047001_100000183359 [0,1,0,0,0,2|1,0,0]=4 10882 B13R1.528 CNC(=O)CSc1cnccc1N 62a_100000183359_100000047001 [0,1,0,0,0,2|1,0,0]=4 10883 B13R1.528 CNC(=O)CSc1ncccc1Br 62a_100000183359_100000696092 [0,1,0,0,0,2|1,0,0]=4 10884 B13R1.528 CNC(=O)CSc1ncccc1Br 62a_100000696092_100000183359 [0,1,0,0,0,2|1,0,0]=4 10885 B13R1.528 CNC(=O)CSc1ncccc1C 62a_100000183359_100000751373 [0,1,0,0,0,2|1,0,0]=4 10886 B13R1.528 CNC(=O)CSc1ncccc1C 62a_100000751373_100000183359 [0,1,0,0,0,2|1,0,0]=4 10887 B13R1.528 CNC(=O)CSc1ncccc1Cl 62a_100000183359_100011356963 [0,1,0,0,0,2|1,0,0]=4 10888 B13R1.528 CNC(=O)CSc1ncccc1Cl 62a_100011356963_100000183359 [0,1,0,0,0,2|1,0,0]=4 10889 B13R1.528 CNC(=O)CSc1ncccc1F 62a_100000183359_100000685392 [0,1,0,0,0,2|1,0,0]=4 10890 B13R1.528 CNC(=O)CSc1ncccc1F 62a_100000685392_100000183359 [0,1,0,0,0,2|1,0,0]=4 10891 B13R1.528 CNC(=O)CSc1ncccc1N 62a_100000183359_100000688686 [0,1,0,0,0,2|1,0,0]=4 10892 B13R1.528 CNC(=O)CSc1ncccc1N 62a_100000688686_100000183359 [0,1,0,0,0,2|1,0,0]=4 10893 B13R1.528 CNC(=O)CSc1ncccc1O 62a_100000034122_100000183359 [0,1,0,0,0,2|1,0,0]=4 10894 B13R1.528 CNC(=O)CSc1ncccc1O 62a_100000183359_100000034122 [0,1,0,0,0,2|1,0,0]=4 10895 B13R1.528 CNC(=O)NCc1ccccc1Br 2708a_100000689332_106832991635 [0,1,0,0,0,2|0,0,0]=3 10896 B13R1.528 CNC(=O)NCc1ccccc1Br 2708a_100102657272_100000689332 [0,1,0,0,0,2|0,0,0]=3 10897 B13R1.528 CNC(=O)NCc1ccccc1Br 273464a_100000689332_100102657272 [0,1,0,0,0,2|0,0,0]=3 10898 B13R1.528 CNC(=O)NCc1ccccc1Br 273464a_100102657272_100000689332 [0,1,0,0,0,2|0,0,0]=3 10899 B13R1.528 CNC(=O)NCc1ccccc1Br 512a_100000689332_100102657272 [0,1,0,0,0,2|0,0,0]=3 10900 B13R1.528 CNC(=O)NCc1ccccc1Br 512a_106832991638_100000689332 [0,1,0,0,0,2|0,0,0]=3 10901 B13R1.528 CNC(=O)NCc1ccccc1C 2708a_100000174972_106832991635 [0,1,0,0,0,2|0,0,0]=3 10902 B13R1.528 CNC(=O)NCc1ccccc1C 2708a_100102657272_100000174972 [0,1,0,0,0,2|0,0,0]=3 10903 B13R1.528 CNC(=O)NCc1ccccc1C 273464a_100000174972_100102657272 [0,1,0,0,0,2|0,0,0]=3 10904 B13R1.528 CNC(=O)NCc1ccccc1C 273464a_100102657272_100000174972 [0,1,0,0,0,2|0,0,0]=3 10905 B13R1.528 CNC(=O)NCc1ccccc1C 512a_100000174972_100102657272 [0,1,0,0,0,2|0,0,0]=3 10906 B13R1.528 CNC(=O)NCc1ccccc1C 512a_106832991638_100000174972 [0,1,0,0,0,2|0,0,0]=3 10907 B13R1.528 CNC(=O)NCc1ccccc1Cl 2708a_100000174879_106832991635 [0,1,0,0,0,2|0,0,0]=3 10908 B13R1.528 CNC(=O)NCc1ccccc1Cl 2708a_100102657272_100000174879 [0,1,0,0,0,2|0,0,0]=3 10909 B13R1.528 CNC(=O)NCc1ccccc1Cl 273464a_100000174879_100102657272 [0,1,0,0,0,2|0,0,0]=3 10910 B13R1.528 CNC(=O)NCc1ccccc1Cl 273464a_100102657272_100000174879 [0,1,0,0,0,2|0,0,0]=3 10911 B13R1.528 CNC(=O)NCc1ccccc1Cl 512a_106832991638_100000174879 [0,1,0,0,0,2|0,0,0]=3 10912 B13R1.528 CNC(=O)NCc1ccccc1F 2708a_100000174869_106832991635 [0,1,0,0,0,2|0,0,0]=3 10913 B13R1.528 CNC(=O)NCc1ccccc1F 2708a_100102657272_100000174869 [0,1,0,0,0,2|0,0,0]=3 10914 B13R1.528 CNC(=O)NCc1ccccc1F 273464a_100000174869_100102657272 [0,1,0,0,0,2|0,0,0]=3 10915 B13R1.528 CNC(=O)NCc1ccccc1F 273464a_100102657272_100000174869 [0,1,0,0,0,2|0,0,0]=3 10916 B13R1.528 CNC(=O)NCc1ccccc1F 512a_100000174869_100102657272 [0,1,0,0,0,2|0,0,0]=3 10917 B13R1.528 CNC(=O)NCc1ccccc1F 512a_106832991638_100000174869 [0,1,0,0,0,2|0,0,0]=3 10918 B13R1.528 CNC(=O)NCc1ccccc1I 2708a_100015347259_106832991635 [0,1,0,0,0,2|0,0,0]=3 10919 B13R1.528 CNC(=O)NCc1ccccc1I 2708a_100102657272_100015347259 [0,1,0,0,0,2|0,0,0]=3 10920 B13R1.528 CNC(=O)NCc1ccccc1I 273464a_100015347259_100102657272 [0,1,0,0,0,2|0,0,0]=3 10921 B13R1.528 CNC(=O)NCc1ccccc1I 273464a_100102657272_100015347259 [0,1,0,0,0,2|0,0,0]=3 10922 B13R1.528 CNC(=O)NCc1ccccc1I 512a_100015347259_100102657272 [0,1,0,0,0,2|0,0,0]=3 10923 B13R1.528 CNC(=O)NCc1ccccc1I 512a_106832991638_100015347259 [0,1,0,0,0,2|0,0,0]=3 10924 B13R1.528 CNC(=O)NCc1ccccc1O 2708a_100000185550_106832991635 [0,1,0,0,0,2|0,0,0]=3 10925 B13R1.528 CNC(=O)NCc1ccccc1O 2708a_100102657272_100000185550 [0,1,0,0,0,2|0,0,0]=3 10926 B13R1.528 CNC(=O)NCc1ccccc1O 273464a_100000185550_100102657272 [0,1,0,0,0,2|0,0,0]=3 10927 B13R1.528 CNC(=O)NCc1ccccc1O 273464a_100102657272_100000185550 [0,1,0,0,0,2|0,0,0]=3 10928 B13R1.528 CNC(=O)NCc1ccccc1O 512a_100000185550_100102657272 [0,1,0,0,0,2|0,0,0]=3 10929 B13R1.528 CNC(=O)NCc1cccnc1Br 2708a_100009818023_106832991635 [0,1,0,0,0,2|1,0,0]=4 10930 B13R1.528 CNC(=O)NCc1cccnc1Br 2708a_100102657272_100009818023 [0,1,0,0,0,2|1,0,0]=4 10931 B13R1.528 CNC(=O)NCc1cccnc1Br 273464a_100009818023_100102657272 [0,1,0,0,0,2|1,0,0]=4 10932 B13R1.528 CNC(=O)NCc1cccnc1Br 273464a_100102657272_100009818023 [0,1,0,0,0,2|1,0,0]=4 10933 B13R1.528 CNC(=O)NCc1cccnc1Br 512a_100009818023_100102657272 [0,1,0,0,0,2|1,0,0]=4 10934 B13R1.528 CNC(=O)NCc1cccnc1Br 512a_106832991638_100009818023 [0,1,0,0,0,2|1,0,0]=4 10935 B13R1.528 CNC(=O)NCc1cccnc1Cl 2708a_100015189234_106832991635 [0,1,0,0,0,2|1,0,0]=4 10936 B13R1.528 CNC(=O)NCc1cccnc1Cl 2708a_100102657272_100015189234 [0,1,0,0,0,2|1,0,0]=4 10937 B13R1.528 CNC(=O)NCc1cccnc1Cl 273464a_100015189234_100102657272 [0,1,0,0,0,2|1,0,0]=4 10938 B13R1.528 CNC(=O)NCc1cccnc1Cl 273464a_100102657272_100015189234 [0,1,0,0,0,2|1,0,0]=4 10939 B13R1.528 CNC(=O)NCc1cccnc1Cl 512a_100015189234_100102657272 [0,1,0,0,0,2|1,0,0]=4 10940 B13R1.528 CNC(=O)NCc1cccnc1Cl 512a_106832991638_100015189234 [0,1,0,0,0,2|1,0,0]=4 10941 B13R1.528 CNC(=O)NCc1cccnc1F 2708a_100000724633_106832991635 [0,1,0,0,0,2|1,0,0]=4 10942 B13R1.528 CNC(=O)NCc1cccnc1F 2708a_100102657272_100000724633 [0,1,0,0,0,2|1,0,0]=4 10943 B13R1.528 CNC(=O)NCc1cccnc1F 273464a_100000724633_100102657272 [0,1,0,0,0,2|1,0,0]=4 10944 B13R1.528 CNC(=O)NCc1cccnc1F 273464a_100102657272_100000724633 [0,1,0,0,0,2|1,0,0]=4 10945 B13R1.528 CNC(=O)NCc1cccnc1F 512a_100000724633_100102657272 [0,1,0,0,0,2|1,0,0]=4 10946 B13R1.528 CNC(=O)NCc1cccnc1F 512a_106832991638_100000724633 [0,1,0,0,0,2|1,0,0]=4 10947 B13R1.528 CNC(=O)NCc1ccncc1Br 2708a_100020640021_106832991635 [0,1,0,0,0,2|1,0,0]=4 10948 B13R1.528 CNC(=O)NCc1ccncc1Br 2708a_100102657272_100020640021 [0,1,0,0,0,2|1,0,0]=4 10949 B13R1.528 CNC(=O)NCc1ccncc1Br 273464a_100020640021_100102657272 [0,1,0,0,0,2|1,0,0]=4 10950 B13R1.528 CNC(=O)NCc1ccncc1Br 273464a_100102657272_100020640021 [0,1,0,0,0,2|1,0,0]=4 10951 B13R1.528 CNC(=O)NCc1ccncc1Br 512a_100020640021_100102657272 [0,1,0,0,0,2|1,0,0]=4 10952 B13R1.528 CNC(=O)NCc1ccncc1Br 512a_106832991638_100020640021 [0,1,0,0,0,2|1,0,0]=4 10953 B13R1.528 CNC(=O)NCc1ccncc1C 2708a_100000708811_106832991635 [0,1,0,0,0,2|1,0,0]=4 10954 B13R1.528 CNC(=O)NCc1ccncc1C 2708a_100102657272_100000708811 [0,1,0,0,0,2|1,0,0]=4 10955 B13R1.528 CNC(=O)NCc1ccncc1C 273464a_100000708811_100102657272 [0,1,0,0,0,2|1,0,0]=4 10956 B13R1.528 CNC(=O)NCc1ccncc1C 273464a_100102657272_100000708811 [0,1,0,0,0,2|1,0,0]=4 10957 B13R1.528 CNC(=O)NCc1ccncc1C 512a_100000708811_100102657272 [0,1,0,0,0,2|1,0,0]=4 10958 B13R1.528 CNC(=O)NCc1ccncc1C 512a_106832991638_100000708811 [0,1,0,0,0,2|1,0,0]=4 10959 B13R1.528 CNC(=O)NCc1ccncc1F 2708a_100011935246_106832991635 [0,1,0,0,0,2|1,0,0]=4 10960 B13R1.528 CNC(=O)NCc1ccncc1F 2708a_100102657272_100011935246 [0,1,0,0,0,2|1,0,0]=4 10961 B13R1.528 CNC(=O)NCc1ccncc1F 273464a_100011935246_100102657272 [0,1,0,0,0,2|1,0,0]=4 10962 B13R1.528 CNC(=O)NCc1ccncc1F 273464a_100102657272_100011935246 [0,1,0,0,0,2|1,0,0]=4 10963 B13R1.528 CNC(=O)NCc1ccncc1F 512a_100011935246_100102657272 [0,1,0,0,0,2|1,0,0]=4 10964 B13R1.528 CNC(=O)NCc1ccncc1F 512a_106832991638_100011935246 [0,1,0,0,0,2|1,0,0]=4 10965 B13R1.528 CNC(=O)NCc1cnccc1C 2708a_100011997553_106832991635 [0,1,0,0,0,2|1,0,0]=4 10966 B13R1.528 CNC(=O)NCc1cnccc1C 2708a_100102657272_100011997553 [0,1,0,0,0,2|1,0,0]=4 10967 B13R1.528 CNC(=O)NCc1cnccc1C 273464a_100011997553_100102657272 [0,1,0,0,0,2|1,0,0]=4 10968 B13R1.528 CNC(=O)NCc1cnccc1C 273464a_100102657272_100011997553 [0,1,0,0,0,2|1,0,0]=4 10969 B13R1.528 CNC(=O)NCc1cnccc1C 512a_100011997553_100102657272 [0,1,0,0,0,2|1,0,0]=4 10970 B13R1.528 CNC(=O)NCc1cnccc1C 512a_106832991638_100011997553 [0,1,0,0,0,2|1,0,0]=4 10971 B13R1.528 CNC(=O)NCc1ncccc1Br 2708a_100020591323_106832991635 [0,1,0,0,0,2|1,0,0]=4 10972 B13R1.528 CNC(=O)NCc1ncccc1Br 2708a_100102657272_100020591323 [0,1,0,0,0,2|1,0,0]=4 10973 B13R1.528 CNC(=O)NCc1ncccc1Br 273464a_100020591323_100102657272 [0,1,0,0,0,2|1,0,0]=4 10974 B13R1.528 CNC(=O)NCc1ncccc1Br 273464a_100102657272_100020591323 [0,1,0,0,0,2|1,0,0]=4 10975 B13R1.528 CNC(=O)NCc1ncccc1Br 512a_100020591323_100102657272 [0,1,0,0,0,2|1,0,0]=4 10976 B13R1.528 CNC(=O)NCc1ncccc1Br 512a_106832991638_100020591323 [0,1,0,0,0,2|1,0,0]=4 10977 B13R1.528 CNC(=O)NCc1ncccc1C 2708a_100011223789_106832991635 [0,1,0,0,0,2|1,0,0]=4 10978 B13R1.528 CNC(=O)NCc1ncccc1C 2708a_100102657272_100011223789 [0,1,0,0,0,2|1,0,0]=4 10979 B13R1.528 CNC(=O)NCc1ncccc1C 273464a_100011223789_100102657272 [0,1,0,0,0,2|1,0,0]=4 10980 B13R1.528 CNC(=O)NCc1ncccc1C 273464a_100102657272_100011223789 [0,1,0,0,0,2|1,0,0]=4 10981 B13R1.528 CNC(=O)NCc1ncccc1C 512a_100011223789_100102657272 [0,1,0,0,0,2|1,0,0]=4 10982 B13R1.528 CNC(=O)NCc1ncccc1C 512a_106832991638_100011223789 [0,1,0,0,0,2|1,0,0]=4 10983 B13R1.528 CNC(=O)NCc1ncccc1Cl 2708a_100015189233_106832991635 [0,1,0,0,0,2|1,0,0]=4 10984 B13R1.528 CNC(=O)NCc1ncccc1Cl 2708a_100102657272_100015189233 [0,1,0,0,0,2|1,0,0]=4 10985 B13R1.528 CNC(=O)NCc1ncccc1Cl 273464a_100015189233_100102657272 [0,1,0,0,0,2|1,0,0]=4 10986 B13R1.528 CNC(=O)NCc1ncccc1Cl 273464a_100102657272_100015189233 [0,1,0,0,0,2|1,0,0]=4 10987 B13R1.528 CNC(=O)NCc1ncccc1Cl 512a_100015189233_100102657272 [0,1,0,0,0,2|1,0,0]=4 10988 B13R1.528 CNC(=O)NCc1ncccc1Cl 512a_106832991638_100015189233 [0,1,0,0,0,2|1,0,0]=4 10989 B13R1.528 CNC(=O)NCc1ncccc1F 2708a_100000690088_106832991635 [0,1,0,0,0,2|1,0,0]=4 10990 B13R1.528 CNC(=O)NCc1ncccc1F 2708a_100102657272_100000690088 [0,1,0,0,0,2|1,0,0]=4 10991 B13R1.528 CNC(=O)NCc1ncccc1F 273464a_100000690088_100102657272 [0,1,0,0,0,2|1,0,0]=4 10992 B13R1.528 CNC(=O)NCc1ncccc1F 273464a_100102657272_100000690088 [0,1,0,0,0,2|1,0,0]=4 10993 B13R1.528 CNC(=O)NCc1ncccc1F 512a_100000690088_100102657272 [0,1,0,0,0,2|1,0,0]=4 10994 B13R1.528 CNC(=O)NCc1ncccc1F 512a_106832991638_100000690088 [0,1,0,0,0,2|1,0,0]=4 10995 B13R1.528 CNC(=O)NNc1ccccc1Br 273464a_100102657272_100000241748 [0,1,0,0,0,2|0,0,0]=3 10996 B13R1.528 CNC(=O)NNc1ccccc1Br 512a_106832991638_100000241748 [0,1,0,0,0,2|0,0,0]=3 10997 B13R1.528 CNC(=O)NNc1ccccc1C 273464a_100102657272_100000184220 [0,1,0,0,0,2|0,0,0]=3 10998 B13R1.528 CNC(=O)NNc1ccccc1C 512a_106832991638_100000184220 [0,1,0,0,0,2|0,0,0]=3 10999 B13R1.528 CNC(=O)NNc1ccccc1Cl 273464a_100102657272_100000683529 [0,1,0,0,0,2|0,0,0]=3 11000 B13R1.528 CNC(=O)NNc1ccccc1Cl 512a_106832991638_100000683529 [0,1,0,0,0,2|0,0,0]=3 11001 B13R1.528 CNC(=O)NNc1ccccc1F 273464a_100102657272_100000239246 [0,1,0,0,0,2|0,0,0]=3 11002 B13R1.528 CNC(=O)NNc1ccccc1F 512a_106832991638_100000239246 [0,1,0,0,0,2|0,0,0]=3 11003 B13R1.528 CNC(=O)NNc1ccccc1I 273464a_100102657272_100011218156 [0,1,0,0,0,2|0,0,0]=3 11004 B13R1.528 CNC(=O)NNc1ccccc1I 512a_106832991638_100011218156 [0,1,0,0,0,2|0,0,0]=3 11005 B13R1.528 CNC(=O)NNc1cccnc1C 273464a_100102657272_100000730703 [0,1,0,0,0,2|1,0,0]=4 11006 B13R1.528 CNC(=O)NNc1cccnc1C 512a_106832991638_100000730703 [0,1,0,0,0,2|1,0,0]=4 11007 B13R1.528 CNC(=O)NNc1ccncc1Br 273464a_100102657272_100013404636 [0,1,0,0,0,2|1,0,0]=4 11008 B13R1.528 CNC(=O)NNc1ccncc1Br 512a_106832991638_100013404636 [0,1,0,0,0,2|1,0,0]=4 11009 B13R1.528 CNC(=O)NNc1ccncc1C 273464a_100102657272_100011935204 [0,1,0,0,0,2|1,0,0]=4 11010 B13R1.528 CNC(=O)NNc1ccncc1C 512a_106832991638_100011935204 [0,1,0,0,0,2|1,0,0]=4 11011 B13R1.528 CNC(=O)NNc1ncccc1Br 273464a_100102657272_100011464834 [0,1,0,0,0,2|1,0,0]=4 11012 B13R1.528 CNC(=O)NNc1ncccc1Br 512a_106832991638_100011464834 [0,1,0,0,0,2|1,0,0]=4 11013 B13R1.528 CNC(=O)NNc1ncccc1C 273464a_100102657272_100000708268 [0,1,0,0,0,2|1,0,0]=4 11014 B13R1.528 CNC(=O)NNc1ncccc1C 512a_106832991638_100000708268 [0,1,0,0,0,2|1,0,0]=4 11015 B13R1.528 CNC(=O)NNc1ncccc1Cl 273464a_100102657272_100000741667 [0,1,0,0,0,2|1,0,0]=4 11016 B13R1.528 CNC(=O)NNc1ncccc1Cl 512a_106832991638_100000741667 [0,1,0,0,0,2|1,0,0]=4 11017 B13R1.528 CNC(=O)NNc1ncccc1F 273464a_100102657272_100000717775 [0,1,0,0,0,2|1,0,0]=4 11018 B13R1.528 CNC(=O)NNc1ncccc1F 512a_106832991638_100000717775 [0,1,0,0,0,2|1,0,0]=4 11019 B13R1.528 CNC(=O)NNc1ncccc1I 273464a_100102657272_100010221029 [0,1,0,0,0,2|1,0,0]=4 11020 B13R1.528 CNC(=O)NNc1ncccc1I 512a_106832991638_100010221029 [0,1,0,0,0,2|1,0,0]=4 11021 B13R1.528 COC(=O)/C=C/c1ccccc1O 271570a_203496583355_100000151022 [0,1,0,0,0,2|1,0,0]=4 11022 B13R1.528 COC(=O)CCc1ccccc1O 271570a_203496583355_100009815308 [0,1,0,0,0,2|1,0,0]=4 11023 B13R1.528 COC(=O)CNc1ccccc1Br 34a_100000210017_100000747449 [0,1,0,0,0,2|1,0,0]=4 11024 B13R1.528 COC(=O)CNc1ccccc1C 34a_100015192222_100000747449 [0,1,0,0,0,2|1,0,0]=4 11025 B13R1.528 COC(=O)CNc1ccccc1Cl 34a_100000185783_100000747449 [0,1,0,0,0,2|1,0,0]=4 11026 B13R1.528 COC(=O)CNc1ccccc1F 34a_100000210422_100000747449 [0,1,0,0,0,2|1,0,0]=4 11027 B13R1.528 COC(=O)CNc1ccccc1I 34a_100000210053_100000747449 [0,1,0,0,0,2|1,0,0]=4 11028 B13R1.528 COC(=O)CNc1ccccc1O 34a_100000185747_100000747449 [0,1,0,0,0,2|1,0,0]=4 11029 B13R1.528 COC(=O)COc1ccccc1Br 34a_100000181306_100000747449 [0,1,0,0,0,2|1,0,0]=4 11030 B13R1.528 COC(=O)COc1ccccc1Br 7a_100000181306_100000747449 [0,1,0,0,0,2|1,0,0]=4 11031 B13R1.528 COC(=O)COc1ccccc1C 34a_100000210338_100000747449 [0,1,0,0,0,2|1,0,0]=4 11032 B13R1.528 COC(=O)COc1ccccc1C 7a_100000210338_100000747449 [0,1,0,0,0,2|1,0,0]=4 11033 B13R1.528 COC(=O)COc1ccccc1Cl 34a_100000210172_100000747449 [0,1,0,0,0,2|1,0,0]=4 11034 B13R1.528 COC(=O)COc1ccccc1Cl 7a_100000210172_100000747449 [0,1,0,0,0,2|1,0,0]=4 11035 B13R1.528 COC(=O)COc1ccccc1F 34a_100000210171_100000747449 [0,1,0,0,0,2|1,0,0]=4 11036 B13R1.528 COC(=O)COc1ccccc1F 7a_100000210171_100000747449 [0,1,0,0,0,2|1,0,0]=4 11037 B13R1.528 COC(=O)COc1ccccc1I 34a_100000739446_100000747449 [0,1,0,0,0,2|1,0,0]=4 11038 B13R1.528 COC(=O)COc1ccccc1I 7a_100000739446_100000747449 [0,1,0,0,0,2|1,0,0]=4 11039 B13R1.528 COC(=O)COc1ccccc1N 34a_100000185747_100000747449 [0,1,0,0,0,2|1,0,0]=4 11040 B13R1.528 COC(=O)COc1ccccc1N 7a_100000185747_100000747449 [0,1,0,0,0,2|1,0,0]=4 11041 B13R1.528 COC(=O)COc1ccccc1O 271570a_203496583355_200000173920 [0,1,0,0,0,2|1,0,0]=4 11042 B13R1.528 COC(=O)CSc1ccccc1Br 62a_100000695589_100000747449 [0,1,0,0,0,2|1,0,0]=4 11043 B13R1.528 COC(=O)CSc1ccccc1Br 62a_100000747449_100000695589 [0,1,0,0,0,2|1,0,0]=4 11044 B13R1.528 COC(=O)CSc1ccccc1C 62a_100000210755_100000747449 [0,1,0,0,0,2|1,0,0]=4 11045 B13R1.528 COC(=O)CSc1ccccc1C 62a_100000747449_100000210755 [0,1,0,0,0,2|1,0,0]=4 11046 B13R1.528 COC(=O)CSc1ccccc1Cl 62a_100000747449_100000764095 [0,1,0,0,0,2|1,0,0]=4 11047 B13R1.528 COC(=O)CSc1ccccc1Cl 62a_100000764095_100000747449 [0,1,0,0,0,2|1,0,0]=4 11048 B13R1.528 COC(=O)CSc1ccccc1F 62a_100000747449_100011215700 [0,1,0,0,0,2|1,0,0]=4 11049 B13R1.528 COC(=O)CSc1ccccc1F 62a_100011215700_100000747449 [0,1,0,0,0,2|1,0,0]=4 11050 B13R1.528 COC(=O)CSc1ccccc1N 62a_100000210017_100000747449 [0,1,0,0,0,2|1,0,0]=4 11051 B13R1.528 COC(=O)CSc1ccccc1N 62a_100000747449_100000210017 [0,1,0,0,0,2|1,0,0]=4 11052 B13R1.528 COC(=O)CSc1ccccc1O 62a_100000739446_100000747449 [0,1,0,0,0,2|1,0,0]=4 11053 B13R1.528 COC(=O)CSc1ccccc1O 62a_100000747449_100000739446 [0,1,0,0,0,2|1,0,0]=4 11054 B13R1.528 NNC(=O)COc1ccccc1O 271570a_203496583355_100025785231 [0,1,0,0,0,2|1,0,0]=4 11055 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Br 1458a_100000763181_100000189115 [0,2,0,0,0,1|1,0,0]=4 11056 B13R1.19 CC#CC(=O)Cc1ccc(cc1)C 1458a_100000763181_100000210814 [0,2,0,0,0,1|1,0,0]=4 11057 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Cl 1458a_100000763181_100000694040 [0,2,0,0,0,1|1,0,0]=4 11058 B13R1.19 CC#CC(=O)Cc1ccc(cc1)F 1458a_100000763181_100000198546 [0,2,0,0,0,1|1,0,0]=4 11059 B13R1.19 CC#CC(=O)Cc1ccc(cc1)I 1458a_100000763181_100000189116 [0,2,0,0,0,1|1,0,0]=4 11060 B13R1.19 CC#CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000763181 [0,2,0,0,0,1|1,0,0]=4 11061 B13R1.19 CC#CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000763181 [0,2,0,0,0,1|1,0,0]=4 11062 B13R1.19 CC#CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000763181 [0,2,0,0,0,1|1,0,0]=4 11063 B13R1.19 CC#CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000763181 [0,2,0,0,0,1|1,0,0]=4 11064 B13R1.19 CC#CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000763181 [0,2,0,0,0,1|1,0,0]=4 11065 B13R1.19 CC#CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000763181 [0,2,0,0,0,1|1,0,0]=4 11066 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Br 1458a_100000210699_100000189115 [0,2,0,0,0,1|1,0,0]=4 11067 B13R1.19 CC=CC(=O)Cc1ccc(cc1)C 1458a_100000210699_100000210814 [0,2,0,0,0,1|1,0,0]=4 11068 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000210699_100000694040 [0,2,0,0,0,1|1,0,0]=4 11069 B13R1.19 CC=CC(=O)Cc1ccc(cc1)F 1458a_100000210699_100000198546 [0,2,0,0,0,1|1,0,0]=4 11070 B13R1.19 CC=CC(=O)Cc1ccc(cc1)I 1458a_100000210699_100000189116 [0,2,0,0,0,1|1,0,0]=4 11071 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210699 [0,2,0,0,0,1|1,0,0]=4 11072 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210699 [0,2,0,0,0,1|1,0,0]=4 11073 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210699 [0,2,0,0,0,1|1,0,0]=4 11074 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210699 [0,2,0,0,0,1|1,0,0]=4 11075 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210699 [0,2,0,0,0,1|1,0,0]=4 11076 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210699 [0,2,0,0,0,1|1,0,0]=4 11077 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210699 [0,2,0,0,0,1|1,0,0]=4 11078 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210699 [0,2,0,0,0,1|1,0,0]=4 11079 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210699 [0,2,0,0,0,1|1,0,0]=4 11080 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210699 [0,2,0,0,0,1|1,0,0]=4 11081 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210699 [0,2,0,0,0,1|1,0,0]=4 11082 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210699 [0,2,0,0,0,1|1,0,0]=4 11083 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210699 [0,2,0,0,0,1|1,0,0]=4 11084 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210699 [0,2,0,0,0,1|1,0,0]=4 11085 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210699 [0,2,0,0,0,1|1,0,0]=4 11086 B13R1.19 CC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210699 [0,2,0,0,0,1|1,0,0]=4 11087 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210303 [0,2,0,0,0,1|1,0,0]=4 11088 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000211992_100000189115 [0,2,0,0,0,1|1,0,0]=4 11089 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000211992_100000210814 [0,2,0,0,0,1|1,0,0]=4 11090 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210303 [0,2,0,0,0,1|1,0,0]=4 11091 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210303 [0,2,0,0,0,1|1,0,0]=4 11092 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211992_100000694040 [0,2,0,0,0,1|1,0,0]=4 11093 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210303 [0,2,0,0,0,1|1,0,0]=4 11094 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000211992_100000198546 [0,2,0,0,0,1|1,0,0]=4 11095 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000211992_100000189116 [0,2,0,0,0,1|1,0,0]=4 11096 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210303 [0,2,0,0,0,1|1,0,0]=4 11097 B13R1.19 CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210303 [0,2,0,0,0,1|1,0,0]=4 11098 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000211992 [0,2,0,0,0,1|1,0,0]=4 11099 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000211992 [0,2,0,0,0,1|1,0,0]=4 11100 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000211992 [0,2,0,0,0,1|1,0,0]=4 11101 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000211992 [0,2,0,0,0,1|1,0,0]=4 11102 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211992 [0,2,0,0,0,1|1,0,0]=4 11103 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211992 [0,2,0,0,0,1|1,0,0]=4 11104 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211992 [0,2,0,0,0,1|1,0,0]=4 11105 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211992 [0,2,0,0,0,1|1,0,0]=4 11106 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000211992 [0,2,0,0,0,1|1,0,0]=4 11107 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000211992 [0,2,0,0,0,1|1,0,0]=4 11108 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211992 [0,2,0,0,0,1|1,0,0]=4 11109 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000211992 [0,2,0,0,0,1|1,0,0]=4 11110 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000211992 [0,2,0,0,0,1|1,0,0]=4 11111 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000211992 [0,2,0,0,0,1|1,0,0]=4 11112 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000211992 [0,2,0,0,0,1|1,0,0]=4 11113 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000211992 [0,2,0,0,0,1|1,0,0]=4 11114 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000211992 [0,2,0,0,0,1|1,0,0]=4 11115 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000211992 [0,2,0,0,0,1|1,0,0]=4 11116 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000211992 [0,2,0,0,0,1|1,0,0]=4 11117 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000211992 [0,2,0,0,0,1|1,0,0]=4 11118 B13R1.19 CCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000211992 [0,2,0,0,0,1|1,0,0]=4 11119 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 11a_100015525214_100000198978 [0,2,0,0,0,1|0,0,0]=3 11120 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 240690a_100015525214_100000198978 [0,2,0,0,0,1|0,0,0]=3 11121 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 527a_100015525214_100000198978 [0,2,0,0,0,1|0,0,0]=3 11122 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 11a_100015525214_100000212244 [0,2,0,0,0,1|0,0,0]=3 11123 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 240690a_100015525214_100000212244 [0,2,0,0,0,1|0,0,0]=3 11124 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 527a_100015525214_100000212244 [0,2,0,0,0,1|0,0,0]=3 11125 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 11a_100015525214_100000211027 [0,2,0,0,0,1|0,0,0]=3 11126 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 240690a_100015525214_100000211027 [0,2,0,0,0,1|0,0,0]=3 11127 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 527a_100015525214_100000211027 [0,2,0,0,0,1|0,0,0]=3 11128 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 11a_100015525214_100000210951 [0,2,0,0,0,1|0,0,0]=3 11129 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 240690a_100015525214_100000210951 [0,2,0,0,0,1|0,0,0]=3 11130 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 527a_100015525214_100000210951 [0,2,0,0,0,1|0,0,0]=3 11131 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 11a_100015525214_100000688869 [0,2,0,0,0,1|0,0,0]=3 11132 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 240690a_100015525214_100000688869 [0,2,0,0,0,1|0,0,0]=3 11133 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 527a_100015525214_100000688869 [0,2,0,0,0,1|0,0,0]=3 11134 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 240690a_100015525214_100000198540 [0,2,0,0,0,1|0,0,0]=3 11135 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 527a_100015525214_100000198540 [0,2,0,0,0,1|0,0,0]=3 11136 B13R1.19 CCNC(=O)Cc1ccc(cn1)Br 11a_100015525214_100020629044 [0,2,0,0,0,1|1,0,0]=4 11137 B13R1.19 CCNC(=O)Cc1ccc(cn1)Br 240690a_100015525214_100020629044 [0,2,0,0,0,1|1,0,0]=4 11138 B13R1.19 CCNC(=O)Cc1ccc(cn1)C 11a_100015525214_100025705728 [0,2,0,0,0,1|1,0,0]=4 11139 B13R1.19 CCNC(=O)Cc1ccc(cn1)C 240690a_100015525214_100025705728 [0,2,0,0,0,1|1,0,0]=4 11140 B13R1.19 CCNC(=O)Cc1ccc(cn1)Cl 11a_100015525214_100000728320 [0,2,0,0,0,1|1,0,0]=4 11141 B13R1.19 CCNC(=O)Cc1ccc(cn1)Cl 240690a_100015525214_100000728320 [0,2,0,0,0,1|1,0,0]=4 11142 B13R1.19 CCNC(=O)Cc1ccc(cn1)Cl 527a_100015525214_100000728320 [0,2,0,0,0,1|1,0,0]=4 11143 B13R1.19 CCNC(=O)Cc1ccc(nc1)Br 11a_100015525214_100010067268 [0,2,0,0,0,1|1,0,0]=4 11144 B13R1.19 CCNC(=O)Cc1ccc(nc1)Br 240690a_100015525214_100010067268 [0,2,0,0,0,1|1,0,0]=4 11145 B13R1.19 CCNC(=O)Cc1ccc(nc1)Br 527a_100015525214_100010067268 [0,2,0,0,0,1|1,0,0]=4 11146 B13R1.19 CCNC(=O)Cc1ccc(nc1)C 11a_100015525214_100000740413 [0,2,0,0,0,1|1,0,0]=4 11147 B13R1.19 CCNC(=O)Cc1ccc(nc1)C 240690a_100015525214_100000740413 [0,2,0,0,0,1|1,0,0]=4 11148 B13R1.19 CCNC(=O)Cc1ccc(nc1)C 527a_100015525214_100000740413 [0,2,0,0,0,1|1,0,0]=4 11149 B13R1.19 CCNC(=O)Cc1ccc(nc1)Cl 11a_100015525214_100000061944 [0,2,0,0,0,1|1,0,0]=4 11150 B13R1.19 CCNC(=O)Cc1ccc(nc1)Cl 240690a_100015525214_100000061944 [0,2,0,0,0,1|1,0,0]=4 11151 B13R1.19 CCNC(=O)Cc1ccc(nc1)Cl 527a_100015525214_100000061944 [0,2,0,0,0,1|1,0,0]=4 11152 B13R1.19 CCNC(=O)Cn1ccc(=O)cc1 11a_100015525214_200000238563 [0,2,0,0,0,1|1,0,0]=4 11153 B13R1.19 CCNC(=O)Cn1ccc(=O)cc1 240690a_100015525214_200000238563 [0,2,0,0,0,1|1,0,0]=4 11154 B13R1.19 CCNC(=O)Cn1ccc(=O)cc1 527a_100015525214_200000238563 [0,2,0,0,0,1|1,0,0]=4 11155 B13R1.19 CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100015525214 [0,2,0,0,0,1|0,0,0]=3 11156 B13R1.19 CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100015525214 [0,2,0,0,0,1|0,0,0]=3 11157 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100015525214 [0,2,0,0,0,1|0,0,0]=3 11158 B13R1.19 CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100015525214 [0,2,0,0,0,1|0,0,0]=3 11159 B13R1.19 CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100015525214 [0,2,0,0,0,1|0,0,0]=3 11160 B13R1.19 CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100015525214 [0,2,0,0,0,1|0,0,0]=3 11161 B13R1.19 CCOC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000170549 [0,2,0,0,0,1|1,0,0]=4 11162 B13R1.19 CCOC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000158341 [0,2,0,0,0,1|1,0,0]=4 11163 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_200000210301 [0,2,0,0,0,1|0,0,0]=3 11164 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 2230a_106832991635_100000183692 [0,2,0,0,0,1|0,0,0]=3 11165 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 34a_100102657272_100000183692 [0,2,0,0,0,1|0,0,0]=3 11166 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 7a_106832991635_100000183692 [0,2,0,0,0,1|0,0,0]=3 11167 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 2230a_106832991635_100000182914 [0,2,0,0,0,1|0,0,0]=3 11168 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 34a_100102657272_100000182914 [0,2,0,0,0,1|0,0,0]=3 11169 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 7a_106832991635_100000182914 [0,2,0,0,0,1|0,0,0]=3 11170 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 2230a_106832991635_100000182960 [0,2,0,0,0,1|0,0,0]=3 11171 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 34a_100102657272_100000182960 [0,2,0,0,0,1|0,0,0]=3 11172 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 7a_106832991635_100000182960 [0,2,0,0,0,1|0,0,0]=3 11173 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_200000210301 [0,2,0,0,0,1|0,0,0]=3 11174 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 2230a_106832991635_100000181725 [0,2,0,0,0,1|0,0,0]=3 11175 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 34a_100025683178_200000210301 [0,2,0,0,0,1|0,0,0]=3 11176 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 34a_100102657272_100000181725 [0,2,0,0,0,1|0,0,0]=3 11177 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 7a_106832991635_100000181725 [0,2,0,0,0,1|0,0,0]=3 11178 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 2230a_106832991635_100000183000 [0,2,0,0,0,1|0,0,0]=3 11179 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 34a_100102657272_100000183000 [0,2,0,0,0,1|0,0,0]=3 11180 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 7a_106832991635_100000183000 [0,2,0,0,0,1|0,0,0]=3 11181 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 2230a_106832991635_100000233757 [0,2,0,0,0,1|0,0,0]=3 11182 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 34a_100102657272_100000233757 [0,2,0,0,0,1|0,0,0]=3 11183 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 7a_106832991635_100000233757 [0,2,0,0,0,1|0,0,0]=3 11184 B13R1.19 CNCC(=O)Nc1ccc(cn1)Br 2230a_106832991635_100000239667 [0,2,0,0,0,1|1,0,0]=4 11185 B13R1.19 CNCC(=O)Nc1ccc(cn1)Br 7a_106832991635_100000239667 [0,2,0,0,0,1|1,0,0]=4 11186 B13R1.19 CNCC(=O)Nc1ccc(cn1)C 2230a_106832991635_100020671718 [0,2,0,0,0,1|1,0,0]=4 11187 B13R1.19 CNCC(=O)Nc1ccc(cn1)C 7a_106832991635_100020671718 [0,2,0,0,0,1|1,0,0]=4 11188 B13R1.19 CNCC(=O)Nc1ccc(cn1)Cl 2230a_106832991635_100000183295 [0,2,0,0,0,1|1,0,0]=4 11189 B13R1.19 CNCC(=O)Nc1ccc(cn1)Cl 7a_106832991635_100000183295 [0,2,0,0,0,1|1,0,0]=4 11190 B13R1.19 CNCC(=O)Nc1ccc(nc1)Cl 2230a_106832991635_100020591235 [0,2,0,0,0,1|1,0,0]=4 11191 B13R1.19 CNCC(=O)Nc1ccc(nc1)Cl 34a_100102657272_100020591235 [0,2,0,0,0,1|1,0,0]=4 11192 B13R1.19 CNCC(=O)Nc1ccc(nc1)Cl 7a_106832991635_100020591235 [0,2,0,0,0,1|1,0,0]=4 11193 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 2230a_106832991635_200010760497 [0,2,0,0,0,1|0,0,0]=3 11194 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 34a_100102657272_200010760497 [0,2,0,0,0,1|0,0,0]=3 11195 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 7a_106832991635_200010760497 [0,2,0,0,0,1|0,0,0]=3 11196 B13R1.19 CNNC(=O)Cc1ccc(cc1)Br 22a_100016993582_100000198978 [0,2,0,0,0,1|0,0,0]=3 11197 B13R1.19 CNNC(=O)Cc1ccc(cc1)C 22a_100016993582_100000212244 [0,2,0,0,0,1|0,0,0]=3 11198 B13R1.19 CNNC(=O)Cc1ccc(cc1)Cl 22a_100016993582_100000211027 [0,2,0,0,0,1|0,0,0]=3 11199 B13R1.19 CNNC(=O)Cc1ccc(cc1)F 22a_100016993582_100000210951 [0,2,0,0,0,1|0,0,0]=3 11200 B13R1.19 CNNC(=O)Cc1ccc(cc1)I 22a_100016993582_100000688869 [0,2,0,0,0,1|0,0,0]=3 11201 B13R1.19 CNNC(=O)Cc1ccc(cc1)O 22a_100016993582_100000198540 [0,2,0,0,0,1|0,0,0]=3 11202 B13R1.19 CNNC(=O)Cc1ccc(cn1)Br 22a_100016993582_100020629044 [0,2,0,0,0,1|1,0,0]=4 11203 B13R1.19 CNNC(=O)Cc1ccc(cn1)C 22a_100016993582_100025705728 [0,2,0,0,0,1|1,0,0]=4 11204 B13R1.19 CNNC(=O)Cc1ccc(cn1)Cl 22a_100016993582_100000728320 [0,2,0,0,0,1|1,0,0]=4 11205 B13R1.19 CNNC(=O)Cc1ccc(nc1)Br 22a_100016993582_100010067268 [0,2,0,0,0,1|1,0,0]=4 11206 B13R1.19 CNNC(=O)Cc1ccc(nc1)C 22a_100016993582_100000740413 [0,2,0,0,0,1|1,0,0]=4 11207 B13R1.19 CNNC(=O)Cc1ccc(nc1)Cl 22a_100016993582_100000061944 [0,2,0,0,0,1|1,0,0]=4 11208 B13R1.19 CNNC(=O)Cn1ccc(=O)cc1 22a_100016993582_200000238563 [0,2,0,0,0,1|1,0,0]=4 11209 B13R1.19 COCC(=O)Cc1ccc(cc1)Br 1458a_100000210968_100000189115 [0,2,0,0,0,1|1,0,0]=4 11210 B13R1.19 COCC(=O)Cc1ccc(cc1)C 1458a_100000210968_100000210814 [0,2,0,0,0,1|1,0,0]=4 11211 B13R1.19 COCC(=O)Cc1ccc(cc1)Cl 1458a_100000210968_100000694040 [0,2,0,0,0,1|1,0,0]=4 11212 B13R1.19 COCC(=O)Cc1ccc(cc1)F 1458a_100000210968_100000198546 [0,2,0,0,0,1|1,0,0]=4 11213 B13R1.19 COCC(=O)Cc1ccc(cc1)I 1458a_100000210968_100000189116 [0,2,0,0,0,1|1,0,0]=4 11214 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210968 [0,2,0,0,0,1|1,0,0]=4 11215 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210968 [0,2,0,0,0,1|1,0,0]=4 11216 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210968 [0,2,0,0,0,1|1,0,0]=4 11217 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000183692 [0,2,0,0,0,1|1,0,0]=4 11218 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210968 [0,2,0,0,0,1|1,0,0]=4 11219 B13R1.19 COCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210968 [0,2,0,0,0,1|1,0,0]=4 11220 B13R1.19 COCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210968 [0,2,0,0,0,1|1,0,0]=4 11221 B13R1.19 COCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210968 [0,2,0,0,0,1|1,0,0]=4 11222 B13R1.19 COCC(=O)Nc1ccc(cc1)C 34a_100138415774_100000182914 [0,2,0,0,0,1|1,0,0]=4 11223 B13R1.19 COCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210968 [0,2,0,0,0,1|1,0,0]=4 11224 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210968 [0,2,0,0,0,1|1,0,0]=4 11225 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210968 [0,2,0,0,0,1|1,0,0]=4 11226 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210968 [0,2,0,0,0,1|1,0,0]=4 11227 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 34a_100138415774_100000182960 [0,2,0,0,0,1|1,0,0]=4 11228 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210968 [0,2,0,0,0,1|1,0,0]=4 11229 B13R1.19 COCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210968 [0,2,0,0,0,1|1,0,0]=4 11230 B13R1.19 COCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210968 [0,2,0,0,0,1|1,0,0]=4 11231 B13R1.19 COCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210968 [0,2,0,0,0,1|1,0,0]=4 11232 B13R1.19 COCC(=O)Nc1ccc(cc1)F 34a_100138415774_100000181725 [0,2,0,0,0,1|1,0,0]=4 11233 B13R1.19 COCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210968 [0,2,0,0,0,1|1,0,0]=4 11234 B13R1.19 COCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210968 [0,2,0,0,0,1|1,0,0]=4 11235 B13R1.19 COCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210968 [0,2,0,0,0,1|1,0,0]=4 11236 B13R1.19 COCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210968 [0,2,0,0,0,1|1,0,0]=4 11237 B13R1.19 COCC(=O)Nc1ccc(cc1)I 34a_100138415774_100000183000 [0,2,0,0,0,1|1,0,0]=4 11238 B13R1.19 COCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210968 [0,2,0,0,0,1|1,0,0]=4 11239 B13R1.19 COCC(=O)Nc1ccc(cc1)N 34a_100011269904_200000210301 [0,2,0,0,0,1|1,0,0]=4 11240 B13R1.19 COCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210968 [0,2,0,0,0,1|1,0,0]=4 11241 B13R1.19 COCC(=O)Nc1ccc(cc1)O 34a_100138415774_100000233757 [0,2,0,0,0,1|1,0,0]=4 11242 B13R1.19 COCC(=O)Oc1ccc(cc1)Br 34a_100138415774_200010760497 [0,2,0,0,0,1|1,0,0]=4 11243 B13R1.19 CSCC(=O)Cc1ccc(cc1)Br 1458a_100000184570_100000189115 [0,2,0,0,0,1|1,0,0]=4 11244 B13R1.19 CSCC(=O)Cc1ccc(cc1)C 1458a_100000184570_100000210814 [0,2,0,0,0,1|1,0,0]=4 11245 B13R1.19 CSCC(=O)Cc1ccc(cc1)Cl 1458a_100000184570_100000694040 [0,2,0,0,0,1|1,0,0]=4 11246 B13R1.19 CSCC(=O)Cc1ccc(cc1)F 1458a_100000184570_100000198546 [0,2,0,0,0,1|1,0,0]=4 11247 B13R1.19 CSCC(=O)Cc1ccc(cc1)I 1458a_100000184570_100000189116 [0,2,0,0,0,1|1,0,0]=4 11248 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000184570 [0,2,0,0,0,1|1,0,0]=4 11249 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000184570 [0,2,0,0,0,1|1,0,0]=4 11250 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000184570 [0,2,0,0,0,1|1,0,0]=4 11251 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000184570 [0,2,0,0,0,1|1,0,0]=4 11252 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_200000210301 [0,2,0,0,0,1|1,0,0]=4 11253 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 62a_200000210301_100000183692 [0,2,0,0,0,1|1,0,0]=4 11254 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000184570 [0,2,0,0,0,1|1,0,0]=4 11255 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000184570 [0,2,0,0,0,1|1,0,0]=4 11256 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000184570 [0,2,0,0,0,1|1,0,0]=4 11257 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000184570 [0,2,0,0,0,1|1,0,0]=4 11258 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 62a_200000210301_100000182914 [0,2,0,0,0,1|1,0,0]=4 11259 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000184570 [0,2,0,0,0,1|1,0,0]=4 11260 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000184570 [0,2,0,0,0,1|1,0,0]=4 11261 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000184570 [0,2,0,0,0,1|1,0,0]=4 11262 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000184570 [0,2,0,0,0,1|1,0,0]=4 11263 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 62a_200000210301_100000182960 [0,2,0,0,0,1|1,0,0]=4 11264 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_200000210301 [0,2,0,0,0,1|1,0,0]=4 11265 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000184570 [0,2,0,0,0,1|1,0,0]=4 11266 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000184570 [0,2,0,0,0,1|1,0,0]=4 11267 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000184570 [0,2,0,0,0,1|1,0,0]=4 11268 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000184570 [0,2,0,0,0,1|1,0,0]=4 11269 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 62a_200000210301_100000181725 [0,2,0,0,0,1|1,0,0]=4 11270 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 62a_200000243717_200000210301 [0,2,0,0,0,1|1,0,0]=4 11271 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000184570 [0,2,0,0,0,1|1,0,0]=4 11272 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000184570 [0,2,0,0,0,1|1,0,0]=4 11273 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000184570 [0,2,0,0,0,1|1,0,0]=4 11274 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000184570 [0,2,0,0,0,1|1,0,0]=4 11275 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 62a_100000183000_200000210301 [0,2,0,0,0,1|1,0,0]=4 11276 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 62a_200000210301_100000183000 [0,2,0,0,0,1|1,0,0]=4 11277 B13R1.19 CSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000184570 [0,2,0,0,0,1|1,0,0]=4 11278 B13R1.19 CSCC(=O)Nc1ccc(cc1)O 62a_200000210301_100000233757 [0,2,0,0,0,1|1,0,0]=4 11279 B13R1.19 CSCC(=O)Oc1ccc(cc1)Br 62a_200000210301_200010760497 [0,2,0,0,0,1|1,0,0]=4 11280 B13R1.19 CSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_200000210301 [0,2,0,0,0,1|1,0,0]=4 11281 B13R1.19 Cc1ccc(cc1)CC(=O)CCF 1458a_100000212244_100011217306 [0,2,0,0,0,1|1,0,0]=4 11282 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100000212244_100000211926 [0,2,0,0,0,1|1,0,0]=4 11283 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000210814 [0,2,0,0,0,1|1,0,0]=4 11284 B13R1.19 Cc1ccc(cc1)NC(=O)CCO 22a_100000124888_100011216618 [0,2,0,0,0,1|1,0,0]=4 11285 B13R1.19 Cc1ccc(cc1)NC(=O)CS[13CH3] 62a_200025704644_100000182914 [0,2,0,0,0,1|1,0,0]=4 11286 B13R1.19 NCCC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000743120 [0,2,0,0,0,1|1,0,0]=4 11287 B13R1.19 O=C(CCF)Cc1ccc(cc1)Br 1458a_100000198978_100011217306 [0,2,0,0,0,1|1,0,0]=4 11288 B13R1.19 O=C(CCF)Cc1ccc(cc1)Cl 1458a_100000211027_100011217306 [0,2,0,0,0,1|1,0,0]=4 11289 B13R1.19 O=C(CCF)Cc1ccc(cc1)F 1458a_100000210951_100011217306 [0,2,0,0,0,1|1,0,0]=4 11290 B13R1.19 O=C(CCF)Cc1ccc(cc1)I 1458a_100000688869_100011217306 [0,2,0,0,0,1|1,0,0]=4 11291 B13R1.19 O=C(CCF)Cc1ccc(cc1)O 1458a_100000198540_100011217306 [0,2,0,0,0,1|1,0,0]=4 11292 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100000198978_100000211926 [0,2,0,0,0,1|1,0,0]=4 11293 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100011216618_100000189115 [0,2,0,0,0,1|1,0,0]=4 11294 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000211926 [0,2,0,0,0,1|1,0,0]=4 11295 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100011216618_100000694040 [0,2,0,0,0,1|1,0,0]=4 11296 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100000210951_100000211926 [0,2,0,0,0,1|1,0,0]=4 11297 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100011216618_100000198546 [0,2,0,0,0,1|1,0,0]=4 11298 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100000688869_100000211926 [0,2,0,0,0,1|1,0,0]=4 11299 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100011216618_100000189116 [0,2,0,0,0,1|1,0,0]=4 11300 B13R1.19 O=C(CCO)Cc1ccc(cc1)O 1458a_100000198540_100000211926 [0,2,0,0,0,1|1,0,0]=4 11301 B13R1.19 O=C(CCO)Nc1ccc(cc1)Br 22a_100000210018_100011216618 [0,2,0,0,0,1|1,0,0]=4 11302 B13R1.19 O=C(CCO)Nc1ccc(cc1)Cl 22a_100000210052_100011216618 [0,2,0,0,0,1|1,0,0]=4 11303 B13R1.19 O=C(CCO)Nc1ccc(cc1)F 22a_100000185862_100011216618 [0,2,0,0,0,1|1,0,0]=4 11304 B13R1.19 O=C(CCO)Nc1ccc(cc1)I 22a_100000185761_100011216618 [0,2,0,0,0,1|1,0,0]=4 11305 B13R1.19 O=C(CCO)Nc1ccc(cc1)O 22a_100000185829_100011216618 [0,2,0,0,0,1|1,0,0]=4 11306 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_200025704644 [0,2,0,0,0,1|0,0,0]=3 11307 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)F 2230a_100025683178_200025704644 [0,2,0,0,0,1|0,0,0]=3 11308 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)F 34a_100025683178_200025704644 [0,2,0,0,0,1|0,0,0]=3 11309 B13R1.19 [13CH3]OCC(=O)Nc1ccc(cc1)N 34a_100011269904_200025704644 [0,2,0,0,0,1|1,0,0]=4 11310 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Br 62a_100000183692_200025704644 [0,2,0,0,0,1|1,0,0]=4 11311 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Br 62a_200025704644_100000183692 [0,2,0,0,0,1|1,0,0]=4 11312 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_200025704644 [0,2,0,0,0,1|1,0,0]=4 11313 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Cl 62a_200025704644_100000182960 [0,2,0,0,0,1|1,0,0]=4 11314 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)F 62a_200000243717_200025704644 [0,2,0,0,0,1|1,0,0]=4 11315 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)F 62a_200025704644_100000181725 [0,2,0,0,0,1|1,0,0]=4 11316 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)I 62a_100000183000_200025704644 [0,2,0,0,0,1|1,0,0]=4 11317 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)I 62a_200025704644_100000183000 [0,2,0,0,0,1|1,0,0]=4 11318 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)O 62a_200025704644_100000233757 [0,2,0,0,0,1|1,0,0]=4 11319 B13R1.19 [13CH3]SCC(=O)Oc1ccc(cc1)Br 62a_200010760497_200025704644 [0,2,0,0,0,1|1,0,0]=4 11320 B13R1.19 [13CH3]SCC(=O)Oc1ccc(cc1)Br 62a_200025704644_200010760497 [0,2,0,0,0,1|1,0,0]=4 11321 B13R1.20 CC#CC(=O)Cc1cccc(c1)Br 1458a_100000763181_100000211773 [0,2,0,0,0,1|1,0,0]=4 11322 B13R1.20 CC#CC(=O)Cc1cccc(c1)C 1458a_100000763181_100000211840 [0,2,0,0,0,1|1,0,0]=4 11323 B13R1.20 CC#CC(=O)Cc1cccc(c1)Cl 1458a_100000763181_100000181238 [0,2,0,0,0,1|1,0,0]=4 11324 B13R1.20 CC#CC(=O)Cc1cccc(c1)F 1458a_100000763181_100000230114 [0,2,0,0,0,1|1,0,0]=4 11325 B13R1.20 CC#CC(=O)Cc1cccc(c1)I 1458a_100000763181_100011218688 [0,2,0,0,0,1|1,0,0]=4 11326 B13R1.20 CC#CC(=O)Cc1cccc(c1)O 1458a_100000763181_100011660834 [0,2,0,0,0,1|1,0,0]=4 11327 B13R1.20 CC#CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000763181 [0,2,0,0,0,1|1,0,0]=4 11328 B13R1.20 CC#CC(=O)Nc1cccc(c1)C 22a_100000188690_100000763181 [0,2,0,0,0,1|1,0,0]=4 11329 B13R1.20 CC#CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000763181 [0,2,0,0,0,1|1,0,0]=4 11330 B13R1.20 CC#CC(=O)Nc1cccc(c1)F 22a_100000210047_100000763181 [0,2,0,0,0,1|1,0,0]=4 11331 B13R1.20 CC#CC(=O)Nc1cccc(c1)I 22a_100000211102_100000763181 [0,2,0,0,0,1|1,0,0]=4 11332 B13R1.20 CC#CC(=O)Nc1cccc(c1)O 22a_100000210217_100000763181 [0,2,0,0,0,1|1,0,0]=4 11333 B13R1.20 CC=CC(=O)Cc1cccc(c1)Br 1458a_100000210699_100000211773 [0,2,0,0,0,1|1,0,0]=4 11334 B13R1.20 CC=CC(=O)Cc1cccc(c1)C 1458a_100000210699_100000211840 [0,2,0,0,0,1|1,0,0]=4 11335 B13R1.20 CC=CC(=O)Cc1cccc(c1)Cl 1458a_100000210699_100000181238 [0,2,0,0,0,1|1,0,0]=4 11336 B13R1.20 CC=CC(=O)Cc1cccc(c1)F 1458a_100000210699_100000230114 [0,2,0,0,0,1|1,0,0]=4 11337 B13R1.20 CC=CC(=O)Cc1cccc(c1)I 1458a_100000210699_100011218688 [0,2,0,0,0,1|1,0,0]=4 11338 B13R1.20 CC=CC(=O)Cc1cccc(c1)O 1458a_100000210699_100011660834 [0,2,0,0,0,1|1,0,0]=4 11339 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210699 [0,2,0,0,0,1|1,0,0]=4 11340 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210699 [0,2,0,0,0,1|1,0,0]=4 11341 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210699 [0,2,0,0,0,1|1,0,0]=4 11342 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 11a_100000188690_100000210699 [0,2,0,0,0,1|1,0,0]=4 11343 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210699 [0,2,0,0,0,1|1,0,0]=4 11344 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000210699 [0,2,0,0,0,1|1,0,0]=4 11345 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210699 [0,2,0,0,0,1|1,0,0]=4 11346 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210699 [0,2,0,0,0,1|1,0,0]=4 11347 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210699 [0,2,0,0,0,1|1,0,0]=4 11348 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 11a_100000210047_100000210699 [0,2,0,0,0,1|1,0,0]=4 11349 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210699 [0,2,0,0,0,1|1,0,0]=4 11350 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000210699 [0,2,0,0,0,1|1,0,0]=4 11351 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 11a_100000211102_100000210699 [0,2,0,0,0,1|1,0,0]=4 11352 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210699 [0,2,0,0,0,1|1,0,0]=4 11353 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000210699 [0,2,0,0,0,1|1,0,0]=4 11354 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210699 [0,2,0,0,0,1|1,0,0]=4 11355 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000210699 [0,2,0,0,0,1|1,0,0]=4 11356 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000211992_100000211773 [0,2,0,0,0,1|1,0,0]=4 11357 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210303 [0,2,0,0,0,1|1,0,0]=4 11358 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100000211992_100000211840 [0,2,0,0,0,1|1,0,0]=4 11359 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210303 [0,2,0,0,0,1|1,0,0]=4 11360 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000211992_100000181238 [0,2,0,0,0,1|1,0,0]=4 11361 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210303 [0,2,0,0,0,1|1,0,0]=4 11362 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210303 [0,2,0,0,0,1|1,0,0]=4 11363 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211992_100000230114 [0,2,0,0,0,1|1,0,0]=4 11364 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000211992_100011218688 [0,2,0,0,0,1|1,0,0]=4 11365 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210303 [0,2,0,0,0,1|1,0,0]=4 11366 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000211992_100011660834 [0,2,0,0,0,1|1,0,0]=4 11367 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210303 [0,2,0,0,0,1|1,0,0]=4 11368 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000211992 [0,2,0,0,0,1|1,0,0]=4 11369 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000211992 [0,2,0,0,0,1|1,0,0]=4 11370 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000211992 [0,2,0,0,0,1|1,0,0]=4 11371 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000211992 [0,2,0,0,0,1|1,0,0]=4 11372 B13R1.20 CCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000211992 [0,2,0,0,0,1|1,0,0]=4 11373 B13R1.20 CCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000211992 [0,2,0,0,0,1|1,0,0]=4 11374 B13R1.20 CCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000211992 [0,2,0,0,0,1|1,0,0]=4 11375 B13R1.20 CCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000211992 [0,2,0,0,0,1|1,0,0]=4 11376 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000211992 [0,2,0,0,0,1|1,0,0]=4 11377 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000211992 [0,2,0,0,0,1|1,0,0]=4 11378 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000211992 [0,2,0,0,0,1|1,0,0]=4 11379 B13R1.20 CCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000211992 [0,2,0,0,0,1|1,0,0]=4 11380 B13R1.20 CCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000211992 [0,2,0,0,0,1|1,0,0]=4 11381 B13R1.20 CCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000211992 [0,2,0,0,0,1|1,0,0]=4 11382 B13R1.20 CCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000211992 [0,2,0,0,0,1|1,0,0]=4 11383 B13R1.20 CCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000211992 [0,2,0,0,0,1|1,0,0]=4 11384 B13R1.20 CCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000211992 [0,2,0,0,0,1|1,0,0]=4 11385 B13R1.20 CCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000211992 [0,2,0,0,0,1|1,0,0]=4 11386 B13R1.20 CCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000211992 [0,2,0,0,0,1|1,0,0]=4 11387 B13R1.20 CCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000211992 [0,2,0,0,0,1|1,0,0]=4 11388 B13R1.20 CCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000211992 [0,2,0,0,0,1|1,0,0]=4 11389 B13R1.20 CCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000211992 [0,2,0,0,0,1|1,0,0]=4 11390 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 11a_100015525214_100000747190 [0,2,0,0,0,1|0,0,0]=3 11391 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 240690a_100015525214_100000747190 [0,2,0,0,0,1|0,0,0]=3 11392 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 527a_100015525214_100000747190 [0,2,0,0,0,1|0,0,0]=3 11393 B13R1.20 CCNC(=O)Cc1cccc(c1)C 11a_100015525214_100011206899 [0,2,0,0,0,1|0,0,0]=3 11394 B13R1.20 CCNC(=O)Cc1cccc(c1)C 240690a_100015525214_100011206899 [0,2,0,0,0,1|0,0,0]=3 11395 B13R1.20 CCNC(=O)Cc1cccc(c1)C 527a_100015525214_100011206899 [0,2,0,0,0,1|0,0,0]=3 11396 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 11a_100015525214_100000749307 [0,2,0,0,0,1|0,0,0]=3 11397 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 240690a_100015525214_100000749307 [0,2,0,0,0,1|0,0,0]=3 11398 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 527a_100015525214_100000749307 [0,2,0,0,0,1|0,0,0]=3 11399 B13R1.20 CCNC(=O)Cc1cccc(c1)F 11a_100015525214_100000211661 [0,2,0,0,0,1|0,0,0]=3 11400 B13R1.20 CCNC(=O)Cc1cccc(c1)F 240690a_100015525214_100000211661 [0,2,0,0,0,1|0,0,0]=3 11401 B13R1.20 CCNC(=O)Cc1cccc(c1)F 527a_100015525214_100000211661 [0,2,0,0,0,1|0,0,0]=3 11402 B13R1.20 CCNC(=O)Cc1cccc(c1)I 11a_100015525214_100000238430 [0,2,0,0,0,1|0,0,0]=3 11403 B13R1.20 CCNC(=O)Cc1cccc(c1)I 240690a_100015525214_100000238430 [0,2,0,0,0,1|0,0,0]=3 11404 B13R1.20 CCNC(=O)Cc1cccc(c1)I 527a_100015525214_100000238430 [0,2,0,0,0,1|0,0,0]=3 11405 B13R1.20 CCNC(=O)Cc1cccc(c1)O 240690a_100015525214_100000745134 [0,2,0,0,0,1|0,0,0]=3 11406 B13R1.20 CCNC(=O)Cc1cccc(c1)O 527a_100015525214_100000745134 [0,2,0,0,0,1|0,0,0]=3 11407 B13R1.20 CCNC(=O)Cc1cccc(n1)Br 11a_100015525214_100010201708 [0,2,0,0,0,1|1,0,0]=4 11408 B13R1.20 CCNC(=O)Cc1cccc(n1)Br 240690a_100015525214_100010201708 [0,2,0,0,0,1|1,0,0]=4 11409 B13R1.20 CCNC(=O)Cc1cccc(n1)Br 527a_100015525214_100010201708 [0,2,0,0,0,1|1,0,0]=4 11410 B13R1.20 CCNC(=O)Cc1cccc(n1)C 11a_100015525214_100012001110 [0,2,0,0,0,1|1,0,0]=4 11411 B13R1.20 CCNC(=O)Cc1cccc(n1)C 240690a_100015525214_100012001110 [0,2,0,0,0,1|1,0,0]=4 11412 B13R1.20 CCNC(=O)Cc1cccc(n1)C 527a_100015525214_100012001110 [0,2,0,0,0,1|1,0,0]=4 11413 B13R1.20 CCNC(=O)Cc1cccc(n1)Cl 11a_100015525214_100000090259 [0,2,0,0,0,1|1,0,0]=4 11414 B13R1.20 CCNC(=O)Cc1cccc(n1)Cl 240690a_100015525214_100000090259 [0,2,0,0,0,1|1,0,0]=4 11415 B13R1.20 CCNC(=O)Cc1cccc(n1)F 11a_100015525214_100000096803 [0,2,0,0,0,1|1,0,0]=4 11416 B13R1.20 CCNC(=O)Cc1cccc(n1)F 240690a_100015525214_100000096803 [0,2,0,0,0,1|1,0,0]=4 11417 B13R1.20 CCNC(=O)Cc1ccnc(c1)Br 11a_100015525214_100010126891 [0,2,0,0,0,1|1,0,0]=4 11418 B13R1.20 CCNC(=O)Cc1ccnc(c1)Br 240690a_100015525214_100010126891 [0,2,0,0,0,1|1,0,0]=4 11419 B13R1.20 CCNC(=O)Cc1ccnc(c1)Br 527a_100015525214_100010126891 [0,2,0,0,0,1|1,0,0]=4 11420 B13R1.20 CCNC(=O)Cc1ccnc(c1)Cl 11a_100015525214_100000085289 [0,2,0,0,0,1|1,0,0]=4 11421 B13R1.20 CCNC(=O)Cc1ccnc(c1)Cl 240690a_100015525214_100000085289 [0,2,0,0,0,1|1,0,0]=4 11422 B13R1.20 CCNC(=O)Cc1ccnc(c1)Cl 527a_100015525214_100000085289 [0,2,0,0,0,1|1,0,0]=4 11423 B13R1.20 CCNC(=O)Cc1cncc(c1)Br 11a_100015525214_100000239331 [0,2,0,0,0,1|1,0,0]=4 11424 B13R1.20 CCNC(=O)Cc1cncc(c1)Br 240690a_100015525214_100000239331 [0,2,0,0,0,1|1,0,0]=4 11425 B13R1.20 CCNC(=O)Cc1cncc(c1)Br 527a_100015525214_100000239331 [0,2,0,0,0,1|1,0,0]=4 11426 B13R1.20 CCNC(=O)Cc1cncc(c1)F 11a_100015525214_100011667516 [0,2,0,0,0,1|1,0,0]=4 11427 B13R1.20 CCNC(=O)Cc1cncc(c1)F 240690a_100015525214_100011667516 [0,2,0,0,0,1|1,0,0]=4 11428 B13R1.20 CCNC(=O)Cc1cncc(c1)F 527a_100015525214_100011667516 [0,2,0,0,0,1|1,0,0]=4 11429 B13R1.20 CCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100015525214 [0,2,0,0,0,1|0,0,0]=3 11430 B13R1.20 CCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100015525214 [0,2,0,0,0,1|0,0,0]=3 11431 B13R1.20 CCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100015525214 [0,2,0,0,0,1|0,0,0]=3 11432 B13R1.20 CCNC(=O)Nc1cccc(c1)C 512a_100000188690_100015525214 [0,2,0,0,0,1|0,0,0]=3 11433 B13R1.20 CCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100015525214 [0,2,0,0,0,1|0,0,0]=3 11434 B13R1.20 CCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100015525214 [0,2,0,0,0,1|0,0,0]=3 11435 B13R1.20 CCNC(=O)Nc1cccc(c1)F 512a_100000210047_100015525214 [0,2,0,0,0,1|0,0,0]=3 11436 B13R1.20 CCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100015525214 [0,2,0,0,0,1|0,0,0]=3 11437 B13R1.20 CCNC(=O)Nc1cccc(c1)I 512a_100000211102_100015525214 [0,2,0,0,0,1|0,0,0]=3 11438 B13R1.20 CCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100015525214 [0,2,0,0,0,1|0,0,0]=3 11439 B13R1.20 CCNC(=O)Nc1cccc(c1)O 512a_100000210217_100015525214 [0,2,0,0,0,1|0,0,0]=3 11440 B13R1.20 CCOC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586817 [0,2,0,0,0,1|1,0,0]=4 11441 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 2230a_106832991635_100000183509 [0,2,0,0,0,1|0,0,0]=3 11442 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 34a_100102657272_100000183509 [0,2,0,0,0,1|0,0,0]=3 11443 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 7a_106832991635_100000183509 [0,2,0,0,0,1|0,0,0]=3 11444 B13R1.20 CNCC(=O)Nc1cccc(c1)C 2230a_106832991635_100000182861 [0,2,0,0,0,1|0,0,0]=3 11445 B13R1.20 CNCC(=O)Nc1cccc(c1)C 34a_100102657272_100000182861 [0,2,0,0,0,1|0,0,0]=3 11446 B13R1.20 CNCC(=O)Nc1cccc(c1)C 7a_106832991635_100000182861 [0,2,0,0,0,1|0,0,0]=3 11447 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_200000210301 [0,2,0,0,0,1|0,0,0]=3 11448 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 2230a_106832991635_100000182995 [0,2,0,0,0,1|0,0,0]=3 11449 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 34a_100102657272_100000182995 [0,2,0,0,0,1|0,0,0]=3 11450 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 7a_106832991635_100000182995 [0,2,0,0,0,1|0,0,0]=3 11451 B13R1.20 CNCC(=O)Nc1cccc(c1)F 2230a_100000168492_200000210301 [0,2,0,0,0,1|0,0,0]=3 11452 B13R1.20 CNCC(=O)Nc1cccc(c1)F 2230a_106832991635_100000183335 [0,2,0,0,0,1|0,0,0]=3 11453 B13R1.20 CNCC(=O)Nc1cccc(c1)F 34a_100000168492_200000210301 [0,2,0,0,0,1|0,0,0]=3 11454 B13R1.20 CNCC(=O)Nc1cccc(c1)F 34a_100102657272_100000183335 [0,2,0,0,0,1|0,0,0]=3 11455 B13R1.20 CNCC(=O)Nc1cccc(c1)F 7a_106832991635_100000183335 [0,2,0,0,0,1|0,0,0]=3 11456 B13R1.20 CNCC(=O)Nc1cccc(c1)O 2230a_106832991635_100011236192 [0,2,0,0,0,1|0,0,0]=3 11457 B13R1.20 CNCC(=O)Nc1cccc(c1)O 34a_100102657272_100011236192 [0,2,0,0,0,1|0,0,0]=3 11458 B13R1.20 CNCC(=O)Nc1cccc(c1)O 7a_106832991635_100011236192 [0,2,0,0,0,1|0,0,0]=3 11459 B13R1.20 CNCC(=O)Nc1cccc(n1)C 2230a_106832991635_103633700106 [0,2,0,0,0,1|1,0,0]=4 11460 B13R1.20 CNCC(=O)Nc1cccc(n1)C 34a_100102657272_103633700106 [0,2,0,0,0,1|1,0,0]=4 11461 B13R1.20 CNNC(=O)Cc1cccc(c1)Br 22a_100016993582_100000747190 [0,2,0,0,0,1|0,0,0]=3 11462 B13R1.20 CNNC(=O)Cc1cccc(c1)C 22a_100016993582_100011206899 [0,2,0,0,0,1|0,0,0]=3 11463 B13R1.20 CNNC(=O)Cc1cccc(c1)Cl 22a_100016993582_100000749307 [0,2,0,0,0,1|0,0,0]=3 11464 B13R1.20 CNNC(=O)Cc1cccc(c1)F 22a_100016993582_100000211661 [0,2,0,0,0,1|0,0,0]=3 11465 B13R1.20 CNNC(=O)Cc1cccc(c1)I 22a_100016993582_100000238430 [0,2,0,0,0,1|0,0,0]=3 11466 B13R1.20 CNNC(=O)Cc1cccc(c1)O 22a_100016993582_100000745134 [0,2,0,0,0,1|0,0,0]=3 11467 B13R1.20 CNNC(=O)Cc1cccc(n1)Br 22a_100016993582_100010201708 [0,2,0,0,0,1|1,0,0]=4 11468 B13R1.20 CNNC(=O)Cc1cccc(n1)C 22a_100016993582_100012001110 [0,2,0,0,0,1|1,0,0]=4 11469 B13R1.20 CNNC(=O)Cc1cccc(n1)Cl 22a_100016993582_100000090259 [0,2,0,0,0,1|1,0,0]=4 11470 B13R1.20 CNNC(=O)Cc1ccnc(c1)Br 22a_100016993582_100010126891 [0,2,0,0,0,1|1,0,0]=4 11471 B13R1.20 CNNC(=O)Cc1ccnc(c1)Cl 22a_100016993582_100000085289 [0,2,0,0,0,1|1,0,0]=4 11472 B13R1.20 CNNC(=O)Cc1cncc(c1)Br 22a_100016993582_100000239331 [0,2,0,0,0,1|1,0,0]=4 11473 B13R1.20 CNNC(=O)Cc1cncc(c1)F 22a_100016993582_100011667516 [0,2,0,0,0,1|1,0,0]=4 11474 B13R1.20 CNNC(=O)Nc1cccc(c1)Br 512a_100000210019_100016993582 [0,2,0,0,0,1|0,0,0]=3 11475 B13R1.20 CNNC(=O)Nc1cccc(c1)C 512a_100000188690_100016993582 [0,2,0,0,0,1|0,0,0]=3 11476 B13R1.20 CNNC(=O)Nc1cccc(c1)F 512a_100000210047_100016993582 [0,2,0,0,0,1|0,0,0]=3 11477 B13R1.20 CNNC(=O)Nc1cccc(c1)I 512a_100000211102_100016993582 [0,2,0,0,0,1|0,0,0]=3 11478 B13R1.20 CNNC(=O)Nc1cccc(c1)O 512a_100000210217_100016993582 [0,2,0,0,0,1|0,0,0]=3 11479 B13R1.20 COCC(=O)Cc1cccc(c1)Br 1458a_100000210968_100000211773 [0,2,0,0,0,1|1,0,0]=4 11480 B13R1.20 COCC(=O)Cc1cccc(c1)C 1458a_100000210968_100000211840 [0,2,0,0,0,1|1,0,0]=4 11481 B13R1.20 COCC(=O)Cc1cccc(c1)Cl 1458a_100000210968_100000181238 [0,2,0,0,0,1|1,0,0]=4 11482 B13R1.20 COCC(=O)Cc1cccc(c1)F 1458a_100000210968_100000230114 [0,2,0,0,0,1|1,0,0]=4 11483 B13R1.20 COCC(=O)Cc1cccc(c1)I 1458a_100000210968_100011218688 [0,2,0,0,0,1|1,0,0]=4 11484 B13R1.20 COCC(=O)Cc1cccc(c1)O 1458a_100000210968_100011660834 [0,2,0,0,0,1|1,0,0]=4 11485 B13R1.20 COCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210968 [0,2,0,0,0,1|1,0,0]=4 11486 B13R1.20 COCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210968 [0,2,0,0,0,1|1,0,0]=4 11487 B13R1.20 COCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210968 [0,2,0,0,0,1|1,0,0]=4 11488 B13R1.20 COCC(=O)Nc1cccc(c1)Br 34a_100138415774_100000183509 [0,2,0,0,0,1|1,0,0]=4 11489 B13R1.20 COCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210968 [0,2,0,0,0,1|1,0,0]=4 11490 B13R1.20 COCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210968 [0,2,0,0,0,1|1,0,0]=4 11491 B13R1.20 COCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210968 [0,2,0,0,0,1|1,0,0]=4 11492 B13R1.20 COCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210968 [0,2,0,0,0,1|1,0,0]=4 11493 B13R1.20 COCC(=O)Nc1cccc(c1)C 34a_100000749660_200000210301 [0,2,0,0,0,1|1,0,0]=4 11494 B13R1.20 COCC(=O)Nc1cccc(c1)C 34a_100138415774_100000182861 [0,2,0,0,0,1|1,0,0]=4 11495 B13R1.20 COCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210968 [0,2,0,0,0,1|1,0,0]=4 11496 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210968 [0,2,0,0,0,1|1,0,0]=4 11497 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210968 [0,2,0,0,0,1|1,0,0]=4 11498 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210968 [0,2,0,0,0,1|1,0,0]=4 11499 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 34a_100138415774_100000182995 [0,2,0,0,0,1|1,0,0]=4 11500 B13R1.20 COCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210968 [0,2,0,0,0,1|1,0,0]=4 11501 B13R1.20 COCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210968 [0,2,0,0,0,1|1,0,0]=4 11502 B13R1.20 COCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210968 [0,2,0,0,0,1|1,0,0]=4 11503 B13R1.20 COCC(=O)Nc1cccc(c1)F 34a_100138415774_100000183335 [0,2,0,0,0,1|1,0,0]=4 11504 B13R1.20 COCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210968 [0,2,0,0,0,1|1,0,0]=4 11505 B13R1.20 COCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210968 [0,2,0,0,0,1|1,0,0]=4 11506 B13R1.20 COCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210968 [0,2,0,0,0,1|1,0,0]=4 11507 B13R1.20 COCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210968 [0,2,0,0,0,1|1,0,0]=4 11508 B13R1.20 COCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210968 [0,2,0,0,0,1|1,0,0]=4 11509 B13R1.20 COCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210968 [0,2,0,0,0,1|1,0,0]=4 11510 B13R1.20 COCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210968 [0,2,0,0,0,1|1,0,0]=4 11511 B13R1.20 COCC(=O)Nc1cccc(c1)O 271570a_203496583355_100000158352 [0,2,0,0,0,1|1,0,0]=4 11512 B13R1.20 COCC(=O)Nc1cccc(c1)O 34a_100138415774_100011236192 [0,2,0,0,0,1|1,0,0]=4 11513 B13R1.20 COCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210968 [0,2,0,0,0,1|1,0,0]=4 11514 B13R1.20 CSCC(=O)Cc1cccc(c1)Br 1458a_100000184570_100000211773 [0,2,0,0,0,1|1,0,0]=4 11515 B13R1.20 CSCC(=O)Cc1cccc(c1)C 1458a_100000184570_100000211840 [0,2,0,0,0,1|1,0,0]=4 11516 B13R1.20 CSCC(=O)Cc1cccc(c1)Cl 1458a_100000184570_100000181238 [0,2,0,0,0,1|1,0,0]=4 11517 B13R1.20 CSCC(=O)Cc1cccc(c1)F 1458a_100000184570_100000230114 [0,2,0,0,0,1|1,0,0]=4 11518 B13R1.20 CSCC(=O)Cc1cccc(c1)I 1458a_100000184570_100011218688 [0,2,0,0,0,1|1,0,0]=4 11519 B13R1.20 CSCC(=O)Cc1cccc(c1)O 1458a_100000184570_100011660834 [0,2,0,0,0,1|1,0,0]=4 11520 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000184570 [0,2,0,0,0,1|1,0,0]=4 11521 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000184570 [0,2,0,0,0,1|1,0,0]=4 11522 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000184570 [0,2,0,0,0,1|1,0,0]=4 11523 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000184570 [0,2,0,0,0,1|1,0,0]=4 11524 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 62a_100000183509_200000210301 [0,2,0,0,0,1|1,0,0]=4 11525 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 62a_200000210301_100000183509 [0,2,0,0,0,1|1,0,0]=4 11526 B13R1.20 CSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000184570 [0,2,0,0,0,1|1,0,0]=4 11527 B13R1.20 CSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000184570 [0,2,0,0,0,1|1,0,0]=4 11528 B13R1.20 CSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000184570 [0,2,0,0,0,1|1,0,0]=4 11529 B13R1.20 CSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000184570 [0,2,0,0,0,1|1,0,0]=4 11530 B13R1.20 CSCC(=O)Nc1cccc(c1)C 62a_100000243722_200000210301 [0,2,0,0,0,1|1,0,0]=4 11531 B13R1.20 CSCC(=O)Nc1cccc(c1)C 62a_200000210301_100000182861 [0,2,0,0,0,1|1,0,0]=4 11532 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000184570 [0,2,0,0,0,1|1,0,0]=4 11533 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000184570 [0,2,0,0,0,1|1,0,0]=4 11534 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000184570 [0,2,0,0,0,1|1,0,0]=4 11535 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 62a_200000210301_100000182995 [0,2,0,0,0,1|1,0,0]=4 11536 B13R1.20 CSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000184570 [0,2,0,0,0,1|1,0,0]=4 11537 B13R1.20 CSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000184570 [0,2,0,0,0,1|1,0,0]=4 11538 B13R1.20 CSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000184570 [0,2,0,0,0,1|1,0,0]=4 11539 B13R1.20 CSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000184570 [0,2,0,0,0,1|1,0,0]=4 11540 B13R1.20 CSCC(=O)Nc1cccc(c1)F 62a_100000183335_200000210301 [0,2,0,0,0,1|1,0,0]=4 11541 B13R1.20 CSCC(=O)Nc1cccc(c1)F 62a_200000210301_100000183335 [0,2,0,0,0,1|1,0,0]=4 11542 B13R1.20 CSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000184570 [0,2,0,0,0,1|1,0,0]=4 11543 B13R1.20 CSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000184570 [0,2,0,0,0,1|1,0,0]=4 11544 B13R1.20 CSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000184570 [0,2,0,0,0,1|1,0,0]=4 11545 B13R1.20 CSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000184570 [0,2,0,0,0,1|1,0,0]=4 11546 B13R1.20 CSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000184570 [0,2,0,0,0,1|1,0,0]=4 11547 B13R1.20 CSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000184570 [0,2,0,0,0,1|1,0,0]=4 11548 B13R1.20 CSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000184570 [0,2,0,0,0,1|1,0,0]=4 11549 B13R1.20 CSCC(=O)Nc1cccc(c1)O 62a_200000210301_100011236192 [0,2,0,0,0,1|1,0,0]=4 11550 B13R1.20 Cc1cccc(c1)CC(=O)CCF 1458a_100011206899_100011217306 [0,2,0,0,0,1|1,0,0]=4 11551 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011206899_100000211926 [0,2,0,0,0,1|1,0,0]=4 11552 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011216618_100000211840 [0,2,0,0,0,1|1,0,0]=4 11553 B13R1.20 Cc1cccc(c1)NC(=O)CCO 22a_100000188690_100011216618 [0,2,0,0,0,1|1,0,0]=4 11554 B13R1.20 Cc1cccc(c1)NC(=O)CO[13CH3] 34a_100000749660_200025704644 [0,2,0,0,0,1|1,0,0]=4 11555 B13R1.20 Cc1cccc(c1)NC(=O)CS[13CH3] 62a_100000243722_200025704644 [0,2,0,0,0,1|1,0,0]=4 11556 B13R1.20 Cc1cccc(c1)NC(=O)CS[13CH3] 62a_200025704644_100000182861 [0,2,0,0,0,1|1,0,0]=4 11557 B13R1.20 O=C(CCF)Cc1cccc(c1)Br 1458a_100000747190_100011217306 [0,2,0,0,0,1|1,0,0]=4 11558 B13R1.20 O=C(CCF)Cc1cccc(c1)Cl 1458a_100000749307_100011217306 [0,2,0,0,0,1|1,0,0]=4 11559 B13R1.20 O=C(CCF)Cc1cccc(c1)F 1458a_100000211661_100011217306 [0,2,0,0,0,1|1,0,0]=4 11560 B13R1.20 O=C(CCF)Cc1cccc(c1)I 1458a_100000238430_100011217306 [0,2,0,0,0,1|1,0,0]=4 11561 B13R1.20 O=C(CCF)Cc1cccc(c1)O 1458a_100000745134_100011217306 [0,2,0,0,0,1|1,0,0]=4 11562 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100000747190_100000211926 [0,2,0,0,0,1|1,0,0]=4 11563 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100011216618_100000211773 [0,2,0,0,0,1|1,0,0]=4 11564 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100000749307_100000211926 [0,2,0,0,0,1|1,0,0]=4 11565 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100011216618_100000181238 [0,2,0,0,0,1|1,0,0]=4 11566 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100000211661_100000211926 [0,2,0,0,0,1|1,0,0]=4 11567 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100011216618_100000230114 [0,2,0,0,0,1|1,0,0]=4 11568 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100000238430_100000211926 [0,2,0,0,0,1|1,0,0]=4 11569 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100011216618_100011218688 [0,2,0,0,0,1|1,0,0]=4 11570 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100000745134_100000211926 [0,2,0,0,0,1|1,0,0]=4 11571 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100011216618_100011660834 [0,2,0,0,0,1|1,0,0]=4 11572 B13R1.20 O=C(CCO)Nc1cccc(c1)Br 22a_100000210019_100011216618 [0,2,0,0,0,1|1,0,0]=4 11573 B13R1.20 O=C(CCO)Nc1cccc(c1)Cl 22a_100000185859_100011216618 [0,2,0,0,0,1|1,0,0]=4 11574 B13R1.20 O=C(CCO)Nc1cccc(c1)F 22a_100000210047_100011216618 [0,2,0,0,0,1|1,0,0]=4 11575 B13R1.20 O=C(CCO)Nc1cccc(c1)I 22a_100000211102_100011216618 [0,2,0,0,0,1|1,0,0]=4 11576 B13R1.20 O=C(CCO)Nc1cccc(c1)O 22a_100000210217_100011216618 [0,2,0,0,0,1|1,0,0]=4 11577 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_200025704644 [0,2,0,0,0,1|0,0,0]=3 11578 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)F 2230a_100000168492_200025704644 [0,2,0,0,0,1|0,0,0]=3 11579 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)F 34a_100000168492_200025704644 [0,2,0,0,0,1|0,0,0]=3 11580 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Br 62a_100000183509_200025704644 [0,2,0,0,0,1|1,0,0]=4 11581 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Br 62a_200025704644_100000183509 [0,2,0,0,0,1|1,0,0]=4 11582 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Cl 62a_200025704644_100000182995 [0,2,0,0,0,1|1,0,0]=4 11583 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)F 62a_100000183335_200025704644 [0,2,0,0,0,1|1,0,0]=4 11584 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)F 62a_200025704644_100000183335 [0,2,0,0,0,1|1,0,0]=4 11585 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)O 62a_200025704644_100011236192 [0,2,0,0,0,1|1,0,0]=4 11586 B13R1.44 C#CCCC(=O)Cc1ccccc1 1458a_100000692101_100015291786 [0,2,0,0,0,1|1,0,0]=4 11587 B13R1.44 C#CCCC(=O)Nc1ccccc1 11a_100000106764_100000692101 [0,2,0,0,0,1|1,0,0]=4 11588 B13R1.44 C#CCCC(=O)Nc1ccccc1 1626a_100000106764_100000692101 [0,2,0,0,0,1|1,0,0]=4 11589 B13R1.44 C#CCCC(=O)Nc1ccccc1 22a_100000106764_100000692101 [0,2,0,0,0,1|1,0,0]=4 11590 B13R1.44 C#CCCC(=O)Nc1ccccc1 527a_100000106764_100000692101 [0,2,0,0,0,1|1,0,0]=4 11591 B13R1.44 C#CCNC(=O)C[n+]1ccccc1 11a_100000212058_200000086051 [0,2,0,0,0,1|1,0,0]=4 11592 B13R1.44 C#CCNC(=O)C[n+]1ccccc1 240690a_100000212058_200000086051 [0,2,0,0,0,1|1,0,0]=4 11593 B13R1.44 C#CCNC(=O)C[n+]1ccccc1 527a_100000212058_200000086051 [0,2,0,0,0,1|1,0,0]=4 11594 B13R1.44 C#CCNC(=O)Cc1ccccn1 11a_100000212058_100000233486 [0,2,0,0,0,1|1,0,0]=4 11595 B13R1.44 C#CCNC(=O)Cc1cccnc1 11a_100000212058_100000737805 [0,2,0,0,0,1|1,0,0]=4 11596 B13R1.44 C#CCNC(=O)Cc1cccnc1 240690a_100000212058_100000737805 [0,2,0,0,0,1|1,0,0]=4 11597 B13R1.44 C#CCNC(=O)Cc1cccnc1 527a_100000212058_100000737805 [0,2,0,0,0,1|1,0,0]=4 11598 B13R1.44 C#CCNC(=O)Cc1ccncc1 11a_100000212058_100011201483 [0,2,0,0,0,1|1,0,0]=4 11599 B13R1.44 C#CCNC(=O)Cc1ccncc1 240690a_100000212058_100011201483 [0,2,0,0,0,1|1,0,0]=4 11600 B13R1.44 C#CCNC(=O)Nc1ccccc1 2430a_100000106764_100000212058 [0,2,0,0,0,1|0,0,0]=3 11601 B13R1.44 C=CCCC(=O)Cc1ccccc1 1458a_100000749702_100015291786 [0,2,0,0,0,1|1,0,0]=4 11602 B13R1.44 C=CCCC(=O)Nc1ccccc1 11a_100000106764_100000749702 [0,2,0,0,0,1|1,0,0]=4 11603 B13R1.44 C=CCCC(=O)Nc1ccccc1 1626a_100000106764_100000749702 [0,2,0,0,0,1|1,0,0]=4 11604 B13R1.44 C=CCCC(=O)Nc1ccccc1 22a_100000106764_100000749702 [0,2,0,0,0,1|1,0,0]=4 11605 B13R1.44 C=CCCC(=O)Nc1ccccc1 527a_100000106764_100000749702 [0,2,0,0,0,1|1,0,0]=4 11606 B13R1.44 C=CCNC(=O)C[n+]1ccccc1 240690a_100020586998_200000086051 [0,2,0,0,0,1|1,0,0]=4 11607 B13R1.44 C=CCNC(=O)C[n+]1ccccc1 527a_100020586998_200000086051 [0,2,0,0,0,1|1,0,0]=4 11608 B13R1.44 C=CCNC(=O)Cc1cccnc1 240690a_100020586998_100000737805 [0,2,0,0,0,1|1,0,0]=4 11609 B13R1.44 C=CCNC(=O)Cc1cccnc1 527a_100020586998_100000737805 [0,2,0,0,0,1|1,0,0]=4 11610 B13R1.44 C=CCNC(=O)Cc1ccncc1 240690a_100020586998_100011201483 [0,2,0,0,0,1|1,0,0]=4 11611 B13R1.44 C=CCNC(=O)Nc1ccccc1 2430a_100000106764_100020586998 [0,2,0,0,0,1|0,0,0]=3 11612 B13R1.44 CC=CCC(=O)Cc1ccccc1 1458a_100121576822_100015291786 [0,2,0,0,0,1|1,0,0]=4 11613 B13R1.44 CC=CCC(=O)Nc1ccccc1 11a_100000106764_100121576822 [0,2,0,0,0,1|1,0,0]=4 11614 B13R1.44 CC=CCC(=O)Nc1ccccc1 1626a_100000106764_100121576822 [0,2,0,0,0,1|1,0,0]=4 11615 B13R1.44 CC=CCC(=O)Nc1ccccc1 22a_100000106764_100121576822 [0,2,0,0,0,1|1,0,0]=4 11616 B13R1.44 CC=CCC(=O)Nc1ccccc1 527a_100000106764_100121576822 [0,2,0,0,0,1|1,0,0]=4 11617 B13R1.44 CC=NNC(=O)C[n+]1ccccc1 4a_100000199085_200000210099 [0,2,0,0,0,1|1,0,0]=4 11618 B13R1.44 CC=NNC(=O)Cc1ccccc1 4a_100000182964_200000210099 [0,2,0,0,0,1|0,0,0]=3 11619 B13R1.44 CC=NNC(=O)Cc1ccccn1 4a_200000059813_200000210099 [0,2,0,0,0,1|1,0,0]=4 11620 B13R1.44 CC=NNC(=O)Cc1ccncc1 4a_100000766356_200000210099 [0,2,0,0,0,1|1,0,0]=4 11621 B13R1.44 CCC#CC(=O)Cc1ccccc1 1458a_100011827653_100015291786 [0,2,0,0,0,1|1,0,0]=4 11622 B13R1.44 CCC#CC(=O)Nc1ccccc1 22a_100000106764_100011827653 [0,2,0,0,0,1|1,0,0]=4 11623 B13R1.44 CCC=CC(=O)Cc1ccccc1 1458a_100000212282_100015291786 [0,2,0,0,0,1|1,0,0]=4 11624 B13R1.44 CCC=CC(=O)Nc1ccccc1 11a_100000106764_100000212282 [0,2,0,0,0,1|1,0,0]=4 11625 B13R1.44 CCC=CC(=O)Nc1ccccc1 1626a_100000106764_100000212282 [0,2,0,0,0,1|1,0,0]=4 11626 B13R1.44 CCC=CC(=O)Nc1ccccc1 22a_100000106764_100000212282 [0,2,0,0,0,1|1,0,0]=4 11627 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [0,2,0,0,0,1|1,0,0]=4 11628 B13R1.44 CCCCC(=O)Nc1ccccc1 11a_100000106764_100000210183 [0,2,0,0,0,1|1,0,0]=4 11629 B13R1.44 CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000210183 [0,2,0,0,0,1|1,0,0]=4 11630 B13R1.44 CCCCC(=O)Nc1ccccc1 22a_100000106764_100000210183 [0,2,0,0,0,1|1,0,0]=4 11631 B13R1.44 CCCCC(=O)Nc1ccccc1 527a_100000106764_100000210183 [0,2,0,0,0,1|1,0,0]=4 11632 B13R1.44 CCCNC(=O)C[n+]1ccccc1 11a_100020643023_200000086051 [0,2,0,0,0,1|1,0,0]=4 11633 B13R1.44 CCCNC(=O)C[n+]1ccccc1 240690a_100020643023_200000086051 [0,2,0,0,0,1|1,0,0]=4 11634 B13R1.44 CCCNC(=O)C[n+]1ccccc1 527a_100020643023_200000086051 [0,2,0,0,0,1|1,0,0]=4 11635 B13R1.44 CCCNC(=O)Cc1ccccn1 11a_100020643023_100000233486 [0,2,0,0,0,1|1,0,0]=4 11636 B13R1.44 CCCNC(=O)Cc1cccnc1 11a_100020643023_100000737805 [0,2,0,0,0,1|1,0,0]=4 11637 B13R1.44 CCCNC(=O)Cc1cccnc1 240690a_100020643023_100000737805 [0,2,0,0,0,1|1,0,0]=4 11638 B13R1.44 CCCNC(=O)Cc1cccnc1 527a_100020643023_100000737805 [0,2,0,0,0,1|1,0,0]=4 11639 B13R1.44 CCCNC(=O)Cc1ccncc1 11a_100020643023_100011201483 [0,2,0,0,0,1|1,0,0]=4 11640 B13R1.44 CCCNC(=O)Cc1ccncc1 240690a_100020643023_100011201483 [0,2,0,0,0,1|1,0,0]=4 11641 B13R1.44 CCCNC(=O)Nc1ccccc1 2430a_100000106764_100020643023 [0,2,0,0,0,1|0,0,0]=3 11642 B13R1.44 CCNCC(=O)Cc1ccccc1 2230a_100015525214_100000233483 [0,2,0,0,0,1|0,0,0]=3 11643 B13R1.44 CCNCC(=O)Nc1ccccc1 2230a_100015525214_100000182850 [0,2,0,0,0,1|0,0,0]=3 11644 B13R1.44 CCNCC(=O)Nc1ccccn1 2230a_100015525214_100020662008 [0,2,0,0,0,1|1,0,0]=4 11645 B13R1.44 CCNCC(=O)Nc1ccncc1 2230a_100015525214_100000754145 [0,2,0,0,0,1|1,0,0]=4 11646 B13R1.44 CCNCC(=O)Oc1ccccc1 2230a_100015525214_100009813826 [0,2,0,0,0,1|0,0,0]=3 11647 B13R1.44 CCNNC(=O)C[n+]1ccccc1 22a_100000756455_200000086051 [0,2,0,0,0,1|1,0,0]=4 11648 B13R1.44 CCNNC(=O)Cc1ccccn1 22a_100000756455_100000233486 [0,2,0,0,0,1|1,0,0]=4 11649 B13R1.44 CCNNC(=O)Cc1cccnc1 22a_100000756455_100000737805 [0,2,0,0,0,1|1,0,0]=4 11650 B13R1.44 CCNNC(=O)Cc1ccncc1 22a_100000756455_100011201483 [0,2,0,0,0,1|1,0,0]=4 11651 B13R1.44 CCOCC(=O)Cc1ccccc1 1458a_100000211967_100015291786 [0,2,0,0,0,1|1,0,0]=4 11652 B13R1.44 CCOCC(=O)Nc1ccccc1 11a_100000106764_100000211967 [0,2,0,0,0,1|1,0,0]=4 11653 B13R1.44 CCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211967 [0,2,0,0,0,1|1,0,0]=4 11654 B13R1.44 CCOCC(=O)Nc1ccccc1 22a_100000106764_100000211967 [0,2,0,0,0,1|1,0,0]=4 11655 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100000246334_100000210202 [0,2,0,0,0,1|1,0,0]=4 11656 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100121572206_100000182850 [0,2,0,0,0,1|1,0,0]=4 11657 B13R1.44 CCOCC(=O)Nc1ccccc1 527a_100000106764_100000211967 [0,2,0,0,0,1|1,0,0]=4 11658 B13R1.44 CCOCC(=O)Oc1ccccc1 34a_100121572206_100009813826 [0,2,0,0,0,1|1,0,0]=4 11659 B13R1.44 CCSCC(=O)Cc1ccccc1 1458a_100000230394_100015291786 [0,2,0,0,0,1|1,0,0]=4 11660 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000210202_100000233483 [0,2,0,0,0,1|1,0,0]=4 11661 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210202 [0,2,0,0,0,1|1,0,0]=4 11662 B13R1.44 CCSCC(=O)Nc1ccccc1 11a_100000106764_100000230394 [0,2,0,0,0,1|1,0,0]=4 11663 B13R1.44 CCSCC(=O)Nc1ccccc1 1626a_100000106764_100000230394 [0,2,0,0,0,1|1,0,0]=4 11664 B13R1.44 CCSCC(=O)Nc1ccccc1 22a_100000106764_100000230394 [0,2,0,0,0,1|1,0,0]=4 11665 B13R1.44 CCSCC(=O)Nc1ccccc1 527a_100000106764_100000230394 [0,2,0,0,0,1|1,0,0]=4 11666 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100000210202_100000182850 [0,2,0,0,0,1|1,0,0]=4 11667 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100012148978_100000210202 [0,2,0,0,0,1|1,0,0]=4 11668 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100000210202_100009813826 [0,2,0,0,0,1|1,0,0]=4 11669 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100009813826_100000210202 [0,2,0,0,0,1|1,0,0]=4 11670 B13R1.44 CNCCC(=O)Nc1ccccc1 2230a_106832991635_100000242058 [0,2,0,0,0,1|0,0,0]=3 11671 B13R1.44 CNCCC(=O)Nc1ccccc1 34a_100102657272_100000242058 [0,2,0,0,0,1|0,0,0]=3 11672 B13R1.44 CNCCC(=O)Nc1ccccc1 7a_106832991635_100000242058 [0,2,0,0,0,1|0,0,0]=3 11673 B13R1.44 CNCCC(=O)Nc1cccnc1 2230a_106832991635_200015187043 [0,2,0,0,0,1|1,0,0]=4 11674 B13R1.44 CNCCC(=O)Nc1cccnc1 34a_100000748795_200000210301 [0,2,0,0,0,1|1,0,0]=4 11675 B13R1.44 CNCCC(=O)Nc1cccnc1 7a_106832991635_200015187043 [0,2,0,0,0,1|1,0,0]=4 11676 B13R1.44 CNCCC(=O)Oc1ccccc1 2230a_106832991635_200000035796 [0,2,0,0,0,1|0,0,0]=3 11677 B13R1.44 CNCCC(=O)Oc1ccccc1 7a_106832991635_200000035796 [0,2,0,0,0,1|0,0,0]=3 11678 B13R1.44 COC=CC(=O)Cc1ccccc1 1458a_100016268678_100015291786 [0,2,0,0,0,1|1,0,0]=4 11679 B13R1.44 COC=CC(=O)Nc1ccccc1 1626a_100000106764_100016268678 [0,2,0,0,0,1|1,0,0]=4 11680 B13R1.44 COC=CC(=O)Nc1ccccc1 22a_100000106764_100016268678 [0,2,0,0,0,1|1,0,0]=4 11681 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [0,2,0,0,0,1|1,0,0]=4 11682 B13R1.44 COCCC(=O)Nc1ccccc1 11a_100000106764_100000749529 [0,2,0,0,0,1|1,0,0]=4 11683 B13R1.44 COCCC(=O)Nc1ccccc1 1626a_100000106764_100000749529 [0,2,0,0,0,1|1,0,0]=4 11684 B13R1.44 COCCC(=O)Nc1ccccc1 22a_100000106764_100000749529 [0,2,0,0,0,1|1,0,0]=4 11685 B13R1.44 COCCC(=O)Nc1ccccc1 34a_100138415774_100000242058 [0,2,0,0,0,1|1,0,0]=4 11686 B13R1.44 COCCC(=O)Nc1ccccc1 527a_100000106764_100000749529 [0,2,0,0,0,1|1,0,0]=4 11687 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [0,2,0,0,0,1|1,0,0]=4 11688 B13R1.44 CSCCC(=O)Nc1ccccc1 11a_100000106764_100000174002 [0,2,0,0,0,1|1,0,0]=4 11689 B13R1.44 CSCCC(=O)Nc1ccccc1 1626a_100000106764_100000174002 [0,2,0,0,0,1|1,0,0]=4 11690 B13R1.44 CSCCC(=O)Nc1ccccc1 22a_100000106764_100000174002 [0,2,0,0,0,1|1,0,0]=4 11691 B13R1.44 CSCCC(=O)Nc1ccccc1 527a_100000106764_100000174002 [0,2,0,0,0,1|1,0,0]=4 11692 B13R1.44 CSCCC(=O)Nc1ccccc1 62a_200000210301_100000242058 [0,2,0,0,0,1|1,0,0]=4 11693 B13R1.44 CSCCC(=O)Oc1ccccc1 62a_200000210301_200000035796 [0,2,0,0,0,1|1,0,0]=4 11694 B13R1.44 N#CCCC(=O)Cc1ccccc1 1458a_100011934036_100015291786 [0,2,0,0,0,1|1,0,0]=4 11695 B13R1.44 N#CCCC(=O)Nc1ccccc1 11a_100000106764_100011934036 [0,2,0,0,0,1|1,0,0]=4 11696 B13R1.44 N#CCCC(=O)Nc1ccccc1 1626a_100000106764_100011934036 [0,2,0,0,0,1|1,0,0]=4 11697 B13R1.44 N#CCCC(=O)Nc1ccccc1 22a_100000106764_100011934036 [0,2,0,0,0,1|1,0,0]=4 11698 B13R1.44 N#CCCC(=O)Nc1ccccc1 527a_100000106764_100011934036 [0,2,0,0,0,1|1,0,0]=4 11699 B13R1.44 N#CCNC(=O)C[n+]1ccccc1 527a_100000734998_200000086051 [0,2,0,0,0,1|1,0,0]=4 11700 B13R1.44 N#CCNC(=O)Cc1cccnc1 527a_100000734998_100000737805 [0,2,0,0,0,1|1,0,0]=4 11701 B13R1.44 N#CCNC(=O)Nc1ccccc1 2430a_100000106764_100000734998 [0,2,0,0,0,1|0,0,0]=3 11702 B13R1.44 O=C(C#CCO)Cc1ccccc1 1458a_100000049017_100015291786 [0,2,0,0,0,1|1,0,0]=4 11703 B13R1.44 O=C(COCF)Nc1ccccc1 34a_100000246334_100015361967 [0,2,0,0,0,1|1,0,0]=4 11704 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100000233483_100015361967 [0,2,0,0,0,1|1,0,0]=4 11705 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100015361967_100000233483 [0,2,0,0,0,1|1,0,0]=4 11706 B13R1.44 O=C(CSCF)Nc1ccccc1 62a_100012148978_100015361967 [0,2,0,0,0,1|1,0,0]=4 11707 B13R1.44 O=C(CSCF)Nc1ccccc1 62a_100015361967_100000182850 [0,2,0,0,0,1|1,0,0]=4 11708 B13R1.44 O=C(CSCF)Oc1ccccc1 62a_100009813826_100015361967 [0,2,0,0,0,1|1,0,0]=4 11709 B13R1.44 O=C(CSCF)Oc1ccccc1 62a_100015361967_100009813826 [0,2,0,0,0,1|1,0,0]=4 11710 B13R1.44 O=C(C[n+]1ccccc1)NCCF 11a_100000724931_200000086051 [0,2,0,0,0,1|1,0,0]=4 11711 B13R1.44 O=C(C[n+]1ccccc1)NCCF 240690a_100000724931_200000086051 [0,2,0,0,0,1|1,0,0]=4 11712 B13R1.44 O=C(C[n+]1ccccc1)NCCF 527a_100000724931_200000086051 [0,2,0,0,0,1|1,0,0]=4 11713 B13R1.44 O=C(C[n+]1ccccc1)NCCO 240690a_100000210304_200000086051 [0,2,0,0,0,1|1,0,0]=4 11714 B13R1.44 O=C(C[n+]1ccccc1)NCCO 527a_100000210304_200000086051 [0,2,0,0,0,1|1,0,0]=4 11715 B13R1.44 O=C(Cc1ccccn1)NCCF 11a_100000724931_100000233486 [0,2,0,0,0,1|1,0,0]=4 11716 B13R1.44 O=C(Cc1cccnc1)NCCF 11a_100000724931_100000737805 [0,2,0,0,0,1|1,0,0]=4 11717 B13R1.44 O=C(Cc1cccnc1)NCCF 240690a_100000724931_100000737805 [0,2,0,0,0,1|1,0,0]=4 11718 B13R1.44 O=C(Cc1cccnc1)NCCF 527a_100000724931_100000737805 [0,2,0,0,0,1|1,0,0]=4 11719 B13R1.44 O=C(Cc1cccnc1)NCCO 240690a_100000210304_100000737805 [0,2,0,0,0,1|1,0,0]=4 11720 B13R1.44 O=C(Cc1cccnc1)NCCO 527a_100000210304_100000737805 [0,2,0,0,0,1|1,0,0]=4 11721 B13R1.44 O=C(Cc1ccncc1)NCCF 11a_100000724931_100011201483 [0,2,0,0,0,1|1,0,0]=4 11722 B13R1.44 O=C(Cc1ccncc1)NCCF 240690a_100000724931_100011201483 [0,2,0,0,0,1|1,0,0]=4 11723 B13R1.44 O=C(Cc1ccncc1)NCCO 240690a_100000210304_100011201483 [0,2,0,0,0,1|1,0,0]=4 11724 B13R1.44 O=C(NCCF)Nc1ccccc1 2430a_100000106764_100000724931 [0,2,0,0,0,1|0,0,0]=3 11725 B13R1.44 O=C(NCCO)Nc1ccccc1 2430a_100000106764_100000210304 [0,2,0,0,0,1|0,0,0]=3 11726 B13R1.44 [13CH3]NCCC(=O)Nc1cccnc1 34a_100000748795_200025704644 [0,2,0,0,0,1|1,0,0]=4 11727 B13R1.44 [13CH3]SCCC(=O)Nc1ccccc1 62a_200025704644_100000242058 [0,2,0,0,0,1|1,0,0]=4 11728 B13R1.44 [13CH3]SCCC(=O)Oc1ccccc1 62a_200025704644_200000035796 [0,2,0,0,0,1|1,0,0]=4 11729 B13R1.47 C=C(C(=O)CCC)c1ccccc1 1458a_100000065200_100000210303 [0,2,0,0,0,1|1,0,0]=4 11730 B13R1.47 C=C(C(=O)CCF)c1ccccc1 1458a_100000065200_100011217306 [0,2,0,0,0,1|1,0,0]=4 11731 B13R1.47 C=C(C(=O)CCO)c1ccccc1 1458a_100000065200_100000211926 [0,2,0,0,0,1|1,0,0]=4 11732 B13R1.47 C=C(C(=O)NNC)c1ccccc1 22a_100016993582_100000065200 [0,2,0,0,0,1|0,0,0]=3 11733 B13R1.47 CC#CC(=O)C(C)c1ccccc1 1458a_100000763181_100000230085 [0,2,0,0,0,1|1,0,0]=4 11734 B13R1.47 CC#CC(=O)N(C)c1ccccc1 22a_100000210012_100000763181 [0,2,0,0,0,1|1,0,0]=4 11735 B13R1.47 CC(C(=O)CCO)c1ccccc1 1458a_100011216618_100000230085 [0,2,0,0,0,1|1,0,0]=4 11736 B13R1.47 CC=CC(=O)C(C)c1ccccc1 1458a_100000210699_100000230085 [0,2,0,0,0,1|1,0,0]=4 11737 B13R1.47 CC=CC(=O)N(C)c1ccccc1 11a_100000210012_100000210699 [0,2,0,0,0,1|1,0,0]=4 11738 B13R1.47 CC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000210699 [0,2,0,0,0,1|1,0,0]=4 11739 B13R1.47 CC=CC(=O)N(C)c1ccccc1 22a_100000210012_100000210699 [0,2,0,0,0,1|1,0,0]=4 11740 B13R1.47 CCCC(=O)C(C)c1ccccc1 1458a_100000211992_100000230085 [0,2,0,0,0,1|1,0,0]=4 11741 B13R1.47 CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210303 [0,2,0,0,0,1|1,0,0]=4 11742 B13R1.47 CCCC(=O)N(C)c1ccccc1 11a_100000210012_100000211992 [0,2,0,0,0,1|1,0,0]=4 11743 B13R1.47 CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000211992 [0,2,0,0,0,1|1,0,0]=4 11744 B13R1.47 CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000211992 [0,2,0,0,0,1|1,0,0]=4 11745 B13R1.47 CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210303 [0,2,0,0,0,1|1,0,0]=4 11746 B13R1.47 CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210303 [0,2,0,0,0,1|1,0,0]=4 11747 B13R1.47 CCNC(=O)C(C)c1ccccn1 11a_100015525214_100000722050 [0,2,0,0,0,1|1,0,0]=4 11748 B13R1.47 CCNC(=O)C(C)c1ccccn1 240690a_100015525214_100000722050 [0,2,0,0,0,1|1,0,0]=4 11749 B13R1.47 CCNC(=O)C(C)c1ccccn1 527a_100015525214_100000722050 [0,2,0,0,0,1|1,0,0]=4 11750 B13R1.47 CCNC(=O)C(F)c1ccccc1 11a_100015525214_100000698975 [0,2,0,0,0,1|0,0,0]=3 11751 B13R1.47 CCNC(=O)C(F)c1ccccc1 240690a_100015525214_100000698975 [0,2,0,0,0,1|0,0,0]=3 11752 B13R1.47 CCNC(=O)C(F)c1ccccc1 527a_100015525214_100000698975 [0,2,0,0,0,1|0,0,0]=3 11753 B13R1.47 CCNC(=O)N(C)c1ccccc1 512a_100015525214_100000210012 [0,2,0,0,0,1|0,0,0]=3 11754 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 11a_100015525214_100000751047 [0,2,0,0,0,1|0,0,0]=3 11755 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 240690a_100015525214_100000751047 [0,2,0,0,0,1|0,0,0]=3 11756 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 527a_100015525214_100000751047 [0,2,0,0,0,1|0,0,0]=3 11757 B13R1.47 CCNC(=O)[C@H](O)c1ccccc1 240690a_100015525214_100000684486 [0,2,0,0,0,1|0,0,0]=3 11758 B13R1.47 CN(C(=O)CCO)c1ccccc1 22a_100000210012_100011216618 [0,2,0,0,0,1|1,0,0]=4 11759 B13R1.47 CN(C(=O)CN[13CH3])c1ccccc1 2230a_200000174886_200025704644 [0,2,0,0,0,1|0,0,0]=3 11760 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_100000183487_200025704644 [0,2,0,0,0,1|1,0,0]=4 11761 B13R1.47 CN(C(=O)CS[13CH3])c1ccccc1 62a_200025704644_100000183487 [0,2,0,0,0,1|1,0,0]=4 11762 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_106832991635_100000183487 [0,2,0,0,0,1|0,0,0]=3 11763 B13R1.47 CNCC(=O)N(C)c1ccccc1 2230a_200000174886_200000210301 [0,2,0,0,0,1|0,0,0]=3 11764 B13R1.47 CNCC(=O)N(C)c1ccccc1 34a_100102657272_100000183487 [0,2,0,0,0,1|0,0,0]=3 11765 B13R1.47 CNCC(=O)N(C)c1ccccc1 7a_106832991635_100000183487 [0,2,0,0,0,1|0,0,0]=3 11766 B13R1.47 CNNC(=O)C(C)c1ccccn1 22a_100016993582_100000722050 [0,2,0,0,0,1|1,0,0]=4 11767 B13R1.47 CNNC(=O)C(F)c1ccccc1 22a_100016993582_100000698975 [0,2,0,0,0,1|0,0,0]=3 11768 B13R1.47 CNNC(=O)N(C)c1ccccc1 512a_100016993582_100000210012 [0,2,0,0,0,1|0,0,0]=3 11769 B13R1.47 CNNC(=O)[C@@H](C)c1ccccc1 22a_100016993582_100000751047 [0,2,0,0,0,1|0,0,0]=3 11770 B13R1.47 CNNC(=O)[C@H](O)c1ccccc1 22a_100016993582_100000684486 [0,2,0,0,0,1|0,0,0]=3 11771 B13R1.47 COCC(=O)C(C)c1ccccc1 1458a_100000210968_100000230085 [0,2,0,0,0,1|1,0,0]=4 11772 B13R1.47 COCC(=O)N(C)c1ccccc1 11a_100000210012_100000210968 [0,2,0,0,0,1|1,0,0]=4 11773 B13R1.47 COCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210968 [0,2,0,0,0,1|1,0,0]=4 11774 B13R1.47 COCC(=O)N(C)c1ccccc1 22a_100000210012_100000210968 [0,2,0,0,0,1|1,0,0]=4 11775 B13R1.47 COCC(=O)N(C)c1ccccc1 34a_100138415774_100000183487 [0,2,0,0,0,1|1,0,0]=4 11776 B13R1.47 CSCC(=O)C(C)c1ccccc1 1458a_100000184570_100000230085 [0,2,0,0,0,1|1,0,0]=4 11777 B13R1.47 CSCC(=O)N(C)c1ccccc1 11a_100000210012_100000184570 [0,2,0,0,0,1|1,0,0]=4 11778 B13R1.47 CSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000184570 [0,2,0,0,0,1|1,0,0]=4 11779 B13R1.47 CSCC(=O)N(C)c1ccccc1 22a_100000210012_100000184570 [0,2,0,0,0,1|1,0,0]=4 11780 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_100000183487_200000210301 [0,2,0,0,0,1|1,0,0]=4 11781 B13R1.47 CSCC(=O)N(C)c1ccccc1 62a_200000210301_100000183487 [0,2,0,0,0,1|1,0,0]=4 11782 B13R1.47 C[C@H](C(=O)CCF)c1ccccc1 1458a_100000751047_100011217306 [0,2,0,0,0,1|1,0,0]=4 11783 B13R1.47 C[C@H](C(=O)CCO)c1ccccc1 1458a_100000751047_100000211926 [0,2,0,0,0,1|1,0,0]=4 11784 B13R1.47 O=C(CCF)C(F)c1ccccc1 1458a_100000698975_100011217306 [0,2,0,0,0,1|1,0,0]=4 11785 B13R1.47 O=C(CCF)[C@H](O)c1ccccc1 1458a_100000684486_100011217306 [0,2,0,0,0,1|1,0,0]=4 11786 B13R1.47 O=C(CCO)C(F)c1ccccc1 1458a_100000698975_100000211926 [0,2,0,0,0,1|1,0,0]=4 11787 B13R1.47 O=C(CCO)[C@H](O)c1ccccc1 1458a_100000684486_100000211926 [0,2,0,0,0,1|1,0,0]=4 11788 B13R1.348 CC(=CC(=O)Cc1ccccc1)C 1458a_100000211388_100015291786 [0,2,0,0,0,1|1,0,0]=4 11789 B13R1.348 CC(=CC(=O)Cc1ccccc1)Cl 1458a_200042562850_100015291786 [0,2,0,0,0,1|1,0,0]=4 11790 B13R1.348 CC(=CC(=O)Cc1ccccc1)I 1458a_100025716642_100015291786 [0,2,0,0,0,1|1,0,0]=4 11791 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 11a_100000106764_100000211388 [0,2,0,0,0,1|1,0,0]=4 11792 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 1626a_100000106764_100000211388 [0,2,0,0,0,1|1,0,0]=4 11793 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 22a_100000106764_100000211388 [0,2,0,0,0,1|1,0,0]=4 11794 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 11a_100000106764_200042562850 [0,2,0,0,0,1|1,0,0]=4 11795 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 1626a_100000106764_200042562850 [0,2,0,0,0,1|1,0,0]=4 11796 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 22a_100000106764_200042562850 [0,2,0,0,0,1|1,0,0]=4 11797 B13R1.348 CC(=CC(=O)Nc1ccccc1)I 11a_100000106764_100025716642 [0,2,0,0,0,1|1,0,0]=4 11798 B13R1.348 CC(=CC(=O)Nc1ccccc1)I 1626a_100000106764_100025716642 [0,2,0,0,0,1|1,0,0]=4 11799 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 1458a_100000070787_100000233483 [0,2,0,0,0,1|1,0,0]=4 11800 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 1458a_100000070787_100000182850 [0,2,0,0,0,1|1,0,0]=4 11801 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 1458a_100000070787_100009813826 [0,2,0,0,0,1|1,0,0]=4 11802 B13R1.348 CC(C)CC(=O)Cc1ccccc1 1458a_100000210554_100015291786 [0,2,0,0,0,1|1,0,0]=4 11803 B13R1.348 CC(C)CC(=O)Nc1ccccc1 11a_100000106764_100000210554 [0,2,0,0,0,1|1,0,0]=4 11804 B13R1.348 CC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000210554 [0,2,0,0,0,1|1,0,0]=4 11805 B13R1.348 CC(C)CC(=O)Nc1ccccc1 22a_100000106764_100000210554 [0,2,0,0,0,1|1,0,0]=4 11806 B13R1.348 CC(C)CC(=O)Nc1ccccc1 527a_100000106764_100000210554 [0,2,0,0,0,1|1,0,0]=4 11807 B13R1.348 CC(C)NC(=O)C[n+]1ccccc1 11a_100138425928_200000086051 [0,2,0,0,0,1|1,0,0]=4 11808 B13R1.348 CC(C)NC(=O)C[n+]1ccccc1 240690a_100138425928_200000086051 [0,2,0,0,0,1|1,0,0]=4 11809 B13R1.348 CC(C)NC(=O)C[n+]1ccccc1 527a_100138425928_200000086051 [0,2,0,0,0,1|1,0,0]=4 11810 B13R1.348 CC(C)NC(=O)Cc1ccccn1 11a_100138425928_100000233486 [0,2,0,0,0,1|1,0,0]=4 11811 B13R1.348 CC(C)NC(=O)Cc1cccnc1 11a_100138425928_100000737805 [0,2,0,0,0,1|1,0,0]=4 11812 B13R1.348 CC(C)NC(=O)Cc1cccnc1 240690a_100138425928_100000737805 [0,2,0,0,0,1|1,0,0]=4 11813 B13R1.348 CC(C)NC(=O)Cc1cccnc1 527a_100138425928_100000737805 [0,2,0,0,0,1|1,0,0]=4 11814 B13R1.348 CC(C)NC(=O)Cc1ccncc1 11a_100138425928_100011201483 [0,2,0,0,0,1|1,0,0]=4 11815 B13R1.348 CC(C)NC(=O)Cc1ccncc1 240690a_100138425928_100011201483 [0,2,0,0,0,1|1,0,0]=4 11816 B13R1.348 CC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100138425928 [0,2,0,0,0,1|0,0,0]=3 11817 B13R1.348 CN(C)CC(=O)Cc1ccccc1 1458a_100000750896_100015291786 [0,2,0,0,0,1|0,0,0]=3 11818 B13R1.348 CN(C)CC(=O)Cc1ccccc1 2230a_100102631434_100000233483 [0,2,0,0,0,1|0,0,0]=3 11819 B13R1.348 CN(C)CC(=O)Cc1ccccc1 269982a_100102631434_100000233483 [0,2,0,0,0,1|0,0,0]=3 11820 B13R1.348 CN(C)CC(=O)Cc1ccccn1 1458a_100000750896_100000721315 [0,2,0,0,0,1|1,0,0]=4 11821 B13R1.348 CN(C)CC(=O)Cc1cccnc1 1458a_100000750896_100000733263 [0,2,0,0,0,1|1,0,0]=4 11822 B13R1.348 CN(C)CC(=O)Cc1ccncc1 1458a_100000750896_100000705612 [0,2,0,0,0,1|1,0,0]=4 11823 B13R1.348 CN(C)CC(=O)Nc1ccccc1 11a_100000106764_100000750896 [0,2,0,0,0,1|0,0,0]=3 11824 B13R1.348 CN(C)CC(=O)Nc1ccccc1 2230a_100102631434_100000182850 [0,2,0,0,0,1|0,0,0]=3 11825 B13R1.348 CN(C)CC(=O)Nc1ccccc1 22a_100000106764_100000750896 [0,2,0,0,0,1|0,0,0]=3 11826 B13R1.348 CN(C)CC(=O)Nc1ccccc1 269982a_100102631434_100000182850 [0,2,0,0,0,1|0,0,0]=3 11827 B13R1.348 CN(C)CC(=O)Nc1ccccc1 527a_100000106764_100000750896 [0,2,0,0,0,1|0,0,0]=3 11828 B13R1.348 CN(C)CC(=O)Nc1ccccn1 2230a_100102631434_100020662008 [0,2,0,0,0,1|1,0,0]=4 11829 B13R1.348 CN(C)CC(=O)Nc1ccccn1 269982a_100102631434_100020662008 [0,2,0,0,0,1|1,0,0]=4 11830 B13R1.348 CN(C)CC(=O)Nc1ccncc1 2230a_100102631434_100000754145 [0,2,0,0,0,1|1,0,0]=4 11831 B13R1.348 CN(C)CC(=O)Nc1ccncc1 269982a_100102631434_100000754145 [0,2,0,0,0,1|1,0,0]=4 11832 B13R1.348 CN(C)CC(=O)Oc1ccccc1 2230a_100102631434_100009813826 [0,2,0,0,0,1|0,0,0]=3 11833 B13R1.348 CN(C)CC(=O)Oc1ccccc1 269982a_100102631434_100009813826 [0,2,0,0,0,1|0,0,0]=3 11834 B13R1.348 C[C@@H](O)CC(=O)Cc1ccccc1 1458a_100011933948_100015291786 [0,2,0,0,0,1|1,0,0]=4 11835 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccc1 22a_100000106764_100011933948 [0,2,0,0,0,1|1,0,0]=4 11836 B13R1.348 C[S+](C)CC(=O)Cc1ccccc1 1458a_200159257847_100015291786 [0,2,0,0,0,1|1,0,0]=4 11837 B13R1.348 C[S+](C)CC(=O)Nc1ccccc1 11a_100000106764_200159257847 [0,2,0,0,0,1|1,0,0]=4 11838 B13R1.348 C[S+](C)CC(=O)Nc1ccccc1 1626a_100000106764_200159257847 [0,2,0,0,0,1|1,0,0]=4 11839 B13R1.348 C[S+](C)CC(=O)Nc1ccccc1 22a_100000106764_200159257847 [0,2,0,0,0,1|1,0,0]=4 11840 B13R1.348 C[S+](C)CC(=O)Nc1ccccc1 527a_100000106764_200159257847 [0,2,0,0,0,1|1,0,0]=4 11841 B13R1.470 CC#CC(=O)Cc1ccccc1Br 1458a_100000763181_100000184730 [0,2,0,0,0,1|1,0,0]=4 11842 B13R1.470 CC#CC(=O)Cc1ccccc1C 1458a_100000763181_100000211839 [0,2,0,0,0,1|1,0,0]=4 11843 B13R1.470 CC#CC(=O)Cc1ccccc1Cl 1458a_100000763181_100000187162 [0,2,0,0,0,1|1,0,0]=4 11844 B13R1.470 CC#CC(=O)Cc1ccccc1F 1458a_100000763181_100000187165 [0,2,0,0,0,1|1,0,0]=4 11845 B13R1.470 CC#CC(=O)Cc1ccccc1I 1458a_100000763181_100011216222 [0,2,0,0,0,1|1,0,0]=4 11846 B13R1.470 CC#CC(=O)Nc1ccccc1C 22a_100015192222_100000763181 [0,2,0,0,0,1|1,0,0]=4 11847 B13R1.470 CC#CC(=O)Nc1ccccc1Cl 22a_100000185783_100000763181 [0,2,0,0,0,1|1,0,0]=4 11848 B13R1.470 CC#CC(=O)Nc1ccccc1F 22a_100000210422_100000763181 [0,2,0,0,0,1|1,0,0]=4 11849 B13R1.470 CC#CC(=O)Nc1ccccc1O 22a_100000185747_100000763181 [0,2,0,0,0,1|1,0,0]=4 11850 B13R1.470 CC=CC(=O)Cc1ccccc1Br 1458a_100000210699_100000184730 [0,2,0,0,0,1|1,0,0]=4 11851 B13R1.470 CC=CC(=O)Cc1ccccc1C 1458a_100000210699_100000211839 [0,2,0,0,0,1|1,0,0]=4 11852 B13R1.470 CC=CC(=O)Cc1ccccc1Cl 1458a_100000210699_100000187162 [0,2,0,0,0,1|1,0,0]=4 11853 B13R1.470 CC=CC(=O)Cc1ccccc1F 1458a_100000210699_100000187165 [0,2,0,0,0,1|1,0,0]=4 11854 B13R1.470 CC=CC(=O)Cc1ccccc1I 1458a_100000210699_100011216222 [0,2,0,0,0,1|1,0,0]=4 11855 B13R1.470 CC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000210699 [0,2,0,0,0,1|1,0,0]=4 11856 B13R1.470 CC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000210699 [0,2,0,0,0,1|1,0,0]=4 11857 B13R1.470 CC=CC(=O)Nc1ccccc1C 11a_100015192222_100000210699 [0,2,0,0,0,1|1,0,0]=4 11858 B13R1.470 CC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000210699 [0,2,0,0,0,1|1,0,0]=4 11859 B13R1.470 CC=CC(=O)Nc1ccccc1C 22a_100015192222_100000210699 [0,2,0,0,0,1|1,0,0]=4 11860 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000210699 [0,2,0,0,0,1|1,0,0]=4 11861 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210699 [0,2,0,0,0,1|1,0,0]=4 11862 B13R1.470 CC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000210699 [0,2,0,0,0,1|1,0,0]=4 11863 B13R1.470 CC=CC(=O)Nc1ccccc1F 11a_100000210422_100000210699 [0,2,0,0,0,1|1,0,0]=4 11864 B13R1.470 CC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000210699 [0,2,0,0,0,1|1,0,0]=4 11865 B13R1.470 CC=CC(=O)Nc1ccccc1F 22a_100000210422_100000210699 [0,2,0,0,0,1|1,0,0]=4 11866 B13R1.470 CC=CC(=O)Nc1ccccc1I 11a_100000210053_100000210699 [0,2,0,0,0,1|1,0,0]=4 11867 B13R1.470 CC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000210699 [0,2,0,0,0,1|1,0,0]=4 11868 B13R1.470 CC=CC(=O)Nc1ccccc1O 22a_100000185747_100000210699 [0,2,0,0,0,1|1,0,0]=4 11869 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000211992_100000184730 [0,2,0,0,0,1|1,0,0]=4 11870 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210303 [0,2,0,0,0,1|1,0,0]=4 11871 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000211992_100000211839 [0,2,0,0,0,1|1,0,0]=4 11872 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210303 [0,2,0,0,0,1|1,0,0]=4 11873 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210303 [0,2,0,0,0,1|1,0,0]=4 11874 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000211992_100000187162 [0,2,0,0,0,1|1,0,0]=4 11875 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000211992_100000187165 [0,2,0,0,0,1|1,0,0]=4 11876 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210303 [0,2,0,0,0,1|1,0,0]=4 11877 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210303 [0,2,0,0,0,1|1,0,0]=4 11878 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000211992_100011216222 [0,2,0,0,0,1|1,0,0]=4 11879 B13R1.470 CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210303 [0,2,0,0,0,1|1,0,0]=4 11880 B13R1.470 CCCC(=O)Nc1ccccc1Br 11a_100000210017_100000211992 [0,2,0,0,0,1|1,0,0]=4 11881 B13R1.470 CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211992 [0,2,0,0,0,1|1,0,0]=4 11882 B13R1.470 CCCC(=O)Nc1ccccc1C 11a_100015192222_100000211992 [0,2,0,0,0,1|1,0,0]=4 11883 B13R1.470 CCCC(=O)Nc1ccccc1C 1626a_100015192222_100000211992 [0,2,0,0,0,1|1,0,0]=4 11884 B13R1.470 CCCC(=O)Nc1ccccc1C 22a_100015192222_100000211992 [0,2,0,0,0,1|1,0,0]=4 11885 B13R1.470 CCCC(=O)Nc1ccccc1C 527a_100015192222_100000211992 [0,2,0,0,0,1|1,0,0]=4 11886 B13R1.470 CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211992 [0,2,0,0,0,1|1,0,0]=4 11887 B13R1.470 CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211992 [0,2,0,0,0,1|1,0,0]=4 11888 B13R1.470 CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211992 [0,2,0,0,0,1|1,0,0]=4 11889 B13R1.470 CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211992 [0,2,0,0,0,1|1,0,0]=4 11890 B13R1.470 CCCC(=O)Nc1ccccc1F 11a_100000210422_100000211992 [0,2,0,0,0,1|1,0,0]=4 11891 B13R1.470 CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000211992 [0,2,0,0,0,1|1,0,0]=4 11892 B13R1.470 CCCC(=O)Nc1ccccc1F 22a_100000210422_100000211992 [0,2,0,0,0,1|1,0,0]=4 11893 B13R1.470 CCCC(=O)Nc1ccccc1F 527a_100000210422_100000211992 [0,2,0,0,0,1|1,0,0]=4 11894 B13R1.470 CCCC(=O)Nc1ccccc1I 11a_100000210053_100000211992 [0,2,0,0,0,1|1,0,0]=4 11895 B13R1.470 CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000211992 [0,2,0,0,0,1|1,0,0]=4 11896 B13R1.470 CCCC(=O)Nc1ccccc1O 22a_100000185747_100000211992 [0,2,0,0,0,1|1,0,0]=4 11897 B13R1.470 CCCC(=O)Nc1ccccc1O 271570a_203496583355_100000153530 [0,2,0,0,0,1|1,0,0]=4 11898 B13R1.470 CCCC(=O)Nc1ccccc1O 527a_100000185747_100000211992 [0,2,0,0,0,1|1,0,0]=4 11899 B13R1.470 CCNC(=O)Cc1ccccc1Br 11a_100015525214_100000751119 [0,2,0,0,0,1|0,0,0]=3 11900 B13R1.470 CCNC(=O)Cc1ccccc1Br 240690a_100015525214_100000751119 [0,2,0,0,0,1|0,0,0]=3 11901 B13R1.470 CCNC(=O)Cc1ccccc1Br 527a_100015525214_100000751119 [0,2,0,0,0,1|0,0,0]=3 11902 B13R1.470 CCNC(=O)Cc1ccccc1C 11a_100015525214_100000212180 [0,2,0,0,0,1|0,0,0]=3 11903 B13R1.470 CCNC(=O)Cc1ccccc1C 240690a_100015525214_100000212180 [0,2,0,0,0,1|0,0,0]=3 11904 B13R1.470 CCNC(=O)Cc1ccccc1C 527a_100015525214_100000212180 [0,2,0,0,0,1|0,0,0]=3 11905 B13R1.470 CCNC(=O)Cc1ccccc1Cl 11a_100015525214_100000183793 [0,2,0,0,0,1|0,0,0]=3 11906 B13R1.470 CCNC(=O)Cc1ccccc1Cl 240690a_100015525214_100000183793 [0,2,0,0,0,1|0,0,0]=3 11907 B13R1.470 CCNC(=O)Cc1ccccc1Cl 527a_100015525214_100000183793 [0,2,0,0,0,1|0,0,0]=3 11908 B13R1.470 CCNC(=O)Cc1ccccc1F 11a_100015525214_100000212012 [0,2,0,0,0,1|0,0,0]=3 11909 B13R1.470 CCNC(=O)Cc1ccccc1F 240690a_100015525214_100000212012 [0,2,0,0,0,1|0,0,0]=3 11910 B13R1.470 CCNC(=O)Cc1ccccc1F 527a_100015525214_100000212012 [0,2,0,0,0,1|0,0,0]=3 11911 B13R1.470 CCNC(=O)Cc1ccccc1I 11a_100015525214_100000036491 [0,2,0,0,0,1|0,0,0]=3 11912 B13R1.470 CCNC(=O)Cc1ccccc1I 240690a_100015525214_100000036491 [0,2,0,0,0,1|0,0,0]=3 11913 B13R1.470 CCNC(=O)Cc1ccccc1I 527a_100015525214_100000036491 [0,2,0,0,0,1|0,0,0]=3 11914 B13R1.470 CCNC(=O)Cc1ccccc1O 240690a_100015525214_100000743006 [0,2,0,0,0,1|0,0,0]=3 11915 B13R1.470 CCNC(=O)Cc1ccccc1O 271570a_203496583355_200009816148 [0,2,0,0,0,1|0,0,0]=3 11916 B13R1.470 CCNC(=O)Cc1ccccc1O 527a_100015525214_100000743006 [0,2,0,0,0,1|0,0,0]=3 11917 B13R1.470 CCNC(=O)Cc1cccnc1Cl 11a_100015525214_100000093521 [0,2,0,0,0,1|1,0,0]=4 11918 B13R1.470 CCNC(=O)Cc1cccnc1Cl 240690a_100015525214_100000093521 [0,2,0,0,0,1|1,0,0]=4 11919 B13R1.470 CCNC(=O)Cc1cccnc1Cl 527a_100015525214_100000093521 [0,2,0,0,0,1|1,0,0]=4 11920 B13R1.470 CCNC(=O)Cc1ncccc1Br 11a_100015525214_200012357574 [0,2,0,0,0,1|1,0,0]=4 11921 B13R1.470 CCNC(=O)Cc1ncccc1Br 240690a_100015525214_200012357574 [0,2,0,0,0,1|1,0,0]=4 11922 B13R1.470 CCNC(=O)Cc1ncccc1C 11a_100015525214_200000722269 [0,2,0,0,0,1|1,0,0]=4 11923 B13R1.470 CCNC(=O)Cc1ncccc1C 240690a_100015525214_200000722269 [0,2,0,0,0,1|1,0,0]=4 11924 B13R1.470 CCNC(=O)Cc1ncccc1Cl 11a_100015525214_100011998755 [0,2,0,0,0,1|1,0,0]=4 11925 B13R1.470 CCNC(=O)Cc1ncccc1Cl 240690a_100015525214_100011998755 [0,2,0,0,0,1|1,0,0]=4 11926 B13R1.470 CCNC(=O)Cc1ncccc1Cl 527a_100015525214_100011998755 [0,2,0,0,0,1|1,0,0]=4 11927 B13R1.470 CCNC(=O)Cn1ccccc1=O 240690a_100015525214_100000189665 [0,2,0,0,0,1|1,0,0]=4 11928 B13R1.470 CCNC(=O)Cn1ccccc1=O 527a_100015525214_100000189665 [0,2,0,0,0,1|1,0,0]=4 11929 B13R1.470 CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100015525214 [0,2,0,0,0,1|0,0,0]=3 11930 B13R1.470 CCNC(=O)Nc1ccccc1C 2430a_100015192222_100015525214 [0,2,0,0,0,1|0,0,0]=3 11931 B13R1.470 CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100015525214 [0,2,0,0,0,1|0,0,0]=3 11932 B13R1.470 CCNC(=O)Nc1ccccc1F 2430a_100000210422_100015525214 [0,2,0,0,0,1|0,0,0]=3 11933 B13R1.470 CCNC(=O)Nc1ccccc1I 2430a_100000210053_100015525214 [0,2,0,0,0,1|0,0,0]=3 11934 B13R1.470 CCNC(=O)Nc1ccccc1O 2430a_100000185747_100015525214 [0,2,0,0,0,1|0,0,0]=3 11935 B13R1.470 CCOC(=O)Cc1ccccc1O 271570a_203496583355_100011218996 [0,2,0,0,0,1|1,0,0]=4 11936 B13R1.470 CNCC(=O)Cc1ccccc1Br 2230a_106832991635_100000700504 [0,2,0,0,0,1|0,0,0]=3 11937 B13R1.470 CNCC(=O)Cc1ccccc1Br 34a_100102657272_100000700504 [0,2,0,0,0,1|0,0,0]=3 11938 B13R1.470 CNCC(=O)Cc1ccccc1Br 7a_106832991635_100000700504 [0,2,0,0,0,1|0,0,0]=3 11939 B13R1.470 CNCC(=O)Cc1ccccc1C 2230a_106832991635_100011223134 [0,2,0,0,0,1|0,0,0]=3 11940 B13R1.470 CNCC(=O)Cc1ccccc1C 7a_106832991635_100011223134 [0,2,0,0,0,1|0,0,0]=3 11941 B13R1.470 CNCC(=O)Nc1ccccc1Br 2230a_100000683505_200000210301 [0,2,0,0,0,1|0,0,0]=3 11942 B13R1.470 CNCC(=O)Nc1ccccc1Br 2230a_106832991635_100000182372 [0,2,0,0,0,1|0,0,0]=3 11943 B13R1.470 CNCC(=O)Nc1ccccc1Br 7a_106832991635_100000182372 [0,2,0,0,0,1|0,0,0]=3 11944 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_100015186652_200000210301 [0,2,0,0,0,1|0,0,0]=3 11945 B13R1.470 CNCC(=O)Nc1ccccc1C 2230a_106832991635_100000183529 [0,2,0,0,0,1|0,0,0]=3 11946 B13R1.470 CNCC(=O)Nc1ccccc1C 34a_100102657272_100000183529 [0,2,0,0,0,1|0,0,0]=3 11947 B13R1.470 CNCC(=O)Nc1ccccc1C 7a_106832991635_100000183529 [0,2,0,0,0,1|0,0,0]=3 11948 B13R1.470 CNCC(=O)Nc1ccccc1Cl 2230a_106832991635_100000182448 [0,2,0,0,0,1|0,0,0]=3 11949 B13R1.470 CNCC(=O)Nc1ccccc1Cl 34a_100102657272_100000182448 [0,2,0,0,0,1|0,0,0]=3 11950 B13R1.470 CNCC(=O)Nc1ccccc1Cl 7a_106832991635_100000182448 [0,2,0,0,0,1|0,0,0]=3 11951 B13R1.470 CNCC(=O)Nc1ccccc1F 2230a_106832991635_100000182988 [0,2,0,0,0,1|0,0,0]=3 11952 B13R1.470 CNCC(=O)Nc1ccccc1F 34a_100102657272_100000243840 [0,2,0,0,0,1|0,0,0]=3 11953 B13R1.470 CNCC(=O)Nc1ccccc1F 7a_106832991635_100000182988 [0,2,0,0,0,1|0,0,0]=3 11954 B13R1.470 CNCC(=O)Nc1ccccc1I 2230a_106832991635_100000180142 [0,2,0,0,0,1|0,0,0]=3 11955 B13R1.470 CNCC(=O)Nc1ccccc1I 34a_100102657272_100000180142 [0,2,0,0,0,1|0,0,0]=3 11956 B13R1.470 CNCC(=O)Nc1ccccc1I 7a_106832991635_100000180142 [0,2,0,0,0,1|0,0,0]=3 11957 B13R1.470 CNCC(=O)Nc1ccccc1O 7a_106832991635_100000014494 [0,2,0,0,0,1|0,0,0]=3 11958 B13R1.470 CNNC(=O)Cc1ccccc1Br 22a_100016993582_100000751119 [0,2,0,0,0,1|0,0,0]=3 11959 B13R1.470 CNNC(=O)Cc1ccccc1C 22a_100016993582_100000212180 [0,2,0,0,0,1|0,0,0]=3 11960 B13R1.470 CNNC(=O)Cc1ccccc1Cl 22a_100016993582_100000183793 [0,2,0,0,0,1|0,0,0]=3 11961 B13R1.470 CNNC(=O)Cc1ccccc1F 22a_100016993582_100000212012 [0,2,0,0,0,1|0,0,0]=3 11962 B13R1.470 CNNC(=O)Cc1ccccc1I 22a_100016993582_100000036491 [0,2,0,0,0,1|0,0,0]=3 11963 B13R1.470 CNNC(=O)Cc1ccccc1O 22a_100016993582_100000743006 [0,2,0,0,0,1|0,0,0]=3 11964 B13R1.470 CNNC(=O)Cc1cccnc1Cl 22a_100016993582_100000093521 [0,2,0,0,0,1|1,0,0]=4 11965 B13R1.470 CNNC(=O)Cc1ncccc1Br 22a_100016993582_200012357574 [0,2,0,0,0,1|1,0,0]=4 11966 B13R1.470 CNNC(=O)Cn1ccccc1=O 22a_100016993582_100000189665 [0,2,0,0,0,1|1,0,0]=4 11967 B13R1.470 COCC(=O)Cc1ccccc1Br 1458a_100000210968_100000184730 [0,2,0,0,0,1|1,0,0]=4 11968 B13R1.470 COCC(=O)Cc1ccccc1Br 34a_100138415774_100000700504 [0,2,0,0,0,1|1,0,0]=4 11969 B13R1.470 COCC(=O)Cc1ccccc1C 1458a_100000210968_100000211839 [0,2,0,0,0,1|1,0,0]=4 11970 B13R1.470 COCC(=O)Cc1ccccc1Cl 1458a_100000210968_100000187162 [0,2,0,0,0,1|1,0,0]=4 11971 B13R1.470 COCC(=O)Cc1ccccc1F 1458a_100000210968_100000187165 [0,2,0,0,0,1|1,0,0]=4 11972 B13R1.470 COCC(=O)Cc1ccccc1I 1458a_100000210968_100011216222 [0,2,0,0,0,1|1,0,0]=4 11973 B13R1.470 COCC(=O)Nc1ccccc1Br 11a_100000210017_100000210968 [0,2,0,0,0,1|1,0,0]=4 11974 B13R1.470 COCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210968 [0,2,0,0,0,1|1,0,0]=4 11975 B13R1.470 COCC(=O)Nc1ccccc1C 11a_100015192222_100000210968 [0,2,0,0,0,1|1,0,0]=4 11976 B13R1.470 COCC(=O)Nc1ccccc1C 1626a_100015192222_100000210968 [0,2,0,0,0,1|1,0,0]=4 11977 B13R1.470 COCC(=O)Nc1ccccc1C 22a_100015192222_100000210968 [0,2,0,0,0,1|1,0,0]=4 11978 B13R1.470 COCC(=O)Nc1ccccc1C 34a_100138415774_100000183529 [0,2,0,0,0,1|1,0,0]=4 11979 B13R1.470 COCC(=O)Nc1ccccc1C 527a_100015192222_100000210968 [0,2,0,0,0,1|1,0,0]=4 11980 B13R1.470 COCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210968 [0,2,0,0,0,1|1,0,0]=4 11981 B13R1.470 COCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210968 [0,2,0,0,0,1|1,0,0]=4 11982 B13R1.470 COCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210968 [0,2,0,0,0,1|1,0,0]=4 11983 B13R1.470 COCC(=O)Nc1ccccc1Cl 34a_100138415774_100000182448 [0,2,0,0,0,1|1,0,0]=4 11984 B13R1.470 COCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210968 [0,2,0,0,0,1|1,0,0]=4 11985 B13R1.470 COCC(=O)Nc1ccccc1F 11a_100000210422_100000210968 [0,2,0,0,0,1|1,0,0]=4 11986 B13R1.470 COCC(=O)Nc1ccccc1F 1626a_100000210422_100000210968 [0,2,0,0,0,1|1,0,0]=4 11987 B13R1.470 COCC(=O)Nc1ccccc1F 22a_100000210422_100000210968 [0,2,0,0,0,1|1,0,0]=4 11988 B13R1.470 COCC(=O)Nc1ccccc1F 34a_100138415774_100000243840 [0,2,0,0,0,1|1,0,0]=4 11989 B13R1.470 COCC(=O)Nc1ccccc1F 527a_100000210422_100000210968 [0,2,0,0,0,1|1,0,0]=4 11990 B13R1.470 COCC(=O)Nc1ccccc1I 11a_100000210053_100000210968 [0,2,0,0,0,1|1,0,0]=4 11991 B13R1.470 COCC(=O)Nc1ccccc1I 1626a_100000210053_100000210968 [0,2,0,0,0,1|1,0,0]=4 11992 B13R1.470 COCC(=O)Nc1ccccc1I 34a_100138415774_100000180142 [0,2,0,0,0,1|1,0,0]=4 11993 B13R1.470 COCC(=O)Nc1ccccc1O 22a_100000185747_100000210968 [0,2,0,0,0,1|1,0,0]=4 11994 B13R1.470 COCC(=O)Nc1ccccc1O 271570a_203496583355_200000158336 [0,2,0,0,0,1|1,0,0]=4 11995 B13R1.470 COCC(=O)Nc1ccccc1O 527a_100000185747_100000210968 [0,2,0,0,0,1|1,0,0]=4 11996 B13R1.470 CSCC(=O)Cc1ccccc1Br 1458a_100000184570_100000184730 [0,2,0,0,0,1|1,0,0]=4 11997 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_100000700504_200000210301 [0,2,0,0,0,1|1,0,0]=4 11998 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_200000210301_100000700504 [0,2,0,0,0,1|1,0,0]=4 11999 B13R1.470 CSCC(=O)Cc1ccccc1C 1458a_100000184570_100000211839 [0,2,0,0,0,1|1,0,0]=4 12000 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_100011223134_200000210301 [0,2,0,0,0,1|1,0,0]=4 12001 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_200000210301_100011223134 [0,2,0,0,0,1|1,0,0]=4 12002 B13R1.470 CSCC(=O)Cc1ccccc1Cl 1458a_100000184570_100000187162 [0,2,0,0,0,1|1,0,0]=4 12003 B13R1.470 CSCC(=O)Cc1ccccc1F 1458a_100000184570_100000187165 [0,2,0,0,0,1|1,0,0]=4 12004 B13R1.470 CSCC(=O)Cc1ccccc1I 1458a_100000184570_100011216222 [0,2,0,0,0,1|1,0,0]=4 12005 B13R1.470 CSCC(=O)Nc1ccccc1Br 11a_100000210017_100000184570 [0,2,0,0,0,1|1,0,0]=4 12006 B13R1.470 CSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000184570 [0,2,0,0,0,1|1,0,0]=4 12007 B13R1.470 CSCC(=O)Nc1ccccc1Br 62a_100000182372_200000210301 [0,2,0,0,0,1|1,0,0]=4 12008 B13R1.470 CSCC(=O)Nc1ccccc1Br 62a_200000210301_100000182372 [0,2,0,0,0,1|1,0,0]=4 12009 B13R1.470 CSCC(=O)Nc1ccccc1C 11a_100015192222_100000184570 [0,2,0,0,0,1|1,0,0]=4 12010 B13R1.470 CSCC(=O)Nc1ccccc1C 1626a_100015192222_100000184570 [0,2,0,0,0,1|1,0,0]=4 12011 B13R1.470 CSCC(=O)Nc1ccccc1C 22a_100015192222_100000184570 [0,2,0,0,0,1|1,0,0]=4 12012 B13R1.470 CSCC(=O)Nc1ccccc1C 527a_100015192222_100000184570 [0,2,0,0,0,1|1,0,0]=4 12013 B13R1.470 CSCC(=O)Nc1ccccc1C 62a_200000210301_100000183529 [0,2,0,0,0,1|1,0,0]=4 12014 B13R1.470 CSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000184570 [0,2,0,0,0,1|1,0,0]=4 12015 B13R1.470 CSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000184570 [0,2,0,0,0,1|1,0,0]=4 12016 B13R1.470 CSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000184570 [0,2,0,0,0,1|1,0,0]=4 12017 B13R1.470 CSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000184570 [0,2,0,0,0,1|1,0,0]=4 12018 B13R1.470 CSCC(=O)Nc1ccccc1Cl 62a_200000210301_100000182448 [0,2,0,0,0,1|1,0,0]=4 12019 B13R1.470 CSCC(=O)Nc1ccccc1Cl 62a_200011202291_200000210301 [0,2,0,0,0,1|1,0,0]=4 12020 B13R1.470 CSCC(=O)Nc1ccccc1F 11a_100000210422_100000184570 [0,2,0,0,0,1|1,0,0]=4 12021 B13R1.470 CSCC(=O)Nc1ccccc1F 1626a_100000210422_100000184570 [0,2,0,0,0,1|1,0,0]=4 12022 B13R1.470 CSCC(=O)Nc1ccccc1F 22a_100000210422_100000184570 [0,2,0,0,0,1|1,0,0]=4 12023 B13R1.470 CSCC(=O)Nc1ccccc1F 527a_100000210422_100000184570 [0,2,0,0,0,1|1,0,0]=4 12024 B13R1.470 CSCC(=O)Nc1ccccc1F 62a_100000182988_200000210301 [0,2,0,0,0,1|1,0,0]=4 12025 B13R1.470 CSCC(=O)Nc1ccccc1F 62a_200000210301_100000182988 [0,2,0,0,0,1|1,0,0]=4 12026 B13R1.470 CSCC(=O)Nc1ccccc1I 11a_100000210053_100000184570 [0,2,0,0,0,1|1,0,0]=4 12027 B13R1.470 CSCC(=O)Nc1ccccc1I 1626a_100000210053_100000184570 [0,2,0,0,0,1|1,0,0]=4 12028 B13R1.470 CSCC(=O)Nc1ccccc1I 62a_100000180142_200000210301 [0,2,0,0,0,1|1,0,0]=4 12029 B13R1.470 CSCC(=O)Nc1ccccc1I 62a_200000210301_100000180142 [0,2,0,0,0,1|1,0,0]=4 12030 B13R1.470 CSCC(=O)Nc1ccccc1O 22a_100000185747_100000184570 [0,2,0,0,0,1|1,0,0]=4 12031 B13R1.470 CSCC(=O)Nc1ccccc1O 527a_100000185747_100000184570 [0,2,0,0,0,1|1,0,0]=4 12032 B13R1.470 CSCC(=O)Nc1ccccc1O 62a_200000210301_100000014494 [0,2,0,0,0,1|1,0,0]=4 12033 B13R1.470 Cc1ccccc1CC(=O)CCF 1458a_100000212180_100011217306 [0,2,0,0,0,1|1,0,0]=4 12034 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100000212180_100000211926 [0,2,0,0,0,1|1,0,0]=4 12035 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100011216618_100000211839 [0,2,0,0,0,1|1,0,0]=4 12036 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_100011223134_200025704644 [0,2,0,0,0,1|1,0,0]=4 12037 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_200025704644_100011223134 [0,2,0,0,0,1|1,0,0]=4 12038 B13R1.470 Cc1ccccc1NC(=O)CCO 22a_100015192222_100011216618 [0,2,0,0,0,1|1,0,0]=4 12039 B13R1.470 Cc1ccccc1NC(=O)CN[13CH3] 2230a_100015186652_200025704644 [0,2,0,0,0,1|0,0,0]=3 12040 B13R1.470 Cc1ccccc1NC(=O)CS[13CH3] 62a_200025704644_100000183529 [0,2,0,0,0,1|1,0,0]=4 12041 B13R1.470 O=C(CCF)Cc1ccccc1Br 1458a_100000751119_100011217306 [0,2,0,0,0,1|1,0,0]=4 12042 B13R1.470 O=C(CCF)Cc1ccccc1Cl 1458a_100000183793_100011217306 [0,2,0,0,0,1|1,0,0]=4 12043 B13R1.470 O=C(CCF)Cc1ccccc1F 1458a_100000212012_100011217306 [0,2,0,0,0,1|1,0,0]=4 12044 B13R1.470 O=C(CCF)Cc1ccccc1I 1458a_100000036491_100011217306 [0,2,0,0,0,1|1,0,0]=4 12045 B13R1.470 O=C(CCF)Cc1ccccc1O 1458a_100000743006_100011217306 [0,2,0,0,0,1|1,0,0]=4 12046 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100000751119_100000211926 [0,2,0,0,0,1|1,0,0]=4 12047 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100011216618_100000184730 [0,2,0,0,0,1|1,0,0]=4 12048 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100000183793_100000211926 [0,2,0,0,0,1|1,0,0]=4 12049 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100011216618_100000187162 [0,2,0,0,0,1|1,0,0]=4 12050 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100000212012_100000211926 [0,2,0,0,0,1|1,0,0]=4 12051 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100011216618_100000187165 [0,2,0,0,0,1|1,0,0]=4 12052 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100000036491_100000211926 [0,2,0,0,0,1|1,0,0]=4 12053 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100011216618_100011216222 [0,2,0,0,0,1|1,0,0]=4 12054 B13R1.470 O=C(CCO)Cc1ccccc1O 1458a_100000743006_100000211926 [0,2,0,0,0,1|1,0,0]=4 12055 B13R1.470 O=C(CCO)Nc1ccccc1Cl 22a_100000185783_100011216618 [0,2,0,0,0,1|1,0,0]=4 12056 B13R1.470 O=C(CCO)Nc1ccccc1F 22a_100000210422_100011216618 [0,2,0,0,0,1|1,0,0]=4 12057 B13R1.470 O=C(CCO)Nc1ccccc1O 22a_100000185747_100011216618 [0,2,0,0,0,1|1,0,0]=4 12058 B13R1.470 [13CH3]NCC(=O)Nc1ccccc1Br 2230a_100000683505_200025704644 [0,2,0,0,0,1|0,0,0]=3 12059 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_100000700504_200025704644 [0,2,0,0,0,1|1,0,0]=4 12060 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_200025704644_100000700504 [0,2,0,0,0,1|1,0,0]=4 12061 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Br 62a_100000182372_200025704644 [0,2,0,0,0,1|1,0,0]=4 12062 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Br 62a_200025704644_100000182372 [0,2,0,0,0,1|1,0,0]=4 12063 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Cl 62a_200011202291_200025704644 [0,2,0,0,0,1|1,0,0]=4 12064 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1Cl 62a_200025704644_100000182448 [0,2,0,0,0,1|1,0,0]=4 12065 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1F 62a_100000182988_200025704644 [0,2,0,0,0,1|1,0,0]=4 12066 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1F 62a_200025704644_100000182988 [0,2,0,0,0,1|1,0,0]=4 12067 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1I 62a_100000180142_200025704644 [0,2,0,0,0,1|1,0,0]=4 12068 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1I 62a_200025704644_100000180142 [0,2,0,0,0,1|1,0,0]=4 12069 B13R1.470 [13CH3]SCC(=O)Nc1ccccc1O 62a_200025704644_100000014494 [0,2,0,0,0,1|1,0,0]=4 12070 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 270084a_100015525214_100000211737 [0,2,0,0,0,1|1,0,0]=4 12071 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 274078a_100015525214_100000211737 [0,2,0,0,0,1|1,0,0]=4 12072 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 40a_100015525214_100000235865 [0,2,0,0,0,1|1,0,0]=4 12073 B13R1.1327 CNNS(=O)(=O)Cc1ccccc1 40a_100016993582_100000235865 [0,2,0,0,0,1|1,0,0]=4 12074 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Br 1458a_100000210414_100000755118 [0,2,0,0,0,1|1,0,0]=4 12075 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000210414_100011261388 [0,2,0,0,0,1|1,0,0]=4 12076 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000210202 [0,2,0,0,0,1|1,0,0]=4 12077 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000210414_100000684792 [0,2,0,0,0,1|1,0,0]=4 12078 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000210202 [0,2,0,0,0,1|1,0,0]=4 12079 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100000210414_100000743420 [0,2,0,0,0,1|1,0,0]=4 12080 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000210202 [0,2,0,0,0,1|1,0,0]=4 12081 B13R1.21 CCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210202 [0,2,0,0,0,1|1,0,0]=4 12082 B13R1.21 CCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210202 [0,2,0,0,0,1|1,0,0]=4 12083 B13R1.21 CCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210202 [0,2,0,0,0,1|1,0,0]=4 12084 B13R1.21 CCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210202 [0,2,0,0,0,1|1,0,0]=4 12085 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [0,2,0,0,0,1|1,0,0]=4 12086 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000210414 [0,2,0,0,0,1|1,0,0]=4 12087 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000210414 [0,2,0,0,0,1|1,0,0]=4 12088 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000210414 [0,2,0,0,0,1|1,0,0]=4 12089 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000210414 [0,2,0,0,0,1|1,0,0]=4 12090 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000210414 [0,2,0,0,0,1|1,0,0]=4 12091 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000210414 [0,2,0,0,0,1|1,0,0]=4 12092 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000210414 [0,2,0,0,0,1|1,0,0]=4 12093 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000210414 [0,2,0,0,0,1|1,0,0]=4 12094 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000210414 [0,2,0,0,0,1|1,0,0]=4 12095 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000210414 [0,2,0,0,0,1|1,0,0]=4 12096 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000210414 [0,2,0,0,0,1|1,0,0]=4 12097 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000210414 [0,2,0,0,0,1|1,0,0]=4 12098 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000210414 [0,2,0,0,0,1|1,0,0]=4 12099 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000210414 [0,2,0,0,0,1|1,0,0]=4 12100 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000210414 [0,2,0,0,0,1|1,0,0]=4 12101 B13R1.21 CCC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000210414 [0,2,0,0,0,1|1,0,0]=4 12102 B13R1.21 CCC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100000210414 [0,2,0,0,0,1|1,0,0]=4 12103 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000210202 [0,2,0,0,0,1|1,0,0]=4 12104 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210202 [0,2,0,0,0,1|1,0,0]=4 12105 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 11a_106832991635_100000751627 [0,2,0,0,0,1|0,0,0]=3 12106 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 1626a_100102657272_100000751627 [0,2,0,0,0,1|0,0,0]=3 12107 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 240690a_100102657272_100000751627 [0,2,0,0,0,1|0,0,0]=3 12108 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 527a_100102657272_100000751627 [0,2,0,0,0,1|0,0,0]=3 12109 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 11a_106832991635_100011216001 [0,2,0,0,0,1|0,0,0]=3 12110 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 1626a_100102657272_100011216001 [0,2,0,0,0,1|0,0,0]=3 12111 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 240690a_100102657272_100011216001 [0,2,0,0,0,1|0,0,0]=3 12112 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 527a_100102657272_100011216001 [0,2,0,0,0,1|0,0,0]=3 12113 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 11a_106832991635_100011435297 [0,2,0,0,0,1|0,0,0]=3 12114 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 1626a_100102657272_100011435297 [0,2,0,0,0,1|0,0,0]=3 12115 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 240690a_100102657272_100011435297 [0,2,0,0,0,1|0,0,0]=3 12116 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 527a_100102657272_100011435297 [0,2,0,0,0,1|0,0,0]=3 12117 B13R1.21 CNC(=O)C(C)c1ccc(cc1)O 240690a_100102657272_100000031422 [0,2,0,0,0,1|0,0,0]=3 12118 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 11a_106832991635_100012277543 [0,2,0,0,0,1|0,0,0]=3 12119 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 1626a_100102657272_100012277543 [0,2,0,0,0,1|0,0,0]=3 12120 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 240690a_100102657272_100012277543 [0,2,0,0,0,1|0,0,0]=3 12121 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 527a_100102657272_100012277543 [0,2,0,0,0,1|0,0,0]=3 12122 B13R1.21 CNC(=O)C(O)c1ccc(cc1)Br 240690a_100102657272_100000756554 [0,2,0,0,0,1|0,0,0]=3 12123 B13R1.21 CNC(=O)C(O)c1ccc(cc1)F 240690a_100102657272_100000209909 [0,2,0,0,0,1|0,0,0]=3 12124 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [0,2,0,0,0,1|0,0,0]=3 12125 B13R1.21 CNC(=O)N(C)c1ccc(cc1)Br 512a_106832991638_100000219623 [0,2,0,0,0,1|0,0,0]=3 12126 B13R1.21 CNC(=O)N(C)c1ccc(cc1)C 512a_106832991638_100000219977 [0,2,0,0,0,1|0,0,0]=3 12127 B13R1.21 CNC(=O)N(C)c1ccc(cc1)I 512a_100000743151_100102657272 [0,2,0,0,0,1|0,0,0]=3 12128 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100102657272_100009815954 [0,2,0,0,0,1|0,0,0]=3 12129 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100102657272_100009817493 [0,2,0,0,0,1|0,0,0]=3 12130 B13R1.21 COC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_100012339527 [0,2,0,0,0,1|1,0,0]=4 12131 B13R1.21 COC(=O)C(N)c1ccc(cc1)O 271570a_203496583355_100000747369 [0,2,0,0,0,1|1,0,0]=4 12132 B13R1.22 CCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000210202 [0,2,0,0,0,1|1,0,0]=4 12133 B13R1.22 CCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000210202 [0,2,0,0,0,1|1,0,0]=4 12134 B13R1.22 CCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000210202 [0,2,0,0,0,1|1,0,0]=4 12135 B13R1.22 CCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000210202 [0,2,0,0,0,1|1,0,0]=4 12136 B13R1.22 CCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210202 [0,2,0,0,0,1|1,0,0]=4 12137 B13R1.22 CCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210202 [0,2,0,0,0,1|1,0,0]=4 12138 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100000210414 [0,2,0,0,0,1|1,0,0]=4 12139 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100000210414 [0,2,0,0,0,1|1,0,0]=4 12140 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000210414 [0,2,0,0,0,1|1,0,0]=4 12141 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100000210414 [0,2,0,0,0,1|1,0,0]=4 12142 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 11a_100000219674_100000210414 [0,2,0,0,0,1|1,0,0]=4 12143 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100000210414 [0,2,0,0,0,1|1,0,0]=4 12144 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000210414 [0,2,0,0,0,1|1,0,0]=4 12145 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100000210414 [0,2,0,0,0,1|1,0,0]=4 12146 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100000210414 [0,2,0,0,0,1|1,0,0]=4 12147 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000210414 [0,2,0,0,0,1|1,0,0]=4 12148 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 11a_100020633736_100000210414 [0,2,0,0,0,1|1,0,0]=4 12149 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100000210414 [0,2,0,0,0,1|1,0,0]=4 12150 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000210414 [0,2,0,0,0,1|1,0,0]=4 12151 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 11a_100000221217_100000210414 [0,2,0,0,0,1|1,0,0]=4 12152 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100000210414 [0,2,0,0,0,1|1,0,0]=4 12153 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000210414 [0,2,0,0,0,1|1,0,0]=4 12154 B13R1.22 CCC(=O)N(C)c1cccc(c1)O 527a_100000756613_100000210414 [0,2,0,0,0,1|1,0,0]=4 12155 B13R1.22 CCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000210202 [0,2,0,0,0,1|1,0,0]=4 12156 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 11a_106832991635_100000722698 [0,2,0,0,0,1|0,0,0]=3 12157 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 1626a_100102657272_100000722698 [0,2,0,0,0,1|0,0,0]=3 12158 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 240690a_100102657272_100000722698 [0,2,0,0,0,1|0,0,0]=3 12159 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 527a_100102657272_100000722698 [0,2,0,0,0,1|0,0,0]=3 12160 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 11a_106832991635_100000762818 [0,2,0,0,0,1|0,0,0]=3 12161 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 1626a_100102657272_100000762818 [0,2,0,0,0,1|0,0,0]=3 12162 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 240690a_100102657272_100000762818 [0,2,0,0,0,1|0,0,0]=3 12163 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 527a_100102657272_100000762818 [0,2,0,0,0,1|0,0,0]=3 12164 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 11a_106832991635_100000762896 [0,2,0,0,0,1|0,0,0]=3 12165 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 1626a_100102657272_100000762896 [0,2,0,0,0,1|0,0,0]=3 12166 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 240690a_100102657272_100000762896 [0,2,0,0,0,1|0,0,0]=3 12167 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 527a_100102657272_100000762896 [0,2,0,0,0,1|0,0,0]=3 12168 B13R1.22 CNC(=O)C(O)c1cccc(c1)C 240690a_100102657272_100011434945 [0,2,0,0,0,1|0,0,0]=3 12169 B13R1.22 CNC(=O)C(O)c1cccc(c1)Cl 240690a_100102657272_100011216955 [0,2,0,0,0,1|0,0,0]=3 12170 B13R1.22 CNC(=O)C(O)c1cccc(c1)F 240690a_100102657272_100011434943 [0,2,0,0,0,1|0,0,0]=3 12171 B13R1.22 CNC(=O)N(C)c1cccc(c1)Br 512a_100000219648_100102657272 [0,2,0,0,0,1|0,0,0]=3 12172 B13R1.22 CNC(=O)N(C)c1cccc(c1)Br 512a_106832991638_100000219648 [0,2,0,0,0,1|0,0,0]=3 12173 B13R1.22 CNC(=O)N(C)c1cccc(c1)C 512a_100000219674_100102657272 [0,2,0,0,0,1|0,0,0]=3 12174 B13R1.22 CNC(=O)N(C)c1cccc(c1)C 512a_106832991638_100000219674 [0,2,0,0,0,1|0,0,0]=3 12175 B13R1.22 CNC(=O)N(C)c1cccc(c1)Cl 512a_100000220044_100102657272 [0,2,0,0,0,1|0,0,0]=3 12176 B13R1.22 CNC(=O)N(C)c1cccc(c1)F 512a_100020633736_100102657272 [0,2,0,0,0,1|0,0,0]=3 12177 B13R1.22 CNC(=O)N(C)c1cccc(c1)I 512a_100000221217_100102657272 [0,2,0,0,0,1|0,0,0]=3 12178 B13R1.22 CNC(=O)N(C)c1cccc(c1)I 512a_106832991638_100000221217 [0,2,0,0,0,1|0,0,0]=3 12179 B13R1.22 CNC(=O)N(C)c1cccc(c1)O 512a_100000756613_100102657272 [0,2,0,0,0,1|0,0,0]=3 12180 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 11a_106832991635_200009911544 [0,2,0,0,0,1|0,0,0]=3 12181 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 1626a_100102657272_200009911544 [0,2,0,0,0,1|0,0,0]=3 12182 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 240690a_100102657272_200009911544 [0,2,0,0,0,1|0,0,0]=3 12183 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 527a_100102657272_200009911544 [0,2,0,0,0,1|0,0,0]=3 12184 B13R1.22 COC(=O)C(=O)c1cccc(c1)O 271570a_203496583355_100000699548 [0,2,0,0,0,1|1,0,0]=4 12185 B13R1.22 COC(=O)C(C)c1cccc(c1)O 271570a_203496583355_100010077029 [0,2,0,0,0,1|1,0,0]=4 12186 B13R1.22 COC(=O)C(N)c1cccc(c1)O 271570a_203496583355_100015207118 [0,2,0,0,0,1|1,0,0]=4 12187 B13R1.152 C=C(C(=O)C(C)C)c1ccccc1 1458a_100000065200_100000210206 [0,2,0,0,0,1|1,0,0]=4 12188 B13R1.152 C=C(C(=O)N(C)C)c1ccccc1 1626a_100102631434_100000065200 [0,2,0,0,0,1|0,0,0]=3 12189 B13R1.152 C=C(C)C(=O)C(C)c1ccccc1 1458a_100000185857_100000230085 [0,2,0,0,0,1|1,0,0]=4 12190 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 11a_100000210012_100000185857 [0,2,0,0,0,1|1,0,0]=4 12191 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 1626a_100000210012_100000185857 [0,2,0,0,0,1|1,0,0]=4 12192 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 22a_100000210012_100000185857 [0,2,0,0,0,1|1,0,0]=4 12193 B13R1.152 CC(=O)C(=O)N(C)c1ccccc1 1458a_100011297159_200000210301 [0,2,0,0,0,1|1,0,0]=4 12194 B13R1.152 CC(C(=O)N(C)C)c1ccccn1 11a_100102631434_100000722050 [0,2,0,0,0,1|1,0,0]=4 12195 B13R1.152 CC(C(=O)N(C)C)c1ccccn1 1626a_100102631434_100000722050 [0,2,0,0,0,1|1,0,0]=4 12196 B13R1.152 CC(C(=O)N(C)C)c1ccccn1 240690a_100102631434_100000722050 [0,2,0,0,0,1|1,0,0]=4 12197 B13R1.152 CC(C(=O)N(C)C)c1ccccn1 527a_100102631434_100000722050 [0,2,0,0,0,1|1,0,0]=4 12198 B13R1.152 CC(C(=O)[C@@H](C)O)c1ccccc1 1458a_100000717761_100000230085 [0,2,0,0,0,1|1,0,0]=4 12199 B13R1.152 CC(C(=O)[C@H](C)O)c1ccccc1 1458a_217856618621_100000230085 [0,2,0,0,0,1|1,0,0]=4 12200 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 1458a_100000210198_100000230085 [0,2,0,0,0,1|1,0,0]=4 12201 B13R1.152 CC(C)C(=O)C(F)c1ccccc1 1458a_100000698975_100000210206 [0,2,0,0,0,1|1,0,0]=4 12202 B13R1.152 CC(C)C(=O)N(C)c1ccccc1 11a_100000210012_100000210198 [0,2,0,0,0,1|1,0,0]=4 12203 B13R1.152 CC(C)C(=O)N(C)c1ccccc1 1626a_100000210012_100000210198 [0,2,0,0,0,1|1,0,0]=4 12204 B13R1.152 CC(C)C(=O)N(C)c1ccccc1 22a_100000210012_100000210198 [0,2,0,0,0,1|1,0,0]=4 12205 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210206 [0,2,0,0,0,1|1,0,0]=4 12206 B13R1.152 CC(C)C(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210206 [0,2,0,0,0,1|1,0,0]=4 12207 B13R1.152 CC(F)C(=O)C(C)c1ccccc1 1458a_100000062450_100000230085 [0,2,0,0,0,1|1,0,0]=4 12208 B13R1.152 CC(F)C(=O)N(C)c1ccccc1 11a_100000210012_100000062450 [0,2,0,0,0,1|1,0,0]=4 12209 B13R1.152 CC(F)C(=O)N(C)c1ccccc1 1626a_100000210012_100000062450 [0,2,0,0,0,1|1,0,0]=4 12210 B13R1.152 CC(F)C(=O)N(C)c1ccccc1 22a_100000210012_100000062450 [0,2,0,0,0,1|1,0,0]=4 12211 B13R1.152 CN(C(=O)C(=O)[13CH3])c1ccccc1 1458a_100011297159_200025704644 [0,2,0,0,0,1|1,0,0]=4 12212 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 11a_100102631434_100000698975 [0,2,0,0,0,1|0,0,0]=3 12213 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 1626a_100102631434_100000698975 [0,2,0,0,0,1|0,0,0]=3 12214 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 240690a_100102631434_100000698975 [0,2,0,0,0,1|0,0,0]=3 12215 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 527a_100102631434_100000698975 [0,2,0,0,0,1|0,0,0]=3 12216 B13R1.152 CN(C)C(=O)[C@H](O)c1ccccc1 240690a_100102631434_100000684486 [0,2,0,0,0,1|0,0,0]=3 12217 B13R1.152 C[C@@H](O)C(=O)N(C)c1ccccc1 22a_100000210012_100000717761 [0,2,0,0,0,1|1,0,0]=4 12218 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 11a_100102631434_100000751047 [0,2,0,0,0,1|0,0,0]=3 12219 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 1626a_100102631434_100000751047 [0,2,0,0,0,1|0,0,0]=3 12220 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 240690a_100102631434_100000751047 [0,2,0,0,0,1|0,0,0]=3 12221 B13R1.152 C[C@H](C(=O)N(C)C)c1ccccc1 527a_100102631434_100000751047 [0,2,0,0,0,1|0,0,0]=3 12222 B13R1.152 C[C@H](O)C(=O)N(C)c1ccccc1 1626a_100000210012_217856618621 [0,2,0,0,0,1|1,0,0]=4 12223 B13R1.152 C[C@H](O)C(=O)N(C)c1ccccc1 22a_100000210012_217856618621 [0,2,0,0,0,1|1,0,0]=4 12224 B13R1.532 CCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210202 [0,2,0,0,0,1|1,0,0]=4 12225 B13R1.532 CCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000210202 [0,2,0,0,0,1|1,0,0]=4 12226 B13R1.532 CCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210414 [0,2,0,0,0,1|1,0,0]=4 12227 B13R1.532 CCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210414 [0,2,0,0,0,1|1,0,0]=4 12228 B13R1.532 CCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210414 [0,2,0,0,0,1|1,0,0]=4 12229 B13R1.532 CCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000210202 [0,2,0,0,0,1|1,0,0]=4 12230 B13R1.532 CCC(C(=O)NC)c1ccccc1 11a_106832991635_100000211302 [0,2,0,0,0,1|0,0,0]=3 12231 B13R1.532 CCC(C(=O)NC)c1ccccc1 1626a_100102657272_100000211302 [0,2,0,0,0,1|0,0,0]=3 12232 B13R1.532 CCC(C(=O)NC)c1ccccc1 240690a_100102657272_100000211302 [0,2,0,0,0,1|0,0,0]=3 12233 B13R1.532 CCC(C(=O)NC)c1ccccc1 527a_100102657272_100000211302 [0,2,0,0,0,1|0,0,0]=3 12234 B13R1.532 CNC(=O)C(CO)c1ccccc1 240690a_100102657272_100011218805 [0,2,0,0,0,1|0,0,0]=3 12235 B13R1.532 CNC(=O)C(NC)c1ccccc1 2230a_100000741928_200000210301 [0,2,0,0,0,1|0,0,0]=3 12236 B13R1.532 CNC(=O)C(NC)c1ccccc1 34a_100000741928_200000210301 [0,2,0,0,0,1|0,0,0]=3 12237 B13R1.532 CNC(=O)C(N[13CH3])c1ccccc1 2230a_100000741928_200025704644 [0,2,0,0,0,1|0,0,0]=3 12238 B13R1.532 CNC(=O)C(N[13CH3])c1ccccc1 34a_100000741928_200025704644 [0,2,0,0,0,1|0,0,0]=3 12239 B13R1.532 CNC(=O)C(OC)c1ccccc1 34a_100012026080_200000210301 [0,2,0,0,0,1|0,0,0]=3 12240 B13R1.532 CNC(=O)C(O[13CH3])c1ccccc1 34a_100012026080_200025704644 [0,2,0,0,0,1|0,0,0]=3 12241 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 11a_106832991635_100000698336 [0,2,0,0,0,1|0,0,0]=3 12242 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 1626a_100102657272_100000698336 [0,2,0,0,0,1|0,0,0]=3 12243 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 240690a_100102657272_100000698336 [0,2,0,0,0,1|0,0,0]=3 12244 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 527a_100102657272_100000698336 [0,2,0,0,0,1|0,0,0]=3 12245 B13R1.532 CNC(C(=O)OC)c1ccccc1 2230a_106832991635_100000754950 [0,2,0,0,0,1|1,0,0]=4 12246 B13R1.532 CNC(C(=O)OC)c1ccccc1 34a_100102657272_100000185205 [0,2,0,0,0,1|1,0,0]=4 12247 B13R1.532 CNC(C(=O)OC)c1ccccc1 7a_106832991635_100000754950 [0,2,0,0,0,1|1,0,0]=4 12248 B13R1.532 COC(=O)C(OC)c1ccccc1 34a_100138415774_100000185205 [0,2,0,0,0,1|1,0,0]=4 12249 B13R1.532 COC(=O)C(SC)c1ccccc1 62a_100000754950_200000210301 [0,2,0,0,0,1|1,0,0]=4 12250 B13R1.532 COC(=O)C(SC)c1ccccc1 62a_200000210301_100000754950 [0,2,0,0,0,1|1,0,0]=4 12251 B13R1.532 COC(=O)C(S[13CH3])c1ccccc1 62a_100000754950_200025704644 [0,2,0,0,0,1|1,0,0]=4 12252 B13R1.532 COC(=O)C(S[13CH3])c1ccccc1 62a_200025704644_100000754950 [0,2,0,0,0,1|1,0,0]=4 12253 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 34a_100009815907_200000210301 [0,2,0,0,0,1|1,0,0]=4 12254 B13R1.532 COC(=O)[C@H](O[13CH3])c1ccccc1 34a_100009815907_200025704644 [0,2,0,0,0,1|1,0,0]=4 12255 B13R1.532 COC(C(=O)NN)c1ccccc1 34a_100011203043_200000210301 [0,2,0,0,0,1|1,0,0]=4 12256 B13R1.532 [13CH3]OC(C(=O)NN)c1ccccc1 34a_100011203043_200025704644 [0,2,0,0,0,1|1,0,0]=4 12257 B13R1.696 CCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210202 [0,2,0,0,0,1|1,0,0]=4 12258 B13R1.696 CCC(=O)C(C)c1ccccc1Cl 1458a_100000210414_100000181259 [0,2,0,0,0,1|1,0,0]=4 12259 B13R1.696 CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210202 [0,2,0,0,0,1|1,0,0]=4 12260 B13R1.696 CCC(=O)C(C)c1ccccc1F 1458a_100000210414_200000741388 [0,2,0,0,0,1|1,0,0]=4 12261 B13R1.696 CCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210202 [0,2,0,0,0,1|1,0,0]=4 12262 B13R1.696 CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210202 [0,2,0,0,0,1|1,0,0]=4 12263 B13R1.696 CCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210202 [0,2,0,0,0,1|1,0,0]=4 12264 B13R1.696 CCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210414 [0,2,0,0,0,1|1,0,0]=4 12265 B13R1.696 CCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210414 [0,2,0,0,0,1|1,0,0]=4 12266 B13R1.696 CCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210414 [0,2,0,0,0,1|1,0,0]=4 12267 B13R1.696 CCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210414 [0,2,0,0,0,1|1,0,0]=4 12268 B13R1.696 CCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210414 [0,2,0,0,0,1|1,0,0]=4 12269 B13R1.696 CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210414 [0,2,0,0,0,1|1,0,0]=4 12270 B13R1.696 CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210414 [0,2,0,0,0,1|1,0,0]=4 12271 B13R1.696 CCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210414 [0,2,0,0,0,1|1,0,0]=4 12272 B13R1.696 CCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210414 [0,2,0,0,0,1|1,0,0]=4 12273 B13R1.696 CCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210414 [0,2,0,0,0,1|1,0,0]=4 12274 B13R1.696 CCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210414 [0,2,0,0,0,1|1,0,0]=4 12275 B13R1.696 CCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210414 [0,2,0,0,0,1|1,0,0]=4 12276 B13R1.696 CNC(=O)C(C)c1ccccc1Br 11a_106832991635_100012359601 [0,2,0,0,0,1|0,0,0]=3 12277 B13R1.696 CNC(=O)C(C)c1ccccc1Br 1626a_100102657272_100012359601 [0,2,0,0,0,1|0,0,0]=3 12278 B13R1.696 CNC(=O)C(C)c1ccccc1Br 240690a_100102657272_100012359601 [0,2,0,0,0,1|0,0,0]=3 12279 B13R1.696 CNC(=O)C(C)c1ccccc1Br 527a_100102657272_100012359601 [0,2,0,0,0,1|0,0,0]=3 12280 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 11a_106832991635_100011667492 [0,2,0,0,0,1|0,0,0]=3 12281 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 1626a_100102657272_100011667492 [0,2,0,0,0,1|0,0,0]=3 12282 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 240690a_100102657272_100011667492 [0,2,0,0,0,1|0,0,0]=3 12283 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 527a_100102657272_100011667492 [0,2,0,0,0,1|0,0,0]=3 12284 B13R1.696 CNC(=O)C(O)c1ccccc1Br 240690a_100102657272_200011356456 [0,2,0,0,0,1|0,0,0]=3 12285 B13R1.696 CNC(=O)C(O)c1ccccc1Cl 240690a_100102657272_100011217820 [0,2,0,0,0,1|0,0,0]=3 12286 B13R1.696 CNC(=O)C(O)c1ccccc1F 240690a_100102657272_100011219519 [0,2,0,0,0,1|0,0,0]=3 12287 B13R1.696 CNC(=O)N(C)c1ccccc1Br 512a_106832991638_100020606079 [0,2,0,0,0,1|0,0,0]=3 12288 B13R1.696 CNC(=O)N(C)c1ccccc1C 512a_106832991638_100000219699 [0,2,0,0,0,1|0,0,0]=3 12289 B13R1.696 CNC(=O)N(C)c1ccccc1Cl 512a_106832991638_100000219374 [0,2,0,0,0,1|0,0,0]=3 12290 B13R1.696 COC(=O)C(=O)c1ccccc1O 271570a_203496583355_200010133017 [0,2,0,0,0,1|1,0,0]=4 12291 B13R1.696 COC(=O)C(O)c1ccccc1O 271570a_203496583355_200011625927 [0,2,0,0,0,1|1,0,0]=4 12292 B13R1.708 CCC(=O)C(C)(C)c1ccccc1 1458a_100000210414_100000034625 [0,2,0,0,0,1|1,0,0]=4 12293 B13R1.708 CCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000210202 [0,2,0,0,0,1|1,0,0]=4 12294 B13R1.708 CCC(=O)C(F)(F)c1ccccc1 1458a_100000210414_100000036403 [0,2,0,0,0,1|1,0,0]=4 12295 B13R1.708 CCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000210202 [0,2,0,0,0,1|1,0,0]=4 12296 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 11a_106832991635_100000211857 [0,2,0,0,0,1|0,0,0]=3 12297 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 1626a_100102657272_100000211857 [0,2,0,0,0,1|0,0,0]=3 12298 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 240690a_100102657272_100000211857 [0,2,0,0,0,1|0,0,0]=3 12299 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 527a_100102657272_100000211857 [0,2,0,0,0,1|0,0,0]=3 12300 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 11a_106832991635_100000182030 [0,2,0,0,0,1|0,0,0]=3 12301 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 1626a_100102657272_100000182030 [0,2,0,0,0,1|0,0,0]=3 12302 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 240690a_100102657272_100000182030 [0,2,0,0,0,1|0,0,0]=3 12303 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 527a_100102657272_100000182030 [0,2,0,0,0,1|0,0,0]=3 12304 B13R1.708 CNC(=O)C(F)(F)c1ccccn1 11a_106832991635_100000690563 [0,2,0,0,0,1|1,0,0]=4 12305 B13R1.708 CNC(=O)C(F)(F)c1ccccn1 1626a_100102657272_100000690563 [0,2,0,0,0,1|1,0,0]=4 12306 B13R1.708 CNC(=O)C(F)(F)c1ccccn1 527a_100102657272_100000690563 [0,2,0,0,0,1|1,0,0]=4 12307 B13R1.708 CNC(=O)[C@](C)(O)c1ccccc1 240690a_100102657272_100000753667 [0,2,0,0,0,1|0,0,0]=3 12308 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Br 1458a_100000185857_100000189115 [0,2,0,0,0,1|1,0,0]=4 12309 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)C 1458a_100000185857_100000210814 [0,2,0,0,0,1|1,0,0]=4 12310 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000185857_100000694040 [0,2,0,0,0,1|1,0,0]=4 12311 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)F 1458a_100000185857_100000198546 [0,2,0,0,0,1|1,0,0]=4 12312 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)I 1458a_100000185857_100000189116 [0,2,0,0,0,1|1,0,0]=4 12313 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000185857 [0,2,0,0,0,1|1,0,0]=4 12314 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185857 [0,2,0,0,0,1|1,0,0]=4 12315 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185857 [0,2,0,0,0,1|1,0,0]=4 12316 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000185857 [0,2,0,0,0,1|1,0,0]=4 12317 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185857 [0,2,0,0,0,1|1,0,0]=4 12318 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000185857 [0,2,0,0,0,1|1,0,0]=4 12319 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000185857 [0,2,0,0,0,1|1,0,0]=4 12320 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185857 [0,2,0,0,0,1|1,0,0]=4 12321 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185857 [0,2,0,0,0,1|1,0,0]=4 12322 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000185857 [0,2,0,0,0,1|1,0,0]=4 12323 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185857 [0,2,0,0,0,1|1,0,0]=4 12324 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000185857 [0,2,0,0,0,1|1,0,0]=4 12325 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000185857 [0,2,0,0,0,1|1,0,0]=4 12326 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185857 [0,2,0,0,0,1|1,0,0]=4 12327 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000185857 [0,2,0,0,0,1|1,0,0]=4 12328 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000185857 [0,2,0,0,0,1|1,0,0]=4 12329 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_200000210301 [0,2,0,0,0,1|1,0,0]=4 12330 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210206 [0,2,0,0,0,1|1,0,0]=4 12331 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000210198_100000189115 [0,2,0,0,0,1|1,0,0]=4 12332 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000210198_100000694040 [0,2,0,0,0,1|1,0,0]=4 12333 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210206 [0,2,0,0,0,1|1,0,0]=4 12334 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210198_100000198546 [0,2,0,0,0,1|1,0,0]=4 12335 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210206 [0,2,0,0,0,1|1,0,0]=4 12336 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000210198_100000189116 [0,2,0,0,0,1|1,0,0]=4 12337 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210206 [0,2,0,0,0,1|1,0,0]=4 12338 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210206 [0,2,0,0,0,1|1,0,0]=4 12339 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210198 [0,2,0,0,0,1|1,0,0]=4 12340 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210198 [0,2,0,0,0,1|1,0,0]=4 12341 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210198 [0,2,0,0,0,1|1,0,0]=4 12342 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210198 [0,2,0,0,0,1|1,0,0]=4 12343 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210198 [0,2,0,0,0,1|1,0,0]=4 12344 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210198 [0,2,0,0,0,1|1,0,0]=4 12345 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210198 [0,2,0,0,0,1|1,0,0]=4 12346 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210198 [0,2,0,0,0,1|1,0,0]=4 12347 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000210198 [0,2,0,0,0,1|1,0,0]=4 12348 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210198 [0,2,0,0,0,1|1,0,0]=4 12349 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000210198 [0,2,0,0,0,1|1,0,0]=4 12350 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000210198 [0,2,0,0,0,1|1,0,0]=4 12351 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000210198 [0,2,0,0,0,1|1,0,0]=4 12352 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210198 [0,2,0,0,0,1|1,0,0]=4 12353 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000210198 [0,2,0,0,0,1|1,0,0]=4 12354 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000210198 [0,2,0,0,0,1|1,0,0]=4 12355 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000210198 [0,2,0,0,0,1|1,0,0]=4 12356 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 271570a_203496583355_200000153573 [0,2,0,0,0,1|1,0,0]=4 12357 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Br 1458a_100000062450_100000189115 [0,2,0,0,0,1|1,0,0]=4 12358 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Cl 1458a_100000062450_100000694040 [0,2,0,0,0,1|1,0,0]=4 12359 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)F 1458a_100000062450_100000198546 [0,2,0,0,0,1|1,0,0]=4 12360 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)I 1458a_100000062450_100000189116 [0,2,0,0,0,1|1,0,0]=4 12361 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000062450 [0,2,0,0,0,1|1,0,0]=4 12362 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000062450 [0,2,0,0,0,1|1,0,0]=4 12363 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000062450 [0,2,0,0,0,1|1,0,0]=4 12364 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000062450 [0,2,0,0,0,1|1,0,0]=4 12365 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000062450 [0,2,0,0,0,1|1,0,0]=4 12366 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000062450 [0,2,0,0,0,1|1,0,0]=4 12367 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000062450 [0,2,0,0,0,1|1,0,0]=4 12368 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000062450 [0,2,0,0,0,1|1,0,0]=4 12369 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000062450 [0,2,0,0,0,1|1,0,0]=4 12370 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000062450 [0,2,0,0,0,1|1,0,0]=4 12371 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000062450 [0,2,0,0,0,1|1,0,0]=4 12372 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000062450 [0,2,0,0,0,1|1,0,0]=4 12373 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000062450 [0,2,0,0,0,1|1,0,0]=4 12374 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000062450 [0,2,0,0,0,1|1,0,0]=4 12375 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000062450 [0,2,0,0,0,1|1,0,0]=4 12376 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000062450 [0,2,0,0,0,1|1,0,0]=4 12377 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000062450 [0,2,0,0,0,1|1,0,0]=4 12378 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 11a_100102631434_100000198978 [0,2,0,0,0,1|0,0,0]=3 12379 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 240690a_100102631434_100000198978 [0,2,0,0,0,1|0,0,0]=3 12380 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 527a_100102631434_100000198978 [0,2,0,0,0,1|0,0,0]=3 12381 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 11a_100102631434_100000211027 [0,2,0,0,0,1|0,0,0]=3 12382 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100102631434_100000211027 [0,2,0,0,0,1|0,0,0]=3 12383 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 527a_100102631434_100000211027 [0,2,0,0,0,1|0,0,0]=3 12384 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 11a_100102631434_100000210951 [0,2,0,0,0,1|0,0,0]=3 12385 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 1626a_100102631434_100000210951 [0,2,0,0,0,1|0,0,0]=3 12386 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 240690a_100102631434_100000210951 [0,2,0,0,0,1|0,0,0]=3 12387 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 527a_100102631434_100000210951 [0,2,0,0,0,1|0,0,0]=3 12388 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 11a_100102631434_100000688869 [0,2,0,0,0,1|0,0,0]=3 12389 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 1626a_100102631434_100000688869 [0,2,0,0,0,1|0,0,0]=3 12390 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 240690a_100102631434_100000688869 [0,2,0,0,0,1|0,0,0]=3 12391 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 527a_100102631434_100000688869 [0,2,0,0,0,1|0,0,0]=3 12392 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 1626a_100102631434_100000198540 [0,2,0,0,0,1|0,0,0]=3 12393 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 240690a_100102631434_100000198540 [0,2,0,0,0,1|0,0,0]=3 12394 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 271570a_203496583355_100000159674 [0,2,0,0,0,1|0,0,0]=3 12395 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 527a_100102631434_100000198540 [0,2,0,0,0,1|0,0,0]=3 12396 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Br 11a_100102631434_100020629044 [0,2,0,0,0,1|1,0,0]=4 12397 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Br 240690a_100102631434_100020629044 [0,2,0,0,0,1|1,0,0]=4 12398 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Cl 11a_100102631434_100000728320 [0,2,0,0,0,1|1,0,0]=4 12399 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Cl 1626a_100102631434_100000728320 [0,2,0,0,0,1|1,0,0]=4 12400 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Cl 240690a_100102631434_100000728320 [0,2,0,0,0,1|1,0,0]=4 12401 B13R1.133 CN(C)C(=O)Cc1ccc(cn1)Cl 527a_100102631434_100000728320 [0,2,0,0,0,1|1,0,0]=4 12402 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Br 11a_100102631434_100010067268 [0,2,0,0,0,1|1,0,0]=4 12403 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Br 240690a_100102631434_100010067268 [0,2,0,0,0,1|1,0,0]=4 12404 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Br 527a_100102631434_100010067268 [0,2,0,0,0,1|1,0,0]=4 12405 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Cl 11a_100102631434_100000061944 [0,2,0,0,0,1|1,0,0]=4 12406 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Cl 1626a_100102631434_100000061944 [0,2,0,0,0,1|1,0,0]=4 12407 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Cl 240690a_100102631434_100000061944 [0,2,0,0,0,1|1,0,0]=4 12408 B13R1.133 CN(C)C(=O)Cc1ccc(nc1)Cl 527a_100102631434_100000061944 [0,2,0,0,0,1|1,0,0]=4 12409 B13R1.133 CN(C)C(=O)Cn1ccc(=O)cc1 11a_100102631434_200000238563 [0,2,0,0,0,1|1,0,0]=4 12410 B13R1.133 CN(C)C(=O)Cn1ccc(=O)cc1 1626a_100102631434_200000238563 [0,2,0,0,0,1|1,0,0]=4 12411 B13R1.133 CN(C)C(=O)Cn1ccc(=O)cc1 240690a_100102631434_200000238563 [0,2,0,0,0,1|1,0,0]=4 12412 B13R1.133 CN(C)C(=O)Cn1ccc(=O)cc1 527a_100102631434_200000238563 [0,2,0,0,0,1|1,0,0]=4 12413 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102631434 [0,2,0,0,0,1|0,0,0]=3 12414 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102631434 [0,2,0,0,0,1|0,0,0]=3 12415 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)F 2430a_100000185862_100102631434 [0,2,0,0,0,1|0,0,0]=3 12416 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)I 2430a_100000185761_100102631434 [0,2,0,0,0,1|0,0,0]=3 12417 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100102631434 [0,2,0,0,0,1|0,0,0]=3 12418 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Br 1458a_100000717761_100000189115 [0,2,0,0,0,1|1,0,0]=4 12419 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_100000717761_100000694040 [0,2,0,0,0,1|1,0,0]=4 12420 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)F 1458a_100000717761_100000198546 [0,2,0,0,0,1|1,0,0]=4 12421 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)I 1458a_100000717761_100000189116 [0,2,0,0,0,1|1,0,0]=4 12422 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000717761 [0,2,0,0,0,1|1,0,0]=4 12423 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000717761 [0,2,0,0,0,1|1,0,0]=4 12424 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000717761 [0,2,0,0,0,1|1,0,0]=4 12425 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000717761 [0,2,0,0,0,1|1,0,0]=4 12426 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000717761 [0,2,0,0,0,1|1,0,0]=4 12427 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Br 1458a_217856618621_100000189115 [0,2,0,0,0,1|1,0,0]=4 12428 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_217856618621_100000694040 [0,2,0,0,0,1|1,0,0]=4 12429 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)F 1458a_217856618621_100000198546 [0,2,0,0,0,1|1,0,0]=4 12430 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)I 1458a_217856618621_100000189116 [0,2,0,0,0,1|1,0,0]=4 12431 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_217856618621 [0,2,0,0,0,1|1,0,0]=4 12432 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_217856618621 [0,2,0,0,0,1|1,0,0]=4 12433 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_217856618621 [0,2,0,0,0,1|1,0,0]=4 12434 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_217856618621 [0,2,0,0,0,1|1,0,0]=4 12435 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_217856618621 [0,2,0,0,0,1|1,0,0]=4 12436 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_217856618621 [0,2,0,0,0,1|1,0,0]=4 12437 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_217856618621 [0,2,0,0,0,1|1,0,0]=4 12438 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_217856618621 [0,2,0,0,0,1|1,0,0]=4 12439 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_217856618621 [0,2,0,0,0,1|1,0,0]=4 12440 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000210198_100000210814 [0,2,0,0,0,1|1,0,0]=4 12441 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000212244_100000210206 [0,2,0,0,0,1|1,0,0]=4 12442 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)F 1458a_100000062450_100000210814 [0,2,0,0,0,1|1,0,0]=4 12443 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 11a_100102631434_100000212244 [0,2,0,0,0,1|0,0,0]=3 12444 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 240690a_100102631434_100000212244 [0,2,0,0,0,1|0,0,0]=3 12445 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 527a_100102631434_100000212244 [0,2,0,0,0,1|0,0,0]=3 12446 B13R1.133 Cc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000210814 [0,2,0,0,0,1|1,0,0]=4 12447 B13R1.133 Cc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000210814 [0,2,0,0,0,1|1,0,0]=4 12448 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)[13CH3] 1458a_100000189662_200025704644 [0,2,0,0,0,1|1,0,0]=4 12449 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 11a_100000124888_100000210198 [0,2,0,0,0,1|1,0,0]=4 12450 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 1626a_100000124888_100000210198 [0,2,0,0,0,1|1,0,0]=4 12451 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 22a_100000124888_100000210198 [0,2,0,0,0,1|1,0,0]=4 12452 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 527a_100000124888_100000210198 [0,2,0,0,0,1|1,0,0]=4 12453 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 11a_100000124888_100000062450 [0,2,0,0,0,1|1,0,0]=4 12454 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 1626a_100000124888_100000062450 [0,2,0,0,0,1|1,0,0]=4 12455 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 22a_100000124888_100000062450 [0,2,0,0,0,1|1,0,0]=4 12456 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 527a_100000124888_100000062450 [0,2,0,0,0,1|1,0,0]=4 12457 B13R1.133 Cc1ccc(cc1)NC(=O)N(C)C 2430a_100000124888_100102631434 [0,2,0,0,0,1|0,0,0]=3 12458 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)O 22a_100000124888_100000717761 [0,2,0,0,0,1|1,0,0]=4 12459 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 1626a_100000124888_217856618621 [0,2,0,0,0,1|1,0,0]=4 12460 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 22a_100000124888_217856618621 [0,2,0,0,0,1|1,0,0]=4 12461 B13R1.133 Cc1ccc(cn1)CC(=O)N(C)C 11a_100102631434_100000740413 [0,2,0,0,0,1|1,0,0]=4 12462 B13R1.133 Cc1ccc(cn1)CC(=O)N(C)C 1626a_100102631434_100000740413 [0,2,0,0,0,1|1,0,0]=4 12463 B13R1.133 Cc1ccc(cn1)CC(=O)N(C)C 240690a_100102631434_100000740413 [0,2,0,0,0,1|1,0,0]=4 12464 B13R1.133 Cc1ccc(cn1)CC(=O)N(C)C 527a_100102631434_100000740413 [0,2,0,0,0,1|1,0,0]=4 12465 B13R1.133 Cc1ccc(nc1)CC(=O)N(C)C 11a_100102631434_100025705728 [0,2,0,0,0,1|1,0,0]=4 12466 B13R1.133 Cc1ccc(nc1)CC(=O)N(C)C 1626a_100102631434_100025705728 [0,2,0,0,0,1|1,0,0]=4 12467 B13R1.133 Cc1ccc(nc1)CC(=O)N(C)C 240690a_100102631434_100025705728 [0,2,0,0,0,1|1,0,0]=4 12468 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Br 1458a_100000185857_100000211773 [0,2,0,0,0,1|1,0,0]=4 12469 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)C 1458a_100000185857_100000211840 [0,2,0,0,0,1|1,0,0]=4 12470 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Cl 1458a_100000185857_100000181238 [0,2,0,0,0,1|1,0,0]=4 12471 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)F 1458a_100000185857_100000230114 [0,2,0,0,0,1|1,0,0]=4 12472 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)I 1458a_100000185857_100011218688 [0,2,0,0,0,1|1,0,0]=4 12473 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)O 1458a_100000185857_100011660834 [0,2,0,0,0,1|1,0,0]=4 12474 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000185857 [0,2,0,0,0,1|1,0,0]=4 12475 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185857 [0,2,0,0,0,1|1,0,0]=4 12476 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000185857 [0,2,0,0,0,1|1,0,0]=4 12477 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 11a_100000188690_100000185857 [0,2,0,0,0,1|1,0,0]=4 12478 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 1626a_100000188690_100000185857 [0,2,0,0,0,1|1,0,0]=4 12479 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 22a_100000188690_100000185857 [0,2,0,0,0,1|1,0,0]=4 12480 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000185857 [0,2,0,0,0,1|1,0,0]=4 12481 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185857 [0,2,0,0,0,1|1,0,0]=4 12482 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185857 [0,2,0,0,0,1|1,0,0]=4 12483 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 11a_100000210047_100000185857 [0,2,0,0,0,1|1,0,0]=4 12484 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000185857 [0,2,0,0,0,1|1,0,0]=4 12485 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 22a_100000210047_100000185857 [0,2,0,0,0,1|1,0,0]=4 12486 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 11a_100000211102_100000185857 [0,2,0,0,0,1|1,0,0]=4 12487 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000185857 [0,2,0,0,0,1|1,0,0]=4 12488 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 22a_100000211102_100000185857 [0,2,0,0,0,1|1,0,0]=4 12489 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000185857 [0,2,0,0,0,1|1,0,0]=4 12490 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000185857 [0,2,0,0,0,1|1,0,0]=4 12491 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200000210301 [0,2,0,0,0,1|1,0,0]=4 12492 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200000210301 [0,2,0,0,0,1|1,0,0]=4 12493 B13R1.148 CC(C)C(=O)Cc1cccc(c1)Br 1458a_100000210198_100000211773 [0,2,0,0,0,1|1,0,0]=4 12494 B13R1.148 CC(C)C(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210206 [0,2,0,0,0,1|1,0,0]=4 12495 B13R1.148 CC(C)C(=O)Cc1cccc(c1)Cl 1458a_100000210198_100000181238 [0,2,0,0,0,1|1,0,0]=4 12496 B13R1.148 CC(C)C(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210206 [0,2,0,0,0,1|1,0,0]=4 12497 B13R1.148 CC(C)C(=O)Cc1cccc(c1)F 1458a_100000210198_100000230114 [0,2,0,0,0,1|1,0,0]=4 12498 B13R1.148 CC(C)C(=O)Cc1cccc(c1)F 1458a_100000211661_100000210206 [0,2,0,0,0,1|1,0,0]=4 12499 B13R1.148 CC(C)C(=O)Cc1cccc(c1)I 1458a_100000210198_100011218688 [0,2,0,0,0,1|1,0,0]=4 12500 B13R1.148 CC(C)C(=O)Cc1cccc(c1)I 1458a_100000238430_100000210206 [0,2,0,0,0,1|1,0,0]=4 12501 B13R1.148 CC(C)C(=O)Cc1cccc(c1)O 1458a_100000210198_100011660834 [0,2,0,0,0,1|1,0,0]=4 12502 B13R1.148 CC(C)C(=O)Cc1cccc(c1)O 1458a_100000745134_100000210206 [0,2,0,0,0,1|1,0,0]=4 12503 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000210198 [0,2,0,0,0,1|1,0,0]=4 12504 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210198 [0,2,0,0,0,1|1,0,0]=4 12505 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000210198 [0,2,0,0,0,1|1,0,0]=4 12506 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Br 527a_100000210019_100000210198 [0,2,0,0,0,1|1,0,0]=4 12507 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210198 [0,2,0,0,0,1|1,0,0]=4 12508 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210198 [0,2,0,0,0,1|1,0,0]=4 12509 B13R1.148 CC(C)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210198 [0,2,0,0,0,1|1,0,0]=4 12510 B13R1.148 CC(C)C(=O)Nc1cccc(c1)F 11a_100000210047_100000210198 [0,2,0,0,0,1|1,0,0]=4 12511 B13R1.148 CC(C)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000210198 [0,2,0,0,0,1|1,0,0]=4 12512 B13R1.148 CC(C)C(=O)Nc1cccc(c1)F 22a_100000210047_100000210198 [0,2,0,0,0,1|1,0,0]=4 12513 B13R1.148 CC(C)C(=O)Nc1cccc(c1)F 527a_100000210047_100000210198 [0,2,0,0,0,1|1,0,0]=4 12514 B13R1.148 CC(C)C(=O)Nc1cccc(c1)I 11a_100000211102_100000210198 [0,2,0,0,0,1|1,0,0]=4 12515 B13R1.148 CC(C)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000210198 [0,2,0,0,0,1|1,0,0]=4 12516 B13R1.148 CC(C)C(=O)Nc1cccc(c1)I 22a_100000211102_100000210198 [0,2,0,0,0,1|1,0,0]=4 12517 B13R1.148 CC(C)C(=O)Nc1cccc(c1)I 527a_100000211102_100000210198 [0,2,0,0,0,1|1,0,0]=4 12518 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000210198 [0,2,0,0,0,1|1,0,0]=4 12519 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000210198 [0,2,0,0,0,1|1,0,0]=4 12520 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 271570a_203496583355_200000153619 [0,2,0,0,0,1|1,0,0]=4 12521 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 527a_100000210217_100000210198 [0,2,0,0,0,1|1,0,0]=4 12522 B13R1.148 CC(F)C(=O)Cc1cccc(c1)Br 1458a_100000062450_100000211773 [0,2,0,0,0,1|1,0,0]=4 12523 B13R1.148 CC(F)C(=O)Cc1cccc(c1)Cl 1458a_100000062450_100000181238 [0,2,0,0,0,1|1,0,0]=4 12524 B13R1.148 CC(F)C(=O)Cc1cccc(c1)F 1458a_100000062450_100000230114 [0,2,0,0,0,1|1,0,0]=4 12525 B13R1.148 CC(F)C(=O)Cc1cccc(c1)I 1458a_100000062450_100011218688 [0,2,0,0,0,1|1,0,0]=4 12526 B13R1.148 CC(F)C(=O)Cc1cccc(c1)O 1458a_100000062450_100011660834 [0,2,0,0,0,1|1,0,0]=4 12527 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000062450 [0,2,0,0,0,1|1,0,0]=4 12528 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000062450 [0,2,0,0,0,1|1,0,0]=4 12529 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000062450 [0,2,0,0,0,1|1,0,0]=4 12530 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Br 527a_100000210019_100000062450 [0,2,0,0,0,1|1,0,0]=4 12531 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000062450 [0,2,0,0,0,1|1,0,0]=4 12532 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000062450 [0,2,0,0,0,1|1,0,0]=4 12533 B13R1.148 CC(F)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000062450 [0,2,0,0,0,1|1,0,0]=4 12534 B13R1.148 CC(F)C(=O)Nc1cccc(c1)F 11a_100000210047_100000062450 [0,2,0,0,0,1|1,0,0]=4 12535 B13R1.148 CC(F)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000062450 [0,2,0,0,0,1|1,0,0]=4 12536 B13R1.148 CC(F)C(=O)Nc1cccc(c1)F 22a_100000210047_100000062450 [0,2,0,0,0,1|1,0,0]=4 12537 B13R1.148 CC(F)C(=O)Nc1cccc(c1)F 527a_100000210047_100000062450 [0,2,0,0,0,1|1,0,0]=4 12538 B13R1.148 CC(F)C(=O)Nc1cccc(c1)I 11a_100000211102_100000062450 [0,2,0,0,0,1|1,0,0]=4 12539 B13R1.148 CC(F)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000062450 [0,2,0,0,0,1|1,0,0]=4 12540 B13R1.148 CC(F)C(=O)Nc1cccc(c1)I 22a_100000211102_100000062450 [0,2,0,0,0,1|1,0,0]=4 12541 B13R1.148 CC(F)C(=O)Nc1cccc(c1)I 527a_100000211102_100000062450 [0,2,0,0,0,1|1,0,0]=4 12542 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000062450 [0,2,0,0,0,1|1,0,0]=4 12543 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 22a_100000210217_100000062450 [0,2,0,0,0,1|1,0,0]=4 12544 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 527a_100000210217_100000062450 [0,2,0,0,0,1|1,0,0]=4 12545 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Br 11a_100102631434_100000747190 [0,2,0,0,0,1|0,0,0]=3 12546 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Br 240690a_100102631434_100000747190 [0,2,0,0,0,1|0,0,0]=3 12547 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Br 527a_100102631434_100000747190 [0,2,0,0,0,1|0,0,0]=3 12548 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Cl 11a_100102631434_100000749307 [0,2,0,0,0,1|0,0,0]=3 12549 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Cl 1626a_100102631434_100000749307 [0,2,0,0,0,1|0,0,0]=3 12550 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Cl 240690a_100102631434_100000749307 [0,2,0,0,0,1|0,0,0]=3 12551 B13R1.148 CN(C)C(=O)Cc1cccc(c1)Cl 527a_100102631434_100000749307 [0,2,0,0,0,1|0,0,0]=3 12552 B13R1.148 CN(C)C(=O)Cc1cccc(c1)F 11a_100102631434_100000211661 [0,2,0,0,0,1|0,0,0]=3 12553 B13R1.148 CN(C)C(=O)Cc1cccc(c1)F 1626a_100102631434_100000211661 [0,2,0,0,0,1|0,0,0]=3 12554 B13R1.148 CN(C)C(=O)Cc1cccc(c1)F 240690a_100102631434_100000211661 [0,2,0,0,0,1|0,0,0]=3 12555 B13R1.148 CN(C)C(=O)Cc1cccc(c1)F 527a_100102631434_100000211661 [0,2,0,0,0,1|0,0,0]=3 12556 B13R1.148 CN(C)C(=O)Cc1cccc(c1)I 11a_100102631434_100000238430 [0,2,0,0,0,1|0,0,0]=3 12557 B13R1.148 CN(C)C(=O)Cc1cccc(c1)I 1626a_100102631434_100000238430 [0,2,0,0,0,1|0,0,0]=3 12558 B13R1.148 CN(C)C(=O)Cc1cccc(c1)I 240690a_100102631434_100000238430 [0,2,0,0,0,1|0,0,0]=3 12559 B13R1.148 CN(C)C(=O)Cc1cccc(c1)I 527a_100102631434_100000238430 [0,2,0,0,0,1|0,0,0]=3 12560 B13R1.148 CN(C)C(=O)Cc1cccc(c1)O 240690a_100102631434_100000745134 [0,2,0,0,0,1|0,0,0]=3 12561 B13R1.148 CN(C)C(=O)Cc1cccc(c1)O 527a_100102631434_100000745134 [0,2,0,0,0,1|0,0,0]=3 12562 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Br 11a_100102631434_100010201708 [0,2,0,0,0,1|1,0,0]=4 12563 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Br 240690a_100102631434_100010201708 [0,2,0,0,0,1|1,0,0]=4 12564 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Br 527a_100102631434_100010201708 [0,2,0,0,0,1|1,0,0]=4 12565 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Cl 11a_100102631434_100000090259 [0,2,0,0,0,1|1,0,0]=4 12566 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Cl 1626a_100102631434_100000090259 [0,2,0,0,0,1|1,0,0]=4 12567 B13R1.148 CN(C)C(=O)Cc1cccc(n1)Cl 240690a_100102631434_100000090259 [0,2,0,0,0,1|1,0,0]=4 12568 B13R1.148 CN(C)C(=O)Cc1cccc(n1)F 11a_100102631434_100000096803 [0,2,0,0,0,1|1,0,0]=4 12569 B13R1.148 CN(C)C(=O)Cc1cccc(n1)F 1626a_100102631434_100000096803 [0,2,0,0,0,1|1,0,0]=4 12570 B13R1.148 CN(C)C(=O)Cc1cccc(n1)F 240690a_100102631434_100000096803 [0,2,0,0,0,1|1,0,0]=4 12571 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Br 11a_100102631434_100010126891 [0,2,0,0,0,1|1,0,0]=4 12572 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Br 240690a_100102631434_100010126891 [0,2,0,0,0,1|1,0,0]=4 12573 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Br 527a_100102631434_100010126891 [0,2,0,0,0,1|1,0,0]=4 12574 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Cl 11a_100102631434_100000085289 [0,2,0,0,0,1|1,0,0]=4 12575 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Cl 1626a_100102631434_100000085289 [0,2,0,0,0,1|1,0,0]=4 12576 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Cl 240690a_100102631434_100000085289 [0,2,0,0,0,1|1,0,0]=4 12577 B13R1.148 CN(C)C(=O)Cc1ccnc(c1)Cl 527a_100102631434_100000085289 [0,2,0,0,0,1|1,0,0]=4 12578 B13R1.148 CN(C)C(=O)Cc1cncc(c1)Br 11a_100102631434_100000239331 [0,2,0,0,0,1|1,0,0]=4 12579 B13R1.148 CN(C)C(=O)Cc1cncc(c1)Br 240690a_100102631434_100000239331 [0,2,0,0,0,1|1,0,0]=4 12580 B13R1.148 CN(C)C(=O)Cc1cncc(c1)Br 527a_100102631434_100000239331 [0,2,0,0,0,1|1,0,0]=4 12581 B13R1.148 CN(C)C(=O)Cc1cncc(c1)F 11a_100102631434_100011667516 [0,2,0,0,0,1|1,0,0]=4 12582 B13R1.148 CN(C)C(=O)Cc1cncc(c1)F 240690a_100102631434_100011667516 [0,2,0,0,0,1|1,0,0]=4 12583 B13R1.148 CN(C)C(=O)Cc1cncc(c1)F 527a_100102631434_100011667516 [0,2,0,0,0,1|1,0,0]=4 12584 B13R1.148 CN(C)C(=O)Nc1cccc(c1)Br 2430a_100000210019_100102631434 [0,2,0,0,0,1|0,0,0]=3 12585 B13R1.148 CN(C)C(=O)Nc1cccc(c1)Cl 2430a_100000185859_100102631434 [0,2,0,0,0,1|0,0,0]=3 12586 B13R1.148 CN(C)C(=O)Nc1cccc(c1)F 2430a_100000210047_100102631434 [0,2,0,0,0,1|0,0,0]=3 12587 B13R1.148 CN(C)C(=O)Nc1cccc(c1)I 2430a_100000211102_100102631434 [0,2,0,0,0,1|0,0,0]=3 12588 B13R1.148 CN(C)C(=O)Nc1cccc(c1)O 2430a_100000210217_100102631434 [0,2,0,0,0,1|0,0,0]=3 12589 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)Br 1458a_100000717761_100000211773 [0,2,0,0,0,1|1,0,0]=4 12590 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)Cl 1458a_100000717761_100000181238 [0,2,0,0,0,1|1,0,0]=4 12591 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)F 1458a_100000717761_100000230114 [0,2,0,0,0,1|1,0,0]=4 12592 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)I 1458a_100000717761_100011218688 [0,2,0,0,0,1|1,0,0]=4 12593 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)O 1458a_100000717761_100011660834 [0,2,0,0,0,1|1,0,0]=4 12594 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000717761 [0,2,0,0,0,1|1,0,0]=4 12595 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000717761 [0,2,0,0,0,1|1,0,0]=4 12596 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)F 22a_100000210047_100000717761 [0,2,0,0,0,1|1,0,0]=4 12597 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)I 22a_100000211102_100000717761 [0,2,0,0,0,1|1,0,0]=4 12598 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)O 22a_100000210217_100000717761 [0,2,0,0,0,1|1,0,0]=4 12599 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)Br 1458a_217856618621_100000211773 [0,2,0,0,0,1|1,0,0]=4 12600 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)Cl 1458a_217856618621_100000181238 [0,2,0,0,0,1|1,0,0]=4 12601 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)F 1458a_217856618621_100000230114 [0,2,0,0,0,1|1,0,0]=4 12602 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)I 1458a_217856618621_100011218688 [0,2,0,0,0,1|1,0,0]=4 12603 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)O 1458a_217856618621_100011660834 [0,2,0,0,0,1|1,0,0]=4 12604 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)Br 1626a_100000210019_217856618621 [0,2,0,0,0,1|1,0,0]=4 12605 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)Br 22a_100000210019_217856618621 [0,2,0,0,0,1|1,0,0]=4 12606 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_217856618621 [0,2,0,0,0,1|1,0,0]=4 12607 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_217856618621 [0,2,0,0,0,1|1,0,0]=4 12608 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)F 1626a_100000210047_217856618621 [0,2,0,0,0,1|1,0,0]=4 12609 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)F 22a_100000210047_217856618621 [0,2,0,0,0,1|1,0,0]=4 12610 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)I 1626a_100000211102_217856618621 [0,2,0,0,0,1|1,0,0]=4 12611 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)I 22a_100000211102_217856618621 [0,2,0,0,0,1|1,0,0]=4 12612 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)O 1626a_100000210217_217856618621 [0,2,0,0,0,1|1,0,0]=4 12613 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)O 22a_100000210217_217856618621 [0,2,0,0,0,1|1,0,0]=4 12614 B13R1.148 Cc1cccc(c1)CC(=O)C(C)C 1458a_100000210198_100000211840 [0,2,0,0,0,1|1,0,0]=4 12615 B13R1.148 Cc1cccc(c1)CC(=O)C(C)C 1458a_100011206899_100000210206 [0,2,0,0,0,1|1,0,0]=4 12616 B13R1.148 Cc1cccc(c1)CC(=O)C(C)F 1458a_100000062450_100000211840 [0,2,0,0,0,1|1,0,0]=4 12617 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C 11a_100102631434_100011206899 [0,2,0,0,0,1|0,0,0]=3 12618 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C 1626a_100102631434_100011206899 [0,2,0,0,0,1|0,0,0]=3 12619 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C 240690a_100102631434_100011206899 [0,2,0,0,0,1|0,0,0]=3 12620 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C 527a_100102631434_100011206899 [0,2,0,0,0,1|0,0,0]=3 12621 B13R1.148 Cc1cccc(c1)CC(=O)[C@@H](C)O 1458a_100000717761_100000211840 [0,2,0,0,0,1|1,0,0]=4 12622 B13R1.148 Cc1cccc(c1)CC(=O)[C@H](C)O 1458a_217856618621_100000211840 [0,2,0,0,0,1|1,0,0]=4 12623 B13R1.148 Cc1cccc(c1)NC(=O)C(C)C 11a_100000188690_100000210198 [0,2,0,0,0,1|1,0,0]=4 12624 B13R1.148 Cc1cccc(c1)NC(=O)C(C)C 1626a_100000188690_100000210198 [0,2,0,0,0,1|1,0,0]=4 12625 B13R1.148 Cc1cccc(c1)NC(=O)C(C)C 22a_100000188690_100000210198 [0,2,0,0,0,1|1,0,0]=4 12626 B13R1.148 Cc1cccc(c1)NC(=O)C(C)C 527a_100000188690_100000210198 [0,2,0,0,0,1|1,0,0]=4 12627 B13R1.148 Cc1cccc(c1)NC(=O)C(C)F 11a_100000188690_100000062450 [0,2,0,0,0,1|1,0,0]=4 12628 B13R1.148 Cc1cccc(c1)NC(=O)C(C)F 1626a_100000188690_100000062450 [0,2,0,0,0,1|1,0,0]=4 12629 B13R1.148 Cc1cccc(c1)NC(=O)C(C)F 22a_100000188690_100000062450 [0,2,0,0,0,1|1,0,0]=4 12630 B13R1.148 Cc1cccc(c1)NC(=O)C(C)F 527a_100000188690_100000062450 [0,2,0,0,0,1|1,0,0]=4 12631 B13R1.148 Cc1cccc(c1)NC(=O)N(C)C 2430a_100000188690_100102631434 [0,2,0,0,0,1|0,0,0]=3 12632 B13R1.148 Cc1cccc(c1)NC(=O)[C@@H](C)O 22a_100000188690_100000717761 [0,2,0,0,0,1|1,0,0]=4 12633 B13R1.148 Cc1cccc(c1)NC(=O)[C@H](C)O 1626a_100000188690_217856618621 [0,2,0,0,0,1|1,0,0]=4 12634 B13R1.148 Cc1cccc(c1)NC(=O)[C@H](C)O 22a_100000188690_217856618621 [0,2,0,0,0,1|1,0,0]=4 12635 B13R1.148 Cc1cccc(n1)CC(=O)N(C)C 11a_100102631434_100012001110 [0,2,0,0,0,1|1,0,0]=4 12636 B13R1.148 Cc1cccc(n1)CC(=O)N(C)C 1626a_100102631434_100012001110 [0,2,0,0,0,1|1,0,0]=4 12637 B13R1.148 Cc1cccc(n1)CC(=O)N(C)C 240690a_100102631434_100012001110 [0,2,0,0,0,1|1,0,0]=4 12638 B13R1.148 Cc1cccc(n1)CC(=O)N(C)C 527a_100102631434_100012001110 [0,2,0,0,0,1|1,0,0]=4 12639 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200025704644 [0,2,0,0,0,1|1,0,0]=4 12640 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200025704644 [0,2,0,0,0,1|1,0,0]=4 12641 B13R1.202 C=C(C)C(=O)Cc1ccccc1Br 1458a_100000185857_100000184730 [0,2,0,0,0,1|1,0,0]=4 12642 B13R1.202 C=C(C)C(=O)Cc1ccccc1C 1458a_100000185857_100000211839 [0,2,0,0,0,1|1,0,0]=4 12643 B13R1.202 C=C(C)C(=O)Cc1ccccc1Cl 1458a_100000185857_100000187162 [0,2,0,0,0,1|1,0,0]=4 12644 B13R1.202 C=C(C)C(=O)Cc1ccccc1F 1458a_100000185857_100000187165 [0,2,0,0,0,1|1,0,0]=4 12645 B13R1.202 C=C(C)C(=O)Cc1ccccc1I 1458a_100000185857_100011216222 [0,2,0,0,0,1|1,0,0]=4 12646 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000185857 [0,2,0,0,0,1|1,0,0]=4 12647 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000185857 [0,2,0,0,0,1|1,0,0]=4 12648 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 11a_100015192222_100000185857 [0,2,0,0,0,1|1,0,0]=4 12649 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 1626a_100015192222_100000185857 [0,2,0,0,0,1|1,0,0]=4 12650 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 22a_100015192222_100000185857 [0,2,0,0,0,1|1,0,0]=4 12651 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000185857 [0,2,0,0,0,1|1,0,0]=4 12652 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000185857 [0,2,0,0,0,1|1,0,0]=4 12653 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000185857 [0,2,0,0,0,1|1,0,0]=4 12654 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 11a_100000210422_100000185857 [0,2,0,0,0,1|1,0,0]=4 12655 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000185857 [0,2,0,0,0,1|1,0,0]=4 12656 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 22a_100000210422_100000185857 [0,2,0,0,0,1|1,0,0]=4 12657 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 11a_100000210053_100000185857 [0,2,0,0,0,1|1,0,0]=4 12658 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000185857 [0,2,0,0,0,1|1,0,0]=4 12659 B13R1.202 C=C(C)C(=O)Nc1ccccc1O 22a_100000185747_100000185857 [0,2,0,0,0,1|1,0,0]=4 12660 B13R1.202 CC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_200000210301 [0,2,0,0,0,1|1,0,0]=4 12661 B13R1.202 CC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200000210301 [0,2,0,0,0,1|1,0,0]=4 12662 B13R1.202 CC(C)C(=O)Cc1ccccc1Br 1458a_100000210198_100000184730 [0,2,0,0,0,1|1,0,0]=4 12663 B13R1.202 CC(C)C(=O)Cc1ccccc1Br 1458a_100000751119_100000210206 [0,2,0,0,0,1|1,0,0]=4 12664 B13R1.202 CC(C)C(=O)Cc1ccccc1Cl 1458a_100000183793_100000210206 [0,2,0,0,0,1|1,0,0]=4 12665 B13R1.202 CC(C)C(=O)Cc1ccccc1Cl 1458a_100000210198_100000187162 [0,2,0,0,0,1|1,0,0]=4 12666 B13R1.202 CC(C)C(=O)Cc1ccccc1F 1458a_100000210198_100000187165 [0,2,0,0,0,1|1,0,0]=4 12667 B13R1.202 CC(C)C(=O)Cc1ccccc1F 1458a_100000212012_100000210206 [0,2,0,0,0,1|1,0,0]=4 12668 B13R1.202 CC(C)C(=O)Cc1ccccc1I 1458a_100000036491_100000210206 [0,2,0,0,0,1|1,0,0]=4 12669 B13R1.202 CC(C)C(=O)Cc1ccccc1I 1458a_100000210198_100011216222 [0,2,0,0,0,1|1,0,0]=4 12670 B13R1.202 CC(C)C(=O)Cc1ccccc1O 1458a_100000743006_100000210206 [0,2,0,0,0,1|1,0,0]=4 12671 B13R1.202 CC(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000210198 [0,2,0,0,0,1|1,0,0]=4 12672 B13R1.202 CC(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000210198 [0,2,0,0,0,1|1,0,0]=4 12673 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000210198 [0,2,0,0,0,1|1,0,0]=4 12674 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000210198 [0,2,0,0,0,1|1,0,0]=4 12675 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000210198 [0,2,0,0,0,1|1,0,0]=4 12676 B13R1.202 CC(C)C(=O)Nc1ccccc1Cl 527a_100000185783_100000210198 [0,2,0,0,0,1|1,0,0]=4 12677 B13R1.202 CC(C)C(=O)Nc1ccccc1F 11a_100000210422_100000210198 [0,2,0,0,0,1|1,0,0]=4 12678 B13R1.202 CC(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000210198 [0,2,0,0,0,1|1,0,0]=4 12679 B13R1.202 CC(C)C(=O)Nc1ccccc1F 22a_100000210422_100000210198 [0,2,0,0,0,1|1,0,0]=4 12680 B13R1.202 CC(C)C(=O)Nc1ccccc1F 527a_100000210422_100000210198 [0,2,0,0,0,1|1,0,0]=4 12681 B13R1.202 CC(C)C(=O)Nc1ccccc1I 11a_100000210053_100000210198 [0,2,0,0,0,1|1,0,0]=4 12682 B13R1.202 CC(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000210198 [0,2,0,0,0,1|1,0,0]=4 12683 B13R1.202 CC(C)C(=O)Nc1ccccc1O 22a_100000185747_100000210198 [0,2,0,0,0,1|1,0,0]=4 12684 B13R1.202 CC(C)C(=O)Nc1ccccc1O 527a_100000185747_100000210198 [0,2,0,0,0,1|1,0,0]=4 12685 B13R1.202 CC(F)C(=O)Cc1ccccc1Br 1458a_100000062450_100000184730 [0,2,0,0,0,1|1,0,0]=4 12686 B13R1.202 CC(F)C(=O)Cc1ccccc1Cl 1458a_100000062450_100000187162 [0,2,0,0,0,1|1,0,0]=4 12687 B13R1.202 CC(F)C(=O)Cc1ccccc1F 1458a_100000062450_100000187165 [0,2,0,0,0,1|1,0,0]=4 12688 B13R1.202 CC(F)C(=O)Cc1ccccc1I 1458a_100000062450_100011216222 [0,2,0,0,0,1|1,0,0]=4 12689 B13R1.202 CC(F)C(=O)Nc1ccccc1Br 11a_100000210017_100000062450 [0,2,0,0,0,1|1,0,0]=4 12690 B13R1.202 CC(F)C(=O)Nc1ccccc1Br 1626a_100000210017_100000062450 [0,2,0,0,0,1|1,0,0]=4 12691 B13R1.202 CC(F)C(=O)Nc1ccccc1Cl 11a_100000185783_100000062450 [0,2,0,0,0,1|1,0,0]=4 12692 B13R1.202 CC(F)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000062450 [0,2,0,0,0,1|1,0,0]=4 12693 B13R1.202 CC(F)C(=O)Nc1ccccc1Cl 22a_100000185783_100000062450 [0,2,0,0,0,1|1,0,0]=4 12694 B13R1.202 CC(F)C(=O)Nc1ccccc1Cl 527a_100000185783_100000062450 [0,2,0,0,0,1|1,0,0]=4 12695 B13R1.202 CC(F)C(=O)Nc1ccccc1F 11a_100000210422_100000062450 [0,2,0,0,0,1|1,0,0]=4 12696 B13R1.202 CC(F)C(=O)Nc1ccccc1F 1626a_100000210422_100000062450 [0,2,0,0,0,1|1,0,0]=4 12697 B13R1.202 CC(F)C(=O)Nc1ccccc1F 22a_100000210422_100000062450 [0,2,0,0,0,1|1,0,0]=4 12698 B13R1.202 CC(F)C(=O)Nc1ccccc1F 527a_100000210422_100000062450 [0,2,0,0,0,1|1,0,0]=4 12699 B13R1.202 CC(F)C(=O)Nc1ccccc1I 11a_100000210053_100000062450 [0,2,0,0,0,1|1,0,0]=4 12700 B13R1.202 CC(F)C(=O)Nc1ccccc1I 1626a_100000210053_100000062450 [0,2,0,0,0,1|1,0,0]=4 12701 B13R1.202 CC(F)C(=O)Nc1ccccc1O 22a_100000185747_100000062450 [0,2,0,0,0,1|1,0,0]=4 12702 B13R1.202 CC(F)C(=O)Nc1ccccc1O 527a_100000185747_100000062450 [0,2,0,0,0,1|1,0,0]=4 12703 B13R1.202 CN(C)C(=O)Cc1ccccc1Br 11a_100102631434_100000751119 [0,2,0,0,0,1|0,0,0]=3 12704 B13R1.202 CN(C)C(=O)Cc1ccccc1Br 240690a_100102631434_100000751119 [0,2,0,0,0,1|0,0,0]=3 12705 B13R1.202 CN(C)C(=O)Cc1ccccc1Br 527a_100102631434_100000751119 [0,2,0,0,0,1|0,0,0]=3 12706 B13R1.202 CN(C)C(=O)Cc1ccccc1Cl 11a_100102631434_100000183793 [0,2,0,0,0,1|0,0,0]=3 12707 B13R1.202 CN(C)C(=O)Cc1ccccc1Cl 1626a_100102631434_100000183793 [0,2,0,0,0,1|0,0,0]=3 12708 B13R1.202 CN(C)C(=O)Cc1ccccc1Cl 240690a_100102631434_100000183793 [0,2,0,0,0,1|0,0,0]=3 12709 B13R1.202 CN(C)C(=O)Cc1ccccc1Cl 527a_100102631434_100000183793 [0,2,0,0,0,1|0,0,0]=3 12710 B13R1.202 CN(C)C(=O)Cc1ccccc1F 11a_100102631434_100000212012 [0,2,0,0,0,1|0,0,0]=3 12711 B13R1.202 CN(C)C(=O)Cc1ccccc1F 1626a_100102631434_100000212012 [0,2,0,0,0,1|0,0,0]=3 12712 B13R1.202 CN(C)C(=O)Cc1ccccc1F 240690a_100102631434_100000212012 [0,2,0,0,0,1|0,0,0]=3 12713 B13R1.202 CN(C)C(=O)Cc1ccccc1F 527a_100102631434_100000212012 [0,2,0,0,0,1|0,0,0]=3 12714 B13R1.202 CN(C)C(=O)Cc1ccccc1I 11a_100102631434_100000036491 [0,2,0,0,0,1|0,0,0]=3 12715 B13R1.202 CN(C)C(=O)Cc1ccccc1I 1626a_100102631434_100000036491 [0,2,0,0,0,1|0,0,0]=3 12716 B13R1.202 CN(C)C(=O)Cc1ccccc1I 240690a_100102631434_100000036491 [0,2,0,0,0,1|0,0,0]=3 12717 B13R1.202 CN(C)C(=O)Cc1ccccc1I 527a_100102631434_100000036491 [0,2,0,0,0,1|0,0,0]=3 12718 B13R1.202 CN(C)C(=O)Cc1ccccc1O 240690a_100102631434_100000743006 [0,2,0,0,0,1|0,0,0]=3 12719 B13R1.202 CN(C)C(=O)Cc1ccccc1O 271570a_203496583355_200009816159 [0,2,0,0,0,1|0,0,0]=3 12720 B13R1.202 CN(C)C(=O)Cc1ccccc1O 527a_100102631434_100000743006 [0,2,0,0,0,1|0,0,0]=3 12721 B13R1.202 CN(C)C(=O)Cc1cccnc1Cl 11a_100102631434_100000093521 [0,2,0,0,0,1|1,0,0]=4 12722 B13R1.202 CN(C)C(=O)Cc1cccnc1Cl 1626a_100102631434_100000093521 [0,2,0,0,0,1|1,0,0]=4 12723 B13R1.202 CN(C)C(=O)Cc1cccnc1Cl 240690a_100102631434_100000093521 [0,2,0,0,0,1|1,0,0]=4 12724 B13R1.202 CN(C)C(=O)Cc1cccnc1Cl 527a_100102631434_100000093521 [0,2,0,0,0,1|1,0,0]=4 12725 B13R1.202 CN(C)C(=O)Cc1ncccc1Br 11a_100102631434_200012357574 [0,2,0,0,0,1|1,0,0]=4 12726 B13R1.202 CN(C)C(=O)Cc1ncccc1Br 240690a_100102631434_200012357574 [0,2,0,0,0,1|1,0,0]=4 12727 B13R1.202 CN(C)C(=O)Cc1ncccc1Cl 11a_100102631434_100011998755 [0,2,0,0,0,1|1,0,0]=4 12728 B13R1.202 CN(C)C(=O)Cc1ncccc1Cl 240690a_100102631434_100011998755 [0,2,0,0,0,1|1,0,0]=4 12729 B13R1.202 CN(C)C(=O)Cc1ncccc1Cl 527a_100102631434_100011998755 [0,2,0,0,0,1|1,0,0]=4 12730 B13R1.202 CN(C)C(=O)Cn1ccccc1=O 1626a_100102631434_100000189665 [0,2,0,0,0,1|1,0,0]=4 12731 B13R1.202 CN(C)C(=O)Cn1ccccc1=O 240690a_100102631434_100000189665 [0,2,0,0,0,1|1,0,0]=4 12732 B13R1.202 CN(C)C(=O)Cn1ccccc1=O 527a_100102631434_100000189665 [0,2,0,0,0,1|1,0,0]=4 12733 B13R1.202 CN(C)C(=O)Nc1ccccc1Br 2430a_100000210017_100102631434 [0,2,0,0,0,1|0,0,0]=3 12734 B13R1.202 CN(C)C(=O)Nc1ccccc1Cl 2430a_100000185783_100102631434 [0,2,0,0,0,1|0,0,0]=3 12735 B13R1.202 CN(C)C(=O)Nc1ccccc1F 2430a_100000210422_100102631434 [0,2,0,0,0,1|0,0,0]=3 12736 B13R1.202 CN(C)C(=O)Nc1ccccc1I 2430a_100000210053_100102631434 [0,2,0,0,0,1|0,0,0]=3 12737 B13R1.202 CN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100102631434 [0,2,0,0,0,1|0,0,0]=3 12738 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1Br 1458a_100000717761_100000184730 [0,2,0,0,0,1|1,0,0]=4 12739 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1Cl 1458a_100000717761_100000187162 [0,2,0,0,0,1|1,0,0]=4 12740 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1F 1458a_100000717761_100000187165 [0,2,0,0,0,1|1,0,0]=4 12741 B13R1.202 C[C@@H](O)C(=O)Cc1ccccc1I 1458a_100000717761_100011216222 [0,2,0,0,0,1|1,0,0]=4 12742 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Cl 22a_100000185783_100000717761 [0,2,0,0,0,1|1,0,0]=4 12743 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1F 22a_100000210422_100000717761 [0,2,0,0,0,1|1,0,0]=4 12744 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1O 22a_100000185747_100000717761 [0,2,0,0,0,1|1,0,0]=4 12745 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1Br 1458a_217856618621_100000184730 [0,2,0,0,0,1|1,0,0]=4 12746 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1Cl 1458a_217856618621_100000187162 [0,2,0,0,0,1|1,0,0]=4 12747 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1F 1458a_217856618621_100000187165 [0,2,0,0,0,1|1,0,0]=4 12748 B13R1.202 C[C@H](O)C(=O)Cc1ccccc1I 1458a_217856618621_100011216222 [0,2,0,0,0,1|1,0,0]=4 12749 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1Br 1626a_100000210017_217856618621 [0,2,0,0,0,1|1,0,0]=4 12750 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1Cl 1626a_100000185783_217856618621 [0,2,0,0,0,1|1,0,0]=4 12751 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1Cl 22a_100000185783_217856618621 [0,2,0,0,0,1|1,0,0]=4 12752 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1F 1626a_100000210422_217856618621 [0,2,0,0,0,1|1,0,0]=4 12753 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1F 22a_100000210422_217856618621 [0,2,0,0,0,1|1,0,0]=4 12754 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1I 1626a_100000210053_217856618621 [0,2,0,0,0,1|1,0,0]=4 12755 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1O 22a_100000185747_217856618621 [0,2,0,0,0,1|1,0,0]=4 12756 B13R1.202 Cc1ccccc1CC(=O)C(C)C 1458a_100000210198_100000211839 [0,2,0,0,0,1|1,0,0]=4 12757 B13R1.202 Cc1ccccc1CC(=O)C(C)C 1458a_100000212180_100000210206 [0,2,0,0,0,1|1,0,0]=4 12758 B13R1.202 Cc1ccccc1CC(=O)C(C)F 1458a_100000062450_100000211839 [0,2,0,0,0,1|1,0,0]=4 12759 B13R1.202 Cc1ccccc1CC(=O)N(C)C 11a_100102631434_100000212180 [0,2,0,0,0,1|0,0,0]=3 12760 B13R1.202 Cc1ccccc1CC(=O)N(C)C 1626a_100102631434_100000212180 [0,2,0,0,0,1|0,0,0]=3 12761 B13R1.202 Cc1ccccc1CC(=O)N(C)C 240690a_100102631434_100000212180 [0,2,0,0,0,1|0,0,0]=3 12762 B13R1.202 Cc1ccccc1CC(=O)N(C)C 527a_100102631434_100000212180 [0,2,0,0,0,1|0,0,0]=3 12763 B13R1.202 Cc1ccccc1CC(=O)[C@@H](C)O 1458a_100000717761_100000211839 [0,2,0,0,0,1|1,0,0]=4 12764 B13R1.202 Cc1ccccc1CC(=O)[C@H](C)O 1458a_217856618621_100000211839 [0,2,0,0,0,1|1,0,0]=4 12765 B13R1.202 Cc1ccccc1NC(=O)C(=O)[13CH3] 1458a_200011297352_200025704644 [0,2,0,0,0,1|1,0,0]=4 12766 B13R1.202 Cc1ccccc1NC(=O)C(C)C 11a_100015192222_100000210198 [0,2,0,0,0,1|1,0,0]=4 12767 B13R1.202 Cc1ccccc1NC(=O)C(C)C 1626a_100015192222_100000210198 [0,2,0,0,0,1|1,0,0]=4 12768 B13R1.202 Cc1ccccc1NC(=O)C(C)C 22a_100015192222_100000210198 [0,2,0,0,0,1|1,0,0]=4 12769 B13R1.202 Cc1ccccc1NC(=O)C(C)C 527a_100015192222_100000210198 [0,2,0,0,0,1|1,0,0]=4 12770 B13R1.202 Cc1ccccc1NC(=O)C(C)F 11a_100015192222_100000062450 [0,2,0,0,0,1|1,0,0]=4 12771 B13R1.202 Cc1ccccc1NC(=O)C(C)F 1626a_100015192222_100000062450 [0,2,0,0,0,1|1,0,0]=4 12772 B13R1.202 Cc1ccccc1NC(=O)C(C)F 22a_100015192222_100000062450 [0,2,0,0,0,1|1,0,0]=4 12773 B13R1.202 Cc1ccccc1NC(=O)C(C)F 527a_100015192222_100000062450 [0,2,0,0,0,1|1,0,0]=4 12774 B13R1.202 Cc1ccccc1NC(=O)N(C)C 2430a_100015192222_100102631434 [0,2,0,0,0,1|0,0,0]=3 12775 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O 22a_100015192222_100000717761 [0,2,0,0,0,1|1,0,0]=4 12776 B13R1.202 Cc1ccccc1NC(=O)[C@H](C)O 1626a_100015192222_217856618621 [0,2,0,0,0,1|1,0,0]=4 12777 B13R1.202 Cc1ccccc1NC(=O)[C@H](C)O 22a_100015192222_217856618621 [0,2,0,0,0,1|1,0,0]=4 12778 B13R1.202 Cc1cccnc1CC(=O)N(C)C 11a_100102631434_200000722269 [0,2,0,0,0,1|1,0,0]=4 12779 B13R1.202 Cc1cccnc1CC(=O)N(C)C 1626a_100102631434_200000722269 [0,2,0,0,0,1|1,0,0]=4 12780 B13R1.202 Cc1cccnc1CC(=O)N(C)C 240690a_100102631434_200000722269 [0,2,0,0,0,1|1,0,0]=4 12781 B13R1.202 [13CH3]C(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200025704644 [0,2,0,0,0,1|1,0,0]=4 12782 B13R1.353 CC(C)(C)C(=O)Cc1ccccc1 1458a_106744555173_100015291786 [0,2,0,0,0,1|1,0,0]=4 12783 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 11a_100000106764_106744555173 [0,2,0,0,0,1|1,0,0]=4 12784 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 1626a_100000106764_106744555173 [0,2,0,0,0,1|1,0,0]=4 12785 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 22a_100000106764_106744555173 [0,2,0,0,0,1|1,0,0]=4 12786 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 527a_100000106764_106744555173 [0,2,0,0,0,1|1,0,0]=4 12787 B13R1.353 CC(C)(F)C(=O)Cc1ccccc1 1458a_100000765255_100015291786 [0,2,0,0,0,1|1,0,0]=4 12788 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 11a_100000106764_100000765255 [0,2,0,0,0,1|1,0,0]=4 12789 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 1626a_100000106764_100000765255 [0,2,0,0,0,1|1,0,0]=4 12790 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 22a_100000106764_100000765255 [0,2,0,0,0,1|1,0,0]=4 12791 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 527a_100000106764_100000765255 [0,2,0,0,0,1|1,0,0]=4 12792 B13R1.353 CC(C)(O)C(=O)Cc1ccccc1 1458a_100000242741_100015291786 [0,2,0,0,0,1|1,0,0]=4 12793 B13R1.353 CC(C)(O)C(=O)Nc1ccccc1 22a_100000106764_100000242741 [0,2,0,0,0,1|1,0,0]=4 12794 B13R1.353 CC(F)(F)C(=O)Nc1ccccc1 11a_100000106764_100000042251 [0,2,0,0,0,1|1,0,0]=4 12795 B13R1.353 CC(F)(F)C(=O)Nc1ccccc1 1626a_100000106764_100000042251 [0,2,0,0,0,1|1,0,0]=4 12796 B13R1.353 CC(F)(F)C(=O)Nc1ccccc1 22a_100000106764_100000042251 [0,2,0,0,0,1|1,0,0]=4 12797 B13R1.353 CC(F)(F)C(=O)Nc1ccccc1 527a_100000106764_100000042251 [0,2,0,0,0,1|1,0,0]=4 12798 B13R1.418 CNC(Cc1ccccc1)C(=O)N 2230a_100000745710_200000210301 [0,2,0,0,0,1|0,0,1]=4 12799 B13R1.418 CNC(Cc1ccccc1)C(=O)N 34a_100000745710_200000210301 [0,2,0,0,0,1|0,0,1]=4 12800 B13R1.418 [13CH3]NC(Cc1ccccc1)C(=O)N 2230a_100000745710_200025704644 [0,2,0,0,0,1|0,0,1]=4 12801 B13R1.418 [13CH3]NC(Cc1ccccc1)C(=O)N 34a_100000745710_200025704644 [0,2,0,0,0,1|0,0,1]=4 12802 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 270084a_100102631434_100000211737 [0,2,0,0,0,1|1,0,0]=4 12803 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 274078a_100102631434_100000211737 [0,2,0,0,0,1|1,0,0]=4 12804 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 40a_100102631434_100000235865 [0,2,0,0,0,1|1,0,0]=4 12805 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000140223 [0,2,0,0,0,1|1,0,0]=4 12806 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_200009884166_100000210202 [0,2,0,0,0,1|1,0,0]=4 12807 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 11a_106832991635_200009884166 [0,2,0,0,0,1|0,0,0]=3 12808 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 1626a_100102657272_200009884166 [0,2,0,0,0,1|0,0,0]=3 12809 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 240690a_100102657272_200009884166 [0,2,0,0,0,1|0,0,0]=3 12810 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 527a_100102657272_200009884166 [0,2,0,0,0,1|0,0,0]=3 12811 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 11a_100011215031_100000210414 [0,2,0,0,0,1|1,0,0]=4 12812 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 1626a_100011215031_100000210414 [0,2,0,0,0,1|1,0,0]=4 12813 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 22a_100011215031_100000210414 [0,2,0,0,0,1|1,0,0]=4 12814 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 527a_100011215031_100000210414 [0,2,0,0,0,1|1,0,0]=4 12815 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 2430a_100011215031_100102657272 [0,2,0,0,0,1|0,0,0]=3 12816 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 512a_100011215031_100102657272 [0,2,0,0,0,1|0,0,0]=3 12817 B13R1.5 C=Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000034074 [0,2,0,0,0,1|1,0,0]=4 12818 B13R1.5 C=Cc1ccc(cc1)CC(=O)NC 271570a_100011290941_100000155101 [0,2,0,0,0,1|0,0,0]=3 12819 B13R1.5 C=Cc1ccc(cc1)CC(=O)OC 271570a_100011290941_100000149743 [0,2,0,0,0,1|1,0,0]=4 12820 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 11a_100011218248_100000210414 [0,2,0,0,0,1|1,0,0]=4 12821 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 1626a_100011218248_100000210414 [0,2,0,0,0,1|1,0,0]=4 12822 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 22a_100011218248_100000210414 [0,2,0,0,0,1|1,0,0]=4 12823 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 527a_100011218248_100000210414 [0,2,0,0,0,1|1,0,0]=4 12824 B13R1.5 C=Cc1ccc(cc1)NC(=O)NC 2430a_100011218248_100102657272 [0,2,0,0,0,1|0,0,0]=3 12825 B13R1.5 C=Cc1ccc(cc1)NC(=O)OC 271570a_100011290941_100000181880 [0,2,0,0,0,1|1,0,0]=4 12826 B13R1.5 C=Cc1ccc(cc1)OC(=O)CC 271570a_100011290941_200009811598 [0,2,0,0,0,1|1,0,0]=4 12827 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000210414_100000184898 [0,2,0,0,0,1|1,0,0]=4 12828 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210202 [0,2,0,0,0,1|1,0,0]=4 12829 B13R1.5 CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210414_100000075337 [0,2,0,0,0,1|1,0,0]=4 12830 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_100000210414_100000747183 [0,2,0,0,0,1|1,0,0]=4 12831 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210202 [0,2,0,0,0,1|1,0,0]=4 12832 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100000210414_100000067286 [0,2,0,0,0,1|1,0,0]=4 12833 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210202 [0,2,0,0,0,1|1,0,0]=4 12834 B13R1.5 CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210202 [0,2,0,0,0,1|1,0,0]=4 12835 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000210414_100000181263 [0,2,0,0,0,1|1,0,0]=4 12836 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210202 [0,2,0,0,0,1|1,0,0]=4 12837 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100000210414 [0,2,0,0,0,1|1,0,0]=4 12838 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100000210414 [0,2,0,0,0,1|1,0,0]=4 12839 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210414 [0,2,0,0,0,1|1,0,0]=4 12840 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210414 [0,2,0,0,0,1|1,0,0]=4 12841 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210414 [0,2,0,0,0,1|1,0,0]=4 12842 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000210414 [0,2,0,0,0,1|1,0,0]=4 12843 B13R1.5 CCC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000210414 [0,2,0,0,0,1|1,0,0]=4 12844 B13R1.5 CCC(=O)Nc1ccc(cc1)NC 34a_100000186511_200000210301 [0,2,0,0,0,1|1,0,0]=4 12845 B13R1.5 CCC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000186511_200025704644 [0,2,0,0,0,1|1,0,0]=4 12846 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210414 [0,2,0,0,0,1|1,0,0]=4 12847 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210414 [0,2,0,0,0,1|1,0,0]=4 12848 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210414 [0,2,0,0,0,1|1,0,0]=4 12849 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 34a_200000243810_200000210301 [0,2,0,0,0,1|1,0,0]=4 12850 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000210414 [0,2,0,0,0,1|1,0,0]=4 12851 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 7a_200000243810_200000210301 [0,2,0,0,0,1|1,0,0]=4 12852 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 34a_200000243810_200025704644 [0,2,0,0,0,1|1,0,0]=4 12853 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 7a_200000243810_200025704644 [0,2,0,0,0,1|1,0,0]=4 12854 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210414 [0,2,0,0,0,1|1,0,0]=4 12855 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210414 [0,2,0,0,0,1|1,0,0]=4 12856 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000210414 [0,2,0,0,0,1|1,0,0]=4 12857 B13R1.5 CCC(=O)Oc1ccc(cc1)SC 62a_200000210301_200009811598 [0,2,0,0,0,1|1,0,0]=4 12858 B13R1.5 CCC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009811598 [0,2,0,0,0,1|1,0,0]=4 12859 B13R1.5 CCc1ccc(cc1)CC(=O)NC 11a_106832991635_200000759805 [0,2,0,0,0,1|0,0,0]=3 12860 B13R1.5 CCc1ccc(cc1)CC(=O)NC 1626a_100102657272_200000759805 [0,2,0,0,0,1|0,0,0]=3 12861 B13R1.5 CCc1ccc(cc1)CC(=O)NC 240690a_100102657272_200000759805 [0,2,0,0,0,1|0,0,0]=3 12862 B13R1.5 CCc1ccc(cc1)CC(=O)NC 527a_100102657272_200000759805 [0,2,0,0,0,1|0,0,0]=3 12863 B13R1.5 CCc1ccc(cc1)NC(=O)NC 2430a_100000211069_100102657272 [0,2,0,0,0,1|0,0,0]=3 12864 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 11a_106832991635_100000748677 [0,2,0,0,0,1|0,0,0]=3 12865 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 1626a_100102657272_100000748677 [0,2,0,0,0,1|0,0,0]=3 12866 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 240690a_100102657272_100000748677 [0,2,0,0,0,1|0,0,0]=3 12867 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 527a_100102657272_100000748677 [0,2,0,0,0,1|0,0,0]=3 12868 B13R1.5 CNC(=O)Cc1ccc(cc1)CO 240690a_100102657272_100011356463 [0,2,0,0,0,1|0,0,0]=3 12869 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 2230a_100000736799_200000210301 [0,2,0,0,0,1|0,0,0]=3 12870 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 34a_100000736799_200000210301 [0,2,0,0,0,1|0,0,0]=3 12871 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 2230a_100000736799_200025704644 [0,2,0,0,0,1|0,0,0]=3 12872 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 34a_100000736799_200025704644 [0,2,0,0,0,1|0,0,0]=3 12873 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 11a_106832991635_100000210706 [0,2,0,0,0,1|0,0,0]=3 12874 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 240690a_100102657272_100000210706 [0,2,0,0,0,1|0,0,0]=3 12875 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 34a_200000020795_200000210301 [0,2,0,0,0,1|0,0,0]=3 12876 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 527a_100102657272_100000210706 [0,2,0,0,0,1|0,0,0]=3 12877 B13R1.5 CNC(=O)Cc1ccc(cc1)O[13CH3] 34a_200000020795_200025704644 [0,2,0,0,0,1|0,0,0]=3 12878 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 11a_106832991635_100000756958 [0,2,0,0,0,1|0,0,0]=3 12879 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 1626a_100102657272_100000756958 [0,2,0,0,0,1|0,0,0]=3 12880 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 240690a_100102657272_100000756958 [0,2,0,0,0,1|0,0,0]=3 12881 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 527a_100102657272_100000756958 [0,2,0,0,0,1|0,0,0]=3 12882 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_100000155101_200000210301 [0,2,0,0,0,1|0,0,0]=3 12883 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000155101 [0,2,0,0,0,1|0,0,0]=3 12884 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000155101_200025704644 [0,2,0,0,0,1|0,0,0]=3 12885 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000155101 [0,2,0,0,0,1|0,0,0]=3 12886 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 11a_106832991635_100000722272 [0,2,0,0,0,1|1,0,0]=4 12887 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 240690a_100102657272_100000722272 [0,2,0,0,0,1|1,0,0]=4 12888 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 527a_100102657272_100000722272 [0,2,0,0,0,1|1,0,0]=4 12889 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 11a_106832991635_100012001117 [0,2,0,0,0,1|1,0,0]=4 12890 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 240690a_100102657272_100012001117 [0,2,0,0,0,1|1,0,0]=4 12891 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 527a_100102657272_100012001117 [0,2,0,0,0,1|1,0,0]=4 12892 B13R1.5 CNC(=O)Nc1ccc(cc1)C#N 2430a_100000185469_100102657272 [0,2,0,0,0,1|0,0,0]=3 12893 B13R1.5 CNC(=O)Nc1ccc(cc1)CO 2430a_100011215238_100102657272 [0,2,0,0,0,1|0,0,0]=3 12894 B13R1.5 CNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100102657272 [0,2,0,0,0,1|0,0,0]=3 12895 B13R1.5 CNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100102657272 [0,2,0,0,0,1|0,0,0]=3 12896 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [0,2,0,0,0,1|1,0,0]=4 12897 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [0,2,0,0,0,1|1,0,0]=4 12898 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [0,2,0,0,0,1|1,0,0]=4 12899 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [0,2,0,0,0,1|1,0,0]=4 12900 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [0,2,0,0,0,1|1,0,0]=4 12901 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [0,2,0,0,0,1|1,0,0]=4 12902 B13R1.5 COC(=O)Nc1ccc(cc1)OC 34a_100011235918_200000210301 [0,2,0,0,0,1|1,0,0]=4 12903 B13R1.5 COC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235918_200025704644 [0,2,0,0,0,1|1,0,0]=4 12904 B13R1.5 COC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000181880 [0,2,0,0,0,1|1,0,0]=4 12905 B13R1.5 COC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000181880 [0,2,0,0,0,1|1,0,0]=4 12906 B13R1.5 COc1ccc(cc1)CC(=O)NN 34a_100000020777_200000210301 [0,2,0,0,0,1|1,0,0]=4 12907 B13R1.5 [13CH3]Oc1ccc(cc1)CC(=O)NN 34a_100000020777_200025704644 [0,2,0,0,0,1|1,0,0]=4 12908 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Br 270084a_100102657272_100000764255 [0,2,0,0,0,1|1,0,0]=4 12909 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Br 274078a_100102657272_100000764255 [0,2,0,0,0,1|1,0,0]=4 12910 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)C 270084a_100102657272_100000689310 [0,2,0,0,0,1|1,0,0]=4 12911 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)C 274078a_100102657272_100000689310 [0,2,0,0,0,1|1,0,0]=4 12912 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Cl 270084a_100102657272_100011198069 [0,2,0,0,0,1|1,0,0]=4 12913 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Cl 274078a_100102657272_100011198069 [0,2,0,0,0,1|1,0,0]=4 12914 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)F 270084a_100102657272_100000735682 [0,2,0,0,0,1|1,0,0]=4 12915 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)F 274078a_100102657272_100000735682 [0,2,0,0,0,1|1,0,0]=4 12916 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100000210414_200012351560 [0,2,0,0,0,1|1,0,0]=4 12917 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210202 [0,2,0,0,0,1|1,0,0]=4 12918 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000210414_100000755608 [0,2,0,0,0,1|1,0,0]=4 12919 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210202 [0,2,0,0,0,1|1,0,0]=4 12920 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000210414_100000243222 [0,2,0,0,0,1|1,0,0]=4 12921 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210202 [0,2,0,0,0,1|1,0,0]=4 12922 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)I 1458a_100000210414_100010146610 [0,2,0,0,0,1|1,0,0]=4 12923 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210202 [0,2,0,0,0,1|1,0,0]=4 12924 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000210414_100000708836 [0,2,0,0,0,1|1,0,0]=4 12925 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210202 [0,2,0,0,0,1|1,0,0]=4 12926 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100000210414_100011219618 [0,2,0,0,0,1|1,0,0]=4 12927 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210202 [0,2,0,0,0,1|1,0,0]=4 12928 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Cl 1458a_100000210414_100012361307 [0,2,0,0,0,1|1,0,0]=4 12929 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100000210414_100000700533 [0,2,0,0,0,1|1,0,0]=4 12930 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210202 [0,2,0,0,0,1|1,0,0]=4 12931 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000210414_100011740631 [0,2,0,0,0,1|1,0,0]=4 12932 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210202 [0,2,0,0,0,1|1,0,0]=4 12933 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)C 1458a_100000210414_100012349684 [0,2,0,0,0,1|1,0,0]=4 12934 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210414_100000188473 [0,2,0,0,0,1|1,0,0]=4 12935 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210202 [0,2,0,0,0,1|1,0,0]=4 12936 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000210414_100011216360 [0,2,0,0,0,1|1,0,0]=4 12937 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210202 [0,2,0,0,0,1|1,0,0]=4 12938 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100000210414_100000211606 [0,2,0,0,0,1|1,0,0]=4 12939 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210202 [0,2,0,0,0,1|1,0,0]=4 12940 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210202 [0,2,0,0,0,1|1,0,0]=4 12941 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000210414_100012002367 [0,2,0,0,0,1|1,0,0]=4 12942 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100000210414_100000709361 [0,2,0,0,0,1|1,0,0]=4 12943 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210202 [0,2,0,0,0,1|1,0,0]=4 12944 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000210414_100000748237 [0,2,0,0,0,1|1,0,0]=4 12945 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210202 [0,2,0,0,0,1|1,0,0]=4 12946 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100000210414_100010244991 [0,2,0,0,0,1|1,0,0]=4 12947 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210202 [0,2,0,0,0,1|1,0,0]=4 12948 B13R1.2679 CCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210202 [0,2,0,0,0,1|1,0,0]=4 12949 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Br 1458a_100000210414_100010146615 [0,2,0,0,0,1|1,0,0]=4 12950 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Cl 1458a_100000210414_100010254388 [0,2,0,0,0,1|1,0,0]=4 12951 B13R1.2679 CCC(=O)Cc1ccc(cc1I)F 1458a_100000210414_100012354799 [0,2,0,0,0,1|1,0,0]=4 12952 B13R1.2679 CCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210202 [0,2,0,0,0,1|1,0,0]=4 12953 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000210414 [0,2,0,0,0,1|1,0,0]=4 12954 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000210414 [0,2,0,0,0,1|1,0,0]=4 12955 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000210414 [0,2,0,0,0,1|1,0,0]=4 12956 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000210414 [0,2,0,0,0,1|1,0,0]=4 12957 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000210414 [0,2,0,0,0,1|1,0,0]=4 12958 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000210414 [0,2,0,0,0,1|1,0,0]=4 12959 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000210414 [0,2,0,0,0,1|1,0,0]=4 12960 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000210414 [0,2,0,0,0,1|1,0,0]=4 12961 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000210414 [0,2,0,0,0,1|1,0,0]=4 12962 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000210414 [0,2,0,0,0,1|1,0,0]=4 12963 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000210414 [0,2,0,0,0,1|1,0,0]=4 12964 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000210414 [0,2,0,0,0,1|1,0,0]=4 12965 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000210414 [0,2,0,0,0,1|1,0,0]=4 12966 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000210414 [0,2,0,0,0,1|1,0,0]=4 12967 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000210414 [0,2,0,0,0,1|1,0,0]=4 12968 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000210414 [0,2,0,0,0,1|1,0,0]=4 12969 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000210414 [0,2,0,0,0,1|1,0,0]=4 12970 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000210414 [0,2,0,0,0,1|1,0,0]=4 12971 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000210414 [0,2,0,0,0,1|1,0,0]=4 12972 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000210414 [0,2,0,0,0,1|1,0,0]=4 12973 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000210414 [0,2,0,0,0,1|1,0,0]=4 12974 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000210414 [0,2,0,0,0,1|1,0,0]=4 12975 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 11a_100000211637_100000210414 [0,2,0,0,0,1|1,0,0]=4 12976 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000210414 [0,2,0,0,0,1|1,0,0]=4 12977 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000210414 [0,2,0,0,0,1|1,0,0]=4 12978 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 527a_100000211637_100000210414 [0,2,0,0,0,1|1,0,0]=4 12979 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 11a_100000184554_100000210414 [0,2,0,0,0,1|1,0,0]=4 12980 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000210414 [0,2,0,0,0,1|1,0,0]=4 12981 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000210414 [0,2,0,0,0,1|1,0,0]=4 12982 B13R1.2679 CCC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000210414 [0,2,0,0,0,1|1,0,0]=4 12983 B13R1.2679 CCC(=O)Nc1ccc(cc1C)O 527a_100000756630_100000210414 [0,2,0,0,0,1|1,0,0]=4 12984 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000210414 [0,2,0,0,0,1|1,0,0]=4 12985 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000210414 [0,2,0,0,0,1|1,0,0]=4 12986 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210414 [0,2,0,0,0,1|1,0,0]=4 12987 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210414 [0,2,0,0,0,1|1,0,0]=4 12988 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210414 [0,2,0,0,0,1|1,0,0]=4 12989 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000210414 [0,2,0,0,0,1|1,0,0]=4 12990 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000210414 [0,2,0,0,0,1|1,0,0]=4 12991 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000210414 [0,2,0,0,0,1|1,0,0]=4 12992 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000210414 [0,2,0,0,0,1|1,0,0]=4 12993 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000210414 [0,2,0,0,0,1|1,0,0]=4 12994 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000210414 [0,2,0,0,0,1|1,0,0]=4 12995 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000210414 [0,2,0,0,0,1|1,0,0]=4 12996 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000210414 [0,2,0,0,0,1|1,0,0]=4 12997 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000210414 [0,2,0,0,0,1|1,0,0]=4 12998 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000210414 [0,2,0,0,0,1|1,0,0]=4 12999 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000210414 [0,2,0,0,0,1|1,0,0]=4 13000 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000210414 [0,2,0,0,0,1|1,0,0]=4 13001 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000210414 [0,2,0,0,0,1|1,0,0]=4 13002 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000210414 [0,2,0,0,0,1|1,0,0]=4 13003 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000210414 [0,2,0,0,0,1|1,0,0]=4 13004 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000210414 [0,2,0,0,0,1|1,0,0]=4 13005 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000210414 [0,2,0,0,0,1|1,0,0]=4 13006 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000210414 [0,2,0,0,0,1|1,0,0]=4 13007 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000210414 [0,2,0,0,0,1|1,0,0]=4 13008 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000210414 [0,2,0,0,0,1|1,0,0]=4 13009 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000210414 [0,2,0,0,0,1|1,0,0]=4 13010 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 11a_100000210720_100000210414 [0,2,0,0,0,1|1,0,0]=4 13011 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000210414 [0,2,0,0,0,1|1,0,0]=4 13012 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000210414 [0,2,0,0,0,1|1,0,0]=4 13013 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 11a_100011215594_100000210414 [0,2,0,0,0,1|1,0,0]=4 13014 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000210414 [0,2,0,0,0,1|1,0,0]=4 13015 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000210414 [0,2,0,0,0,1|1,0,0]=4 13016 B13R1.2679 CCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000210414 [0,2,0,0,0,1|1,0,0]=4 13017 B13R1.2679 CCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100000210414 [0,2,0,0,0,1|1,0,0]=4 13018 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000210414 [0,2,0,0,0,1|1,0,0]=4 13019 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000210414 [0,2,0,0,0,1|1,0,0]=4 13020 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000210414 [0,2,0,0,0,1|1,0,0]=4 13021 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000210414 [0,2,0,0,0,1|1,0,0]=4 13022 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000210414 [0,2,0,0,0,1|1,0,0]=4 13023 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000210414 [0,2,0,0,0,1|1,0,0]=4 13024 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 11a_100000760547_100000210414 [0,2,0,0,0,1|1,0,0]=4 13025 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000210414 [0,2,0,0,0,1|1,0,0]=4 13026 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000210414 [0,2,0,0,0,1|1,0,0]=4 13027 B13R1.2679 CCC(=O)Nc1ccc(cc1I)I 11a_100010002754_100000210414 [0,2,0,0,0,1|1,0,0]=4 13028 B13R1.2679 CCC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000210414 [0,2,0,0,0,1|1,0,0]=4 13029 B13R1.2679 CCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000210414 [0,2,0,0,0,1|1,0,0]=4 13030 B13R1.2679 CCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100000210414 [0,2,0,0,0,1|1,0,0]=4 13031 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13032 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13033 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000210414 [0,2,0,0,0,1|1,0,0]=4 13034 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152038 [0,2,0,0,0,1|1,0,0]=4 13035 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000210414 [0,2,0,0,0,1|1,0,0]=4 13036 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210414 [0,2,0,0,0,1|1,0,0]=4 13037 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000210414 [0,2,0,0,0,1|1,0,0]=4 13038 B13R1.2679 CCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000210414 [0,2,0,0,0,1|1,0,0]=4 13039 B13R1.2679 CCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000210414 [0,2,0,0,0,1|1,0,0]=4 13040 B13R1.2679 CCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000210414 [0,2,0,0,0,1|1,0,0]=4 13041 B13R1.2679 CCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000210414 [0,2,0,0,0,1|1,0,0]=4 13042 B13R1.2679 CCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210414 [0,2,0,0,0,1|1,0,0]=4 13043 B13R1.2679 CCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000210414 [0,2,0,0,0,1|1,0,0]=4 13044 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 11a_106832991635_100010172832 [0,2,0,0,0,1|0,0,0]=3 13045 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 240690a_100102657272_100010172832 [0,2,0,0,0,1|0,0,0]=3 13046 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 527a_100102657272_100010172832 [0,2,0,0,0,1|0,0,0]=3 13047 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 11a_106832991635_100000755479 [0,2,0,0,0,1|0,0,0]=3 13048 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 1626a_100102657272_100000755479 [0,2,0,0,0,1|0,0,0]=3 13049 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 240690a_100102657272_100000755479 [0,2,0,0,0,1|0,0,0]=3 13050 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 527a_100102657272_100000755479 [0,2,0,0,0,1|0,0,0]=3 13051 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 11a_106832991635_100000708238 [0,2,0,0,0,1|0,0,0]=3 13052 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 1626a_100102657272_100000708238 [0,2,0,0,0,1|0,0,0]=3 13053 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 240690a_100102657272_100000708238 [0,2,0,0,0,1|0,0,0]=3 13054 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 527a_100102657272_100000708238 [0,2,0,0,0,1|0,0,0]=3 13055 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 240690a_100102657272_100010176083 [0,2,0,0,0,1|0,0,0]=3 13056 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 527a_100102657272_100010176083 [0,2,0,0,0,1|0,0,0]=3 13057 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 11a_106832991635_100000697930 [0,2,0,0,0,1|0,0,0]=3 13058 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 1626a_100102657272_100000697930 [0,2,0,0,0,1|0,0,0]=3 13059 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 240690a_100102657272_100000697930 [0,2,0,0,0,1|0,0,0]=3 13060 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 527a_100102657272_100000697930 [0,2,0,0,0,1|0,0,0]=3 13061 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 11a_106832991635_100011236500 [0,2,0,0,0,1|0,0,0]=3 13062 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 1626a_100102657272_100011236500 [0,2,0,0,0,1|0,0,0]=3 13063 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 240690a_100102657272_100011236500 [0,2,0,0,0,1|0,0,0]=3 13064 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 527a_100102657272_100011236500 [0,2,0,0,0,1|0,0,0]=3 13065 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 11a_106832991635_100011667441 [0,2,0,0,0,1|0,0,0]=3 13066 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 1626a_100102657272_100011667441 [0,2,0,0,0,1|0,0,0]=3 13067 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 240690a_100102657272_100011667441 [0,2,0,0,0,1|0,0,0]=3 13068 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 527a_100102657272_100011667441 [0,2,0,0,0,1|0,0,0]=3 13069 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 11a_106832991635_100012361378 [0,2,0,0,0,1|0,0,0]=3 13070 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 1626a_100102657272_100012361378 [0,2,0,0,0,1|0,0,0]=3 13071 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 240690a_100102657272_100012361378 [0,2,0,0,0,1|0,0,0]=3 13072 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 527a_100102657272_100012361378 [0,2,0,0,0,1|0,0,0]=3 13073 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 11a_106832991635_100000210926 [0,2,0,0,0,1|0,0,0]=3 13074 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100102657272_100000210926 [0,2,0,0,0,1|0,0,0]=3 13075 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100102657272_100000210926 [0,2,0,0,0,1|0,0,0]=3 13076 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 527a_100102657272_100000210926 [0,2,0,0,0,1|0,0,0]=3 13077 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 11a_106832991635_100000690284 [0,2,0,0,0,1|0,0,0]=3 13078 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 1626a_100102657272_100000690284 [0,2,0,0,0,1|0,0,0]=3 13079 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 240690a_100102657272_100000690284 [0,2,0,0,0,1|0,0,0]=3 13080 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 527a_100102657272_100000690284 [0,2,0,0,0,1|0,0,0]=3 13081 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 11a_106832991635_100011295475 [0,2,0,0,0,1|0,0,0]=3 13082 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 1626a_100102657272_100011295475 [0,2,0,0,0,1|0,0,0]=3 13083 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 240690a_100102657272_100011295475 [0,2,0,0,0,1|0,0,0]=3 13084 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 527a_100102657272_100011295475 [0,2,0,0,0,1|0,0,0]=3 13085 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 11a_106832991635_100000042674 [0,2,0,0,0,1|0,0,0]=3 13086 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 1626a_100102657272_100000042674 [0,2,0,0,0,1|0,0,0]=3 13087 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 240690a_100102657272_100000042674 [0,2,0,0,0,1|0,0,0]=3 13088 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 527a_100102657272_100000042674 [0,2,0,0,0,1|0,0,0]=3 13089 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 11a_106832991635_100011830378 [0,2,0,0,0,1|0,0,0]=3 13090 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 1626a_100102657272_100011830378 [0,2,0,0,0,1|0,0,0]=3 13091 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 240690a_100102657272_100011830378 [0,2,0,0,0,1|0,0,0]=3 13092 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 527a_100102657272_100011830378 [0,2,0,0,0,1|0,0,0]=3 13093 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 11a_106832991635_100000684719 [0,2,0,0,0,1|0,0,0]=3 13094 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 1626a_100102657272_100000684719 [0,2,0,0,0,1|0,0,0]=3 13095 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 240690a_100102657272_100000684719 [0,2,0,0,0,1|0,0,0]=3 13096 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 527a_100102657272_100000684719 [0,2,0,0,0,1|0,0,0]=3 13097 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 11a_106832991635_100010149628 [0,2,0,0,0,1|0,0,0]=3 13098 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 1626a_100102657272_100010149628 [0,2,0,0,0,1|0,0,0]=3 13099 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 240690a_100102657272_100010149628 [0,2,0,0,0,1|0,0,0]=3 13100 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 527a_100102657272_100010149628 [0,2,0,0,0,1|0,0,0]=3 13101 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 240690a_100102657272_100000090534 [0,2,0,0,0,1|0,0,0]=3 13102 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 527a_100102657272_100000090534 [0,2,0,0,0,1|0,0,0]=3 13103 B13R1.2679 CNC(=O)Cc1ccc(cc1O)Br 240690a_100102657272_100000707504 [0,2,0,0,0,1|0,0,0]=3 13104 B13R1.2679 CNC(=O)Cc1ccc(nc1Cl)Cl 11a_106832991635_200010067290 [0,2,0,0,0,1|1,0,0]=4 13105 B13R1.2679 CNC(=O)Cc1ccc(nc1Cl)Cl 1626a_100102657272_200010067290 [0,2,0,0,0,1|1,0,0]=4 13106 B13R1.2679 CNC(=O)Cc1ccc(nc1Cl)Cl 240690a_100102657272_200010067290 [0,2,0,0,0,1|1,0,0]=4 13107 B13R1.2679 CNC(=O)Cc1ccc(nc1Cl)Cl 527a_100102657272_200010067290 [0,2,0,0,0,1|1,0,0]=4 13108 B13R1.2679 CNC(=O)Cc1ncc(cc1Br)Cl 11a_106832991635_200012351915 [0,2,0,0,0,1|1,0,0]=4 13109 B13R1.2679 CNC(=O)Cc1ncc(cc1Br)Cl 240690a_100102657272_200012351915 [0,2,0,0,0,1|1,0,0]=4 13110 B13R1.2679 CNC(=O)Cc1ncc(cc1F)Br 11a_106832991635_100012351917 [0,2,0,0,0,1|1,0,0]=4 13111 B13R1.2679 CNC(=O)Cc1ncc(cc1F)Br 240690a_100102657272_100012351917 [0,2,0,0,0,1|1,0,0]=4 13112 B13R1.2679 CNC(=O)Cc1ncc(cc1F)Br 527a_100102657272_100012351917 [0,2,0,0,0,1|1,0,0]=4 13113 B13R1.2679 CNC(=O)Cn1ccc(cc1=O)C 1626a_100102657272_100000721392 [0,2,0,0,0,1|1,0,0]=4 13114 B13R1.2679 CNC(=O)Cn1ccc(cc1=O)C 240690a_100102657272_100000721392 [0,2,0,0,0,1|1,0,0]=4 13115 B13R1.2679 CNC(=O)Cn1ccc(cc1=O)C 527a_100102657272_100000721392 [0,2,0,0,0,1|1,0,0]=4 13116 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100102657272 [0,2,0,0,0,1|0,0,0]=3 13117 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100102657272 [0,2,0,0,0,1|0,0,0]=3 13118 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100102657272 [0,2,0,0,0,1|0,0,0]=3 13119 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100102657272 [0,2,0,0,0,1|0,0,0]=3 13120 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100102657272 [0,2,0,0,0,1|0,0,0]=3 13121 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100102657272 [0,2,0,0,0,1|0,0,0]=3 13122 B13R1.2679 CNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100102657272 [0,2,0,0,0,1|0,0,0]=3 13123 B13R1.2679 CNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100102657272 [0,2,0,0,0,1|0,0,0]=3 13124 B13R1.2679 CNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100102657272 [0,2,0,0,0,1|0,0,0]=3 13125 B13R1.2679 CNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100102657272 [0,2,0,0,0,1|0,0,0]=3 13126 B13R1.2679 CNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100102657272 [0,2,0,0,0,1|0,0,0]=3 13127 B13R1.2679 CNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100102657272 [0,2,0,0,0,1|0,0,0]=3 13128 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100102657272 [0,2,0,0,0,1|0,0,0]=3 13129 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100102657272 [0,2,0,0,0,1|0,0,0]=3 13130 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100102657272 [0,2,0,0,0,1|0,0,0]=3 13131 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100102657272 [0,2,0,0,0,1|0,0,0]=3 13132 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100102657272 [0,2,0,0,0,1|0,0,0]=3 13133 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100102657272 [0,2,0,0,0,1|0,0,0]=3 13134 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100102657272 [0,2,0,0,0,1|0,0,0]=3 13135 B13R1.2679 CNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100102657272 [0,2,0,0,0,1|0,0,0]=3 13136 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100102657272 [0,2,0,0,0,1|0,0,0]=3 13137 B13R1.2679 CNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100102657272 [0,2,0,0,0,1|0,0,0]=3 13138 B13R1.2679 CNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100102657272 [0,2,0,0,0,1|0,0,0]=3 13139 B13R1.2679 CNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100102657272 [0,2,0,0,0,1|0,0,0]=3 13140 B13R1.2679 CNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100102657272 [0,2,0,0,0,1|0,0,0]=3 13141 B13R1.2679 CNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100102657272 [0,2,0,0,0,1|0,0,0]=3 13142 B13R1.2679 CNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100102657272 [0,2,0,0,0,1|0,0,0]=3 13143 B13R1.2679 CNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100102657272 [0,2,0,0,0,1|0,0,0]=3 13144 B13R1.2679 CNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100102657272 [0,2,0,0,0,1|0,0,0]=3 13145 B13R1.2679 CNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100102657272 [0,2,0,0,0,1|0,0,0]=3 13146 B13R1.2679 CNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100102657272 [0,2,0,0,0,1|0,0,0]=3 13147 B13R1.2679 CNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100102657272 [0,2,0,0,0,1|0,0,0]=3 13148 B13R1.2679 CNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100102657272 [0,2,0,0,0,1|0,0,0]=3 13149 B13R1.2679 CNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100102657272 [0,2,0,0,0,1|0,0,0]=3 13150 B13R1.2679 CNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100102657272 [0,2,0,0,0,1|0,0,0]=3 13151 B13R1.2679 COC(=O)Cc1ccc(cc1F)O 271570a_203496583355_100013023952 [0,2,0,0,0,1|1,0,0]=4 13152 B13R1.2679 COC(=O)Cc1ccc(cc1O)F 271570a_203496583355_200012569216 [0,2,0,0,0,1|1,0,0]=4 13153 B13R1.2679 COC(=O)Cc1ccc(cc1O)O 271570a_203496583355_100010150832 [0,2,0,0,0,1|1,0,0]=4 13154 B13R1.2679 COC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000750523 [0,2,0,0,0,1|1,0,0]=4 13155 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000210414_100012353900 [0,2,0,0,0,1|1,0,0]=4 13156 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000210414_100012232412 [0,2,0,0,0,1|1,0,0]=4 13157 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000210202 [0,2,0,0,0,1|1,0,0]=4 13158 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000210414_100012353894 [0,2,0,0,0,1|1,0,0]=4 13159 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210202 [0,2,0,0,0,1|1,0,0]=4 13160 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000210414_100011206884 [0,2,0,0,0,1|1,0,0]=4 13161 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210202 [0,2,0,0,0,1|1,0,0]=4 13162 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [0,2,0,0,0,1|1,0,0]=4 13163 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000210414_100000727479 [0,2,0,0,0,1|1,0,0]=4 13164 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000210202 [0,2,0,0,0,1|1,0,0]=4 13165 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000210202 [0,2,0,0,0,1|1,0,0]=4 13166 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000210414_100000742320 [0,2,0,0,0,1|1,0,0]=4 13167 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000210414_100012184735 [0,2,0,0,0,1|1,0,0]=4 13168 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100000210414_100011216667 [0,2,0,0,0,1|1,0,0]=4 13169 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000210202 [0,2,0,0,0,1|1,0,0]=4 13170 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [0,2,0,0,0,1|1,0,0]=4 13171 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000210414_100012353895 [0,2,0,0,0,1|1,0,0]=4 13172 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210202 [0,2,0,0,0,1|1,0,0]=4 13173 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000210414_100011823929 [0,2,0,0,0,1|1,0,0]=4 13174 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210414_100000184707 [0,2,0,0,0,1|1,0,0]=4 13175 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210202 [0,2,0,0,0,1|1,0,0]=4 13176 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000210414_100000717365 [0,2,0,0,0,1|1,0,0]=4 13177 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210202 [0,2,0,0,0,1|1,0,0]=4 13178 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000210414_100012349665 [0,2,0,0,0,1|1,0,0]=4 13179 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [0,2,0,0,0,1|1,0,0]=4 13180 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000210414_100000767054 [0,2,0,0,0,1|1,0,0]=4 13181 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210202 [0,2,0,0,0,1|1,0,0]=4 13182 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100000210414_100011217369 [0,2,0,0,0,1|1,0,0]=4 13183 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000210202 [0,2,0,0,0,1|1,0,0]=4 13184 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000210414_100000716492 [0,2,0,0,0,1|1,0,0]=4 13185 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210202 [0,2,0,0,0,1|1,0,0]=4 13186 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000210414_100000757363 [0,2,0,0,0,1|1,0,0]=4 13187 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210202 [0,2,0,0,0,1|1,0,0]=4 13188 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100000210414_100010149604 [0,2,0,0,0,1|1,0,0]=4 13189 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210202 [0,2,0,0,0,1|1,0,0]=4 13190 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [0,2,0,0,0,1|1,0,0]=4 13191 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000210414_100010146616 [0,2,0,0,0,1|1,0,0]=4 13192 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)C 1458a_100000210414_100010206137 [0,2,0,0,0,1|1,0,0]=4 13193 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)F 1458a_100000210414_100010188208 [0,2,0,0,0,1|1,0,0]=4 13194 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210202 [0,2,0,0,0,1|1,0,0]=4 13195 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [0,2,0,0,0,1|1,0,0]=4 13196 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100000210414 [0,2,0,0,0,1|1,0,0]=4 13197 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100000210414 [0,2,0,0,0,1|1,0,0]=4 13198 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000210414 [0,2,0,0,0,1|1,0,0]=4 13199 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000210414 [0,2,0,0,0,1|1,0,0]=4 13200 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100000210414 [0,2,0,0,0,1|1,0,0]=4 13201 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100000210414 [0,2,0,0,0,1|1,0,0]=4 13202 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000210414 [0,2,0,0,0,1|1,0,0]=4 13203 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100000210414 [0,2,0,0,0,1|1,0,0]=4 13204 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000210414 [0,2,0,0,0,1|1,0,0]=4 13205 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000210414 [0,2,0,0,0,1|1,0,0]=4 13206 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000210414 [0,2,0,0,0,1|1,0,0]=4 13207 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000210414 [0,2,0,0,0,1|1,0,0]=4 13208 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100000210414 [0,2,0,0,0,1|1,0,0]=4 13209 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100000210414 [0,2,0,0,0,1|1,0,0]=4 13210 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000210414 [0,2,0,0,0,1|1,0,0]=4 13211 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100000210414 [0,2,0,0,0,1|1,0,0]=4 13212 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100000210414 [0,2,0,0,0,1|1,0,0]=4 13213 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100000210414 [0,2,0,0,0,1|1,0,0]=4 13214 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000210414 [0,2,0,0,0,1|1,0,0]=4 13215 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100000210414 [0,2,0,0,0,1|1,0,0]=4 13216 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210414 [0,2,0,0,0,1|1,0,0]=4 13217 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210414 [0,2,0,0,0,1|1,0,0]=4 13218 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100000210414 [0,2,0,0,0,1|1,0,0]=4 13219 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100000210414 [0,2,0,0,0,1|1,0,0]=4 13220 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000210414 [0,2,0,0,0,1|1,0,0]=4 13221 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100000210414 [0,2,0,0,0,1|1,0,0]=4 13222 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100000210414 [0,2,0,0,0,1|1,0,0]=4 13223 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100000210414 [0,2,0,0,0,1|1,0,0]=4 13224 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000210414 [0,2,0,0,0,1|1,0,0]=4 13225 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100000210414 [0,2,0,0,0,1|1,0,0]=4 13226 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000210414 [0,2,0,0,0,1|1,0,0]=4 13227 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000210414 [0,2,0,0,0,1|1,0,0]=4 13228 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000210414 [0,2,0,0,0,1|1,0,0]=4 13229 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000210414 [0,2,0,0,0,1|1,0,0]=4 13230 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100000210414 [0,2,0,0,0,1|1,0,0]=4 13231 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100000210414 [0,2,0,0,0,1|1,0,0]=4 13232 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000210414 [0,2,0,0,0,1|1,0,0]=4 13233 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100000210414 [0,2,0,0,0,1|1,0,0]=4 13234 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100000210414 [0,2,0,0,0,1|1,0,0]=4 13235 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100000210414 [0,2,0,0,0,1|1,0,0]=4 13236 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000210414 [0,2,0,0,0,1|1,0,0]=4 13237 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100000210414 [0,2,0,0,0,1|1,0,0]=4 13238 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000210414 [0,2,0,0,0,1|1,0,0]=4 13239 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000210414 [0,2,0,0,0,1|1,0,0]=4 13240 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000210414 [0,2,0,0,0,1|1,0,0]=4 13241 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100000210414 [0,2,0,0,0,1|1,0,0]=4 13242 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100000210414 [0,2,0,0,0,1|1,0,0]=4 13243 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000210414 [0,2,0,0,0,1|1,0,0]=4 13244 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000210414 [0,2,0,0,0,1|1,0,0]=4 13245 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100000210414 [0,2,0,0,0,1|1,0,0]=4 13246 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100000210414 [0,2,0,0,0,1|1,0,0]=4 13247 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000210414 [0,2,0,0,0,1|1,0,0]=4 13248 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100000210414 [0,2,0,0,0,1|1,0,0]=4 13249 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000210414 [0,2,0,0,0,1|1,0,0]=4 13250 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000210414 [0,2,0,0,0,1|1,0,0]=4 13251 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000210414 [0,2,0,0,0,1|1,0,0]=4 13252 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000210414 [0,2,0,0,0,1|1,0,0]=4 13253 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13254 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13255 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13256 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13257 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100000210414 [0,2,0,0,0,1|1,0,0]=4 13258 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100000210414 [0,2,0,0,0,1|1,0,0]=4 13259 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000210414 [0,2,0,0,0,1|1,0,0]=4 13260 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210414 [0,2,0,0,0,1|1,0,0]=4 13261 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100000210414 [0,2,0,0,0,1|1,0,0]=4 13262 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100000210414 [0,2,0,0,0,1|1,0,0]=4 13263 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000210414 [0,2,0,0,0,1|1,0,0]=4 13264 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100000210414 [0,2,0,0,0,1|1,0,0]=4 13265 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100000210414 [0,2,0,0,0,1|1,0,0]=4 13266 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100000210414 [0,2,0,0,0,1|1,0,0]=4 13267 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000210414 [0,2,0,0,0,1|1,0,0]=4 13268 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100000210414 [0,2,0,0,0,1|1,0,0]=4 13269 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000210414 [0,2,0,0,0,1|1,0,0]=4 13270 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000210414 [0,2,0,0,0,1|1,0,0]=4 13271 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000210414 [0,2,0,0,0,1|1,0,0]=4 13272 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100000210414 [0,2,0,0,0,1|1,0,0]=4 13273 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100000210414 [0,2,0,0,0,1|1,0,0]=4 13274 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000210414 [0,2,0,0,0,1|1,0,0]=4 13275 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100000210414 [0,2,0,0,0,1|1,0,0]=4 13276 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100000210414 [0,2,0,0,0,1|1,0,0]=4 13277 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000210414 [0,2,0,0,0,1|1,0,0]=4 13278 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000210414 [0,2,0,0,0,1|1,0,0]=4 13279 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000210414 [0,2,0,0,0,1|1,0,0]=4 13280 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100000210414 [0,2,0,0,0,1|1,0,0]=4 13281 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100000210414 [0,2,0,0,0,1|1,0,0]=4 13282 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000210414 [0,2,0,0,0,1|1,0,0]=4 13283 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100000210414 [0,2,0,0,0,1|1,0,0]=4 13284 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100000210414 [0,2,0,0,0,1|1,0,0]=4 13285 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100000210414 [0,2,0,0,0,1|1,0,0]=4 13286 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000210414 [0,2,0,0,0,1|1,0,0]=4 13287 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100000210414 [0,2,0,0,0,1|1,0,0]=4 13288 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000210414 [0,2,0,0,0,1|1,0,0]=4 13289 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000210414 [0,2,0,0,0,1|1,0,0]=4 13290 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000210414 [0,2,0,0,0,1|1,0,0]=4 13291 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000210414 [0,2,0,0,0,1|1,0,0]=4 13292 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100000210414 [0,2,0,0,0,1|1,0,0]=4 13293 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100000210414 [0,2,0,0,0,1|1,0,0]=4 13294 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000210414 [0,2,0,0,0,1|1,0,0]=4 13295 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100000210414 [0,2,0,0,0,1|1,0,0]=4 13296 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000210414 [0,2,0,0,0,1|1,0,0]=4 13297 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000210414 [0,2,0,0,0,1|1,0,0]=4 13298 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000210414 [0,2,0,0,0,1|1,0,0]=4 13299 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210414 [0,2,0,0,0,1|1,0,0]=4 13300 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000210414 [0,2,0,0,0,1|1,0,0]=4 13301 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000210414 [0,2,0,0,0,1|1,0,0]=4 13302 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210414 [0,2,0,0,0,1|1,0,0]=4 13303 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210414 [0,2,0,0,0,1|1,0,0]=4 13304 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 11a_106832991635_100000709925 [0,2,0,0,0,1|0,0,0]=3 13305 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 240690a_100102657272_100000709925 [0,2,0,0,0,1|0,0,0]=3 13306 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 527a_100102657272_100000709925 [0,2,0,0,0,1|0,0,0]=3 13307 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 11a_106832991635_100012349508 [0,2,0,0,0,1|0,0,0]=3 13308 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100012349508 [0,2,0,0,0,1|0,0,0]=3 13309 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100102657272_100012349508 [0,2,0,0,0,1|0,0,0]=3 13310 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 11a_106832991635_100000742997 [0,2,0,0,0,1|0,0,0]=3 13311 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 240690a_100102657272_100000742997 [0,2,0,0,0,1|0,0,0]=3 13312 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 527a_100102657272_100000742997 [0,2,0,0,0,1|0,0,0]=3 13313 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [0,2,0,0,0,1|0,0,0]=3 13314 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [0,2,0,0,0,1|0,0,0]=3 13315 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 11a_106832991635_100012340274 [0,2,0,0,0,1|0,0,0]=3 13316 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 240690a_100102657272_100012340274 [0,2,0,0,0,1|0,0,0]=3 13317 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 527a_100102657272_100012340274 [0,2,0,0,0,1|0,0,0]=3 13318 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 11a_106832991635_100000184070 [0,2,0,0,0,1|0,0,0]=3 13319 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 240690a_100102657272_100000184070 [0,2,0,0,0,1|0,0,0]=3 13320 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 527a_100102657272_100000184070 [0,2,0,0,0,1|0,0,0]=3 13321 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 11a_106832991635_100011667458 [0,2,0,0,0,1|0,0,0]=3 13322 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 240690a_100102657272_100011667458 [0,2,0,0,0,1|0,0,0]=3 13323 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 527a_100102657272_100011667458 [0,2,0,0,0,1|0,0,0]=3 13324 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [0,2,0,0,0,1|0,0,0]=3 13325 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [0,2,0,0,0,1|0,0,0]=3 13326 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 11a_106832991635_100000766880 [0,2,0,0,0,1|0,0,0]=3 13327 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100102657272_100000766880 [0,2,0,0,0,1|0,0,0]=3 13328 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100102657272_100000766880 [0,2,0,0,0,1|0,0,0]=3 13329 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000210702 [0,2,0,0,0,1|0,0,0]=3 13330 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210702 [0,2,0,0,0,1|0,0,0]=3 13331 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100102657272_100000210702 [0,2,0,0,0,1|0,0,0]=3 13332 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 11a_106832991635_100011217296 [0,2,0,0,0,1|0,0,0]=3 13333 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100102657272_100011217296 [0,2,0,0,0,1|0,0,0]=3 13334 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100102657272_100011217296 [0,2,0,0,0,1|0,0,0]=3 13335 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 527a_100102657272_100011217296 [0,2,0,0,0,1|0,0,0]=3 13336 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [0,2,0,0,0,1|0,0,0]=3 13337 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [0,2,0,0,0,1|0,0,0]=3 13338 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 11a_106832991635_100000691132 [0,2,0,0,0,1|0,0,0]=3 13339 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 240690a_100102657272_100000691132 [0,2,0,0,0,1|0,0,0]=3 13340 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 527a_100102657272_100000691132 [0,2,0,0,0,1|0,0,0]=3 13341 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 11a_106832991635_100011217375 [0,2,0,0,0,1|0,0,0]=3 13342 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 240690a_100102657272_100011217375 [0,2,0,0,0,1|0,0,0]=3 13343 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 527a_100102657272_100011217375 [0,2,0,0,0,1|0,0,0]=3 13344 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 11a_106832991635_100000722404 [0,2,0,0,0,1|0,0,0]=3 13345 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100102657272_100000722404 [0,2,0,0,0,1|0,0,0]=3 13346 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 527a_100102657272_100000722404 [0,2,0,0,0,1|0,0,0]=3 13347 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 11a_106832991635_100000684721 [0,2,0,0,0,1|0,0,0]=3 13348 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 1626a_100102657272_100000684721 [0,2,0,0,0,1|0,0,0]=3 13349 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 240690a_100102657272_100000684721 [0,2,0,0,0,1|0,0,0]=3 13350 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 527a_100102657272_100000684721 [0,2,0,0,0,1|0,0,0]=3 13351 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 11a_106832991635_100010149632 [0,2,0,0,0,1|0,0,0]=3 13352 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 1626a_100102657272_100010149632 [0,2,0,0,0,1|0,0,0]=3 13353 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 240690a_100102657272_100010149632 [0,2,0,0,0,1|0,0,0]=3 13354 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 527a_100102657272_100010149632 [0,2,0,0,0,1|0,0,0]=3 13355 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [0,2,0,0,0,1|0,0,0]=3 13356 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [0,2,0,0,0,1|0,0,0]=3 13357 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 11a_106832991635_100000082272 [0,2,0,0,0,1|0,0,0]=3 13358 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 240690a_100102657272_100000082272 [0,2,0,0,0,1|0,0,0]=3 13359 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 527a_100102657272_100000082272 [0,2,0,0,0,1|0,0,0]=3 13360 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [0,2,0,0,0,1|0,0,0]=3 13361 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100102657272 [0,2,0,0,0,1|0,0,0]=3 13362 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)C 2430a_100000736455_100102657272 [0,2,0,0,0,1|0,0,0]=3 13363 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100102657272 [0,2,0,0,0,1|0,0,0]=3 13364 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)F 2430a_100000760356_100102657272 [0,2,0,0,0,1|0,0,0]=3 13365 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)I 2430a_100000750458_100102657272 [0,2,0,0,0,1|0,0,0]=3 13366 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100102657272 [0,2,0,0,0,1|0,0,0]=3 13367 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Br 2430a_100000210723_100102657272 [0,2,0,0,0,1|0,0,0]=3 13368 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)C 2430a_100000724040_100102657272 [0,2,0,0,0,1|0,0,0]=3 13369 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100102657272 [0,2,0,0,0,1|0,0,0]=3 13370 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)F 2430a_100000750164_100102657272 [0,2,0,0,0,1|0,0,0]=3 13371 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)I 2430a_100000198070_100102657272 [0,2,0,0,0,1|0,0,0]=3 13372 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100102657272 [0,2,0,0,0,1|0,0,0]=3 13373 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100102657272 [0,2,0,0,0,1|0,0,0]=3 13374 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)C 2430a_100000188892_100102657272 [0,2,0,0,0,1|0,0,0]=3 13375 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100102657272 [0,2,0,0,0,1|0,0,0]=3 13376 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100102657272 [0,2,0,0,0,1|0,0,0]=3 13377 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100102657272 [0,2,0,0,0,1|0,0,0]=3 13378 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100102657272 [0,2,0,0,0,1|0,0,0]=3 13379 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Br 2430a_100000759894_100102657272 [0,2,0,0,0,1|0,0,0]=3 13380 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)C 2430a_100000210958_100102657272 [0,2,0,0,0,1|0,0,0]=3 13381 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100102657272 [0,2,0,0,0,1|0,0,0]=3 13382 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)F 2430a_100000210724_100102657272 [0,2,0,0,0,1|0,0,0]=3 13383 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)I 2430a_100011356925_100102657272 [0,2,0,0,0,1|0,0,0]=3 13384 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100102657272 [0,2,0,0,0,1|0,0,0]=3 13385 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Br 2430a_100000750459_100102657272 [0,2,0,0,0,1|0,0,0]=3 13386 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)C 2430a_100000184131_100102657272 [0,2,0,0,0,1|0,0,0]=3 13387 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100102657272 [0,2,0,0,0,1|0,0,0]=3 13388 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 2430a_114828291077_100102657272 [0,2,0,0,0,1|0,0,0]=3 13389 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 512a_114828291077_100102657272 [0,2,0,0,0,1|0,0,0]=3 13390 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100102657272 [0,2,0,0,0,1|0,0,0]=3 13391 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100102657272 [0,2,0,0,0,1|0,0,0]=3 13392 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100102657272 [0,2,0,0,0,1|0,0,0]=3 13393 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100102657272 [0,2,0,0,0,1|0,0,0]=3 13394 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [0,2,0,0,0,1|1,0,0]=4 13395 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)F 271570a_203496583355_100011435807 [0,2,0,0,0,1|1,0,0]=4 13396 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [0,2,0,0,0,1|1,0,0]=4 13397 B13R1.2879 COC(=O)Nc1ccc(c(c1)N)O 271570a_203496583355_100012639261 [0,2,0,0,0,1|1,0,0]=4 13398 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100000210414_200012349612 [0,2,0,0,0,1|1,0,0]=4 13399 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210202 [0,2,0,0,0,1|1,0,0]=4 13400 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100000210414_100010145525 [0,2,0,0,0,1|1,0,0]=4 13401 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210202 [0,2,0,0,0,1|1,0,0]=4 13402 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100000210414_100012351116 [0,2,0,0,0,1|1,0,0]=4 13403 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210202 [0,2,0,0,0,1|1,0,0]=4 13404 B13R1.40 CCC(=O)Cc1cccc(c1Br)I 1458a_100000210414_100010254545 [0,2,0,0,0,1|1,0,0]=4 13405 B13R1.40 CCC(=O)Cc1cccc(c1C)Br 1458a_100000210414_100000694682 [0,2,0,0,0,1|1,0,0]=4 13406 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100000210414_100011515928 [0,2,0,0,0,1|1,0,0]=4 13407 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210202 [0,2,0,0,0,1|1,0,0]=4 13408 B13R1.40 CCC(=O)Cc1cccc(c1C)Cl 1458a_100000210414_100012186920 [0,2,0,0,0,1|1,0,0]=4 13409 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210202 [0,2,0,0,0,1|1,0,0]=4 13410 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000210414_100009813626 [0,2,0,0,0,1|1,0,0]=4 13411 B13R1.40 CCC(=O)Cc1cccc(c1C)I 1458a_100000210414_100010150147 [0,2,0,0,0,1|1,0,0]=4 13412 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100000210414_100012349491 [0,2,0,0,0,1|1,0,0]=4 13413 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210202 [0,2,0,0,0,1|1,0,0]=4 13414 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000210414_100000720918 [0,2,0,0,0,1|1,0,0]=4 13415 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210202 [0,2,0,0,0,1|1,0,0]=4 13416 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100000210414_100000696688 [0,2,0,0,0,1|1,0,0]=4 13417 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210202 [0,2,0,0,0,1|1,0,0]=4 13418 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100000210414_100012356507 [0,2,0,0,0,1|1,0,0]=4 13419 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210202 [0,2,0,0,0,1|1,0,0]=4 13420 B13R1.40 CCC(=O)Cc1cccc(c1F)C 1458a_100000210414_100011216058 [0,2,0,0,0,1|1,0,0]=4 13421 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000210414_100000716733 [0,2,0,0,0,1|1,0,0]=4 13422 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210202 [0,2,0,0,0,1|1,0,0]=4 13423 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000210414_100000217499 [0,2,0,0,0,1|1,0,0]=4 13424 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210202 [0,2,0,0,0,1|1,0,0]=4 13425 B13R1.40 CCC(=O)Cc1cccc(c1I)F 1458a_100000210414_100010149603 [0,2,0,0,0,1|1,0,0]=4 13426 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 11a_100000684715_100000210414 [0,2,0,0,0,1|1,0,0]=4 13427 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000210414 [0,2,0,0,0,1|1,0,0]=4 13428 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000210414 [0,2,0,0,0,1|1,0,0]=4 13429 B13R1.40 CCC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100000210414 [0,2,0,0,0,1|1,0,0]=4 13430 B13R1.40 CCC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100000210414 [0,2,0,0,0,1|1,0,0]=4 13431 B13R1.40 CCC(=O)Nc1cccc(c1Br)F 11a_100011934729_100000210414 [0,2,0,0,0,1|1,0,0]=4 13432 B13R1.40 CCC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100000210414 [0,2,0,0,0,1|1,0,0]=4 13433 B13R1.40 CCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000210414 [0,2,0,0,0,1|1,0,0]=4 13434 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 11a_100000750434_100000210414 [0,2,0,0,0,1|1,0,0]=4 13435 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100000210414 [0,2,0,0,0,1|1,0,0]=4 13436 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000210414 [0,2,0,0,0,1|1,0,0]=4 13437 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 527a_100000750434_100000210414 [0,2,0,0,0,1|1,0,0]=4 13438 B13R1.40 CCC(=O)Nc1cccc(c1C)C 11a_100000210026_100000210414 [0,2,0,0,0,1|1,0,0]=4 13439 B13R1.40 CCC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000210414 [0,2,0,0,0,1|1,0,0]=4 13440 B13R1.40 CCC(=O)Nc1cccc(c1C)C 22a_100000210026_100000210414 [0,2,0,0,0,1|1,0,0]=4 13441 B13R1.40 CCC(=O)Nc1cccc(c1C)C 527a_100000210026_100000210414 [0,2,0,0,0,1|1,0,0]=4 13442 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100000210414 [0,2,0,0,0,1|1,0,0]=4 13443 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100000210414 [0,2,0,0,0,1|1,0,0]=4 13444 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000210414 [0,2,0,0,0,1|1,0,0]=4 13445 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100000210414 [0,2,0,0,0,1|1,0,0]=4 13446 B13R1.40 CCC(=O)Nc1cccc(c1C)F 11a_100000745574_100000210414 [0,2,0,0,0,1|1,0,0]=4 13447 B13R1.40 CCC(=O)Nc1cccc(c1C)F 1626a_100000745574_100000210414 [0,2,0,0,0,1|1,0,0]=4 13448 B13R1.40 CCC(=O)Nc1cccc(c1C)F 22a_100000745574_100000210414 [0,2,0,0,0,1|1,0,0]=4 13449 B13R1.40 CCC(=O)Nc1cccc(c1C)F 527a_100000745574_100000210414 [0,2,0,0,0,1|1,0,0]=4 13450 B13R1.40 CCC(=O)Nc1cccc(c1C)I 11a_100000761887_100000210414 [0,2,0,0,0,1|1,0,0]=4 13451 B13R1.40 CCC(=O)Nc1cccc(c1C)I 1626a_100000761887_100000210414 [0,2,0,0,0,1|1,0,0]=4 13452 B13R1.40 CCC(=O)Nc1cccc(c1C)I 22a_100000761887_100000210414 [0,2,0,0,0,1|1,0,0]=4 13453 B13R1.40 CCC(=O)Nc1cccc(c1C)I 527a_100000761887_100000210414 [0,2,0,0,0,1|1,0,0]=4 13454 B13R1.40 CCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000210414 [0,2,0,0,0,1|1,0,0]=4 13455 B13R1.40 CCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000210414 [0,2,0,0,0,1|1,0,0]=4 13456 B13R1.40 CCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000210414 [0,2,0,0,0,1|1,0,0]=4 13457 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100000210414 [0,2,0,0,0,1|1,0,0]=4 13458 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100000210414 [0,2,0,0,0,1|1,0,0]=4 13459 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100000210414 [0,2,0,0,0,1|1,0,0]=4 13460 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100000210414 [0,2,0,0,0,1|1,0,0]=4 13461 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000210414 [0,2,0,0,0,1|1,0,0]=4 13462 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000210414 [0,2,0,0,0,1|1,0,0]=4 13463 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100000210414 [0,2,0,0,0,1|1,0,0]=4 13464 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100000210414 [0,2,0,0,0,1|1,0,0]=4 13465 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100000210414 [0,2,0,0,0,1|1,0,0]=4 13466 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100000210414 [0,2,0,0,0,1|1,0,0]=4 13467 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000210414 [0,2,0,0,0,1|1,0,0]=4 13468 B13R1.40 CCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000210414 [0,2,0,0,0,1|1,0,0]=4 13469 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 11a_100011935091_100000210414 [0,2,0,0,0,1|1,0,0]=4 13470 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100000210414 [0,2,0,0,0,1|1,0,0]=4 13471 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000210414 [0,2,0,0,0,1|1,0,0]=4 13472 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100000210414 [0,2,0,0,0,1|1,0,0]=4 13473 B13R1.40 CCC(=O)Nc1cccc(c1F)C 11a_100000697159_100000210414 [0,2,0,0,0,1|1,0,0]=4 13474 B13R1.40 CCC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000210414 [0,2,0,0,0,1|1,0,0]=4 13475 B13R1.40 CCC(=O)Nc1cccc(c1F)C 527a_100000697159_100000210414 [0,2,0,0,0,1|1,0,0]=4 13476 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13477 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13478 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000210414 [0,2,0,0,0,1|1,0,0]=4 13479 B13R1.40 CCC(=O)Nc1cccc(c1F)F 11a_100000743855_100000210414 [0,2,0,0,0,1|1,0,0]=4 13480 B13R1.40 CCC(=O)Nc1cccc(c1F)F 1626a_100000743855_100000210414 [0,2,0,0,0,1|1,0,0]=4 13481 B13R1.40 CCC(=O)Nc1cccc(c1F)F 22a_100000743855_100000210414 [0,2,0,0,0,1|1,0,0]=4 13482 B13R1.40 CCC(=O)Nc1cccc(c1I)Br 11a_100020590159_100000210414 [0,2,0,0,0,1|1,0,0]=4 13483 B13R1.40 CCC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100000210414 [0,2,0,0,0,1|1,0,0]=4 13484 B13R1.40 CCC(=O)Nc1cccc(c1I)C 11a_100000761888_100000210414 [0,2,0,0,0,1|1,0,0]=4 13485 B13R1.40 CCC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000210414 [0,2,0,0,0,1|1,0,0]=4 13486 B13R1.40 CCC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100000210414 [0,2,0,0,0,1|1,0,0]=4 13487 B13R1.40 CCC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100000210414 [0,2,0,0,0,1|1,0,0]=4 13488 B13R1.40 CCC(=O)Nc1cccc(c1I)F 11a_100000690935_100000210414 [0,2,0,0,0,1|1,0,0]=4 13489 B13R1.40 CCC(=O)Nc1cccc(c1I)F 1626a_100000690935_100000210414 [0,2,0,0,0,1|1,0,0]=4 13490 B13R1.40 CCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000210414 [0,2,0,0,0,1|1,0,0]=4 13491 B13R1.40 CCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000210414 [0,2,0,0,0,1|1,0,0]=4 13492 B13R1.40 CCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000210414 [0,2,0,0,0,1|1,0,0]=4 13493 B13R1.40 CCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000210414 [0,2,0,0,0,1|1,0,0]=4 13494 B13R1.40 CCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000210414 [0,2,0,0,0,1|1,0,0]=4 13495 B13R1.40 CCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000210414 [0,2,0,0,0,1|1,0,0]=4 13496 B13R1.40 CCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000210414 [0,2,0,0,0,1|1,0,0]=4 13497 B13R1.40 CCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000210414 [0,2,0,0,0,1|1,0,0]=4 13498 B13R1.40 CCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000210414 [0,2,0,0,0,1|1,0,0]=4 13499 B13R1.40 CCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000210414 [0,2,0,0,0,1|1,0,0]=4 13500 B13R1.40 CCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000210414 [0,2,0,0,0,1|1,0,0]=4 13501 B13R1.40 CCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000210414 [0,2,0,0,0,1|1,0,0]=4 13502 B13R1.40 CCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000210414 [0,2,0,0,0,1|1,0,0]=4 13503 B13R1.40 CCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000210414 [0,2,0,0,0,1|1,0,0]=4 13504 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 11a_106832991635_100010147021 [0,2,0,0,0,1|0,0,0]=3 13505 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 1626a_100102657272_100010147021 [0,2,0,0,0,1|0,0,0]=3 13506 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 240690a_100102657272_100010147021 [0,2,0,0,0,1|0,0,0]=3 13507 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 527a_100102657272_100010147021 [0,2,0,0,0,1|0,0,0]=3 13508 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 11a_106832991635_100010145769 [0,2,0,0,0,1|0,0,0]=3 13509 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 1626a_100102657272_100010145769 [0,2,0,0,0,1|0,0,0]=3 13510 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 240690a_100102657272_100010145769 [0,2,0,0,0,1|0,0,0]=3 13511 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 527a_100102657272_100010145769 [0,2,0,0,0,1|0,0,0]=3 13512 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 11a_106832991635_100012356664 [0,2,0,0,0,1|0,0,0]=3 13513 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 1626a_100102657272_100012356664 [0,2,0,0,0,1|0,0,0]=3 13514 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 240690a_100102657272_100012356664 [0,2,0,0,0,1|0,0,0]=3 13515 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 527a_100102657272_100012356664 [0,2,0,0,0,1|0,0,0]=3 13516 B13R1.40 CNC(=O)Cc1cccc(c1C)C 11a_106832991635_100011698479 [0,2,0,0,0,1|0,0,0]=3 13517 B13R1.40 CNC(=O)Cc1cccc(c1C)C 1626a_100102657272_100011698479 [0,2,0,0,0,1|0,0,0]=3 13518 B13R1.40 CNC(=O)Cc1cccc(c1C)C 240690a_100102657272_100011698479 [0,2,0,0,0,1|0,0,0]=3 13519 B13R1.40 CNC(=O)Cc1cccc(c1C)C 527a_100102657272_100011698479 [0,2,0,0,0,1|0,0,0]=3 13520 B13R1.40 CNC(=O)Cc1cccc(c1C)F 11a_106832991635_100000035905 [0,2,0,0,0,1|0,0,0]=3 13521 B13R1.40 CNC(=O)Cc1cccc(c1C)F 1626a_100102657272_100000035905 [0,2,0,0,0,1|0,0,0]=3 13522 B13R1.40 CNC(=O)Cc1cccc(c1C)F 240690a_100102657272_100000035905 [0,2,0,0,0,1|0,0,0]=3 13523 B13R1.40 CNC(=O)Cc1cccc(c1C)F 527a_100102657272_100000035905 [0,2,0,0,0,1|0,0,0]=3 13524 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 11a_106832991635_100010145770 [0,2,0,0,0,1|0,0,0]=3 13525 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 1626a_100102657272_100010145770 [0,2,0,0,0,1|0,0,0]=3 13526 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 240690a_100102657272_100010145770 [0,2,0,0,0,1|0,0,0]=3 13527 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 527a_100102657272_100010145770 [0,2,0,0,0,1|0,0,0]=3 13528 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 11a_106832991635_100000759314 [0,2,0,0,0,1|0,0,0]=3 13529 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 1626a_100102657272_100000759314 [0,2,0,0,0,1|0,0,0]=3 13530 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 240690a_100102657272_100000759314 [0,2,0,0,0,1|0,0,0]=3 13531 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 527a_100102657272_100000759314 [0,2,0,0,0,1|0,0,0]=3 13532 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 11a_106832991635_100012001123 [0,2,0,0,0,1|0,0,0]=3 13533 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 1626a_100102657272_100012001123 [0,2,0,0,0,1|0,0,0]=3 13534 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 240690a_100102657272_100012001123 [0,2,0,0,0,1|0,0,0]=3 13535 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 527a_100102657272_100012001123 [0,2,0,0,0,1|0,0,0]=3 13536 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 11a_106832991635_100011935088 [0,2,0,0,0,1|0,0,0]=3 13537 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 1626a_100102657272_100011935088 [0,2,0,0,0,1|0,0,0]=3 13538 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 240690a_100102657272_100011935088 [0,2,0,0,0,1|0,0,0]=3 13539 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 527a_100102657272_100011935088 [0,2,0,0,0,1|0,0,0]=3 13540 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 11a_106832991635_100000709823 [0,2,0,0,0,1|0,0,0]=3 13541 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 1626a_100102657272_100000709823 [0,2,0,0,0,1|0,0,0]=3 13542 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 240690a_100102657272_100000709823 [0,2,0,0,0,1|0,0,0]=3 13543 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 527a_100102657272_100000709823 [0,2,0,0,0,1|0,0,0]=3 13544 B13R1.40 CNC(=O)Cc1cccc(c1F)F 11a_106832991635_100000684727 [0,2,0,0,0,1|0,0,0]=3 13545 B13R1.40 CNC(=O)Cc1cccc(c1F)F 1626a_100102657272_100000684727 [0,2,0,0,0,1|0,0,0]=3 13546 B13R1.40 CNC(=O)Cc1cccc(c1F)F 240690a_100102657272_100000684727 [0,2,0,0,0,1|0,0,0]=3 13547 B13R1.40 CNC(=O)Cc1cccc(c1F)F 527a_100102657272_100000684727 [0,2,0,0,0,1|0,0,0]=3 13548 B13R1.40 CNC(=O)Cn1cccc(c1=O)C 240690a_100102657272_100000697016 [0,2,0,0,0,1|1,0,0]=4 13549 B13R1.40 CNC(=O)Cn1cccc(c1=O)C 527a_100102657272_100000697016 [0,2,0,0,0,1|1,0,0]=4 13550 B13R1.40 CNC(=O)Nc1cccc(c1Br)C 2430a_100000684715_100102657272 [0,2,0,0,0,1|0,0,0]=3 13551 B13R1.40 CNC(=O)Nc1cccc(c1Br)Cl 2430a_100000687072_100102657272 [0,2,0,0,0,1|0,0,0]=3 13552 B13R1.40 CNC(=O)Nc1cccc(c1Br)F 2430a_100011934729_100102657272 [0,2,0,0,0,1|0,0,0]=3 13553 B13R1.40 CNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100102657272 [0,2,0,0,0,1|0,0,0]=3 13554 B13R1.40 CNC(=O)Nc1cccc(c1C)Br 2430a_100000750434_100102657272 [0,2,0,0,0,1|0,0,0]=3 13555 B13R1.40 CNC(=O)Nc1cccc(c1C)C 2430a_100000210026_100102657272 [0,2,0,0,0,1|0,0,0]=3 13556 B13R1.40 CNC(=O)Nc1cccc(c1C)Cl 2430a_100000210441_100102657272 [0,2,0,0,0,1|0,0,0]=3 13557 B13R1.40 CNC(=O)Nc1cccc(c1C)F 2430a_100000745574_100102657272 [0,2,0,0,0,1|0,0,0]=3 13558 B13R1.40 CNC(=O)Nc1cccc(c1C)I 2430a_100000761887_100102657272 [0,2,0,0,0,1|0,0,0]=3 13559 B13R1.40 CNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100102657272 [0,2,0,0,0,1|0,0,0]=3 13560 B13R1.40 CNC(=O)Nc1cccc(c1Cl)Br 2430a_100000687075_100102657272 [0,2,0,0,0,1|0,0,0]=3 13561 B13R1.40 CNC(=O)Nc1cccc(c1Cl)C 2430a_100000765562_100102657272 [0,2,0,0,0,1|0,0,0]=3 13562 B13R1.40 CNC(=O)Nc1cccc(c1Cl)Cl 2430a_100000185733_100102657272 [0,2,0,0,0,1|0,0,0]=3 13563 B13R1.40 CNC(=O)Nc1cccc(c1Cl)F 2430a_100000692321_100102657272 [0,2,0,0,0,1|0,0,0]=3 13564 B13R1.40 CNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100102657272 [0,2,0,0,0,1|0,0,0]=3 13565 B13R1.40 CNC(=O)Nc1cccc(c1F)Br 2430a_100011935091_100102657272 [0,2,0,0,0,1|0,0,0]=3 13566 B13R1.40 CNC(=O)Nc1cccc(c1F)Br 512a_100011935091_100102657272 [0,2,0,0,0,1|0,0,0]=3 13567 B13R1.40 CNC(=O)Nc1cccc(c1F)C 2430a_100000697159_100102657272 [0,2,0,0,0,1|0,0,0]=3 13568 B13R1.40 CNC(=O)Nc1cccc(c1F)C 512a_100000697159_100102657272 [0,2,0,0,0,1|0,0,0]=3 13569 B13R1.40 CNC(=O)Nc1cccc(c1F)Cl 2430a_100000199060_100102657272 [0,2,0,0,0,1|0,0,0]=3 13570 B13R1.40 CNC(=O)Nc1cccc(c1F)F 2430a_100000743855_100102657272 [0,2,0,0,0,1|0,0,0]=3 13571 B13R1.40 CNC(=O)Nc1cccc(c1F)F 512a_100000743855_100102657272 [0,2,0,0,0,1|0,0,0]=3 13572 B13R1.40 CNC(=O)Nc1cccc(c1I)Br 2430a_100020590159_100102657272 [0,2,0,0,0,1|0,0,0]=3 13573 B13R1.40 CNC(=O)Nc1cccc(c1I)Br 512a_100020590159_100102657272 [0,2,0,0,0,1|0,0,0]=3 13574 B13R1.40 CNC(=O)Nc1cccc(c1I)C 2430a_100000761888_100102657272 [0,2,0,0,0,1|0,0,0]=3 13575 B13R1.40 CNC(=O)Nc1cccc(c1I)Cl 2430a_100000049713_100102657272 [0,2,0,0,0,1|0,0,0]=3 13576 B13R1.40 CNC(=O)Nc1cccc(c1I)F 512a_100000690935_100102657272 [0,2,0,0,0,1|0,0,0]=3 13577 B13R1.40 CNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100102657272 [0,2,0,0,0,1|0,0,0]=3 13578 B13R1.40 CNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100102657272 [0,2,0,0,0,1|0,0,0]=3 13579 B13R1.40 CNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100102657272 [0,2,0,0,0,1|0,0,0]=3 13580 B13R1.40 CNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100102657272 [0,2,0,0,0,1|0,0,0]=3 13581 B13R1.40 CNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100102657272 [0,2,0,0,0,1|0,0,0]=3 13582 B13R1.40 COC(=O)Cc1cccc(c1F)O 271570a_203496583355_100010741560 [0,2,0,0,0,1|1,0,0]=4 13583 B13R1.40 COC(=O)Cc1cccc(c1O)C 271570a_203496583355_200010150888 [0,2,0,0,0,1|1,0,0]=4 13584 B13R1.40 COC(=O)Cc1cccc(c1O)O 271570a_203496583355_100010150830 [0,2,0,0,0,1|1,0,0]=4 13585 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 11a_100000735509_100000210414 [0,2,0,0,0,1|1,0,0]=4 13586 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 1626a_100000735509_100000210414 [0,2,0,0,0,1|1,0,0]=4 13587 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 22a_100000735509_100000210414 [0,2,0,0,0,1|1,0,0]=4 13588 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 527a_100000735509_100000210414 [0,2,0,0,0,1|1,0,0]=4 13589 B13R1.81 C#Cc1cccc(c1)NC(=O)NC 2430a_100000735509_100102657272 [0,2,0,0,0,1|0,0,0]=3 13590 B13R1.81 C#Cc1cccc(c1)NC(=O)NC 512a_100000735509_100102657272 [0,2,0,0,0,1|0,0,0]=3 13591 B13R1.81 C=Cc1cccc(c1)CC(=O)OC 271570a_100011290941_100000699549 [0,2,0,0,0,1|1,0,0]=4 13592 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 11a_100011827668_100000210414 [0,2,0,0,0,1|1,0,0]=4 13593 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 1626a_100011827668_100000210414 [0,2,0,0,0,1|1,0,0]=4 13594 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 22a_100011827668_100000210414 [0,2,0,0,0,1|1,0,0]=4 13595 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 527a_100011827668_100000210414 [0,2,0,0,0,1|1,0,0]=4 13596 B13R1.81 C=Cc1cccc(c1)NC(=O)NC 2430a_100011827668_100102657272 [0,2,0,0,0,1|0,0,0]=3 13597 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000210414_100000233786 [0,2,0,0,0,1|1,0,0]=4 13598 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000210202 [0,2,0,0,0,1|1,0,0]=4 13599 B13R1.81 CCC(=O)Cc1cccc(c1)C=O 1458a_100000210414_100009816774 [0,2,0,0,0,1|1,0,0]=4 13600 B13R1.81 CCC(=O)Cc1cccc(c1)CO 1458a_100000210414_100010188025 [0,2,0,0,0,1|1,0,0]=4 13601 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000210414_100000211672 [0,2,0,0,0,1|1,0,0]=4 13602 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210202 [0,2,0,0,0,1|1,0,0]=4 13603 B13R1.81 CCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000210202 [0,2,0,0,0,1|1,0,0]=4 13604 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 11a_100000210922_100000210414 [0,2,0,0,0,1|1,0,0]=4 13605 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100000210414 [0,2,0,0,0,1|1,0,0]=4 13606 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000210414 [0,2,0,0,0,1|1,0,0]=4 13607 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 527a_100000210922_100000210414 [0,2,0,0,0,1|1,0,0]=4 13608 B13R1.81 CCC(=O)Nc1cccc(c1)CC 11a_100000211250_100000210414 [0,2,0,0,0,1|1,0,0]=4 13609 B13R1.81 CCC(=O)Nc1cccc(c1)CC 1626a_100000211250_100000210414 [0,2,0,0,0,1|1,0,0]=4 13610 B13R1.81 CCC(=O)Nc1cccc(c1)CC 22a_100000211250_100000210414 [0,2,0,0,0,1|1,0,0]=4 13611 B13R1.81 CCC(=O)Nc1cccc(c1)CC 527a_100000211250_100000210414 [0,2,0,0,0,1|1,0,0]=4 13612 B13R1.81 CCC(=O)Nc1cccc(c1)CF 11a_100000126320_100000210414 [0,2,0,0,0,1|1,0,0]=4 13613 B13R1.81 CCC(=O)Nc1cccc(c1)CF 1626a_100000126320_100000210414 [0,2,0,0,0,1|1,0,0]=4 13614 B13R1.81 CCC(=O)Nc1cccc(c1)CF 22a_100000126320_100000210414 [0,2,0,0,0,1|1,0,0]=4 13615 B13R1.81 CCC(=O)Nc1cccc(c1)CF 527a_100000126320_100000210414 [0,2,0,0,0,1|1,0,0]=4 13616 B13R1.81 CCC(=O)Nc1cccc(c1)CO 22a_100000211919_100000210414 [0,2,0,0,0,1|1,0,0]=4 13617 B13R1.81 CCC(=O)Nc1cccc(c1)NC 34a_100000186510_200000210301 [0,2,0,0,0,1|1,0,0]=4 13618 B13R1.81 CCC(=O)Nc1cccc(c1)N[13CH3] 34a_100000186510_200025704644 [0,2,0,0,0,1|1,0,0]=4 13619 B13R1.81 CCC(=O)Nc1cccc(c1)OC 11a_100000210024_100000210414 [0,2,0,0,0,1|1,0,0]=4 13620 B13R1.81 CCC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000210414 [0,2,0,0,0,1|1,0,0]=4 13621 B13R1.81 CCC(=O)Nc1cccc(c1)OC 22a_100000210024_100000210414 [0,2,0,0,0,1|1,0,0]=4 13622 B13R1.81 CCC(=O)Nc1cccc(c1)OC 34a_100000158609_200000210301 [0,2,0,0,0,1|1,0,0]=4 13623 B13R1.81 CCC(=O)Nc1cccc(c1)OC 527a_100000210024_100000210414 [0,2,0,0,0,1|1,0,0]=4 13624 B13R1.81 CCC(=O)Nc1cccc(c1)OC 7a_100000158609_200000210301 [0,2,0,0,0,1|1,0,0]=4 13625 B13R1.81 CCC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158609_200025704644 [0,2,0,0,0,1|1,0,0]=4 13626 B13R1.81 CCC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158609_200025704644 [0,2,0,0,0,1|1,0,0]=4 13627 B13R1.81 CCC(=O)Nc1cccc(c1)SC 11a_100000210049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13628 B13R1.81 CCC(=O)Nc1cccc(c1)SC 1626a_100000210049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13629 B13R1.81 CCC(=O)Nc1cccc(c1)SC 22a_100000210049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13630 B13R1.81 CCC(=O)Nc1cccc(c1)SC 527a_100000210049_100000210414 [0,2,0,0,0,1|1,0,0]=4 13631 B13R1.81 CCc1cccc(c1)NC(=O)NC 2430a_100000211250_100102657272 [0,2,0,0,0,1|0,0,0]=3 13632 B13R1.81 CCc1cccc(c1)NC(=O)NC 512a_100000211250_100102657272 [0,2,0,0,0,1|0,0,0]=3 13633 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 11a_106832991635_100000684415 [0,2,0,0,0,1|0,0,0]=3 13634 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 1626a_100102657272_100000684415 [0,2,0,0,0,1|0,0,0]=3 13635 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 240690a_100102657272_100000684415 [0,2,0,0,0,1|0,0,0]=3 13636 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 527a_100102657272_100000684415 [0,2,0,0,0,1|0,0,0]=3 13637 B13R1.81 CNC(=O)Cc1cccc(c1)NC 2230a_100011690097_200000210301 [0,2,0,0,0,1|0,0,0]=3 13638 B13R1.81 CNC(=O)Cc1cccc(c1)NC 34a_100011690097_200000210301 [0,2,0,0,0,1|0,0,0]=3 13639 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 2230a_100011690097_200025704644 [0,2,0,0,0,1|0,0,0]=3 13640 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 34a_100011690097_200025704644 [0,2,0,0,0,1|0,0,0]=3 13641 B13R1.81 CNC(=O)Cc1cccc(c1)OC 11a_106832991635_100000211281 [0,2,0,0,0,1|0,0,0]=3 13642 B13R1.81 CNC(=O)Cc1cccc(c1)OC 1626a_100102657272_100000211281 [0,2,0,0,0,1|0,0,0]=3 13643 B13R1.81 CNC(=O)Cc1cccc(c1)OC 240690a_100102657272_100000211281 [0,2,0,0,0,1|0,0,0]=3 13644 B13R1.81 CNC(=O)Cc1cccc(c1)OC 527a_100102657272_100000211281 [0,2,0,0,0,1|0,0,0]=3 13645 B13R1.81 CNC(=O)Cc1cccc(c1)SC 11a_106832991635_100000035702 [0,2,0,0,0,1|0,0,0]=3 13646 B13R1.81 CNC(=O)Cc1cccc(c1)SC 1626a_100102657272_100000035702 [0,2,0,0,0,1|0,0,0]=3 13647 B13R1.81 CNC(=O)Cc1cccc(c1)SC 240690a_100102657272_100000035702 [0,2,0,0,0,1|0,0,0]=3 13648 B13R1.81 CNC(=O)Cc1cccc(c1)SC 527a_100102657272_100000035702 [0,2,0,0,0,1|0,0,0]=3 13649 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 11a_106832991635_100000718155 [0,2,0,0,0,1|1,0,0]=4 13650 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 240690a_100102657272_100000718155 [0,2,0,0,0,1|1,0,0]=4 13651 B13R1.81 CNC(=O)Nc1cccc(c1)C#N 2430a_100000210922_100102657272 [0,2,0,0,0,1|0,0,0]=3 13652 B13R1.81 CNC(=O)Nc1cccc(c1)C#N 512a_100000210922_100102657272 [0,2,0,0,0,1|0,0,0]=3 13653 B13R1.81 CNC(=O)Nc1cccc(c1)CF 2430a_100000126320_100102657272 [0,2,0,0,0,1|0,0,0]=3 13654 B13R1.81 CNC(=O)Nc1cccc(c1)CF 512a_100000126320_100102657272 [0,2,0,0,0,1|0,0,0]=3 13655 B13R1.81 CNC(=O)Nc1cccc(c1)CO 2430a_100000211919_100102657272 [0,2,0,0,0,1|0,0,0]=3 13656 B13R1.81 CNC(=O)Nc1cccc(c1)OC 2430a_100000210024_100102657272 [0,2,0,0,0,1|0,0,0]=3 13657 B13R1.81 CNC(=O)Nc1cccc(c1)OC 512a_100000210024_100102657272 [0,2,0,0,0,1|0,0,0]=3 13658 B13R1.81 CNC(=O)Nc1cccc(c1)SC 2430a_100000210049_100102657272 [0,2,0,0,0,1|0,0,0]=3 13659 B13R1.81 CNC(=O)Nc1cccc(c1)SC 512a_100000210049_100102657272 [0,2,0,0,0,1|0,0,0]=3 13660 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_100000699549_200000210301 [0,2,0,0,0,1|1,0,0]=4 13661 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_200000210301_100000699549 [0,2,0,0,0,1|1,0,0]=4 13662 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_100000699549_200025704644 [0,2,0,0,0,1|1,0,0]=4 13663 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000699549 [0,2,0,0,0,1|1,0,0]=4 13664 B13R1.81 COC(=O)Nc1cccc(c1)OC 34a_100000741004_200000210301 [0,2,0,0,0,1|1,0,0]=4 13665 B13R1.81 COC(=O)Nc1cccc(c1)OC 7a_100000741004_200000210301 [0,2,0,0,0,1|1,0,0]=4 13666 B13R1.81 COC(=O)Nc1cccc(c1)O[13CH3] 34a_100000741004_200025704644 [0,2,0,0,0,1|1,0,0]=4 13667 B13R1.81 COC(=O)Nc1cccc(c1)O[13CH3] 7a_100000741004_200025704644 [0,2,0,0,0,1|1,0,0]=4 13668 B13R1.81 COc1cccc(c1)CC(=O)NN 34a_100011472680_200000210301 [0,2,0,0,0,1|1,0,0]=4 13669 B13R1.81 [13CH3]Oc1cccc(c1)CC(=O)NN 34a_100011472680_200025704644 [0,2,0,0,0,1|1,0,0]=4 13670 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Br 270084a_100102657272_100000726588 [0,2,0,0,0,1|1,0,0]=4 13671 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Br 274078a_100102657272_100000726588 [0,2,0,0,0,1|1,0,0]=4 13672 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 270084a_100102657272_100000743697 [0,2,0,0,0,1|1,0,0]=4 13673 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 274078a_100102657272_100000743697 [0,2,0,0,0,1|1,0,0]=4 13674 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 40a_100102657272_100015207158 [0,2,0,0,0,1|1,0,0]=4 13675 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Cl 270084a_100102657272_100000725668 [0,2,0,0,0,1|1,0,0]=4 13676 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Cl 274078a_100102657272_100000725668 [0,2,0,0,0,1|1,0,0]=4 13677 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)F 270084a_100102657272_100000750188 [0,2,0,0,0,1|1,0,0]=4 13678 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)F 274078a_100102657272_100000750188 [0,2,0,0,0,1|1,0,0]=4 13679 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100000210414_100011982794 [0,2,0,0,0,1|1,0,0]=4 13680 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210202 [0,2,0,0,0,1|1,0,0]=4 13681 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210202 [0,2,0,0,0,1|1,0,0]=4 13682 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000210414_100000733903 [0,2,0,0,0,1|1,0,0]=4 13683 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210202 [0,2,0,0,0,1|1,0,0]=4 13684 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000210414_100000736370 [0,2,0,0,0,1|1,0,0]=4 13685 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210202 [0,2,0,0,0,1|1,0,0]=4 13686 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)I 1458a_100000210414_100012355412 [0,2,0,0,0,1|1,0,0]=4 13687 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210202 [0,2,0,0,0,1|1,0,0]=4 13688 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000210414_100000184699 [0,2,0,0,0,1|1,0,0]=4 13689 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210202 [0,2,0,0,0,1|1,0,0]=4 13690 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Cl 1458a_100000210414_100012186985 [0,2,0,0,0,1|1,0,0]=4 13691 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100000210414_100000709795 [0,2,0,0,0,1|1,0,0]=4 13692 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210202 [0,2,0,0,0,1|1,0,0]=4 13693 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000210414_100000763347 [0,2,0,0,0,1|1,0,0]=4 13694 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210202 [0,2,0,0,0,1|1,0,0]=4 13695 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)C 1458a_100000210414_100009871730 [0,2,0,0,0,1|1,0,0]=4 13696 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000210414_100000754809 [0,2,0,0,0,1|1,0,0]=4 13697 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210202 [0,2,0,0,0,1|1,0,0]=4 13698 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100000210414_100000709952 [0,2,0,0,0,1|1,0,0]=4 13699 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210202 [0,2,0,0,0,1|1,0,0]=4 13700 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)I 1458a_100000210414_100010188191 [0,2,0,0,0,1|1,0,0]=4 13701 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000210414_100000736399 [0,2,0,0,0,1|1,0,0]=4 13702 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210202 [0,2,0,0,0,1|1,0,0]=4 13703 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100000210414_100011260760 [0,2,0,0,0,1|1,0,0]=4 13704 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210202 [0,2,0,0,0,1|1,0,0]=4 13705 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100000210414_100000716957 [0,2,0,0,0,1|1,0,0]=4 13706 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210202 [0,2,0,0,0,1|1,0,0]=4 13707 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000210414_100000741279 [0,2,0,0,0,1|1,0,0]=4 13708 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210202 [0,2,0,0,0,1|1,0,0]=4 13709 B13R1.2872 CCC(=O)Cc1cc(ccc1F)I 1458a_100000210414_200010149601 [0,2,0,0,0,1|1,0,0]=4 13710 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Br 1458a_100000210414_100012362523 [0,2,0,0,0,1|1,0,0]=4 13711 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Cl 1458a_100000210414_100012348826 [0,2,0,0,0,1|1,0,0]=4 13712 B13R1.2872 CCC(=O)Cc1cc(ccc1I)F 1458a_100000210414_100010149606 [0,2,0,0,0,1|1,0,0]=4 13713 B13R1.2872 CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210202 [0,2,0,0,0,1|1,0,0]=4 13714 B13R1.2872 CCC(=O)Cc1cc(ccc1O)F 1458a_100000210414_100010161318 [0,2,0,0,0,1|1,0,0]=4 13715 B13R1.2872 CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210202 [0,2,0,0,0,1|1,0,0]=4 13716 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000210414 [0,2,0,0,0,1|1,0,0]=4 13717 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000210414 [0,2,0,0,0,1|1,0,0]=4 13718 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000210414 [0,2,0,0,0,1|1,0,0]=4 13719 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000210414 [0,2,0,0,0,1|1,0,0]=4 13720 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000210414 [0,2,0,0,0,1|1,0,0]=4 13721 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000210414 [0,2,0,0,0,1|1,0,0]=4 13722 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000210414 [0,2,0,0,0,1|1,0,0]=4 13723 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000210414 [0,2,0,0,0,1|1,0,0]=4 13724 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000210414 [0,2,0,0,0,1|1,0,0]=4 13725 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000210414 [0,2,0,0,0,1|1,0,0]=4 13726 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000210414 [0,2,0,0,0,1|1,0,0]=4 13727 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000210414 [0,2,0,0,0,1|1,0,0]=4 13728 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000210414 [0,2,0,0,0,1|1,0,0]=4 13729 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000210414 [0,2,0,0,0,1|1,0,0]=4 13730 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000210414 [0,2,0,0,0,1|1,0,0]=4 13731 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000210414 [0,2,0,0,0,1|1,0,0]=4 13732 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000210414 [0,2,0,0,0,1|1,0,0]=4 13733 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000210414 [0,2,0,0,0,1|1,0,0]=4 13734 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000210414 [0,2,0,0,0,1|1,0,0]=4 13735 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000210414 [0,2,0,0,0,1|1,0,0]=4 13736 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000210414 [0,2,0,0,0,1|1,0,0]=4 13737 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000210414 [0,2,0,0,0,1|1,0,0]=4 13738 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000210414 [0,2,0,0,0,1|1,0,0]=4 13739 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000210414 [0,2,0,0,0,1|1,0,0]=4 13740 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000210414 [0,2,0,0,0,1|1,0,0]=4 13741 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000210414 [0,2,0,0,0,1|1,0,0]=4 13742 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000210414 [0,2,0,0,0,1|1,0,0]=4 13743 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000210414 [0,2,0,0,0,1|1,0,0]=4 13744 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000210414 [0,2,0,0,0,1|1,0,0]=4 13745 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000210414 [0,2,0,0,0,1|1,0,0]=4 13746 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000210414 [0,2,0,0,0,1|1,0,0]=4 13747 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000210414 [0,2,0,0,0,1|1,0,0]=4 13748 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000210414 [0,2,0,0,0,1|1,0,0]=4 13749 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000210414 [0,2,0,0,0,1|1,0,0]=4 13750 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000210414 [0,2,0,0,0,1|1,0,0]=4 13751 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000210414 [0,2,0,0,0,1|1,0,0]=4 13752 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000210414 [0,2,0,0,0,1|1,0,0]=4 13753 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000210414 [0,2,0,0,0,1|1,0,0]=4 13754 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000210414 [0,2,0,0,0,1|1,0,0]=4 13755 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000210414 [0,2,0,0,0,1|1,0,0]=4 13756 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000210414 [0,2,0,0,0,1|1,0,0]=4 13757 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000210414 [0,2,0,0,0,1|1,0,0]=4 13758 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000210414 [0,2,0,0,0,1|1,0,0]=4 13759 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000210414 [0,2,0,0,0,1|1,0,0]=4 13760 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000210414 [0,2,0,0,0,1|1,0,0]=4 13761 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000210414 [0,2,0,0,0,1|1,0,0]=4 13762 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000210414 [0,2,0,0,0,1|1,0,0]=4 13763 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000210414 [0,2,0,0,0,1|1,0,0]=4 13764 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000210414 [0,2,0,0,0,1|1,0,0]=4 13765 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000210414 [0,2,0,0,0,1|1,0,0]=4 13766 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000210414 [0,2,0,0,0,1|1,0,0]=4 13767 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000210414 [0,2,0,0,0,1|1,0,0]=4 13768 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000210414 [0,2,0,0,0,1|1,0,0]=4 13769 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000210414 [0,2,0,0,0,1|1,0,0]=4 13770 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000210414 [0,2,0,0,0,1|1,0,0]=4 13771 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000210414 [0,2,0,0,0,1|1,0,0]=4 13772 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000210414 [0,2,0,0,0,1|1,0,0]=4 13773 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000210414 [0,2,0,0,0,1|1,0,0]=4 13774 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000210414 [0,2,0,0,0,1|1,0,0]=4 13775 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000210414 [0,2,0,0,0,1|1,0,0]=4 13776 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000210414 [0,2,0,0,0,1|1,0,0]=4 13777 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13778 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13779 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000210414 [0,2,0,0,0,1|1,0,0]=4 13780 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000210414 [0,2,0,0,0,1|1,0,0]=4 13781 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000210414 [0,2,0,0,0,1|1,0,0]=4 13782 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000210414 [0,2,0,0,0,1|1,0,0]=4 13783 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000210414 [0,2,0,0,0,1|1,0,0]=4 13784 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000210414 [0,2,0,0,0,1|1,0,0]=4 13785 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000210414 [0,2,0,0,0,1|1,0,0]=4 13786 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000210414 [0,2,0,0,0,1|1,0,0]=4 13787 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000210414 [0,2,0,0,0,1|1,0,0]=4 13788 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000210414 [0,2,0,0,0,1|1,0,0]=4 13789 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000210414 [0,2,0,0,0,1|1,0,0]=4 13790 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000210414 [0,2,0,0,0,1|1,0,0]=4 13791 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000210414 [0,2,0,0,0,1|1,0,0]=4 13792 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000210414 [0,2,0,0,0,1|1,0,0]=4 13793 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000210414 [0,2,0,0,0,1|1,0,0]=4 13794 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000210414 [0,2,0,0,0,1|1,0,0]=4 13795 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000210414 [0,2,0,0,0,1|1,0,0]=4 13796 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 11a_106832991635_100010004897 [0,2,0,0,0,1|0,0,0]=3 13797 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 240690a_100102657272_100010004897 [0,2,0,0,0,1|0,0,0]=3 13798 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 527a_100102657272_100010004897 [0,2,0,0,0,1|0,0,0]=3 13799 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 11a_106832991635_100010004923 [0,2,0,0,0,1|0,0,0]=3 13800 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 1626a_100102657272_100010004923 [0,2,0,0,0,1|0,0,0]=3 13801 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 240690a_100102657272_100010004923 [0,2,0,0,0,1|0,0,0]=3 13802 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 527a_100102657272_100010004923 [0,2,0,0,0,1|0,0,0]=3 13803 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 11a_106832991635_100000690875 [0,2,0,0,0,1|0,0,0]=3 13804 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 1626a_100102657272_100000690875 [0,2,0,0,0,1|0,0,0]=3 13805 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 240690a_100102657272_100000690875 [0,2,0,0,0,1|0,0,0]=3 13806 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 527a_100102657272_100000690875 [0,2,0,0,0,1|0,0,0]=3 13807 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 11a_106832991635_100000690878 [0,2,0,0,0,1|0,0,0]=3 13808 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 1626a_100102657272_100000690878 [0,2,0,0,0,1|0,0,0]=3 13809 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 240690a_100102657272_100000690878 [0,2,0,0,0,1|0,0,0]=3 13810 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 527a_100102657272_100000690878 [0,2,0,0,0,1|0,0,0]=3 13811 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 11a_106832991635_100010244045 [0,2,0,0,0,1|0,0,0]=3 13812 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 1626a_100102657272_100010244045 [0,2,0,0,0,1|0,0,0]=3 13813 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 240690a_100102657272_100010244045 [0,2,0,0,0,1|0,0,0]=3 13814 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 527a_100102657272_100010244045 [0,2,0,0,0,1|0,0,0]=3 13815 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 11a_106832991635_100000749331 [0,2,0,0,0,1|0,0,0]=3 13816 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 1626a_100102657272_100000749331 [0,2,0,0,0,1|0,0,0]=3 13817 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 240690a_100102657272_100000749331 [0,2,0,0,0,1|0,0,0]=3 13818 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 527a_100102657272_100000749331 [0,2,0,0,0,1|0,0,0]=3 13819 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 11a_106832991635_100011219217 [0,2,0,0,0,1|0,0,0]=3 13820 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 1626a_100102657272_100011219217 [0,2,0,0,0,1|0,0,0]=3 13821 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 240690a_100102657272_100011219217 [0,2,0,0,0,1|0,0,0]=3 13822 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 527a_100102657272_100011219217 [0,2,0,0,0,1|0,0,0]=3 13823 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 11a_106832991635_100011600618 [0,2,0,0,0,1|0,0,0]=3 13824 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 1626a_100102657272_100011600618 [0,2,0,0,0,1|0,0,0]=3 13825 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 240690a_100102657272_100011600618 [0,2,0,0,0,1|0,0,0]=3 13826 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 527a_100102657272_100011600618 [0,2,0,0,0,1|0,0,0]=3 13827 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 11a_106832991635_100000748246 [0,2,0,0,0,1|0,0,0]=3 13828 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100102657272_100000748246 [0,2,0,0,0,1|0,0,0]=3 13829 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100102657272_100000748246 [0,2,0,0,0,1|0,0,0]=3 13830 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 527a_100102657272_100000748246 [0,2,0,0,0,1|0,0,0]=3 13831 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 11a_106832991635_100011830335 [0,2,0,0,0,1|0,0,0]=3 13832 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 1626a_100102657272_100011830335 [0,2,0,0,0,1|0,0,0]=3 13833 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 240690a_100102657272_100011830335 [0,2,0,0,0,1|0,0,0]=3 13834 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 527a_100102657272_100011830335 [0,2,0,0,0,1|0,0,0]=3 13835 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 11a_106832991635_100000690877 [0,2,0,0,0,1|0,0,0]=3 13836 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 1626a_100102657272_100000690877 [0,2,0,0,0,1|0,0,0]=3 13837 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 240690a_100102657272_100000690877 [0,2,0,0,0,1|0,0,0]=3 13838 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 527a_100102657272_100000690877 [0,2,0,0,0,1|0,0,0]=3 13839 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 11a_106832991635_100011667363 [0,2,0,0,0,1|0,0,0]=3 13840 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 1626a_100102657272_100011667363 [0,2,0,0,0,1|0,0,0]=3 13841 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 240690a_100102657272_100011667363 [0,2,0,0,0,1|0,0,0]=3 13842 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 527a_100102657272_100011667363 [0,2,0,0,0,1|0,0,0]=3 13843 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 11a_106832991635_100011217548 [0,2,0,0,0,1|0,0,0]=3 13844 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 1626a_100102657272_100011217548 [0,2,0,0,0,1|0,0,0]=3 13845 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 240690a_100102657272_100011217548 [0,2,0,0,0,1|0,0,0]=3 13846 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 527a_100102657272_100011217548 [0,2,0,0,0,1|0,0,0]=3 13847 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 11a_106832991635_100000762760 [0,2,0,0,0,1|0,0,0]=3 13848 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 1626a_100102657272_100000762760 [0,2,0,0,0,1|0,0,0]=3 13849 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 240690a_100102657272_100000762760 [0,2,0,0,0,1|0,0,0]=3 13850 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 527a_100102657272_100000762760 [0,2,0,0,0,1|0,0,0]=3 13851 B13R1.2872 CNC(=O)Cc1cc(ccc1O)Br 240690a_100102657272_100010072483 [0,2,0,0,0,1|0,0,0]=3 13852 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)Br 11a_106832991635_200000738489 [0,2,0,0,0,1|1,0,0]=4 13853 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)Br 1626a_100102657272_200000738489 [0,2,0,0,0,1|1,0,0]=4 13854 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)Br 240690a_100102657272_200000738489 [0,2,0,0,0,1|1,0,0]=4 13855 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)Br 527a_100102657272_200000738489 [0,2,0,0,0,1|1,0,0]=4 13856 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 11a_106832991635_100009850670 [0,2,0,0,0,1|1,0,0]=4 13857 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 1626a_100102657272_100009850670 [0,2,0,0,0,1|1,0,0]=4 13858 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 240690a_100102657272_100009850670 [0,2,0,0,0,1|1,0,0]=4 13859 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 527a_100102657272_100009850670 [0,2,0,0,0,1|1,0,0]=4 13860 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100102657272 [0,2,0,0,0,1|0,0,0]=3 13861 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100102657272 [0,2,0,0,0,1|0,0,0]=3 13862 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100102657272 [0,2,0,0,0,1|0,0,0]=3 13863 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100102657272 [0,2,0,0,0,1|0,0,0]=3 13864 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100102657272 [0,2,0,0,0,1|0,0,0]=3 13865 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100102657272 [0,2,0,0,0,1|0,0,0]=3 13866 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100102657272 [0,2,0,0,0,1|0,0,0]=3 13867 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100102657272 [0,2,0,0,0,1|0,0,0]=3 13868 B13R1.2872 CNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100102657272 [0,2,0,0,0,1|0,0,0]=3 13869 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100102657272 [0,2,0,0,0,1|0,0,0]=3 13870 B13R1.2872 CNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100102657272 [0,2,0,0,0,1|0,0,0]=3 13871 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100102657272 [0,2,0,0,0,1|0,0,0]=3 13872 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100102657272 [0,2,0,0,0,1|0,0,0]=3 13873 B13R1.2872 CNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100102657272 [0,2,0,0,0,1|0,0,0]=3 13874 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100102657272 [0,2,0,0,0,1|0,0,0]=3 13875 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100102657272 [0,2,0,0,0,1|0,0,0]=3 13876 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100102657272 [0,2,0,0,0,1|0,0,0]=3 13877 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100102657272 [0,2,0,0,0,1|0,0,0]=3 13878 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100102657272 [0,2,0,0,0,1|0,0,0]=3 13879 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100102657272 [0,2,0,0,0,1|0,0,0]=3 13880 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100102657272 [0,2,0,0,0,1|0,0,0]=3 13881 B13R1.2872 CNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100102657272 [0,2,0,0,0,1|0,0,0]=3 13882 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100102657272 [0,2,0,0,0,1|0,0,0]=3 13883 B13R1.2872 CNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100102657272 [0,2,0,0,0,1|0,0,0]=3 13884 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100102657272 [0,2,0,0,0,1|0,0,0]=3 13885 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100102657272 [0,2,0,0,0,1|0,0,0]=3 13886 B13R1.2872 CNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100102657272 [0,2,0,0,0,1|0,0,0]=3 13887 B13R1.2872 CNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100102657272 [0,2,0,0,0,1|0,0,0]=3 13888 B13R1.2872 CNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100102657272 [0,2,0,0,0,1|0,0,0]=3 13889 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100102657272 [0,2,0,0,0,1|0,0,0]=3 13890 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100102657272 [0,2,0,0,0,1|0,0,0]=3 13891 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100102657272 [0,2,0,0,0,1|0,0,0]=3 13892 B13R1.2872 CNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100102657272 [0,2,0,0,0,1|0,0,0]=3 13893 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100102657272 [0,2,0,0,0,1|0,0,0]=3 13894 B13R1.2872 CNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100102657272 [0,2,0,0,0,1|0,0,0]=3 13895 B13R1.2872 CNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100102657272 [0,2,0,0,0,1|0,0,0]=3 13896 B13R1.2872 COC(=O)Cc1cc(ccc1O)O 271570a_203496583355_100010185610 [0,2,0,0,0,1|1,0,0]=4 13897 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000210414_100011216082 [0,2,0,0,0,1|1,0,0]=4 13898 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000210202 [0,2,0,0,0,1|1,0,0]=4 13899 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000210414_100012348363 [0,2,0,0,0,1|1,0,0]=4 13900 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000210414_100000766940 [0,2,0,0,0,1|1,0,0]=4 13901 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000210202 [0,2,0,0,0,1|1,0,0]=4 13902 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100000210414_100000181317 [0,2,0,0,0,1|1,0,0]=4 13903 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000210202 [0,2,0,0,0,1|1,0,0]=4 13904 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000210414_100011219208 [0,2,0,0,0,1|1,0,0]=4 13905 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000210202 [0,2,0,0,0,1|1,0,0]=4 13906 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000210414_100011219885 [0,2,0,0,0,1|1,0,0]=4 13907 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000210202 [0,2,0,0,0,1|1,0,0]=4 13908 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100000210414_100011219130 [0,2,0,0,0,1|1,0,0]=4 13909 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000210202 [0,2,0,0,0,1|1,0,0]=4 13910 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100000210414_100000697002 [0,2,0,0,0,1|1,0,0]=4 13911 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000210202 [0,2,0,0,0,1|1,0,0]=4 13912 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000210414_100010146614 [0,2,0,0,0,1|1,0,0]=4 13913 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)F 1458a_100000210414_100010149605 [0,2,0,0,0,1|1,0,0]=4 13914 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100000210414 [0,2,0,0,0,1|1,0,0]=4 13915 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100000210414 [0,2,0,0,0,1|1,0,0]=4 13916 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000210414 [0,2,0,0,0,1|1,0,0]=4 13917 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100000210414 [0,2,0,0,0,1|1,0,0]=4 13918 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13919 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13920 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13921 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13922 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100000210414 [0,2,0,0,0,1|1,0,0]=4 13923 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100000210414 [0,2,0,0,0,1|1,0,0]=4 13924 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000210414 [0,2,0,0,0,1|1,0,0]=4 13925 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100000210414 [0,2,0,0,0,1|1,0,0]=4 13926 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100000210414 [0,2,0,0,0,1|1,0,0]=4 13927 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000210414 [0,2,0,0,0,1|1,0,0]=4 13928 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100000210414 [0,2,0,0,0,1|1,0,0]=4 13929 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100000210414 [0,2,0,0,0,1|1,0,0]=4 13930 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000210414 [0,2,0,0,0,1|1,0,0]=4 13931 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100000210414 [0,2,0,0,0,1|1,0,0]=4 13932 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100000210414 [0,2,0,0,0,1|1,0,0]=4 13933 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100000210414 [0,2,0,0,0,1|1,0,0]=4 13934 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000210414 [0,2,0,0,0,1|1,0,0]=4 13935 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100000210414 [0,2,0,0,0,1|1,0,0]=4 13936 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100000210414 [0,2,0,0,0,1|1,0,0]=4 13937 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000210414 [0,2,0,0,0,1|1,0,0]=4 13938 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100000210414 [0,2,0,0,0,1|1,0,0]=4 13939 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100000210414 [0,2,0,0,0,1|1,0,0]=4 13940 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000210414 [0,2,0,0,0,1|1,0,0]=4 13941 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000210414 [0,2,0,0,0,1|1,0,0]=4 13942 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000210414 [0,2,0,0,0,1|1,0,0]=4 13943 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100000210414 [0,2,0,0,0,1|1,0,0]=4 13944 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100000210414 [0,2,0,0,0,1|1,0,0]=4 13945 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000210414 [0,2,0,0,0,1|1,0,0]=4 13946 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100000210414 [0,2,0,0,0,1|1,0,0]=4 13947 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100000210414 [0,2,0,0,0,1|1,0,0]=4 13948 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100000210414 [0,2,0,0,0,1|1,0,0]=4 13949 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000210414 [0,2,0,0,0,1|1,0,0]=4 13950 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100000210414 [0,2,0,0,0,1|1,0,0]=4 13951 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100000210414 [0,2,0,0,0,1|1,0,0]=4 13952 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000210414 [0,2,0,0,0,1|1,0,0]=4 13953 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100000210414 [0,2,0,0,0,1|1,0,0]=4 13954 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100000210414 [0,2,0,0,0,1|1,0,0]=4 13955 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100000210414 [0,2,0,0,0,1|1,0,0]=4 13956 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000210414 [0,2,0,0,0,1|1,0,0]=4 13957 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13958 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13959 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000210414 [0,2,0,0,0,1|1,0,0]=4 13960 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13961 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13962 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13963 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100000210414 [0,2,0,0,0,1|1,0,0]=4 13964 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000210414 [0,2,0,0,0,1|1,0,0]=4 13965 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000210414 [0,2,0,0,0,1|1,0,0]=4 13966 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100000210414 [0,2,0,0,0,1|1,0,0]=4 13967 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000210414 [0,2,0,0,0,1|1,0,0]=4 13968 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 11a_106832991635_100010186705 [0,2,0,0,0,1|0,0,0]=3 13969 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100102657272_100010186705 [0,2,0,0,0,1|0,0,0]=3 13970 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 527a_100102657272_100010186705 [0,2,0,0,0,1|0,0,0]=3 13971 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 11a_106832991635_100011935118 [0,2,0,0,0,1|0,0,0]=3 13972 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 240690a_100102657272_100011935118 [0,2,0,0,0,1|0,0,0]=3 13973 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 527a_100102657272_100011935118 [0,2,0,0,0,1|0,0,0]=3 13974 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 11a_106832991635_100011202310 [0,2,0,0,0,1|0,0,0]=3 13975 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 240690a_100102657272_100011202310 [0,2,0,0,0,1|0,0,0]=3 13976 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 527a_100102657272_100011202310 [0,2,0,0,0,1|0,0,0]=3 13977 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 11a_106832991635_100012340057 [0,2,0,0,0,1|0,0,0]=3 13978 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100102657272_100012340057 [0,2,0,0,0,1|0,0,0]=3 13979 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100102657272_100012340057 [0,2,0,0,0,1|0,0,0]=3 13980 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100102657272_100012340057 [0,2,0,0,0,1|0,0,0]=3 13981 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 11a_106832991635_100011217690 [0,2,0,0,0,1|0,0,0]=3 13982 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100102657272_100011217690 [0,2,0,0,0,1|0,0,0]=3 13983 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100102657272_100011217690 [0,2,0,0,0,1|0,0,0]=3 13984 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 527a_100102657272_100011217690 [0,2,0,0,0,1|0,0,0]=3 13985 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 11a_106832991635_100011216671 [0,2,0,0,0,1|0,0,0]=3 13986 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 1626a_100102657272_100011216671 [0,2,0,0,0,1|0,0,0]=3 13987 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 240690a_100102657272_100011216671 [0,2,0,0,0,1|0,0,0]=3 13988 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 527a_100102657272_100011216671 [0,2,0,0,0,1|0,0,0]=3 13989 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 11a_106832991635_100011220011 [0,2,0,0,0,1|0,0,0]=3 13990 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 1626a_100102657272_100011220011 [0,2,0,0,0,1|0,0,0]=3 13991 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 240690a_100102657272_100011220011 [0,2,0,0,0,1|0,0,0]=3 13992 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 527a_100102657272_100011220011 [0,2,0,0,0,1|0,0,0]=3 13993 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 240690a_100102657272_100000080560 [0,2,0,0,0,1|0,0,0]=3 13994 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 527a_100102657272_100000080560 [0,2,0,0,0,1|0,0,0]=3 13995 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Br 2430a_100012047176_100102657272 [0,2,0,0,0,1|0,0,0]=3 13996 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Br 512a_100012047176_100102657272 [0,2,0,0,0,1|0,0,0]=3 13997 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)C 2430a_100000695972_100102657272 [0,2,0,0,0,1|0,0,0]=3 13998 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)C 512a_100000695972_100102657272 [0,2,0,0,0,1|0,0,0]=3 13999 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Cl 2430a_100011934539_100102657272 [0,2,0,0,0,1|0,0,0]=3 14000 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Cl 512a_100011934539_100102657272 [0,2,0,0,0,1|0,0,0]=3 14001 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)F 2430a_100000705686_100102657272 [0,2,0,0,0,1|0,0,0]=3 14002 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)F 512a_100000705686_100102657272 [0,2,0,0,0,1|0,0,0]=3 14003 B13R1.2874 CNC(=O)Nc1cc(cc(c1)C)C 2430a_100000210930_100102657272 [0,2,0,0,0,1|0,0,0]=3 14004 B13R1.2874 CNC(=O)Nc1cc(cc(c1)C)C 512a_100000210930_100102657272 [0,2,0,0,0,1|0,0,0]=3 14005 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)C 2430a_100012022512_100102657272 [0,2,0,0,0,1|0,0,0]=3 14006 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)C 512a_100012022512_100102657272 [0,2,0,0,0,1|0,0,0]=3 14007 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)Cl 2430a_100000210456_100102657272 [0,2,0,0,0,1|0,0,0]=3 14008 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)Cl 512a_100000210456_100102657272 [0,2,0,0,0,1|0,0,0]=3 14009 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)F 2430a_100000686136_100102657272 [0,2,0,0,0,1|0,0,0]=3 14010 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)F 512a_100000686136_100102657272 [0,2,0,0,0,1|0,0,0]=3 14011 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)O 2430a_100000123917_100102657272 [0,2,0,0,0,1|0,0,0]=3 14012 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)O 512a_100000123917_100102657272 [0,2,0,0,0,1|0,0,0]=3 14013 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)C 2430a_100000742734_100102657272 [0,2,0,0,0,1|0,0,0]=3 14014 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)C 512a_100000742734_100102657272 [0,2,0,0,0,1|0,0,0]=3 14015 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)F 2430a_100000233717_100102657272 [0,2,0,0,0,1|0,0,0]=3 14016 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)F 512a_100000233717_100102657272 [0,2,0,0,0,1|0,0,0]=3 14017 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Br 2430a_100009814763_100102657272 [0,2,0,0,0,1|0,0,0]=3 14018 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Br 512a_100009814763_100102657272 [0,2,0,0,0,1|0,0,0]=3 14019 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Cl 2430a_100010147676_100102657272 [0,2,0,0,0,1|0,0,0]=3 14020 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Cl 512a_100010147676_100102657272 [0,2,0,0,0,1|0,0,0]=3 14021 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)F 2430a_100011356972_100102657272 [0,2,0,0,0,1|0,0,0]=3 14022 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)F 512a_100011356972_100102657272 [0,2,0,0,0,1|0,0,0]=3 14023 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)I 2430a_200000696836_100102657272 [0,2,0,0,0,1|0,0,0]=3 14024 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)I 512a_200000696836_100102657272 [0,2,0,0,0,1|0,0,0]=3 14025 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)C 2430a_100011995906_100102657272 [0,2,0,0,0,1|0,0,0]=3 14026 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)C 512a_100011995906_100102657272 [0,2,0,0,0,1|0,0,0]=3 14027 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)O 2430a_100000043371_100102657272 [0,2,0,0,0,1|0,0,0]=3 14028 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)O 512a_100000043371_100102657272 [0,2,0,0,0,1|0,0,0]=3 14029 B13R1.2874 COC(=O)Cc1cc(cc(c1)F)O 271570a_203496583355_100012569085 [0,2,0,0,0,1|1,0,0]=4 14030 B13R1.275 CNS(=O)(=O)Cc1ccccc1Br 270084a_100102657272_100000765529 [0,2,0,0,0,1|1,0,0]=4 14031 B13R1.275 CNS(=O)(=O)Cc1ccccc1Br 274078a_100102657272_100000765529 [0,2,0,0,0,1|1,0,0]=4 14032 B13R1.275 CNS(=O)(=O)Cc1ccccc1C 270084a_100102657272_100000750338 [0,2,0,0,0,1|1,0,0]=4 14033 B13R1.275 CNS(=O)(=O)Cc1ccccc1C 274078a_100102657272_100000750338 [0,2,0,0,0,1|1,0,0]=4 14034 B13R1.275 CNS(=O)(=O)Cc1ccccc1Cl 270084a_100102657272_100000750118 [0,2,0,0,0,1|1,0,0]=4 14035 B13R1.275 CNS(=O)(=O)Cc1ccccc1Cl 274078a_100102657272_100000750118 [0,2,0,0,0,1|1,0,0]=4 14036 B13R1.275 CNS(=O)(=O)Cc1ccccc1F 270084a_100102657272_100000739656 [0,2,0,0,0,1|1,0,0]=4 14037 B13R1.275 CNS(=O)(=O)Cc1ccccc1F 274078a_100102657272_100000739656 [0,2,0,0,0,1|1,0,0]=4 14038 B13R1.91 C#Cc1ccccc1NC(=O)CC 11a_100011470550_100000210414 [0,2,0,0,0,1|1,0,0]=4 14039 B13R1.91 C#Cc1ccccc1NC(=O)CC 1626a_100011470550_100000210414 [0,2,0,0,0,1|1,0,0]=4 14040 B13R1.91 C#Cc1ccccc1NC(=O)CC 22a_100011470550_100000210414 [0,2,0,0,0,1|1,0,0]=4 14041 B13R1.91 C#Cc1ccccc1NC(=O)NC 2430a_100011470550_100102657272 [0,2,0,0,0,1|0,0,0]=3 14042 B13R1.91 C=Cc1ccccc1CC(=O)NC 271570a_100011290941_200009816160 [0,2,0,0,0,1|0,0,0]=3 14043 B13R1.91 C=Cc1ccccc1CC(=O)NN 271570a_100011290941_200010210069 [0,2,0,0,0,1|1,0,0]=4 14044 B13R1.91 C=Cc1ccccc1CC(=O)OC 271570a_100011290941_100000699816 [0,2,0,0,0,1|1,0,0]=4 14045 B13R1.91 C=Cc1ccccc1NC(=O)CC 11a_100012022501_100000210414 [0,2,0,0,0,1|1,0,0]=4 14046 B13R1.91 C=Cc1ccccc1NC(=O)CC 1626a_100012022501_100000210414 [0,2,0,0,0,1|1,0,0]=4 14047 B13R1.91 C=Cc1ccccc1NC(=O)CC 22a_100012022501_100000210414 [0,2,0,0,0,1|1,0,0]=4 14048 B13R1.91 C=Cc1ccccc1NC(=O)CC 271570a_100011290941_100000153536 [0,2,0,0,0,1|1,0,0]=4 14049 B13R1.91 C=Cc1ccccc1NC(=O)NC 2430a_100012022501_100102657272 [0,2,0,0,0,1|0,0,0]=3 14050 B13R1.91 C=Cc1ccccc1NC(=O)OC 271570a_100011290941_100000216184 [0,2,0,0,0,1|1,0,0]=4 14051 B13R1.91 CCC(=O)Cc1ccccc1C#N 1458a_100000210414_100000181865 [0,2,0,0,0,1|1,0,0]=4 14052 B13R1.91 CCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210202 [0,2,0,0,0,1|1,0,0]=4 14053 B13R1.91 CCC(=O)Cc1ccccc1C=O 1458a_100000210414_200009853537 [0,2,0,0,0,1|1,0,0]=4 14054 B13R1.91 CCC(=O)Cc1ccccc1CO 1458a_100000210414_100009816955 [0,2,0,0,0,1|1,0,0]=4 14055 B13R1.91 CCC(=O)Cc1ccccc1OC 1458a_100000210414_100000210004 [0,2,0,0,0,1|1,0,0]=4 14056 B13R1.91 CCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210202 [0,2,0,0,0,1|1,0,0]=4 14057 B13R1.91 CCC(=O)Cc1ccccc1SC 1458a_100000210414_100000699184 [0,2,0,0,0,1|1,0,0]=4 14058 B13R1.91 CCC(=O)Nc1ccccc1C#N 11a_100000211148_100000210414 [0,2,0,0,0,1|1,0,0]=4 14059 B13R1.91 CCC(=O)Nc1ccccc1C#N 1626a_100000211148_100000210414 [0,2,0,0,0,1|1,0,0]=4 14060 B13R1.91 CCC(=O)Nc1ccccc1CC 11a_100000212081_100000210414 [0,2,0,0,0,1|1,0,0]=4 14061 B13R1.91 CCC(=O)Nc1ccccc1CC 1626a_100000212081_100000210414 [0,2,0,0,0,1|1,0,0]=4 14062 B13R1.91 CCC(=O)Nc1ccccc1CC 22a_100000212081_100000210414 [0,2,0,0,0,1|1,0,0]=4 14063 B13R1.91 CCC(=O)Nc1ccccc1CC 527a_100000212081_100000210414 [0,2,0,0,0,1|1,0,0]=4 14064 B13R1.91 CCC(=O)Nc1ccccc1CO 22a_100000212039_100000210414 [0,2,0,0,0,1|1,0,0]=4 14065 B13R1.91 CCC(=O)Nc1ccccc1OC 11a_100000210025_100000210414 [0,2,0,0,0,1|1,0,0]=4 14066 B13R1.91 CCC(=O)Nc1ccccc1OC 1626a_100000210025_100000210414 [0,2,0,0,0,1|1,0,0]=4 14067 B13R1.91 CCC(=O)Nc1ccccc1OC 22a_100000210025_100000210414 [0,2,0,0,0,1|1,0,0]=4 14068 B13R1.91 CCC(=O)Nc1ccccc1OC 527a_100000210025_100000210414 [0,2,0,0,0,1|1,0,0]=4 14069 B13R1.91 CCC(=O)Nc1ccccc1SC 11a_100000211160_100000210414 [0,2,0,0,0,1|1,0,0]=4 14070 B13R1.91 CCC(=O)Nc1ccccc1SC 22a_100000211160_100000210414 [0,2,0,0,0,1|1,0,0]=4 14071 B13R1.91 CCC(=O)Nc1ccccc1SC 62a_200000210301_100000153536 [0,2,0,0,0,1|1,0,0]=4 14072 B13R1.91 CCC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000153536 [0,2,0,0,0,1|1,0,0]=4 14073 B13R1.91 CCc1ccccc1NC(=O)NC 2430a_100000212081_100102657272 [0,2,0,0,0,1|0,0,0]=3 14074 B13R1.91 CNC(=O)Cc1ccccc1C#N 11a_106832991635_100000238613 [0,2,0,0,0,1|0,0,0]=3 14075 B13R1.91 CNC(=O)Cc1ccccc1C#N 527a_100102657272_100000238613 [0,2,0,0,0,1|0,0,0]=3 14076 B13R1.91 CNC(=O)Cc1ccccc1NC 2230a_100000738506_200000210301 [0,2,0,0,0,1|0,0,0]=3 14077 B13R1.91 CNC(=O)Cc1ccccc1NC 34a_100000738506_200000210301 [0,2,0,0,0,1|0,0,0]=3 14078 B13R1.91 CNC(=O)Cc1ccccc1N[13CH3] 2230a_100000738506_200025704644 [0,2,0,0,0,1|0,0,0]=3 14079 B13R1.91 CNC(=O)Cc1ccccc1N[13CH3] 34a_100000738506_200025704644 [0,2,0,0,0,1|0,0,0]=3 14080 B13R1.91 CNC(=O)Cc1ccccc1OC 11a_106832991635_100000211604 [0,2,0,0,0,1|0,0,0]=3 14081 B13R1.91 CNC(=O)Cc1ccccc1OC 1626a_100102657272_100000211604 [0,2,0,0,0,1|0,0,0]=3 14082 B13R1.91 CNC(=O)Cc1ccccc1OC 240690a_100102657272_100000211604 [0,2,0,0,0,1|0,0,0]=3 14083 B13R1.91 CNC(=O)Cc1ccccc1OC 527a_100102657272_100000211604 [0,2,0,0,0,1|0,0,0]=3 14084 B13R1.91 CNC(=O)Cc1ccccc1SC 62a_200000210301_200009816160 [0,2,0,0,0,1|0,0,0]=3 14085 B13R1.91 CNC(=O)Cc1ccccc1SC 62a_200009816160_200000210301 [0,2,0,0,0,1|0,0,0]=3 14086 B13R1.91 CNC(=O)Cc1ccccc1S[13CH3] 62a_200009816160_200025704644 [0,2,0,0,0,1|0,0,0]=3 14087 B13R1.91 CNC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_200009816160 [0,2,0,0,0,1|0,0,0]=3 14088 B13R1.91 CNC(=O)Nc1ccccc1C#N 2430a_100000211148_100102657272 [0,2,0,0,0,1|0,0,0]=3 14089 B13R1.91 CNC(=O)Nc1ccccc1OC 2430a_100000210025_100102657272 [0,2,0,0,0,1|0,0,0]=3 14090 B13R1.91 CNC(=O)Nc1ccccc1SC 2430a_100000211160_100102657272 [0,2,0,0,0,1|0,0,0]=3 14091 B13R1.91 CNC(=O)Nc1ccccc1SC 512a_100000211160_100102657272 [0,2,0,0,0,1|0,0,0]=3 14092 B13R1.91 COC(=O)Cc1ccccc1OC 7a_100000758901_200000210301 [0,2,0,0,0,1|1,0,0]=4 14093 B13R1.91 COC(=O)Cc1ccccc1O[13CH3] 7a_100000758901_200025704644 [0,2,0,0,0,1|1,0,0]=4 14094 B13R1.91 COC(=O)Cc1ccccc1SC 62a_100000699816_200000210301 [0,2,0,0,0,1|1,0,0]=4 14095 B13R1.91 COC(=O)Cc1ccccc1SC 62a_200000210301_100000699816 [0,2,0,0,0,1|1,0,0]=4 14096 B13R1.91 COC(=O)Cc1ccccc1S[13CH3] 62a_100000699816_200025704644 [0,2,0,0,0,1|1,0,0]=4 14097 B13R1.91 COC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100000699816 [0,2,0,0,0,1|1,0,0]=4 14098 B13R1.91 COC(=O)Nc1ccccc1SC 62a_200000210301_100000216184 [0,2,0,0,0,1|1,0,0]=4 14099 B13R1.91 COC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000216184 [0,2,0,0,0,1|1,0,0]=4 14100 B13R1.91 COc1ccccc1CC(=O)NN 34a_200012021708_200000210301 [0,2,0,0,0,1|1,0,0]=4 14101 B13R1.91 CSc1ccccc1CC(=O)NN 62a_200000210301_200010210069 [0,2,0,0,0,1|1,0,0]=4 14102 B13R1.91 CSc1ccccc1CC(=O)NN 62a_200010210069_200000210301 [0,2,0,0,0,1|1,0,0]=4 14103 B13R1.91 [13CH3]Oc1ccccc1CC(=O)NN 34a_200012021708_200025704644 [0,2,0,0,0,1|1,0,0]=4 14104 B13R1.91 [13CH3]Sc1ccccc1CC(=O)NN 62a_200010210069_200025704644 [0,2,0,0,0,1|1,0,0]=4 14105 B13R1.91 [13CH3]Sc1ccccc1CC(=O)NN 62a_200025704644_200010210069 [0,2,0,0,0,1|1,0,0]=4 14106 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000210202 [0,2,0,0,0,1|1,0,0]=4 14107 B13R1.4928 CCC(=O)Cc1c(cccc1Br)C 1458a_100000210414_100010146847 [0,2,0,0,0,1|1,0,0]=4 14108 B13R1.4928 CCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000210202 [0,2,0,0,0,1|1,0,0]=4 14109 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100000210414_100010138402 [0,2,0,0,0,1|1,0,0]=4 14110 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210202 [0,2,0,0,0,1|1,0,0]=4 14111 B13R1.4928 CCC(=O)Cc1c(cccc1Br)F 1458a_100000210414_100000696636 [0,2,0,0,0,1|1,0,0]=4 14112 B13R1.4928 CCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000210202 [0,2,0,0,0,1|1,0,0]=4 14113 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000210414_100000758300 [0,2,0,0,0,1|1,0,0]=4 14114 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210202 [0,2,0,0,0,1|1,0,0]=4 14115 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210414_100000187851 [0,2,0,0,0,1|1,0,0]=4 14116 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210202 [0,2,0,0,0,1|1,0,0]=4 14117 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210202 [0,2,0,0,0,1|1,0,0]=4 14118 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000210414_100000187852 [0,2,0,0,0,1|1,0,0]=4 14119 B13R1.4928 CCC(=O)Cc1c(cccc1F)C 1458a_100000210414_100009814554 [0,2,0,0,0,1|1,0,0]=4 14120 B13R1.4928 CCC(=O)Cc1c(cccc1F)F 1458a_100000210414_100000698325 [0,2,0,0,0,1|1,0,0]=4 14121 B13R1.4928 CCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000210202 [0,2,0,0,0,1|1,0,0]=4 14122 B13R1.4928 CCC(=O)Cc1c(cccc1I)Br 1458a_100000210414_100010146611 [0,2,0,0,0,1|1,0,0]=4 14123 B13R1.4928 CCC(=O)Cc1c(cccc1I)C 1458a_100000210414_100010150146 [0,2,0,0,0,1|1,0,0]=4 14124 B13R1.4928 CCC(=O)Cc1c(cccc1I)F 1458a_100000210414_100010149602 [0,2,0,0,0,1|1,0,0]=4 14125 B13R1.4928 CCC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100000210414 [0,2,0,0,0,1|1,0,0]=4 14126 B13R1.4928 CCC(=O)Nc1c(cccc1Br)C 11a_100011834072_100000210414 [0,2,0,0,0,1|1,0,0]=4 14127 B13R1.4928 CCC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100000210414 [0,2,0,0,0,1|1,0,0]=4 14128 B13R1.4928 CCC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100000210414 [0,2,0,0,0,1|1,0,0]=4 14129 B13R1.4928 CCC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100000210414 [0,2,0,0,0,1|1,0,0]=4 14130 B13R1.4928 CCC(=O)Nc1c(cccc1Br)F 11a_100000684712_100000210414 [0,2,0,0,0,1|1,0,0]=4 14131 B13R1.4928 CCC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100000210414 [0,2,0,0,0,1|1,0,0]=4 14132 B13R1.4928 CCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000210414 [0,2,0,0,0,1|1,0,0]=4 14133 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 11a_100000185769_100000210414 [0,2,0,0,0,1|1,0,0]=4 14134 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 1626a_100000185769_100000210414 [0,2,0,0,0,1|1,0,0]=4 14135 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 22a_100000185769_100000210414 [0,2,0,0,0,1|1,0,0]=4 14136 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100000210414 [0,2,0,0,0,1|1,0,0]=4 14137 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100000210414 [0,2,0,0,0,1|1,0,0]=4 14138 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000210414 [0,2,0,0,0,1|1,0,0]=4 14139 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000210414 [0,2,0,0,0,1|1,0,0]=4 14140 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100000210414 [0,2,0,0,0,1|1,0,0]=4 14141 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100000210414 [0,2,0,0,0,1|1,0,0]=4 14142 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000210414 [0,2,0,0,0,1|1,0,0]=4 14143 B13R1.4928 CCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000210414 [0,2,0,0,0,1|1,0,0]=4 14144 B13R1.4928 CCC(=O)Nc1c(cccc1F)C 11a_100000766463_100000210414 [0,2,0,0,0,1|1,0,0]=4 14145 B13R1.4928 CCC(=O)Nc1c(cccc1F)C 1626a_100000766463_100000210414 [0,2,0,0,0,1|1,0,0]=4 14146 B13R1.4928 CCC(=O)Nc1c(cccc1F)C 22a_100000766463_100000210414 [0,2,0,0,0,1|1,0,0]=4 14147 B13R1.4928 CCC(=O)Nc1c(cccc1F)F 11a_100000210704_100000210414 [0,2,0,0,0,1|1,0,0]=4 14148 B13R1.4928 CCC(=O)Nc1c(cccc1F)F 1626a_100000210704_100000210414 [0,2,0,0,0,1|1,0,0]=4 14149 B13R1.4928 CCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000210414 [0,2,0,0,0,1|1,0,0]=4 14150 B13R1.4928 CCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000210414 [0,2,0,0,0,1|1,0,0]=4 14151 B13R1.4928 CCC(=O)Nc1c(cccc1I)Br 11a_100010146558_100000210414 [0,2,0,0,0,1|1,0,0]=4 14152 B13R1.4928 CCC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100000210414 [0,2,0,0,0,1|1,0,0]=4 14153 B13R1.4928 CCC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100000210414 [0,2,0,0,0,1|1,0,0]=4 14154 B13R1.4928 CCC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100000210414 [0,2,0,0,0,1|1,0,0]=4 14155 B13R1.4928 CCC(=O)Nc1c(cccc1I)F 11a_100000042321_100000210414 [0,2,0,0,0,1|1,0,0]=4 14156 B13R1.4928 CCC(=O)Nc1c(cccc1I)F 1626a_100000042321_100000210414 [0,2,0,0,0,1|1,0,0]=4 14157 B13R1.4928 CCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000210414 [0,2,0,0,0,1|1,0,0]=4 14158 B13R1.4928 CCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000210414 [0,2,0,0,0,1|1,0,0]=4 14159 B13R1.4928 CCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000210414 [0,2,0,0,0,1|1,0,0]=4 14160 B13R1.4928 CCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000210414 [0,2,0,0,0,1|1,0,0]=4 14161 B13R1.4928 CCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000210414 [0,2,0,0,0,1|1,0,0]=4 14162 B13R1.4928 CCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000210414 [0,2,0,0,0,1|1,0,0]=4 14163 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 11a_106832991635_100010209379 [0,2,0,0,0,1|0,0,0]=3 14164 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 240690a_100102657272_100010209379 [0,2,0,0,0,1|0,0,0]=3 14165 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 527a_100102657272_100010209379 [0,2,0,0,0,1|0,0,0]=3 14166 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 11a_106832991635_100010147022 [0,2,0,0,0,1|0,0,0]=3 14167 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 1626a_100102657272_100010147022 [0,2,0,0,0,1|0,0,0]=3 14168 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 240690a_100102657272_100010147022 [0,2,0,0,0,1|0,0,0]=3 14169 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 527a_100102657272_100010147022 [0,2,0,0,0,1|0,0,0]=3 14170 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 11a_106832991635_100013084675 [0,2,0,0,0,1|0,0,0]=3 14171 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 1626a_100102657272_100013084675 [0,2,0,0,0,1|0,0,0]=3 14172 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 240690a_100102657272_100013084675 [0,2,0,0,0,1|0,0,0]=3 14173 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 527a_100102657272_100013084675 [0,2,0,0,0,1|0,0,0]=3 14174 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 11a_106832991635_100010172741 [0,2,0,0,0,1|0,0,0]=3 14175 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 1626a_100102657272_100010172741 [0,2,0,0,0,1|0,0,0]=3 14176 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 240690a_100102657272_100010172741 [0,2,0,0,0,1|0,0,0]=3 14177 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 527a_100102657272_100010172741 [0,2,0,0,0,1|0,0,0]=3 14178 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 11a_106832991635_100000689862 [0,2,0,0,0,1|0,0,0]=3 14179 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 1626a_100102657272_100000689862 [0,2,0,0,0,1|0,0,0]=3 14180 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 240690a_100102657272_100000689862 [0,2,0,0,0,1|0,0,0]=3 14181 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 527a_100102657272_100000689862 [0,2,0,0,0,1|0,0,0]=3 14182 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 11a_106832991635_100000211232 [0,2,0,0,0,1|0,0,0]=3 14183 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 1626a_100102657272_100000211232 [0,2,0,0,0,1|0,0,0]=3 14184 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 240690a_100102657272_100000211232 [0,2,0,0,0,1|0,0,0]=3 14185 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 527a_100102657272_100000211232 [0,2,0,0,0,1|0,0,0]=3 14186 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 11a_106832991635_100000185183 [0,2,0,0,0,1|0,0,0]=3 14187 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 1626a_100102657272_100000185183 [0,2,0,0,0,1|0,0,0]=3 14188 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 240690a_100102657272_100000185183 [0,2,0,0,0,1|0,0,0]=3 14189 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 527a_100102657272_100000185183 [0,2,0,0,0,1|0,0,0]=3 14190 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 11a_106832991635_100000684726 [0,2,0,0,0,1|0,0,0]=3 14191 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 1626a_100102657272_100000684726 [0,2,0,0,0,1|0,0,0]=3 14192 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 240690a_100102657272_100000684726 [0,2,0,0,0,1|0,0,0]=3 14193 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 527a_100102657272_100000684726 [0,2,0,0,0,1|0,0,0]=3 14194 B13R1.4928 CNC(=O)Nc1c(cccc1Br)C 2430a_100011834072_100102657272 [0,2,0,0,0,1|0,0,0]=3 14195 B13R1.4928 CNC(=O)Nc1c(cccc1Br)Cl 2430a_100102946385_100102657272 [0,2,0,0,0,1|0,0,0]=3 14196 B13R1.4928 CNC(=O)Nc1c(cccc1C)C 2430a_100000185769_100102657272 [0,2,0,0,0,1|0,0,0]=3 14197 B13R1.4928 CNC(=O)Nc1c(cccc1C)C 512a_106832991638_100000185769 [0,2,0,0,0,1|0,0,0]=3 14198 B13R1.4928 CNC(=O)Nc1c(cccc1Cl)C 2430a_100000756524_100102657272 [0,2,0,0,0,1|0,0,0]=3 14199 B13R1.4928 CNC(=O)Nc1c(cccc1Cl)F 2430a_100000760031_100102657272 [0,2,0,0,0,1|0,0,0]=3 14200 B13R1.4928 CNC(=O)Nc1c(cccc1F)C 2430a_100000766463_100102657272 [0,2,0,0,0,1|0,0,0]=3 14201 B13R1.4928 CNC(=O)Nc1c(cccc1F)F 2430a_100000210704_100102657272 [0,2,0,0,0,1|0,0,0]=3 14202 B13R1.4928 CNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100102657272 [0,2,0,0,0,1|0,0,0]=3 14203 B13R1.4928 CNC(=O)Nc1c(cccc1I)Br 512a_100010146558_100102657272 [0,2,0,0,0,1|0,0,0]=3 14204 B13R1.4928 CNC(=O)Nc1c(cccc1I)F 2430a_100000042321_100102657272 [0,2,0,0,0,1|0,0,0]=3 14205 B13R1.4928 CNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100102657272 [0,2,0,0,0,1|0,0,0]=3 14206 B13R1.4928 COC(=O)Cc1c(cccc1F)O 271570a_203496583355_100010741561 [0,2,0,0,0,1|1,0,0]=4 14207 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 270084a_100015525214_100000182491 [0,3,0,0,0,0|1,0,0]=4 14208 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 274078a_100015525214_100000182491 [0,3,0,0,0,0|1,0,0]=4 14209 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 40a_100015525214_100010306709 [0,3,0,0,0,0|1,0,0]=4 14210 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 270084a_100015525214_100000211267 [0,3,0,0,0,0|1,0,0]=4 14211 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 274078a_100015525214_100000211267 [0,3,0,0,0,0|1,0,0]=4 14212 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 40a_100015525214_100000039673 [0,3,0,0,0,0|1,0,0]=4 14213 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100015525214_100000209962 [0,3,0,0,0,0|1,0,0]=4 14214 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100015525214_100000209962 [0,3,0,0,0,0|1,0,0]=4 14215 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 40a_100015525214_100000077732 [0,3,0,0,0,0|1,0,0]=4 14216 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 270084a_100015525214_100000184267 [0,3,0,0,0,0|1,0,0]=4 14217 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 274078a_100015525214_100000184267 [0,3,0,0,0,0|1,0,0]=4 14218 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 40a_100015525214_100000081159 [0,3,0,0,0,0|1,0,0]=4 14219 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)I 270084a_100015525214_100011205396 [0,3,0,0,0,0|1,0,0]=4 14220 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)I 274078a_100015525214_100011205396 [0,3,0,0,0,0|1,0,0]=4 14221 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)N 40a_100015525214_100000054796 [0,3,0,0,0,0|1,0,0]=4 14222 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 270084a_100015525214_100020667864 [0,3,0,0,0,0|1,0,0]=4 14223 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_200000165184 [0,3,0,0,0,0|1,0,0]=4 14224 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 274078a_100015525214_100020667864 [0,3,0,0,0,0|1,0,0]=4 14225 B13R1.29 CNCS(=O)(=O)c1ccc(cc1)C 34a_100102657272_100000183660 [0,3,0,0,0,0|1,0,0]=4 14226 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)Br 40a_100016993582_100010306709 [0,3,0,0,0,0|1,0,0]=4 14227 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)C 40a_100016993582_100000039673 [0,3,0,0,0,0|1,0,0]=4 14228 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)Cl 40a_100016993582_100000077732 [0,3,0,0,0,0|1,0,0]=4 14229 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)F 40a_100016993582_100000081159 [0,3,0,0,0,0|1,0,0]=4 14230 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)N 40a_100016993582_100000054796 [0,3,0,0,0,0|1,0,0]=4 14231 B13R1.187 C=Cc1ccc(cc1)S(=O)(=O)NC 270084a_100102657272_100000034458 [0,3,0,0,0,0|1,0,0]=4 14232 B13R1.187 C=Cc1ccc(cc1)S(=O)(=O)NC 271570a_100011290941_100000754977 [0,3,0,0,0,0|1,0,0]=4 14233 B13R1.187 C=Cc1ccc(cc1)S(=O)(=O)NC 274078a_100102657272_100000034458 [0,3,0,0,0,0|1,0,0]=4 14234 B13R1.187 CCc1ccc(cc1)S(=O)(=O)NC 270084a_100102657272_100000212210 [0,3,0,0,0,0|1,0,0]=4 14235 B13R1.187 CCc1ccc(cc1)S(=O)(=O)NC 274078a_100102657272_100000212210 [0,3,0,0,0,0|1,0,0]=4 14236 B13R1.187 CNS(=O)(=O)c1ccc(cc1)C#N 270084a_100102657272_100000184514 [0,3,0,0,0,0|1,0,0]=4 14237 B13R1.187 CNS(=O)(=O)c1ccc(cc1)C#N 274078a_100102657272_100000184514 [0,3,0,0,0,0|1,0,0]=4 14238 B13R1.187 CNS(=O)(=O)c1ccc(cc1)C#N 40a_100102657272_100010740313 [0,3,0,0,0,0|1,0,0]=4 14239 B13R1.187 CNS(=O)(=O)c1ccc(cc1)C=O 270084a_100102657272_100000045293 [0,3,0,0,0,0|1,0,0]=4 14240 B13R1.187 CNS(=O)(=O)c1ccc(cc1)C=O 274078a_100102657272_100000045293 [0,3,0,0,0,0|1,0,0]=4 14241 B13R1.187 CNS(=O)(=O)c1ccc(cc1)CBr 270084a_100102657272_100000763552 [0,3,0,0,0,0|1,0,0]=4 14242 B13R1.187 CNS(=O)(=O)c1ccc(cc1)CBr 274078a_100102657272_100000763552 [0,3,0,0,0,0|1,0,0]=4 14243 B13R1.187 CNS(=O)(=O)c1ccc(cc1)CBr 40a_100102657272_100011072442 [0,3,0,0,0,0|1,0,0]=4 14244 B13R1.187 CNS(=O)(=O)c1ccc(cc1)N[13CH3] 34a_100000184917_200025704644 [0,3,0,0,0,0|1,0,0]=4 14245 B13R1.187 CNS(=O)(=O)c1ccc(cc1)OC 270084a_100102657272_100000182833 [0,3,0,0,0,0|1,0,0]=4 14246 B13R1.187 CNS(=O)(=O)c1ccc(cc1)OC 274078a_100102657272_100000182833 [0,3,0,0,0,0|1,0,0]=4 14247 B13R1.187 CNS(=O)(=O)c1ccc(cc1)SC 270084a_100102657272_100000747762 [0,3,0,0,0,0|1,0,0]=4 14248 B13R1.187 CNS(=O)(=O)c1ccc(cc1)SC 274078a_100102657272_100000747762 [0,3,0,0,0,0|1,0,0]=4 14249 B13R1.187 CNS(=O)(=O)c1ccc(cc1)SC 62a_100000754977_200000210301 [0,3,0,0,0,0|1,0,0]=4 14250 B13R1.187 CNS(=O)(=O)c1ccc(cc1)SC 62a_200000210301_100000754977 [0,3,0,0,0,0|1,0,0]=4 14251 B13R1.187 CNS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_100000754977_200025704644 [0,3,0,0,0,0|1,0,0]=4 14252 B13R1.187 CNS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000754977 [0,3,0,0,0,0|1,0,0]=4 14253 B13R1.187 CNc1ccc(cc1)S(=O)(=O)NC 34a_100000184917_200000210301 [0,3,0,0,0,0|1,0,0]=4 14254 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)Br 270084a_100102657272_200011211985 [0,3,0,0,0,0|1,0,0]=4 14255 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)Br 274078a_100102657272_200011211985 [0,3,0,0,0,0|1,0,0]=4 14256 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)C 270084a_100102657272_100000764225 [0,3,0,0,0,0|1,0,0]=4 14257 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)C 274078a_100102657272_100000764225 [0,3,0,0,0,0|1,0,0]=4 14258 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)Cl 270084a_100102657272_100000687180 [0,3,0,0,0,0|1,0,0]=4 14259 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)Cl 274078a_100102657272_100000687180 [0,3,0,0,0,0|1,0,0]=4 14260 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)F 270084a_100102657272_100000765437 [0,3,0,0,0,0|1,0,0]=4 14261 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)F 274078a_100102657272_100000765437 [0,3,0,0,0,0|1,0,0]=4 14262 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Br)F 40a_100102657272_100015196426 [0,3,0,0,0,0|1,0,0]=4 14263 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 270084a_100102657272_100000184575 [0,3,0,0,0,0|1,0,0]=4 14264 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 274078a_100102657272_100000184575 [0,3,0,0,0,0|1,0,0]=4 14265 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 40a_100102657272_200015196462 [0,3,0,0,0,0|1,0,0]=4 14266 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)C 270084a_100102657272_200000182954 [0,3,0,0,0,0|1,0,0]=4 14267 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)C 274078a_100102657272_200000182954 [0,3,0,0,0,0|1,0,0]=4 14268 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Cl 270084a_100102657272_100000051332 [0,3,0,0,0,0|1,0,0]=4 14269 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Cl 274078a_100102657272_100000051332 [0,3,0,0,0,0|1,0,0]=4 14270 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)F 270084a_100102657272_100000742315 [0,3,0,0,0,0|1,0,0]=4 14271 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)F 274078a_100102657272_100000742315 [0,3,0,0,0,0|1,0,0]=4 14272 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000165156 [0,3,0,0,0,0|1,0,0]=4 14273 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Br 270084a_100102657272_100000692077 [0,3,0,0,0,0|1,0,0]=4 14274 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Br 274078a_100102657272_100000692077 [0,3,0,0,0,0|1,0,0]=4 14275 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Br 40a_100102657272_100015196460 [0,3,0,0,0,0|1,0,0]=4 14276 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)C 270084a_100102657272_100000739382 [0,3,0,0,0,0|1,0,0]=4 14277 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)C 274078a_100102657272_100000739382 [0,3,0,0,0,0|1,0,0]=4 14278 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)C 40a_100102657272_200015694257 [0,3,0,0,0,0|1,0,0]=4 14279 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Cl 270084a_100102657272_100000183565 [0,3,0,0,0,0|1,0,0]=4 14280 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Cl 274078a_100102657272_100000183565 [0,3,0,0,0,0|1,0,0]=4 14281 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)Cl 40a_100102657272_200010235540 [0,3,0,0,0,0|1,0,0]=4 14282 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)F 270084a_100102657272_100000184080 [0,3,0,0,0,0|1,0,0]=4 14283 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)F 274078a_100102657272_100000184080 [0,3,0,0,0,0|1,0,0]=4 14284 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)Cl)N 40a_100102657272_200000036663 [0,3,0,0,0,0|1,0,0]=4 14285 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)Br 270084a_100102657272_100000763610 [0,3,0,0,0,0|1,0,0]=4 14286 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)Br 274078a_100102657272_100000763610 [0,3,0,0,0,0|1,0,0]=4 14287 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)C 270084a_100102657272_100000739383 [0,3,0,0,0,0|1,0,0]=4 14288 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)C 274078a_100102657272_100000739383 [0,3,0,0,0,0|1,0,0]=4 14289 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)Cl 270084a_100102657272_100011317203 [0,3,0,0,0,0|1,0,0]=4 14290 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)Cl 274078a_100102657272_100011317203 [0,3,0,0,0,0|1,0,0]=4 14291 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)F 270084a_100102657272_100000211408 [0,3,0,0,0,0|1,0,0]=4 14292 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)F)F 274078a_100102657272_100000211408 [0,3,0,0,0,0|1,0,0]=4 14293 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)N)Cl 40a_100102657272_100000039682 [0,3,0,0,0,0|1,0,0]=4 14294 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)O)C 271570a_203496583355_200012355755 [0,3,0,0,0,0|1,0,0]=4 14295 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Br 270084a_100102631434_100000182491 [0,3,0,0,0,0|1,0,0]=4 14296 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Br 274078a_100102631434_100000182491 [0,3,0,0,0,0|1,0,0]=4 14297 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Br 40a_100102631434_100010306709 [0,3,0,0,0,0|1,0,0]=4 14298 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Cl 270084a_100102631434_100000209962 [0,3,0,0,0,0|1,0,0]=4 14299 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Cl 274078a_100102631434_100000209962 [0,3,0,0,0,0|1,0,0]=4 14300 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)Cl 40a_100102631434_100000077732 [0,3,0,0,0,0|1,0,0]=4 14301 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)F 270084a_100102631434_100000184267 [0,3,0,0,0,0|1,0,0]=4 14302 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)F 274078a_100102631434_100000184267 [0,3,0,0,0,0|1,0,0]=4 14303 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)F 40a_100102631434_100000081159 [0,3,0,0,0,0|1,0,0]=4 14304 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)I 270084a_100102631434_100011205396 [0,3,0,0,0,0|1,0,0]=4 14305 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)I 274078a_100102631434_100011205396 [0,3,0,0,0,0|1,0,0]=4 14306 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)N 40a_100102631434_100000054796 [0,3,0,0,0,0|1,0,0]=4 14307 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 270084a_100102631434_100020667864 [0,3,0,0,0,0|1,0,0]=4 14308 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000165035 [0,3,0,0,0,0|1,0,0]=4 14309 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 274078a_100102631434_100020667864 [0,3,0,0,0,0|1,0,0]=4 14310 B13R1.522 Cc1ccc(cc1)S(=O)(=O)N(C)C 270084a_100102631434_100000211267 [0,3,0,0,0,0|1,0,0]=4 14311 B13R1.522 Cc1ccc(cc1)S(=O)(=O)N(C)C 274078a_100102631434_100000211267 [0,3,0,0,0,0|1,0,0]=4 14312 B13R1.522 Cc1ccc(cc1)S(=O)(=O)N(C)C 40a_100102631434_100000039673 [0,3,0,0,0,0|1,0,0]=4 14313 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)Br 270084a_100102657272_100000741759 [0,3,0,0,0,0|1,0,0]=4 14314 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)Br 274078a_100102657272_100000741759 [0,3,0,0,0,0|1,0,0]=4 14315 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)C 270084a_100102657272_100000736722 [0,3,0,0,0,0|1,0,0]=4 14316 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)C 274078a_100102657272_100000736722 [0,3,0,0,0,0|1,0,0]=4 14317 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)Cl 270084a_100102657272_100000726161 [0,3,0,0,0,0|1,0,0]=4 14318 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)Cl 274078a_100102657272_100000726161 [0,3,0,0,0,0|1,0,0]=4 14319 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)F 270084a_100102657272_100000739518 [0,3,0,0,0,0|1,0,0]=4 14320 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Br)F 274078a_100102657272_100000739518 [0,3,0,0,0,0|1,0,0]=4 14321 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)Br 270084a_100102657272_100000744902 [0,3,0,0,0,0|1,0,0]=4 14322 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)Br 274078a_100102657272_100000744902 [0,3,0,0,0,0|1,0,0]=4 14323 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)Br 40a_100102657272_100015196448 [0,3,0,0,0,0|1,0,0]=4 14324 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)C 270084a_100102657272_100000182922 [0,3,0,0,0,0|1,0,0]=4 14325 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)C 274078a_100102657272_100000182922 [0,3,0,0,0,0|1,0,0]=4 14326 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)Cl 270084a_100102657272_200000739422 [0,3,0,0,0,0|1,0,0]=4 14327 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)Cl 274078a_100102657272_200000739422 [0,3,0,0,0,0|1,0,0]=4 14328 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)F 270084a_100102657272_100000736127 [0,3,0,0,0,0|1,0,0]=4 14329 B13R1.4183 CNS(=O)(=O)c1ccc(cc1C)F 274078a_100102657272_100000736127 [0,3,0,0,0,0|1,0,0]=4 14330 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)Br 270084a_100102657272_100000184074 [0,3,0,0,0,0|1,0,0]=4 14331 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)Br 274078a_100102657272_100000184074 [0,3,0,0,0,0|1,0,0]=4 14332 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)C 270084a_100102657272_100000735684 [0,3,0,0,0,0|1,0,0]=4 14333 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)C 274078a_100102657272_100000735684 [0,3,0,0,0,0|1,0,0]=4 14334 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)Cl 270084a_100102657272_100000720568 [0,3,0,0,0,0|1,0,0]=4 14335 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)Cl 274078a_100102657272_100000720568 [0,3,0,0,0,0|1,0,0]=4 14336 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)F 270084a_100102657272_100000736424 [0,3,0,0,0,0|1,0,0]=4 14337 B13R1.4183 CNS(=O)(=O)c1ccc(cc1Cl)F 274078a_100102657272_100000736424 [0,3,0,0,0,0|1,0,0]=4 14338 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)Br 270084a_100102657272_100000752951 [0,3,0,0,0,0|1,0,0]=4 14339 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)Br 274078a_100102657272_100000752951 [0,3,0,0,0,0|1,0,0]=4 14340 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)C 270084a_100102657272_100000751630 [0,3,0,0,0,0|1,0,0]=4 14341 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)C 274078a_100102657272_100000751630 [0,3,0,0,0,0|1,0,0]=4 14342 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)Cl 274078a_100102657272_100000179752 [0,3,0,0,0,0|1,0,0]=4 14343 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)F 270084a_100102657272_100000204641 [0,3,0,0,0,0|1,0,0]=4 14344 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)F 274078a_100102657272_100000204641 [0,3,0,0,0,0|1,0,0]=4 14345 B13R1.4183 CNS(=O)(=O)c1ccc(cc1F)N 40a_100102657272_100021443812 [0,3,0,0,0,0|1,0,0]=4 14346 B13R1.7 CNS(=O)(=O)c1cccc(c1Br)C 270084a_100102657272_100000690207 [0,3,0,0,0,0|1,0,0]=4 14347 B13R1.7 CNS(=O)(=O)c1cccc(c1Br)C 274078a_100102657272_100000690207 [0,3,0,0,0,0|1,0,0]=4 14348 B13R1.7 CNS(=O)(=O)c1cccc(c1Br)Cl 270084a_100102657272_100000719369 [0,3,0,0,0,0|1,0,0]=4 14349 B13R1.7 CNS(=O)(=O)c1cccc(c1Br)Cl 274078a_100102657272_100000719369 [0,3,0,0,0,0|1,0,0]=4 14350 B13R1.7 CNS(=O)(=O)c1cccc(c1C)Br 270084a_100102657272_100000765892 [0,3,0,0,0,0|1,0,0]=4 14351 B13R1.7 CNS(=O)(=O)c1cccc(c1C)Br 274078a_100102657272_100000765892 [0,3,0,0,0,0|1,0,0]=4 14352 B13R1.7 CNS(=O)(=O)c1cccc(c1C)Cl 270084a_100102657272_100000739340 [0,3,0,0,0,0|1,0,0]=4 14353 B13R1.7 CNS(=O)(=O)c1cccc(c1C)Cl 274078a_100102657272_100000739340 [0,3,0,0,0,0|1,0,0]=4 14354 B13R1.7 CNS(=O)(=O)c1cccc(c1C)F 270084a_100102657272_100000764228 [0,3,0,0,0,0|1,0,0]=4 14355 B13R1.7 CNS(=O)(=O)c1cccc(c1C)F 274078a_100102657272_100000764228 [0,3,0,0,0,0|1,0,0]=4 14356 B13R1.7 CNS(=O)(=O)c1cccc(c1Cl)Cl 270084a_100102657272_100000182955 [0,3,0,0,0,0|1,0,0]=4 14357 B13R1.7 CNS(=O)(=O)c1cccc(c1Cl)Cl 274078a_100102657272_100000182955 [0,3,0,0,0,0|1,0,0]=4 14358 B13R1.7 CNS(=O)(=O)c1cccc(c1Cl)Cl 40a_100102657272_200015196484 [0,3,0,0,0,0|1,0,0]=4 14359 B13R1.7 CNS(=O)(=O)c1cccc(c1Cl)F 270084a_100102657272_200012020443 [0,3,0,0,0,0|1,0,0]=4 14360 B13R1.7 CNS(=O)(=O)c1cccc(c1Cl)F 274078a_100102657272_200012020443 [0,3,0,0,0,0|1,0,0]=4 14361 B13R1.7 CNS(=O)(=O)c1cccc(c1F)Br 270084a_100102657272_100000726105 [0,3,0,0,0,0|1,0,0]=4 14362 B13R1.7 CNS(=O)(=O)c1cccc(c1F)Br 274078a_100102657272_100000726105 [0,3,0,0,0,0|1,0,0]=4 14363 B13R1.7 CNS(=O)(=O)c1cccc(c1F)Cl 270084a_100102657272_100000739339 [0,3,0,0,0,0|1,0,0]=4 14364 B13R1.7 CNS(=O)(=O)c1cccc(c1F)Cl 274078a_100102657272_100000739339 [0,3,0,0,0,0|1,0,0]=4 14365 B13R1.7 CNS(=O)(=O)c1cccc(c1F)F 270084a_100102657272_100000749228 [0,3,0,0,0,0|1,0,0]=4 14366 B13R1.7 CNS(=O)(=O)c1cccc(c1F)F 274078a_100102657272_100000749228 [0,3,0,0,0,0|1,0,0]=4 14367 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Br 270084a_100015525214_100000184224 [0,3,0,0,0,0|1,0,0]=4 14368 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Br 274078a_100015525214_100000184224 [0,3,0,0,0,0|1,0,0]=4 14369 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Br 40a_100015525214_100010340488 [0,3,0,0,0,0|1,0,0]=4 14370 B13R1.30 CCNS(=O)(=O)c1cccc(c1)C 270084a_100015525214_100000182797 [0,3,0,0,0,0|1,0,0]=4 14371 B13R1.30 CCNS(=O)(=O)c1cccc(c1)C 274078a_100015525214_100000182797 [0,3,0,0,0,0|1,0,0]=4 14372 B13R1.30 CCNS(=O)(=O)c1cccc(c1)C 40a_100015525214_100010983817 [0,3,0,0,0,0|1,0,0]=4 14373 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Cl 270084a_100015525214_100000182923 [0,3,0,0,0,0|1,0,0]=4 14374 B13R1.30 CCNS(=O)(=O)c1cccc(c1)Cl 274078a_100015525214_100000182923 [0,3,0,0,0,0|1,0,0]=4 14375 B13R1.30 CCNS(=O)(=O)c1cccc(c1)F 270084a_100015525214_100000184201 [0,3,0,0,0,0|1,0,0]=4 14376 B13R1.30 CCNS(=O)(=O)c1cccc(c1)F 274078a_100015525214_100000184201 [0,3,0,0,0,0|1,0,0]=4 14377 B13R1.30 CCNS(=O)(=O)c1cccc(c1)N 40a_100015525214_100000034547 [0,3,0,0,0,0|1,0,0]=4 14378 B13R1.30 CNNS(=O)(=O)c1cccc(c1)Br 40a_100016993582_100010340488 [0,3,0,0,0,0|1,0,0]=4 14379 B13R1.30 CNNS(=O)(=O)c1cccc(c1)C 40a_100016993582_100010983817 [0,3,0,0,0,0|1,0,0]=4 14380 B13R1.30 CNNS(=O)(=O)c1cccc(c1)N 40a_100016993582_100000034547 [0,3,0,0,0,0|1,0,0]=4 14381 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)Br 270084a_100102657272_100000211531 [0,3,0,0,0,0|1,0,0]=4 14382 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)Br 274078a_100102657272_100000211531 [0,3,0,0,0,0|1,0,0]=4 14383 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)C 270084a_100102657272_100000755929 [0,3,0,0,0,0|1,0,0]=4 14384 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)C 274078a_100102657272_100000755929 [0,3,0,0,0,0|1,0,0]=4 14385 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)F 270084a_100102657272_100000756779 [0,3,0,0,0,0|1,0,0]=4 14386 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)F 274078a_100102657272_100000756779 [0,3,0,0,0,0|1,0,0]=4 14387 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)Br 270084a_100102657272_100000212279 [0,3,0,0,0,0|1,0,0]=4 14388 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)Br 274078a_100102657272_100000212279 [0,3,0,0,0,0|1,0,0]=4 14389 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)C 270084a_100102657272_100000182921 [0,3,0,0,0,0|1,0,0]=4 14390 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)C 274078a_100102657272_100000182921 [0,3,0,0,0,0|1,0,0]=4 14391 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)Cl 270084a_100102657272_100000737673 [0,3,0,0,0,0|1,0,0]=4 14392 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)Cl 274078a_100102657272_100000737673 [0,3,0,0,0,0|1,0,0]=4 14393 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)F 270084a_100102657272_100000739337 [0,3,0,0,0,0|1,0,0]=4 14394 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)F 274078a_100102657272_100000739337 [0,3,0,0,0,0|1,0,0]=4 14395 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)N 40a_100102657272_100009955767 [0,3,0,0,0,0|1,0,0]=4 14396 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)O 271570a_203496583355_100000198749 [0,3,0,0,0,0|1,0,0]=4 14397 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)Br 270084a_100102657272_100000750863 [0,3,0,0,0,0|1,0,0]=4 14398 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)Br 274078a_100102657272_100000750863 [0,3,0,0,0,0|1,0,0]=4 14399 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)C 270084a_100102657272_100000695277 [0,3,0,0,0,0|1,0,0]=4 14400 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)C 274078a_100102657272_100000695277 [0,3,0,0,0,0|1,0,0]=4 14401 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)Cl 270084a_100102657272_100000182608 [0,3,0,0,0,0|1,0,0]=4 14402 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)Cl 274078a_100102657272_100000182608 [0,3,0,0,0,0|1,0,0]=4 14403 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)F 270084a_100102657272_100000751632 [0,3,0,0,0,0|1,0,0]=4 14404 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)F 274078a_100102657272_100000751632 [0,3,0,0,0,0|1,0,0]=4 14405 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)Br 270084a_100102657272_100000748325 [0,3,0,0,0,0|1,0,0]=4 14406 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)Br 274078a_100102657272_100000748325 [0,3,0,0,0,0|1,0,0]=4 14407 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)Br 40a_100102657272_100015196433 [0,3,0,0,0,0|1,0,0]=4 14408 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)C 270084a_100102657272_100000739338 [0,3,0,0,0,0|1,0,0]=4 14409 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)C 274078a_100102657272_100000739338 [0,3,0,0,0,0|1,0,0]=4 14410 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)Cl 270084a_100102657272_100000760850 [0,3,0,0,0,0|1,0,0]=4 14411 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)Cl 274078a_100102657272_100000760850 [0,3,0,0,0,0|1,0,0]=4 14412 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)F 270084a_100102657272_100000212297 [0,3,0,0,0,0|1,0,0]=4 14413 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)F 274078a_100102657272_100000212297 [0,3,0,0,0,0|1,0,0]=4 14414 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)O 271570a_203496583355_100011640944 [0,3,0,0,0,0|1,0,0]=4 14415 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)Br 270084a_100102657272_100010254530 [0,3,0,0,0,0|1,0,0]=4 14416 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)Br 274078a_100102657272_100010254530 [0,3,0,0,0,0|1,0,0]=4 14417 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)C 270084a_100102657272_100000708958 [0,3,0,0,0,0|1,0,0]=4 14418 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)C 274078a_100102657272_100000708958 [0,3,0,0,0,0|1,0,0]=4 14419 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)Cl 270084a_100102657272_100010173016 [0,3,0,0,0,0|1,0,0]=4 14420 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)Cl 274078a_100102657272_100010173016 [0,3,0,0,0,0|1,0,0]=4 14421 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)F 270084a_100102657272_100016011139 [0,3,0,0,0,0|1,0,0]=4 14422 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Br)F 274078a_100102657272_100016011139 [0,3,0,0,0,0|1,0,0]=4 14423 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)C)C 270084a_100102657272_100000184731 [0,3,0,0,0,0|1,0,0]=4 14424 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)C)C 274078a_100102657272_100000184731 [0,3,0,0,0,0|1,0,0]=4 14425 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Cl)Cl 270084a_100102657272_100000184198 [0,3,0,0,0,0|1,0,0]=4 14426 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Cl)Cl 274078a_100102657272_100000184198 [0,3,0,0,0,0|1,0,0]=4 14427 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Cl)F 270084a_100102657272_100000693249 [0,3,0,0,0,0|1,0,0]=4 14428 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)Cl)F 274078a_100102657272_100000693249 [0,3,0,0,0,0|1,0,0]=4 14429 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)F)F 270084a_100102657272_100000229896 [0,3,0,0,0,0|1,0,0]=4 14430 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)F)F 274078a_100102657272_100000229896 [0,3,0,0,0,0|1,0,0]=4 14431 B13R1.260 CNS(=O)(=O)c1cc(cc(c1)F)F 40a_100102657272_100010984358 [0,3,0,0,0,0|1,0,0]=4 14432 B13R1.3040 C=Cc1cccc(c1)S(=O)(=O)NC 271570a_100011290941_100000165148 [0,3,0,0,0,0|1,0,0]=4 14433 B13R1.3040 CNS(=O)(=O)c1cccc(c1)C#N 270084a_100102657272_100000184524 [0,3,0,0,0,0|1,0,0]=4 14434 B13R1.3040 CNS(=O)(=O)c1cccc(c1)C#N 274078a_100102657272_100000184524 [0,3,0,0,0,0|1,0,0]=4 14435 B13R1.3040 CNS(=O)(=O)c1cccc(c1)C#N 40a_100102657272_100011004471 [0,3,0,0,0,0|1,0,0]=4 14436 B13R1.3040 CNS(=O)(=O)c1cccc(c1)CBr 270084a_100102657272_200000734173 [0,3,0,0,0,0|1,0,0]=4 14437 B13R1.3040 CNS(=O)(=O)c1cccc(c1)CBr 274078a_100102657272_200000734173 [0,3,0,0,0,0|1,0,0]=4 14438 B13R1.3040 CNS(=O)(=O)c1cccc(c1)N[13CH3] 34a_100000738320_200025704644 [0,3,0,0,0,0|1,0,0]=4 14439 B13R1.3040 CNS(=O)(=O)c1cccc(c1)N[13CH3] 7a_100000738320_200025704644 [0,3,0,0,0,0|1,0,0]=4 14440 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 270084a_100102657272_100000750905 [0,3,0,0,0,0|1,0,0]=4 14441 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 274078a_100102657272_100000750905 [0,3,0,0,0,0|1,0,0]=4 14442 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 40a_100102657272_200010300420 [0,3,0,0,0,0|1,0,0]=4 14443 B13R1.3040 CNS(=O)(=O)c1cccc(c1)SC 62a_100000165148_200000210301 [0,3,0,0,0,0|1,0,0]=4 14444 B13R1.3040 CNS(=O)(=O)c1cccc(c1)SC 62a_200000210301_100000165148 [0,3,0,0,0,0|1,0,0]=4 14445 B13R1.3040 CNS(=O)(=O)c1cccc(c1)S[13CH3] 62a_100000165148_200025704644 [0,3,0,0,0,0|1,0,0]=4 14446 B13R1.3040 CNS(=O)(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000165148 [0,3,0,0,0,0|1,0,0]=4 14447 B13R1.3040 CNc1cccc(c1)S(=O)(=O)NC 34a_100000738320_200000210301 [0,3,0,0,0,0|1,0,0]=4 14448 B13R1.3040 CNc1cccc(c1)S(=O)(=O)NC 7a_100000738320_200000210301 [0,3,0,0,0,0|1,0,0]=4 14449 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)Br 270084a_100102631434_100000184224 [0,3,0,0,0,0|1,0,0]=4 14450 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)Br 274078a_100102631434_100000184224 [0,3,0,0,0,0|1,0,0]=4 14451 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)Br 40a_100102631434_100010340488 [0,3,0,0,0,0|1,0,0]=4 14452 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)Cl 270084a_100102631434_100000182923 [0,3,0,0,0,0|1,0,0]=4 14453 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)Cl 274078a_100102631434_100000182923 [0,3,0,0,0,0|1,0,0]=4 14454 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)F 270084a_100102631434_100000184201 [0,3,0,0,0,0|1,0,0]=4 14455 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)F 274078a_100102631434_100000184201 [0,3,0,0,0,0|1,0,0]=4 14456 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)N 40a_100102631434_100000034547 [0,3,0,0,0,0|1,0,0]=4 14457 B13R1.3493 CN(C)S(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000165079 [0,3,0,0,0,0|1,0,0]=4 14458 B13R1.3493 Cc1cccc(c1)S(=O)(=O)N(C)C 270084a_100102631434_100000182797 [0,3,0,0,0,0|1,0,0]=4 14459 B13R1.3493 Cc1cccc(c1)S(=O)(=O)N(C)C 274078a_100102631434_100000182797 [0,3,0,0,0,0|1,0,0]=4 14460 B13R1.3493 Cc1cccc(c1)S(=O)(=O)N(C)C 40a_100102631434_100010983817 [0,3,0,0,0,0|1,0,0]=4 14461 B13R1.122 C#CCNS(=O)(=O)c1ccccc1 274078a_100000212058_100000210345 [0,3,0,0,0,0|1,0,0]=4 14462 B13R1.122 C#CCNS(=O)(=O)c1ccccc1 40a_100000212058_100000032697 [0,3,0,0,0,0|1,0,0]=4 14463 B13R1.122 C=CCNS(=O)(=O)c1ccccc1 270084a_100020586998_100000210345 [0,3,0,0,0,0|1,0,0]=4 14464 B13R1.122 C=CCNS(=O)(=O)c1ccccc1 274078a_100020586998_100000210345 [0,3,0,0,0,0|1,0,0]=4 14465 B13R1.122 C=CCNS(=O)(=O)c1ccccc1 40a_100020586998_100000032697 [0,3,0,0,0,0|1,0,0]=4 14466 B13R1.122 CCCNS(=O)(=O)c1ccccc1 270084a_100020643023_100000210345 [0,3,0,0,0,0|1,0,0]=4 14467 B13R1.122 CCCNS(=O)(=O)c1ccccc1 274078a_100020643023_100000210345 [0,3,0,0,0,0|1,0,0]=4 14468 B13R1.122 CCCNS(=O)(=O)c1ccccc1 40a_100020643023_100000032697 [0,3,0,0,0,0|1,0,0]=4 14469 B13R1.122 CCNNS(=O)(=O)c1ccccc1 40a_100000756455_100000032697 [0,3,0,0,0,0|1,0,0]=4 14470 B13R1.122 CNCCS(=O)(=O)c1ccccc1 2230a_100000168333_200000210301 [0,3,0,0,0,0|1,0,0]=4 14471 B13R1.122 CNCCS(=O)(=O)c1ccccc1 2230a_106832991635_100000229977 [0,3,0,0,0,0|1,0,0]=4 14472 B13R1.122 CNCCS(=O)(=O)c1ccccc1 7a_106832991635_100000229977 [0,3,0,0,0,0|1,0,0]=4 14473 B13R1.122 N#CCNS(=O)(=O)c1ccccc1 274078a_100000734998_100000210345 [0,3,0,0,0,0|1,0,0]=4 14474 B13R1.122 O=S(=O)(NCCF)c1ccccc1 270084a_100000724931_100000210345 [0,3,0,0,0,0|1,0,0]=4 14475 B13R1.122 O=S(=O)(NCCF)c1ccccc1 274078a_100000724931_100000210345 [0,3,0,0,0,0|1,0,0]=4 14476 B13R1.122 O=S(=O)(NCCF)c1ccccc1 40a_100000724931_100000032697 [0,3,0,0,0,0|1,0,0]=4 14477 B13R1.122 O=S(=O)(NCCO)c1ccccc1 270084a_100000210304_100000210345 [0,3,0,0,0,0|1,0,0]=4 14478 B13R1.122 O=S(=O)(NCCO)c1ccccc1 274078a_100000210304_100000210345 [0,3,0,0,0,0|1,0,0]=4 14479 B13R1.122 O=S(=O)(NCCO)c1ccccc1 40a_100000210304_100000032697 [0,3,0,0,0,0|1,0,0]=4 14480 B13R1.122 [13CH3]NCCS(=O)(=O)c1ccccc1 2230a_100000168333_200025704644 [0,3,0,0,0,0|1,0,0]=4 14481 B13R1.347 CC(=O)NS(=O)(=O)c1ccccc1 2740a_100000164509_100015343762 [0,3,0,0,0,0|1,0,0]=4 14482 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 270084a_100138425928_100000210345 [0,3,0,0,0,0|1,0,0]=4 14483 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 274078a_100138425928_100000210345 [0,3,0,0,0,0|1,0,0]=4 14484 B13R1.347 CN(C)CS(=O)(=O)c1ccccc1 269982a_100102631434_100000240042 [0,3,0,0,0,0|1,0,0]=4 14485 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 270084a_100015525214_100000184729 [0,3,0,0,0,0|1,0,0]=4 14486 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 274078a_100015525214_100000184729 [0,3,0,0,0,0|1,0,0]=4 14487 B13R1.2819 CCNS(=O)(=O)c1ccccc1Br 40a_100015525214_100010380725 [0,3,0,0,0,0|1,0,0]=4 14488 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 270084a_100015525214_100000750907 [0,3,0,0,0,0|1,0,0]=4 14489 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 274078a_100015525214_100000750907 [0,3,0,0,0,0|1,0,0]=4 14490 B13R1.2819 CCNS(=O)(=O)c1ccccc1C 40a_100015525214_100010269479 [0,3,0,0,0,0|1,0,0]=4 14491 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl 270084a_100015525214_100000184199 [0,3,0,0,0,0|1,0,0]=4 14492 B13R1.2819 CCNS(=O)(=O)c1ccccc1Cl 274078a_100015525214_100000184199 [0,3,0,0,0,0|1,0,0]=4 14493 B13R1.2819 CCNS(=O)(=O)c1ccccc1F 270084a_100015525214_100000184916 [0,3,0,0,0,0|1,0,0]=4 14494 B13R1.2819 CCNS(=O)(=O)c1ccccc1F 274078a_100015525214_100000184916 [0,3,0,0,0,0|1,0,0]=4 14495 B13R1.2819 CCNS(=O)(=O)c1ccccc1I 270084a_100015525214_100011191325 [0,3,0,0,0,0|1,0,0]=4 14496 B13R1.2819 CCNS(=O)(=O)c1ccccc1I 274078a_100015525214_100011191325 [0,3,0,0,0,0|1,0,0]=4 14497 B13R1.2819 CCNS(=O)(=O)c1ccccc1N 40a_100015525214_100000703237 [0,3,0,0,0,0|1,0,0]=4 14498 B13R1.2819 CCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165236 [0,3,0,0,0,0|1,0,0]=4 14499 B13R1.2819 CNNS(=O)(=O)c1ccccc1Br 40a_100016993582_100010380725 [0,3,0,0,0,0|1,0,0]=4 14500 B13R1.2819 CNNS(=O)(=O)c1ccccc1C 40a_100016993582_100010269479 [0,3,0,0,0,0|1,0,0]=4 14501 B13R1.2819 CNNS(=O)(=O)c1ccccc1N 40a_100016993582_100000703237 [0,3,0,0,0,0|1,0,0]=4 14502 B13R1.2129 C=Cc1ccccc1S(=O)(=O)NC 271570a_100011290941_200000165157 [0,3,0,0,0,0|1,0,0]=4 14503 B13R1.2129 CCc1ccccc1S(=O)(=O)NC 270084a_100102657272_100000708428 [0,3,0,0,0,0|1,0,0]=4 14504 B13R1.2129 CCc1ccccc1S(=O)(=O)NC 274078a_100102657272_100000708428 [0,3,0,0,0,0|1,0,0]=4 14505 B13R1.2129 CNS(=O)(=O)c1ccccc1C#N 274078a_100102657272_100000184585 [0,3,0,0,0,0|1,0,0]=4 14506 B13R1.2129 CNS(=O)(=O)c1ccccc1C#N 40a_100102657272_100010340462 [0,3,0,0,0,0|1,0,0]=4 14507 B13R1.2129 CNS(=O)(=O)c1ccccc1N[13CH3] 34a_100000736802_200025704644 [0,3,0,0,0,0|1,0,0]=4 14508 B13R1.2129 CNS(=O)(=O)c1ccccc1OC 270084a_100102657272_100000183792 [0,3,0,0,0,0|1,0,0]=4 14509 B13R1.2129 CNS(=O)(=O)c1ccccc1OC 274078a_100102657272_100000183792 [0,3,0,0,0,0|1,0,0]=4 14510 B13R1.2129 CNS(=O)(=O)c1ccccc1SC 62a_200000165157_200000210301 [0,3,0,0,0,0|1,0,0]=4 14511 B13R1.2129 CNS(=O)(=O)c1ccccc1S[13CH3] 62a_200000165157_200025704644 [0,3,0,0,0,0|1,0,0]=4 14512 B13R1.2129 CNc1ccccc1S(=O)(=O)NC 34a_100000736802_200000210301 [0,3,0,0,0,0|1,0,0]=4 14513 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1Br 270084a_100102631434_100000184729 [0,3,0,0,0,0|1,0,0]=4 14514 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1Br 274078a_100102631434_100000184729 [0,3,0,0,0,0|1,0,0]=4 14515 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1Br 40a_100102631434_100010380725 [0,3,0,0,0,0|1,0,0]=4 14516 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1Cl 270084a_100102631434_100000184199 [0,3,0,0,0,0|1,0,0]=4 14517 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1Cl 274078a_100102631434_100000184199 [0,3,0,0,0,0|1,0,0]=4 14518 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1F 270084a_100102631434_100000184916 [0,3,0,0,0,0|1,0,0]=4 14519 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1F 274078a_100102631434_100000184916 [0,3,0,0,0,0|1,0,0]=4 14520 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1I 270084a_100102631434_100011191325 [0,3,0,0,0,0|1,0,0]=4 14521 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1I 274078a_100102631434_100011191325 [0,3,0,0,0,0|1,0,0]=4 14522 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1N 40a_100102631434_100000703237 [0,3,0,0,0,0|1,0,0]=4 14523 B13R1.3802 CN(C)S(=O)(=O)c1ccccc1O 271570a_203496583355_100000165087 [0,3,0,0,0,0|1,0,0]=4 14524 B13R1.3802 Cc1ccccc1S(=O)(=O)N(C)C 270084a_100102631434_100000750907 [0,3,0,0,0,0|1,0,0]=4 14525 B13R1.3802 Cc1ccccc1S(=O)(=O)N(C)C 274078a_100102631434_100000750907 [0,3,0,0,0,0|1,0,0]=4 14526 B13R1.3802 Cc1ccccc1S(=O)(=O)N(C)C 40a_100102631434_100010269479 [0,3,0,0,0,0|1,0,0]=4 14527 B13R1.8256 CNS(=O)(=O)c1c(cccc1Br)Br 270084a_100102657272_100012360373 [0,3,0,0,0,0|1,0,0]=4 14528 B13R1.8256 CNS(=O)(=O)c1c(cccc1Br)Br 274078a_100102657272_100012360373 [0,3,0,0,0,0|1,0,0]=4 14529 B13R1.8256 CNS(=O)(=O)c1c(cccc1Br)F 270084a_100102657272_100000686590 [0,3,0,0,0,0|1,0,0]=4 14530 B13R1.8256 CNS(=O)(=O)c1c(cccc1Br)F 274078a_100102657272_100000686590 [0,3,0,0,0,0|1,0,0]=4 14531 B13R1.8256 CNS(=O)(=O)c1c(cccc1Cl)C 270084a_100102657272_100011215119 [0,3,0,0,0,0|1,0,0]=4 14532 B13R1.8256 CNS(=O)(=O)c1c(cccc1Cl)C 274078a_100102657272_100011215119 [0,3,0,0,0,0|1,0,0]=4 14533 B13R1.8256 CNS(=O)(=O)c1c(cccc1Cl)Cl 270084a_100102657272_100000183960 [0,3,0,0,0,0|1,0,0]=4 14534 B13R1.8256 CNS(=O)(=O)c1c(cccc1Cl)Cl 274078a_100102657272_100000183960 [0,3,0,0,0,0|1,0,0]=4 14535 B13R1.8256 CNS(=O)(=O)c1c(cccc1F)F 274078a_100102657272_100000212100 [0,3,0,0,0,0|1,0,0]=4 14536 B13R1.26 C=CC(=NNCC)c1ccccc1 4a_100000756455_200000750708 [0,3,0,0,0,0|1,0,0]=4 14537 B13R1.26 CCNN=C(CC)c1ccccc1 4a_100000756455_100000210124 [0,3,0,0,0,0|1,0,0]=4 14538 B13R1.26 CCNN=C(CF)c1ccccc1 4a_100000756455_100000069468 [0,3,0,0,0,0|1,0,0]=4 14539 B13R1.26 CCNN=C(CO)c1ccccc1 4a_100000756455_100000748912 [0,3,0,0,0,0|0,0,1]=4 14540 B13R1.405 CCNC(C(=O)C)c1ccccc1 2230a_100015525214_100009888967 [0,3,0,0,0,0|0,0,1]=4 14541 B13R1.405 CCNC(C(=O)N)c1ccccc1 2230a_100015525214_100000188848 [0,3,0,0,0,0|0,0,1]=4 14542 B13R1.405 CCNC(C(=O)O)c1ccccc1 269956a_100000230147_100000210202 [0,3,0,0,0,0|0,0,1]=4 14543 B13R1.405 CCN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_100000210202 [0,3,0,0,0,0|0,0,1]=4 14544 B13R1.405 CNCC(C(=O)O)c1ccccc1 269956a_100000722792_200000210301 [0,3,0,0,0,0|0,0,1]=4 14545 B13R1.405 O=C(O)C(NCF)c1ccccc1 269956a_100000230147_100015361967 [0,3,0,0,0,0|0,0,1]=4 14546 B13R1.405 [13CH3]NCC(C(=O)O)c1ccccc1 269956a_100000722792_200025704644 [0,3,0,0,0,0|0,0,1]=4 14547 B13R1.713 CN[C@@H](CC(=O)O)c1ccccc1 269956a_100000751379_200000210301 [0,3,0,0,0,0|0,0,1]=4 14548 B13R1.713 [13CH3]N[C@@H](CC(=O)O)c1ccccc1 269956a_100000751379_200025704644 [0,3,0,0,0,0|0,0,1]=4 14549 B13R1.706 CNC(C(=O)O)c1ccc(cc1)Br 269956a_100102946273_200000210301 [0,3,0,0,0,0|0,0,1]=4 14550 B13R1.706 CNC(C(=O)O)c1ccc(cc1)C 269956a_100138412518_200000210301 [0,3,0,0,0,0|0,0,1]=4 14551 B13R1.706 CNC(C(=O)O)c1ccc(cc1)Cl 269956a_100000761553_200000210301 [0,3,0,0,0,0|0,0,1]=4 14552 B13R1.706 CNC(C(=O)O)c1ccc(cc1)F 269956a_100011215775_200000210301 [0,3,0,0,0,0|0,0,1]=4 14553 B13R1.706 Cc1ccc(cc1)C(N[13CH3])C(=O)O 269956a_100138412518_200025704644 [0,3,0,0,0,0|0,0,1]=4 14554 B13R1.706 [13CH3]NC(C(=O)O)c1ccc(cc1)Br 269956a_100102946273_200025704644 [0,3,0,0,0,0|0,0,1]=4 14555 B13R1.706 [13CH3]NC(C(=O)O)c1ccc(cc1)Cl 269956a_100000761553_200025704644 [0,3,0,0,0,0|0,0,1]=4 14556 B13R1.706 [13CH3]NC(C(=O)O)c1ccc(cc1)F 269956a_100011215775_200025704644 [0,3,0,0,0,0|0,0,1]=4 14557 B13R1.716 CNC(C(=O)O)c1cccc(c1)Br 269956a_100025717458_200000210301 [0,3,0,0,0,0|0,0,1]=4 14558 B13R1.716 CNC(C(=O)O)c1cccc(c1)C 269956a_100015207286_200000210301 [0,3,0,0,0,0|0,0,1]=4 14559 B13R1.716 CNC(C(=O)O)c1cccc(c1)Cl 269956a_100000752362_200000210301 [0,3,0,0,0,0|0,0,1]=4 14560 B13R1.716 CNC(C(=O)O)c1cccc(c1)F 269956a_100000752392_200000210301 [0,3,0,0,0,0|0,0,1]=4 14561 B13R1.716 Cc1cccc(c1)C(N[13CH3])C(=O)O 269956a_100015207286_200025704644 [0,3,0,0,0,0|0,0,1]=4 14562 B13R1.716 [13CH3]NC(C(=O)O)c1cccc(c1)Br 269956a_100025717458_200025704644 [0,3,0,0,0,0|0,0,1]=4 14563 B13R1.716 [13CH3]NC(C(=O)O)c1cccc(c1)Cl 269956a_100000752362_200025704644 [0,3,0,0,0,0|0,0,1]=4 14564 B13R1.716 [13CH3]NC(C(=O)O)c1cccc(c1)F 269956a_100000752392_200025704644 [0,3,0,0,0,0|0,0,1]=4 14565 B13R1.720 CNC(C(=O)O)c1ccccc1Br 269956a_100000744630_200000210301 [0,3,0,0,0,0|0,0,1]=4 14566 B13R1.720 CNC(C(=O)O)c1ccccc1C 269956a_100011223803_200000210301 [0,3,0,0,0,0|0,0,1]=4 14567 B13R1.720 CNC(C(=O)O)c1ccccc1F 269956a_100138411467_200000210301 [0,3,0,0,0,0|0,0,1]=4 14568 B13R1.720 CN[C@H](C(=O)O)c1ccccc1Cl 269956a_100009815989_200000210301 [0,3,0,0,0,0|0,0,1]=4 14569 B13R1.720 Cc1ccccc1C(N[13CH3])C(=O)O 269956a_100011223803_200025704644 [0,3,0,0,0,0|0,0,1]=4 14570 B13R1.720 [13CH3]NC(C(=O)O)c1ccccc1Br 269956a_100000744630_200025704644 [0,3,0,0,0,0|0,0,1]=4 14571 B13R1.720 [13CH3]NC(C(=O)O)c1ccccc1F 269956a_100138411467_200025704644 [0,3,0,0,0,0|0,0,1]=4 14572 B13R1.720 [13CH3]N[C@H](C(=O)O)c1ccccc1Cl 269956a_100009815989_200025704644 [0,3,0,0,0,0|0,0,1]=4 14573 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 1458a_100000743987_200000210301 [0,3,0,0,0,0|0,0,1]=4 14574 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 2230a_100102631434_100009888967 [0,3,0,0,0,0|0,0,1]=4 14575 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 269982a_100102631434_100009888967 [0,3,0,0,0,0|0,0,1]=4 14576 B13R1.1111 CN(C)C(C(=O)N)c1ccccc1 2230a_100102631434_100000188848 [0,3,0,0,0,0|0,0,1]=4 14577 B13R1.1111 CN(C)C(C(=O)N)c1ccccc1 269982a_100102631434_100000188848 [0,3,0,0,0,0|0,0,1]=4 14578 B13R1.1111 CN(C)C(C(=O)[13CH3])c1ccccc1 1458a_100000743987_200025704644 [0,3,0,0,0,0|0,0,1]=4 14579 B13R1.17 C#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000753159 [0,3,0,0,0,0|1,0,0]=4 14580 B13R1.17 C#CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000753159 [0,3,0,0,0,0|1,0,0]=4 14581 B13R1.17 C#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000753159 [0,3,0,0,0,0|1,0,0]=4 14582 B13R1.17 C#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000753159 [0,3,0,0,0,0|1,0,0]=4 14583 B13R1.17 C#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000753159 [0,3,0,0,0,0|1,0,0]=4 14584 B13R1.17 C#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000753159 [0,3,0,0,0,0|1,0,0]=4 14585 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 11a_100000212058_100000185839 [0,3,0,0,0,0|0,0,0]=3 14586 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 1626a_100000212058_100000185839 [0,3,0,0,0,0|0,0,0]=3 14587 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 240690a_100000212058_100000185839 [0,3,0,0,0,0|0,0,0]=3 14588 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 527a_100000212058_100000185839 [0,3,0,0,0,0|0,0,0]=3 14589 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 11a_100000212058_100000188618 [0,3,0,0,0,0|0,0,0]=3 14590 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 1626a_100000212058_100000188618 [0,3,0,0,0,0|0,0,0]=3 14591 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 240690a_100000212058_100000188618 [0,3,0,0,0,0|0,0,0]=3 14592 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 527a_100000212058_100000188618 [0,3,0,0,0,0|0,0,0]=3 14593 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 11a_100000212058_100000210187 [0,3,0,0,0,0|0,0,0]=3 14594 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 1626a_100000212058_100000210187 [0,3,0,0,0,0|0,0,0]=3 14595 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 240690a_100000212058_100000210187 [0,3,0,0,0,0|0,0,0]=3 14596 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 527a_100000212058_100000210187 [0,3,0,0,0,0|0,0,0]=3 14597 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 11a_100000212058_100000187176 [0,3,0,0,0,0|0,0,0]=3 14598 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 1626a_100000212058_100000187176 [0,3,0,0,0,0|0,0,0]=3 14599 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 240690a_100000212058_100000187176 [0,3,0,0,0,0|0,0,0]=3 14600 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 527a_100000212058_100000187176 [0,3,0,0,0,0|0,0,0]=3 14601 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 11a_100000212058_100000187904 [0,3,0,0,0,0|0,0,0]=3 14602 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 1626a_100000212058_100000187904 [0,3,0,0,0,0|0,0,0]=3 14603 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 240690a_100000212058_100000187904 [0,3,0,0,0,0|0,0,0]=3 14604 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 527a_100000212058_100000187904 [0,3,0,0,0,0|0,0,0]=3 14605 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 240690a_100000212058_100000212099 [0,3,0,0,0,0|0,0,0]=3 14606 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 527a_100000212058_100000212099 [0,3,0,0,0,0|0,0,0]=3 14607 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)Br 1458a_100000185839_100102629194 [0,3,0,0,0,0|1,0,0]=4 14608 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)C 1458a_100000188618_100102629194 [0,3,0,0,0,0|1,0,0]=4 14609 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100102629194 [0,3,0,0,0,0|1,0,0]=4 14610 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)F 1458a_100000187176_100102629194 [0,3,0,0,0,0|1,0,0]=4 14611 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)I 1458a_100000187904_100102629194 [0,3,0,0,0,0|1,0,0]=4 14612 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)O 1458a_100000212099_100102629194 [0,3,0,0,0,0|1,0,0]=4 14613 B13R1.17 C=CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000754431 [0,3,0,0,0,0|1,0,0]=4 14614 B13R1.17 C=CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000754431 [0,3,0,0,0,0|1,0,0]=4 14615 B13R1.17 C=CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000754431 [0,3,0,0,0,0|1,0,0]=4 14616 B13R1.17 C=CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000754431 [0,3,0,0,0,0|1,0,0]=4 14617 B13R1.17 C=CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000754431 [0,3,0,0,0,0|1,0,0]=4 14618 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000754431 [0,3,0,0,0,0|1,0,0]=4 14619 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 271570a_203496583355_200012050250 [0,3,0,0,0,0|1,0,0]=4 14620 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 1626a_100020586998_100000185839 [0,3,0,0,0,0|0,0,0]=3 14621 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 240690a_100020586998_100000185839 [0,3,0,0,0,0|0,0,0]=3 14622 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 527a_100020586998_100000185839 [0,3,0,0,0,0|0,0,0]=3 14623 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 1626a_100020586998_100000188618 [0,3,0,0,0,0|0,0,0]=3 14624 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 240690a_100020586998_100000188618 [0,3,0,0,0,0|0,0,0]=3 14625 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 527a_100020586998_100000188618 [0,3,0,0,0,0|0,0,0]=3 14626 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 1626a_100020586998_100000210187 [0,3,0,0,0,0|0,0,0]=3 14627 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 240690a_100020586998_100000210187 [0,3,0,0,0,0|0,0,0]=3 14628 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 527a_100020586998_100000210187 [0,3,0,0,0,0|0,0,0]=3 14629 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 1626a_100020586998_100000187176 [0,3,0,0,0,0|0,0,0]=3 14630 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 240690a_100020586998_100000187176 [0,3,0,0,0,0|0,0,0]=3 14631 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 527a_100020586998_100000187176 [0,3,0,0,0,0|0,0,0]=3 14632 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 1626a_100020586998_100000187904 [0,3,0,0,0,0|0,0,0]=3 14633 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 240690a_100020586998_100000187904 [0,3,0,0,0,0|0,0,0]=3 14634 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 527a_100020586998_100000187904 [0,3,0,0,0,0|0,0,0]=3 14635 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 240690a_100020586998_100000212099 [0,3,0,0,0,0|0,0,0]=3 14636 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 527a_100020586998_100000212099 [0,3,0,0,0,0|0,0,0]=3 14637 B13R1.17 CC#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748600 [0,3,0,0,0,0|1,0,0]=4 14638 B13R1.17 CC#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000748600 [0,3,0,0,0,0|1,0,0]=4 14639 B13R1.17 CC#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748600 [0,3,0,0,0,0|1,0,0]=4 14640 B13R1.17 CC#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000748600 [0,3,0,0,0,0|1,0,0]=4 14641 B13R1.17 CC#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000748600 [0,3,0,0,0,0|1,0,0]=4 14642 B13R1.17 CC#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000748600 [0,3,0,0,0,0|1,0,0]=4 14643 B13R1.17 CC=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000070051 [0,3,0,0,0,0|1,0,0]=4 14644 B13R1.17 CC=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000070051 [0,3,0,0,0,0|1,0,0]=4 14645 B13R1.17 CC=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000070051 [0,3,0,0,0,0|1,0,0]=4 14646 B13R1.17 CC=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000070051 [0,3,0,0,0,0|1,0,0]=4 14647 B13R1.17 CC=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000070051 [0,3,0,0,0,0|1,0,0]=4 14648 B13R1.17 CC=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000070051 [0,3,0,0,0,0|1,0,0]=4 14649 B13R1.17 CC=NNC(=O)c1ccc(=O)[nH]c1 4a_100000189851_200000210099 [0,3,0,0,0,0|1,0,0]=4 14650 B13R1.17 CC=NNC(=O)c1ccc(cc1)Br 4a_100000183614_200000210099 [0,3,0,0,0,0|0,0,0]=3 14651 B13R1.17 CC=NNC(=O)c1ccc(cc1)C 4a_100000189790_200000210099 [0,3,0,0,0,0|0,0,0]=3 14652 B13R1.17 CC=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_200000210099 [0,3,0,0,0,0|0,0,0]=3 14653 B13R1.17 CC=NNC(=O)c1ccc(cc1)F 4a_100000182866_200000210099 [0,3,0,0,0,0|0,0,0]=3 14654 B13R1.17 CC=NNC(=O)c1ccc(cc1)I 4a_100000189773_200000210099 [0,3,0,0,0,0|0,0,0]=3 14655 B13R1.17 CC=NNC(=O)c1ccc(cn1)Br 4a_100011781063_200000210099 [0,3,0,0,0,0|1,0,0]=4 14656 B13R1.17 CC=NNC(=O)c1ccc(cn1)Cl 4a_100012017650_200000210099 [0,3,0,0,0,0|1,0,0]=4 14657 B13R1.17 CC=NNC(=O)c1ccc(cn1)F 4a_100012021870_200000210099 [0,3,0,0,0,0|1,0,0]=4 14658 B13R1.17 CC=NNC(=O)c1ccc(nc1)C 4a_100011193134_200000210099 [0,3,0,0,0,0|1,0,0]=4 14659 B13R1.17 CC=NNC(=O)c1ccc(nc1)Cl 4a_100000189807_200000210099 [0,3,0,0,0,0|1,0,0]=4 14660 B13R1.17 CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210211 [0,3,0,0,0,0|1,0,0]=4 14661 B13R1.17 CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210211 [0,3,0,0,0,0|1,0,0]=4 14662 B13R1.17 CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210211 [0,3,0,0,0,0|1,0,0]=4 14663 B13R1.17 CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210211 [0,3,0,0,0,0|1,0,0]=4 14664 B13R1.17 CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210211 [0,3,0,0,0,0|1,0,0]=4 14665 B13R1.17 CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210211 [0,3,0,0,0,0|1,0,0]=4 14666 B13R1.17 CCCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011215321 [0,3,0,0,0,0|1,0,0]=4 14667 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 11a_100020643023_100000185839 [0,3,0,0,0,0|0,0,0]=3 14668 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 1626a_100020643023_100000185839 [0,3,0,0,0,0|0,0,0]=3 14669 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 240690a_100020643023_100000185839 [0,3,0,0,0,0|0,0,0]=3 14670 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 527a_100020643023_100000185839 [0,3,0,0,0,0|0,0,0]=3 14671 B13R1.17 CCCNC(=O)c1ccc(cc1)C 11a_100020643023_100000188618 [0,3,0,0,0,0|0,0,0]=3 14672 B13R1.17 CCCNC(=O)c1ccc(cc1)C 1626a_100020643023_100000188618 [0,3,0,0,0,0|0,0,0]=3 14673 B13R1.17 CCCNC(=O)c1ccc(cc1)C 240690a_100020643023_100000188618 [0,3,0,0,0,0|0,0,0]=3 14674 B13R1.17 CCCNC(=O)c1ccc(cc1)C 527a_100020643023_100000188618 [0,3,0,0,0,0|0,0,0]=3 14675 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 11a_100020643023_100000210187 [0,3,0,0,0,0|0,0,0]=3 14676 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 1626a_100020643023_100000210187 [0,3,0,0,0,0|0,0,0]=3 14677 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 240690a_100020643023_100000210187 [0,3,0,0,0,0|0,0,0]=3 14678 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 527a_100020643023_100000210187 [0,3,0,0,0,0|0,0,0]=3 14679 B13R1.17 CCCNC(=O)c1ccc(cc1)F 11a_100020643023_100000187176 [0,3,0,0,0,0|0,0,0]=3 14680 B13R1.17 CCCNC(=O)c1ccc(cc1)F 1626a_100020643023_100000187176 [0,3,0,0,0,0|0,0,0]=3 14681 B13R1.17 CCCNC(=O)c1ccc(cc1)F 240690a_100020643023_100000187176 [0,3,0,0,0,0|0,0,0]=3 14682 B13R1.17 CCCNC(=O)c1ccc(cc1)F 527a_100020643023_100000187176 [0,3,0,0,0,0|0,0,0]=3 14683 B13R1.17 CCCNC(=O)c1ccc(cc1)I 11a_100020643023_100000187904 [0,3,0,0,0,0|0,0,0]=3 14684 B13R1.17 CCCNC(=O)c1ccc(cc1)I 1626a_100020643023_100000187904 [0,3,0,0,0,0|0,0,0]=3 14685 B13R1.17 CCCNC(=O)c1ccc(cc1)I 240690a_100020643023_100000187904 [0,3,0,0,0,0|0,0,0]=3 14686 B13R1.17 CCCNC(=O)c1ccc(cc1)I 527a_100020643023_100000187904 [0,3,0,0,0,0|0,0,0]=3 14687 B13R1.17 CCCNC(=O)c1ccc(cc1)O 240690a_100020643023_100000212099 [0,3,0,0,0,0|0,0,0]=3 14688 B13R1.17 CCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000152267 [0,3,0,0,0,0|0,0,0]=3 14689 B13R1.17 CCCNC(=O)c1ccc(cc1)O 527a_100020643023_100000212099 [0,3,0,0,0,0|0,0,0]=3 14690 B13R1.17 CCCNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781247 [0,3,0,0,0,0|1,0,0]=4 14691 B13R1.17 CCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000161739 [0,3,0,0,0,0|1,0,0]=4 14692 B13R1.17 CCNCC(=O)c1ccc(cc1)C 2230a_100015525214_100000211441 [0,3,0,0,0,0|0,0,0]=3 14693 B13R1.17 CCNN=C(C)c1ccc(cc1)Br 4a_100000756455_100000185794 [0,3,0,0,0,0|1,0,0]=4 14694 B13R1.17 CCNN=C(C)c1ccc(cc1)C 4a_100000756455_100000185793 [0,3,0,0,0,0|1,0,0]=4 14695 B13R1.17 CCNN=C(C)c1ccc(cc1)Cl 4a_100000756455_100000185797 [0,3,0,0,0,0|1,0,0]=4 14696 B13R1.17 CCNN=C(C)c1ccc(cc1)F 4a_100000756455_100000185800 [0,3,0,0,0,0|1,0,0]=4 14697 B13R1.17 CCNN=C(C)c1ccc(cc1)I 4a_100000756455_100000185465 [0,3,0,0,0,0|1,0,0]=4 14698 B13R1.17 CCNN=C(C)c1ccc(cc1)O 4a_100000756455_100000185113 [0,3,0,0,0,0|1,0,0]=4 14699 B13R1.17 CCNNC(=O)c1ccc(cc1)Br 22a_100000756455_100000185839 [0,3,0,0,0,0|0,0,0]=3 14700 B13R1.17 CCNNC(=O)c1ccc(cc1)C 22a_100000756455_100000188618 [0,3,0,0,0,0|0,0,0]=3 14701 B13R1.17 CCNNC(=O)c1ccc(cc1)Cl 22a_100000756455_100000210187 [0,3,0,0,0,0|0,0,0]=3 14702 B13R1.17 CCNNC(=O)c1ccc(cc1)F 22a_100000756455_100000187176 [0,3,0,0,0,0|0,0,0]=3 14703 B13R1.17 CCNNC(=O)c1ccc(cc1)I 22a_100000756455_100000187904 [0,3,0,0,0,0|0,0,0]=3 14704 B13R1.17 CCNNC(=O)c1ccc(cc1)O 22a_100000756455_100000212099 [0,3,0,0,0,0|0,0,0]=3 14705 B13R1.17 CCOCC(=O)c1ccc(cc1)Br 34a_100121572206_100000188085 [0,3,0,0,0,0|1,0,0]=4 14706 B13R1.17 CCOCC(=O)c1ccc(cc1)C 34a_100121572206_100000211441 [0,3,0,0,0,0|1,0,0]=4 14707 B13R1.17 CCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210202 [0,3,0,0,0,0|1,0,0]=4 14708 B13R1.17 CCOCC(=O)c1ccc(cc1)I 34a_100121572206_100011216261 [0,3,0,0,0,0|1,0,0]=4 14709 B13R1.17 CCOCC(=O)c1ccc(cc1)O 34a_100121572206_100009814261 [0,3,0,0,0,0|1,0,0]=4 14710 B13R1.17 CCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210202 [0,3,0,0,0,0|1,0,0]=4 14711 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000210202_100000211441 [0,3,0,0,0,0|1,0,0]=4 14712 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210202 [0,3,0,0,0,0|1,0,0]=4 14713 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000210202_100000211071 [0,3,0,0,0,0|1,0,0]=4 14714 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210202 [0,3,0,0,0,0|1,0,0]=4 14715 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000210202_100000211279 [0,3,0,0,0,0|1,0,0]=4 14716 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210202 [0,3,0,0,0,0|1,0,0]=4 14717 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100000210202_100011216261 [0,3,0,0,0,0|1,0,0]=4 14718 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210202 [0,3,0,0,0,0|1,0,0]=4 14719 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100000210202_100009814261 [0,3,0,0,0,0|1,0,0]=4 14720 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210202 [0,3,0,0,0,0|1,0,0]=4 14721 B13R1.17 CNCCC(=O)c1ccc(cc1)Br 7a_106832991635_100011215963 [0,3,0,0,0,0|0,0,0]=3 14722 B13R1.17 CNCCC(=O)c1ccc(cc1)C 2230a_106832991635_100000701375 [0,3,0,0,0,0|0,0,0]=3 14723 B13R1.17 CNCCC(=O)c1ccc(cc1)C 7a_106832991635_100000701375 [0,3,0,0,0,0|0,0,0]=3 14724 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl 7a_106832991635_100011216492 [0,3,0,0,0,0|0,0,0]=3 14725 B13R1.17 CNCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211231 [0,3,0,0,0,0|0,0,0]=3 14726 B13R1.17 CNCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211231 [0,3,0,0,0,0|0,0,0]=3 14727 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [0,3,0,0,0,0|0,0,0]=3 14728 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [0,3,0,0,0,0|0,0,0]=3 14729 B13R1.17 COCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000233755 [0,3,0,0,0,0|1,0,0]=4 14730 B13R1.17 COCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000233755 [0,3,0,0,0,0|1,0,0]=4 14731 B13R1.17 COCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000233755 [0,3,0,0,0,0|1,0,0]=4 14732 B13R1.17 COCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000233755 [0,3,0,0,0,0|1,0,0]=4 14733 B13R1.17 COCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000233755 [0,3,0,0,0,0|1,0,0]=4 14734 B13R1.17 COCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000233755 [0,3,0,0,0,0|1,0,0]=4 14735 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000751147 [0,3,0,0,0,0|1,0,0]=4 14736 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_100011215963_200000210301 [0,3,0,0,0,0|1,0,0]=4 14737 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_200000210301_100011215963 [0,3,0,0,0,0|1,0,0]=4 14738 B13R1.17 CSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000751147 [0,3,0,0,0,0|1,0,0]=4 14739 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_100000701375_200000210301 [0,3,0,0,0,0|1,0,0]=4 14740 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_200000210301_100000701375 [0,3,0,0,0,0|1,0,0]=4 14741 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000751147 [0,3,0,0,0,0|1,0,0]=4 14742 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200000210301 [0,3,0,0,0,0|1,0,0]=4 14743 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_200000210301_100011216492 [0,3,0,0,0,0|1,0,0]=4 14744 B13R1.17 CSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000751147 [0,3,0,0,0,0|1,0,0]=4 14745 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_100000211231_200000210301 [0,3,0,0,0,0|1,0,0]=4 14746 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211231 [0,3,0,0,0,0|1,0,0]=4 14747 B13R1.17 CSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000751147 [0,3,0,0,0,0|1,0,0]=4 14748 B13R1.17 CSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000751147 [0,3,0,0,0,0|1,0,0]=4 14749 B13R1.17 CSCCC(=O)c1ccc(cc1)O 62a_200000210301_100009879949 [0,3,0,0,0,0|1,0,0]=4 14750 B13R1.17 Cc1ccc(cc1)C(=O)CCC#N 1458a_100000188618_100011215226 [0,3,0,0,0,0|1,0,0]=4 14751 B13R1.17 Cc1ccc(cc1)C(=O)CCCF 1458a_100000188618_100011934791 [0,3,0,0,0,0|1,0,0]=4 14752 B13R1.17 Cc1ccc(cc1)C(=O)CCCO 1458a_100000188618_100011215043 [0,3,0,0,0,0|1,0,0]=4 14753 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_100000701375_200025704644 [0,3,0,0,0,0|1,0,0]=4 14754 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_200025704644_100000701375 [0,3,0,0,0,0|1,0,0]=4 14755 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100000211441_100015361967 [0,3,0,0,0,0|1,0,0]=4 14756 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100015361967_100000211441 [0,3,0,0,0,0|1,0,0]=4 14757 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000188618 [0,3,0,0,0,0|0,0,0]=3 14758 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000188618 [0,3,0,0,0,0|0,0,0]=3 14759 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000188618 [0,3,0,0,0,0|0,0,0]=3 14760 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000188618 [0,3,0,0,0,0|0,0,0]=3 14761 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000188618 [0,3,0,0,0,0|0,0,0]=3 14762 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000188618 [0,3,0,0,0,0|0,0,0]=3 14763 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000188618 [0,3,0,0,0,0|0,0,0]=3 14764 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000188618 [0,3,0,0,0,0|0,0,0]=3 14765 B13R1.17 N#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215226 [0,3,0,0,0,0|1,0,0]=4 14766 B13R1.17 N#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215226 [0,3,0,0,0,0|1,0,0]=4 14767 B13R1.17 N#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215226 [0,3,0,0,0,0|1,0,0]=4 14768 B13R1.17 N#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215226 [0,3,0,0,0,0|1,0,0]=4 14769 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215226 [0,3,0,0,0,0|1,0,0]=4 14770 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100000689336 [0,3,0,0,0,0|1,0,0]=4 14771 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 1626a_100000734998_100000185839 [0,3,0,0,0,0|0,0,0]=3 14772 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 527a_100000734998_100000185839 [0,3,0,0,0,0|0,0,0]=3 14773 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 1626a_100000734998_100000210187 [0,3,0,0,0,0|0,0,0]=3 14774 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 527a_100000734998_100000210187 [0,3,0,0,0,0|0,0,0]=3 14775 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 1626a_100000734998_100000187176 [0,3,0,0,0,0|0,0,0]=3 14776 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 527a_100000734998_100000187176 [0,3,0,0,0,0|0,0,0]=3 14777 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 1626a_100000734998_100000187904 [0,3,0,0,0,0|0,0,0]=3 14778 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 527a_100000734998_100000187904 [0,3,0,0,0,0|0,0,0]=3 14779 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000752546 [0,3,0,0,0,0|0,0,0]=3 14780 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 527a_100000734998_100000212099 [0,3,0,0,0,0|0,0,0]=3 14781 B13R1.17 O=C(CCCF)c1ccc(cc1)Br 1458a_100000185839_100011934791 [0,3,0,0,0,0|1,0,0]=4 14782 B13R1.17 O=C(CCCF)c1ccc(cc1)Cl 1458a_100000210187_100011934791 [0,3,0,0,0,0|1,0,0]=4 14783 B13R1.17 O=C(CCCF)c1ccc(cc1)F 1458a_100000187176_100011934791 [0,3,0,0,0,0|1,0,0]=4 14784 B13R1.17 O=C(CCCF)c1ccc(cc1)I 1458a_100000187904_100011934791 [0,3,0,0,0,0|1,0,0]=4 14785 B13R1.17 O=C(CCCF)c1ccc(cc1)O 1458a_100000212099_100011934791 [0,3,0,0,0,0|1,0,0]=4 14786 B13R1.17 O=C(CCCO)c1ccc(cc1)Br 1458a_100000185839_100011215043 [0,3,0,0,0,0|1,0,0]=4 14787 B13R1.17 O=C(CCCO)c1ccc(cc1)Cl 1458a_100000210187_100011215043 [0,3,0,0,0,0|1,0,0]=4 14788 B13R1.17 O=C(CCCO)c1ccc(cc1)F 1458a_100000187176_100011215043 [0,3,0,0,0,0|1,0,0]=4 14789 B13R1.17 O=C(CCCO)c1ccc(cc1)I 1458a_100000187904_100011215043 [0,3,0,0,0,0|1,0,0]=4 14790 B13R1.17 O=C(CCCO)c1ccc(cc1)O 1458a_100000212099_100011215043 [0,3,0,0,0,0|1,0,0]=4 14791 B13R1.17 O=C(COCF)c1ccc(cc1)F 34a_100000246311_100015361967 [0,3,0,0,0,0|1,0,0]=4 14792 B13R1.17 O=C(CSCF)c1ccc(cc1)Br 62a_100000188085_100015361967 [0,3,0,0,0,0|1,0,0]=4 14793 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100000211071_100015361967 [0,3,0,0,0,0|1,0,0]=4 14794 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100015361967_100000211071 [0,3,0,0,0,0|1,0,0]=4 14795 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100000211279_100015361967 [0,3,0,0,0,0|1,0,0]=4 14796 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100015361967_100000211279 [0,3,0,0,0,0|1,0,0]=4 14797 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100011216261_100015361967 [0,3,0,0,0,0|1,0,0]=4 14798 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100015361967_100011216261 [0,3,0,0,0,0|1,0,0]=4 14799 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100009814261_100015361967 [0,3,0,0,0,0|1,0,0]=4 14800 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100015361967_100009814261 [0,3,0,0,0,0|1,0,0]=4 14801 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 11a_100000724931_100000185839 [0,3,0,0,0,0|0,0,0]=3 14802 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 1626a_100000724931_100000185839 [0,3,0,0,0,0|0,0,0]=3 14803 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 240690a_100000724931_100000185839 [0,3,0,0,0,0|0,0,0]=3 14804 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 527a_100000724931_100000185839 [0,3,0,0,0,0|0,0,0]=3 14805 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 11a_100000724931_100000210187 [0,3,0,0,0,0|0,0,0]=3 14806 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 1626a_100000724931_100000210187 [0,3,0,0,0,0|0,0,0]=3 14807 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 240690a_100000724931_100000210187 [0,3,0,0,0,0|0,0,0]=3 14808 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 527a_100000724931_100000210187 [0,3,0,0,0,0|0,0,0]=3 14809 B13R1.17 O=C(NCCF)c1ccc(cc1)F 11a_100000724931_100000187176 [0,3,0,0,0,0|0,0,0]=3 14810 B13R1.17 O=C(NCCF)c1ccc(cc1)F 1626a_100000724931_100000187176 [0,3,0,0,0,0|0,0,0]=3 14811 B13R1.17 O=C(NCCF)c1ccc(cc1)F 240690a_100000724931_100000187176 [0,3,0,0,0,0|0,0,0]=3 14812 B13R1.17 O=C(NCCF)c1ccc(cc1)F 527a_100000724931_100000187176 [0,3,0,0,0,0|0,0,0]=3 14813 B13R1.17 O=C(NCCF)c1ccc(cc1)I 11a_100000724931_100000187904 [0,3,0,0,0,0|0,0,0]=3 14814 B13R1.17 O=C(NCCF)c1ccc(cc1)I 1626a_100000724931_100000187904 [0,3,0,0,0,0|0,0,0]=3 14815 B13R1.17 O=C(NCCF)c1ccc(cc1)I 240690a_100000724931_100000187904 [0,3,0,0,0,0|0,0,0]=3 14816 B13R1.17 O=C(NCCF)c1ccc(cc1)I 527a_100000724931_100000187904 [0,3,0,0,0,0|0,0,0]=3 14817 B13R1.17 O=C(NCCF)c1ccc(cc1)O 240690a_100000724931_100000212099 [0,3,0,0,0,0|0,0,0]=3 14818 B13R1.17 O=C(NCCF)c1ccc(cc1)O 527a_100000724931_100000212099 [0,3,0,0,0,0|0,0,0]=3 14819 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 240690a_100000210304_100000185839 [0,3,0,0,0,0|0,0,0]=3 14820 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 527a_100000210304_100000185839 [0,3,0,0,0,0|0,0,0]=3 14821 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 240690a_100000210304_100000210187 [0,3,0,0,0,0|0,0,0]=3 14822 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 527a_100000210304_100000210187 [0,3,0,0,0,0|0,0,0]=3 14823 B13R1.17 O=C(NCCO)c1ccc(cc1)F 240690a_100000210304_100000187176 [0,3,0,0,0,0|0,0,0]=3 14824 B13R1.17 O=C(NCCO)c1ccc(cc1)F 527a_100000210304_100000187176 [0,3,0,0,0,0|0,0,0]=3 14825 B13R1.17 O=C(NCCO)c1ccc(cc1)I 240690a_100000210304_100000187904 [0,3,0,0,0,0|0,0,0]=3 14826 B13R1.17 O=C(NCCO)c1ccc(cc1)I 527a_100000210304_100000187904 [0,3,0,0,0,0|0,0,0]=3 14827 B13R1.17 O=C(NCCO)c1ccc(cc1)O 240690a_100000210304_100000212099 [0,3,0,0,0,0|0,0,0]=3 14828 B13R1.17 O=C(NCCO)c1ccc(cc1)O 271570a_203496583355_200000158904 [0,3,0,0,0,0|0,0,0]=3 14829 B13R1.17 O=C(NCCO)c1ccc(cc1)O 527a_100000210304_100000212099 [0,3,0,0,0,0|0,0,0]=3 14830 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_100011215963_200025704644 [0,3,0,0,0,0|1,0,0]=4 14831 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_200025704644_100011215963 [0,3,0,0,0,0|1,0,0]=4 14832 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200025704644 [0,3,0,0,0,0|1,0,0]=4 14833 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_200025704644_100011216492 [0,3,0,0,0,0|1,0,0]=4 14834 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_100000211231_200025704644 [0,3,0,0,0,0|1,0,0]=4 14835 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211231 [0,3,0,0,0,0|1,0,0]=4 14836 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)O 62a_200025704644_100009879949 [0,3,0,0,0,0|1,0,0]=4 14837 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748629 [0,3,0,0,0,0|1,0,0]=4 14838 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000748629 [0,3,0,0,0,0|1,0,0]=4 14839 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748629 [0,3,0,0,0,0|1,0,0]=4 14840 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000748629 [0,3,0,0,0,0|1,0,0]=4 14841 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000748629 [0,3,0,0,0,0|1,0,0]=4 14842 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000748629 [0,3,0,0,0,0|1,0,0]=4 14843 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000070787_100000188085 [0,3,0,0,0,0|1,0,0]=4 14844 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C 1458a_100000070787_100000211441 [0,3,0,0,0,0|1,0,0]=4 14845 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000070787_100000211071 [0,3,0,0,0,0|1,0,0]=4 14846 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)F 1458a_100000070787_100000211279 [0,3,0,0,0,0|1,0,0]=4 14847 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)I 1458a_100000070787_100011216261 [0,3,0,0,0,0|1,0,0]=4 14848 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 1458a_100000070787_100009814261 [0,3,0,0,0,0|1,0,0]=4 14849 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100000184285 [0,3,0,0,0,0|1,0,0]=4 14850 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210624 [0,3,0,0,0,0|1,0,0]=4 14851 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210624 [0,3,0,0,0,0|1,0,0]=4 14852 B13R1.132 CC(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000210624 [0,3,0,0,0,0|1,0,0]=4 14853 B13R1.132 CC(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000210624 [0,3,0,0,0,0|1,0,0]=4 14854 B13R1.132 CC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000210624 [0,3,0,0,0,0|1,0,0]=4 14855 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 11a_100138425928_100000185839 [0,3,0,0,0,0|0,0,0]=3 14856 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 1626a_100138425928_100000185839 [0,3,0,0,0,0|0,0,0]=3 14857 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 240690a_100138425928_100000185839 [0,3,0,0,0,0|0,0,0]=3 14858 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 527a_100138425928_100000185839 [0,3,0,0,0,0|0,0,0]=3 14859 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 11a_100138425928_100000210187 [0,3,0,0,0,0|0,0,0]=3 14860 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 1626a_100138425928_100000210187 [0,3,0,0,0,0|0,0,0]=3 14861 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 240690a_100138425928_100000210187 [0,3,0,0,0,0|0,0,0]=3 14862 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 527a_100138425928_100000210187 [0,3,0,0,0,0|0,0,0]=3 14863 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 11a_100138425928_100000187176 [0,3,0,0,0,0|0,0,0]=3 14864 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 1626a_100138425928_100000187176 [0,3,0,0,0,0|0,0,0]=3 14865 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 240690a_100138425928_100000187176 [0,3,0,0,0,0|0,0,0]=3 14866 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 527a_100138425928_100000187176 [0,3,0,0,0,0|0,0,0]=3 14867 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 11a_100138425928_100000187904 [0,3,0,0,0,0|0,0,0]=3 14868 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 1626a_100138425928_100000187904 [0,3,0,0,0,0|0,0,0]=3 14869 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 240690a_100138425928_100000187904 [0,3,0,0,0,0|0,0,0]=3 14870 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 527a_100138425928_100000187904 [0,3,0,0,0,0|0,0,0]=3 14871 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 240690a_100138425928_100000212099 [0,3,0,0,0,0|0,0,0]=3 14872 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 271570a_203496583355_200000152628 [0,3,0,0,0,0|0,0,0]=3 14873 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 527a_100138425928_100000212099 [0,3,0,0,0,0|0,0,0]=3 14874 B13R1.132 CC(C)NC(=O)c1ccc(nc1)O 271570a_203496583355_100000157566 [0,3,0,0,0,0|1,0,0]=4 14875 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011218427 [0,3,0,0,0,0|1,0,0]=4 14876 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011218427 [0,3,0,0,0,0|1,0,0]=4 14877 B13R1.132 CC(O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011218427 [0,3,0,0,0,0|1,0,0]=4 14878 B13R1.132 CC(O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011218427 [0,3,0,0,0,0|1,0,0]=4 14879 B13R1.132 CC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218427 [0,3,0,0,0,0|1,0,0]=4 14880 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Br 269982a_100102631434_100000188085 [0,3,0,0,0,0|0,0,0]=3 14881 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Cl 269982a_100102631434_100000211071 [0,3,0,0,0,0|0,0,0]=3 14882 B13R1.132 CN(C)CC(=O)c1ccc(cc1)F 269982a_100102631434_100000211279 [0,3,0,0,0,0|0,0,0]=3 14883 B13R1.132 CN(C)CC(=O)c1ccc(cc1)I 269982a_100102631434_100011216261 [0,3,0,0,0,0|0,0,0]=3 14884 B13R1.132 CN(C)CC(=O)c1ccc(cc1)O 269982a_100102631434_100009814261 [0,3,0,0,0,0|0,0,0]=3 14885 B13R1.132 CN(C)CC(=O)c1ccc(cn1)Cl 269982a_100102631434_100016989621 [0,3,0,0,0,0|1,0,0]=4 14886 B13R1.132 CN(C)CC(=O)c1ccc(nc1)Cl 269982a_100102631434_100009864725 [0,3,0,0,0,0|1,0,0]=4 14887 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)C 1458a_100000188618_100000210624 [0,3,0,0,0,0|1,0,0]=4 14888 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)O 1458a_100000188618_100011218427 [0,3,0,0,0,0|1,0,0]=4 14889 B13R1.132 Cc1ccc(cc1)C(=O)CC(F)F 1458a_100000188618_100011934356 [0,3,0,0,0,0|1,0,0]=4 14890 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100000211441 [0,3,0,0,0,0|0,0,0]=3 14891 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100000211441 [0,3,0,0,0,0|0,0,0]=3 14892 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 11a_100138425928_100000188618 [0,3,0,0,0,0|0,0,0]=3 14893 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 1626a_100138425928_100000188618 [0,3,0,0,0,0|0,0,0]=3 14894 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 240690a_100138425928_100000188618 [0,3,0,0,0,0|0,0,0]=3 14895 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 527a_100138425928_100000188618 [0,3,0,0,0,0|0,0,0]=3 14896 B13R1.132 Cc1ccc(cn1)C(=O)CN(C)C 269982a_100102631434_100012027583 [0,3,0,0,0,0|1,0,0]=4 14897 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Br 1458a_100000185839_100011934356 [0,3,0,0,0,0|1,0,0]=4 14898 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Cl 1458a_100000210187_100011934356 [0,3,0,0,0,0|1,0,0]=4 14899 B13R1.132 O=C(CC(F)F)c1ccc(cc1)F 1458a_100000187176_100011934356 [0,3,0,0,0,0|1,0,0]=4 14900 B13R1.132 O=C(CC(F)F)c1ccc(cc1)I 1458a_100000187904_100011934356 [0,3,0,0,0,0|1,0,0]=4 14901 B13R1.132 O=C(CC(F)F)c1ccc(cc1)O 1458a_100000212099_100011934356 [0,3,0,0,0,0|1,0,0]=4 14902 B13R1.452 C#Cc1ccc(cc1)C(=O)CCC 1458a_100011217615_100000210303 [0,3,0,0,0,0|1,0,0]=4 14903 B13R1.452 C#Cc1ccc(cc1)C(=O)CCF 1458a_100011217615_100011217306 [0,3,0,0,0,0|1,0,0]=4 14904 B13R1.452 C#Cc1ccc(cc1)C(=O)CCO 1458a_100011217615_100000211926 [0,3,0,0,0,0|1,0,0]=4 14905 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100011217615 [0,3,0,0,0,0|0,0,0]=3 14906 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100011217615 [0,3,0,0,0,0|0,0,0]=3 14907 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100011217615 [0,3,0,0,0,0|0,0,0]=3 14908 B13R1.452 C#Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100011217615 [0,3,0,0,0,0|0,0,0]=3 14909 B13R1.452 C=Cc1ccc(cc1)C(=O)C#CC 271570a_100011290941_100153741113 [0,3,0,0,0,0|1,0,0]=4 14910 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 1458a_100000687532_100000210303 [0,3,0,0,0,0|1,0,0]=4 14911 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 271570a_100011290941_100011267722 [0,3,0,0,0,0|1,0,0]=4 14912 B13R1.452 C=Cc1ccc(cc1)C(=O)CCF 1458a_100000687532_100011217306 [0,3,0,0,0,0|1,0,0]=4 14913 B13R1.452 C=Cc1ccc(cc1)C(=O)CCO 1458a_100000687532_100000211926 [0,3,0,0,0,0|1,0,0]=4 14914 B13R1.452 C=Cc1ccc(cc1)C(=O)COC 271570a_100011290941_200011343064 [0,3,0,0,0,0|1,0,0]=4 14915 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100000687532 [0,3,0,0,0,0|0,0,0]=3 14916 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000687532 [0,3,0,0,0,0|0,0,0]=3 14917 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 271570a_100011290941_100000155177 [0,3,0,0,0,0|0,0,0]=3 14918 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100000687532 [0,3,0,0,0,0|0,0,0]=3 14919 B13R1.452 C=Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100000687532 [0,3,0,0,0,0|0,0,0]=3 14920 B13R1.452 C=Cc1ccc(cc1)C(=O)OCC 271570a_100011290941_100000170077 [0,3,0,0,0,0|1,0,0]=4 14921 B13R1.452 C=Cc1ccc(cn1)C(=O)NCC 271570a_100011290941_100000160145 [0,3,0,0,0,0|1,0,0]=4 14922 B13R1.452 C=Cc1ccc(nc1)C(=O)NCC 271570a_100011290941_200011781264 [0,3,0,0,0,0|1,0,0]=4 14923 B13R1.452 CC#CC(=O)c1ccc(cc1)SC 62a_200000210301_100153741113 [0,3,0,0,0,0|1,0,0]=4 14924 B13R1.452 CC#CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100153741113 [0,3,0,0,0,0|1,0,0]=4 14925 B13R1.452 CCCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210303 [0,3,0,0,0,0|1,0,0]=4 14926 B13R1.452 CCCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210303 [0,3,0,0,0,0|1,0,0]=4 14927 B13R1.452 CCCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210303 [0,3,0,0,0,0|1,0,0]=4 14928 B13R1.452 CCCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210303 [0,3,0,0,0,0|1,0,0]=4 14929 B13R1.452 CCCC(=O)c1ccc(cc1)OC 34a_100011216482_200000210301 [0,3,0,0,0,0|1,0,0]=4 14930 B13R1.452 CCCC(=O)c1ccc(cc1)OC 7a_100011216482_200000210301 [0,3,0,0,0,0|1,0,0]=4 14931 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 34a_100011216482_200025704644 [0,3,0,0,0,0|1,0,0]=4 14932 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 7a_100011216482_200025704644 [0,3,0,0,0,0|1,0,0]=4 14933 B13R1.452 CCCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210303 [0,3,0,0,0,0|1,0,0]=4 14934 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_100011267722_200000210301 [0,3,0,0,0,0|1,0,0]=4 14935 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_200000210301_100011267722 [0,3,0,0,0,0|1,0,0]=4 14936 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_100011267722_200025704644 [0,3,0,0,0,0|1,0,0]=4 14937 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011267722 [0,3,0,0,0,0|1,0,0]=4 14938 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 11a_100015525214_100000210717 [0,3,0,0,0,0|0,0,0]=3 14939 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 240690a_100015525214_100000210717 [0,3,0,0,0,0|0,0,0]=3 14940 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 527a_100015525214_100000210717 [0,3,0,0,0,0|0,0,0]=3 14941 B13R1.452 CCNC(=O)c1ccc(cc1)CC 11a_100015525214_100000211226 [0,3,0,0,0,0|0,0,0]=3 14942 B13R1.452 CCNC(=O)c1ccc(cc1)CC 240690a_100015525214_100000211226 [0,3,0,0,0,0|0,0,0]=3 14943 B13R1.452 CCNC(=O)c1ccc(cc1)CC 527a_100015525214_100000211226 [0,3,0,0,0,0|0,0,0]=3 14944 B13R1.452 CCNC(=O)c1ccc(cc1)CO 240690a_100015525214_100000183892 [0,3,0,0,0,0|0,0,0]=3 14945 B13R1.452 CCNC(=O)c1ccc(cc1)NC 2230a_100000741011_200000210301 [0,3,0,0,0,0|0,0,0]=3 14946 B13R1.452 CCNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155177 [0,3,0,0,0,0|0,0,0]=3 14947 B13R1.452 CCNC(=O)c1ccc(cc1)NC 34a_100000741011_200000210301 [0,3,0,0,0,0|0,0,0]=3 14948 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000741011_200025704644 [0,3,0,0,0,0|0,0,0]=3 14949 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 34a_100000741011_200025704644 [0,3,0,0,0,0|0,0,0]=3 14950 B13R1.452 CCNC(=O)c1ccc(cc1)OC 11a_100015525214_100000184203 [0,3,0,0,0,0|0,0,0]=3 14951 B13R1.452 CCNC(=O)c1ccc(cc1)OC 240690a_100015525214_100000184203 [0,3,0,0,0,0|0,0,0]=3 14952 B13R1.452 CCNC(=O)c1ccc(cc1)OC 527a_100015525214_100000184203 [0,3,0,0,0,0|0,0,0]=3 14953 B13R1.452 CCNC(=O)c1ccc(cc1)SC 11a_100015525214_100000189692 [0,3,0,0,0,0|0,0,0]=3 14954 B13R1.452 CCNC(=O)c1ccc(cc1)SC 240690a_100015525214_100000189692 [0,3,0,0,0,0|0,0,0]=3 14955 B13R1.452 CCNC(=O)c1ccc(cc1)SC 527a_100015525214_100000189692 [0,3,0,0,0,0|0,0,0]=3 14956 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_100000155177_200000210301 [0,3,0,0,0,0|0,0,0]=3 14957 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155177 [0,3,0,0,0,0|0,0,0]=3 14958 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155177_200025704644 [0,3,0,0,0,0|0,0,0]=3 14959 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155177 [0,3,0,0,0,0|0,0,0]=3 14960 B13R1.452 CCNC(=O)c1ccc(cn1)NC 27a_100102657272_200011781264 [0,3,0,0,0,0|1,0,0]=4 14961 B13R1.452 CCNC(=O)c1ccc(cn1)SC 62a_200000210301_200011781264 [0,3,0,0,0,0|1,0,0]=4 14962 B13R1.452 CCNC(=O)c1ccc(cn1)SC 62a_200011781264_200000210301 [0,3,0,0,0,0|1,0,0]=4 14963 B13R1.452 CCNC(=O)c1ccc(cn1)S[13CH3] 62a_200011781264_200025704644 [0,3,0,0,0,0|1,0,0]=4 14964 B13R1.452 CCNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_200011781264 [0,3,0,0,0,0|1,0,0]=4 14965 B13R1.452 CCNC(=O)c1ccc(nc1)NC 27a_100102657272_100000160145 [0,3,0,0,0,0|1,0,0]=4 14966 B13R1.452 CCNC(=O)c1ccc(nc1)SC 62a_100000160145_200000210301 [0,3,0,0,0,0|1,0,0]=4 14967 B13R1.452 CCNC(=O)c1ccc(nc1)SC 62a_200000210301_100000160145 [0,3,0,0,0,0|1,0,0]=4 14968 B13R1.452 CCNC(=O)c1ccc(nc1)S[13CH3] 62a_100000160145_200025704644 [0,3,0,0,0,0|1,0,0]=4 14969 B13R1.452 CCNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000160145 [0,3,0,0,0,0|1,0,0]=4 14970 B13R1.452 CCOC(=O)c1ccc(cc1)OC 34a_100000169885_200000210301 [0,3,0,0,0,0|1,0,0]=4 14971 B13R1.452 CCOC(=O)c1ccc(cc1)OC 7a_100000169885_200000210301 [0,3,0,0,0,0|1,0,0]=4 14972 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 34a_100000169885_200025704644 [0,3,0,0,0,0|1,0,0]=4 14973 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 7a_100000169885_200025704644 [0,3,0,0,0,0|1,0,0]=4 14974 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_100000169895_200000210301 [0,3,0,0,0,0|1,0,0]=4 14975 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_200000210301_100000169919 [0,3,0,0,0,0|1,0,0]=4 14976 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_100000169895_200025704644 [0,3,0,0,0,0|1,0,0]=4 14977 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000169919 [0,3,0,0,0,0|1,0,0]=4 14978 B13R1.452 CCc1ccc(cc1)C(=O)CCF 1458a_100000211226_100011217306 [0,3,0,0,0,0|1,0,0]=4 14979 B13R1.452 CCc1ccc(cc1)C(=O)CCO 1458a_100000211226_100000211926 [0,3,0,0,0,0|1,0,0]=4 14980 B13R1.452 CCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000689809 [0,3,0,0,0,0|0,0,0]=3 14981 B13R1.452 CCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000183122 [0,3,0,0,0,0|0,0,0]=3 14982 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_100000689809_200000210301 [0,3,0,0,0,0|1,0,0]=4 14983 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000689809 [0,3,0,0,0,0|1,0,0]=4 14984 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000689809_200025704644 [0,3,0,0,0,0|1,0,0]=4 14985 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000689809 [0,3,0,0,0,0|1,0,0]=4 14986 B13R1.452 CCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000211226 [0,3,0,0,0,0|0,0,0]=3 14987 B13R1.452 CNCC(=O)c1ccc(cc1)C#N 2230a_106832991635_100000212069 [0,3,0,0,0,0|0,0,0]=3 14988 B13R1.452 CNCC(=O)c1ccc(cc1)OC 2230a_106832991635_100000212054 [0,3,0,0,0,0|0,0,0]=3 14989 B13R1.452 CNCC(=O)c1ccc(cc1)OC 7a_106832991635_100000212054 [0,3,0,0,0,0|0,0,0]=3 14990 B13R1.452 CNCC(=O)c1ccc(cc1)SC 2230a_106832991635_100011216809 [0,3,0,0,0,0|0,0,0]=3 14991 B13R1.452 CNCC(=O)c1ccc(cc1)SC 34a_100102657272_100011216809 [0,3,0,0,0,0|0,0,0]=3 14992 B13R1.452 CNNC(=O)c1ccc(cc1)C#N 22a_100016993582_100000210717 [0,3,0,0,0,0|0,0,0]=3 14993 B13R1.452 CNNC(=O)c1ccc(cc1)CO 22a_100016993582_100000183892 [0,3,0,0,0,0|0,0,0]=3 14994 B13R1.452 CNNC(=O)c1ccc(cc1)OC 22a_100016993582_100000184203 [0,3,0,0,0,0|0,0,0]=3 14995 B13R1.452 CNNC(=O)c1ccc(cc1)SC 22a_100016993582_100000189692 [0,3,0,0,0,0|0,0,0]=3 14996 B13R1.452 COCC(=O)c1ccc(cc1)C#N 34a_100011592799_200000210301 [0,3,0,0,0,0|1,0,0]=4 14997 B13R1.452 COCC(=O)c1ccc(cc1)OC 34a_200009861119_200000210301 [0,3,0,0,0,0|1,0,0]=4 14998 B13R1.452 COCC(=O)c1ccc(cc1)OC 7a_200009861119_200000210301 [0,3,0,0,0,0|1,0,0]=4 14999 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 34a_200009861119_200025704644 [0,3,0,0,0,0|1,0,0]=4 15000 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 7a_200009861119_200025704644 [0,3,0,0,0,0|1,0,0]=4 15001 B13R1.452 COCC(=O)c1ccc(cc1)SC 34a_100138415774_100011216809 [0,3,0,0,0,0|1,0,0]=4 15002 B13R1.452 COCC(=O)c1ccc(cc1)SC 62a_200011343064_200000210301 [0,3,0,0,0,0|1,0,0]=4 15003 B13R1.452 COCC(=O)c1ccc(cc1)S[13CH3] 62a_200011343064_200025704644 [0,3,0,0,0,0|1,0,0]=4 15004 B13R1.452 COc1ccc(cc1)C(=O)CCCl 7a_100009879949_200000210301 [0,3,0,0,0,0|1,0,0]=4 15005 B13R1.452 COc1ccc(cc1)C(=O)CCF 1458a_100000184203_100011217306 [0,3,0,0,0,0|1,0,0]=4 15006 B13R1.452 COc1ccc(cc1)C(=O)CCO 1458a_100000184203_100000211926 [0,3,0,0,0,0|1,0,0]=4 15007 B13R1.452 COc1ccc(cc1)C(=O)CSC 62a_100000212054_200000210301 [0,3,0,0,0,0|1,0,0]=4 15008 B13R1.452 COc1ccc(cc1)C(=O)CSC 62a_200000210301_100000212054 [0,3,0,0,0,0|1,0,0]=4 15009 B13R1.452 COc1ccc(cc1)C(=O)CS[13CH3] 62a_100000212054_200025704644 [0,3,0,0,0,0|1,0,0]=4 15010 B13R1.452 COc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000212054 [0,3,0,0,0,0|1,0,0]=4 15011 B13R1.452 CSCC(=O)c1ccc(cc1)C#N 62a_100000212069_200000210301 [0,3,0,0,0,0|1,0,0]=4 15012 B13R1.452 CSCC(=O)c1ccc(cc1)C#N 62a_200000210301_100000212069 [0,3,0,0,0,0|1,0,0]=4 15013 B13R1.452 CSCC(=O)c1ccc(cc1)SC 62a_100011216809_200000210301 [0,3,0,0,0,0|1,0,0]=4 15014 B13R1.452 CSCC(=O)c1ccc(cc1)SC 62a_200000210301_100011216809 [0,3,0,0,0,0|1,0,0]=4 15015 B13R1.452 CSc1ccc(cc1)C(=O)CCF 1458a_100000189692_100011217306 [0,3,0,0,0,0|1,0,0]=4 15016 B13R1.452 CSc1ccc(cc1)C(=O)CCO 1458a_100000189692_100000211926 [0,3,0,0,0,0|1,0,0]=4 15017 B13R1.452 CSc1ccc(cc1)C(=O)CS[13CH3] 62a_100011216809_200025704644 [0,3,0,0,0,0|1,0,0]=4 15018 B13R1.452 CSc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100011216809 [0,3,0,0,0,0|1,0,0]=4 15019 B13R1.452 N#Cc1ccc(cc1)C(=O)CCF 1458a_100000210717_100011217306 [0,3,0,0,0,0|1,0,0]=4 15020 B13R1.452 N#Cc1ccc(cc1)C(=O)CCO 1458a_100000210717_100000211926 [0,3,0,0,0,0|1,0,0]=4 15021 B13R1.452 O=C(CCF)c1ccc(cc1)CO 1458a_100000183892_100011217306 [0,3,0,0,0,0|1,0,0]=4 15022 B13R1.452 O=C(CCO)c1ccc(cc1)CO 1458a_100000183892_100000211926 [0,3,0,0,0,0|1,0,0]=4 15023 B13R1.452 [13CH3]OCC(=O)c1ccc(cc1)C#N 34a_100011592799_200025704644 [0,3,0,0,0,0|1,0,0]=4 15024 B13R1.452 [13CH3]Oc1ccc(cc1)C(=O)CCCl 7a_100009879949_200025704644 [0,3,0,0,0,0|1,0,0]=4 15025 B13R1.452 [13CH3]SCC(=O)c1ccc(cc1)C#N 62a_100000212069_200025704644 [0,3,0,0,0,0|1,0,0]=4 15026 B13R1.452 [13CH3]SCC(=O)c1ccc(cc1)C#N 62a_200025704644_100000212069 [0,3,0,0,0,0|1,0,0]=4 15027 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210303 [0,3,0,0,0,0|1,0,0]=4 15028 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210303 [0,3,0,0,0,0|1,0,0]=4 15029 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210303 [0,3,0,0,0,0|1,0,0]=4 15030 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210303 [0,3,0,0,0,0|1,0,0]=4 15031 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210303 [0,3,0,0,0,0|1,0,0]=4 15032 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210303 [0,3,0,0,0,0|1,0,0]=4 15033 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210303 [0,3,0,0,0,0|1,0,0]=4 15034 B13R1.466 CCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210303 [0,3,0,0,0,0|1,0,0]=4 15035 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210303 [0,3,0,0,0,0|1,0,0]=4 15036 B13R1.466 CCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210303 [0,3,0,0,0,0|1,0,0]=4 15037 B13R1.466 CCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210303 [0,3,0,0,0,0|1,0,0]=4 15038 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210303 [0,3,0,0,0,0|1,0,0]=4 15039 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012345043 [0,3,0,0,0,0|1,0,0]=4 15040 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210303 [0,3,0,0,0,0|1,0,0]=4 15041 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210303 [0,3,0,0,0,0|1,0,0]=4 15042 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210303 [0,3,0,0,0,0|1,0,0]=4 15043 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210303 [0,3,0,0,0,0|1,0,0]=4 15044 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210303 [0,3,0,0,0,0|1,0,0]=4 15045 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210303 [0,3,0,0,0,0|1,0,0]=4 15046 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210303 [0,3,0,0,0,0|1,0,0]=4 15047 B13R1.466 CCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210303 [0,3,0,0,0,0|1,0,0]=4 15048 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210303 [0,3,0,0,0,0|1,0,0]=4 15049 B13R1.466 CCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210303 [0,3,0,0,0,0|1,0,0]=4 15050 B13R1.466 CCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210303 [0,3,0,0,0,0|1,0,0]=4 15051 B13R1.466 CCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210303 [0,3,0,0,0,0|1,0,0]=4 15052 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210303 [0,3,0,0,0,0|1,0,0]=4 15053 B13R1.466 CCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210303 [0,3,0,0,0,0|1,0,0]=4 15054 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210303 [0,3,0,0,0,0|1,0,0]=4 15055 B13R1.466 CCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210303 [0,3,0,0,0,0|1,0,0]=4 15056 B13R1.466 CCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210303 [0,3,0,0,0,0|1,0,0]=4 15057 B13R1.466 CCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210303 [0,3,0,0,0,0|1,0,0]=4 15058 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210303 [0,3,0,0,0,0|1,0,0]=4 15059 B13R1.466 CCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210303 [0,3,0,0,0,0|1,0,0]=4 15060 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210303 [0,3,0,0,0,0|1,0,0]=4 15061 B13R1.466 CCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210303 [0,3,0,0,0,0|1,0,0]=4 15062 B13R1.466 CCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210303 [0,3,0,0,0,0|1,0,0]=4 15063 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [0,3,0,0,0,0|1,0,0]=4 15064 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 11a_100015525214_100012339404 [0,3,0,0,0,0|0,0,0]=3 15065 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 240690a_100015525214_100012339404 [0,3,0,0,0,0|0,0,0]=3 15066 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 527a_100015525214_100012339404 [0,3,0,0,0,0|0,0,0]=3 15067 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 11a_100015525214_100000186397 [0,3,0,0,0,0|0,0,0]=3 15068 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 240690a_100015525214_100000186397 [0,3,0,0,0,0|0,0,0]=3 15069 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 527a_100015525214_100000186397 [0,3,0,0,0,0|0,0,0]=3 15070 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 11a_100015525214_100000691181 [0,3,0,0,0,0|0,0,0]=3 15071 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100015525214_100000691181 [0,3,0,0,0,0|0,0,0]=3 15072 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100015525214_100000691181 [0,3,0,0,0,0|0,0,0]=3 15073 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 11a_100015525214_100000760357 [0,3,0,0,0,0|0,0,0]=3 15074 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 240690a_100015525214_100000760357 [0,3,0,0,0,0|0,0,0]=3 15075 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 527a_100015525214_100000760357 [0,3,0,0,0,0|0,0,0]=3 15076 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 11a_100015525214_100000739115 [0,3,0,0,0,0|0,0,0]=3 15077 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 240690a_100015525214_100000739115 [0,3,0,0,0,0|0,0,0]=3 15078 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 527a_100015525214_100000739115 [0,3,0,0,0,0|0,0,0]=3 15079 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)O 240690a_100015525214_100000189672 [0,3,0,0,0,0|0,0,0]=3 15080 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 11a_100015525214_100000692631 [0,3,0,0,0,0|0,0,0]=3 15081 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 240690a_100015525214_100000692631 [0,3,0,0,0,0|0,0,0]=3 15082 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 527a_100015525214_100000692631 [0,3,0,0,0,0|0,0,0]=3 15083 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 11a_100015525214_100000210898 [0,3,0,0,0,0|0,0,0]=3 15084 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 240690a_100015525214_100000210898 [0,3,0,0,0,0|0,0,0]=3 15085 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 527a_100015525214_100000210898 [0,3,0,0,0,0|0,0,0]=3 15086 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 11a_100015525214_100000686306 [0,3,0,0,0,0|0,0,0]=3 15087 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 240690a_100015525214_100000686306 [0,3,0,0,0,0|0,0,0]=3 15088 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 527a_100015525214_100000686306 [0,3,0,0,0,0|0,0,0]=3 15089 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 11a_100015525214_100000751819 [0,3,0,0,0,0|0,0,0]=3 15090 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 240690a_100015525214_100000751819 [0,3,0,0,0,0|0,0,0]=3 15091 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 527a_100015525214_100000751819 [0,3,0,0,0,0|0,0,0]=3 15092 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 11a_100015525214_100000751300 [0,3,0,0,0,0|0,0,0]=3 15093 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 240690a_100015525214_100000751300 [0,3,0,0,0,0|0,0,0]=3 15094 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 527a_100015525214_100000751300 [0,3,0,0,0,0|0,0,0]=3 15095 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 240690a_100015525214_100000685612 [0,3,0,0,0,0|0,0,0]=3 15096 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357431 [0,3,0,0,0,0|0,0,0]=3 15097 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 11a_100015525214_100000687082 [0,3,0,0,0,0|0,0,0]=3 15098 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100015525214_100000687082 [0,3,0,0,0,0|0,0,0]=3 15099 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100015525214_100000687082 [0,3,0,0,0,0|0,0,0]=3 15100 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 11a_100015525214_100000751740 [0,3,0,0,0,0|0,0,0]=3 15101 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 240690a_100015525214_100000751740 [0,3,0,0,0,0|0,0,0]=3 15102 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 527a_100015525214_100000751740 [0,3,0,0,0,0|0,0,0]=3 15103 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100015525214_100000210401 [0,3,0,0,0,0|0,0,0]=3 15104 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100015525214_100000210401 [0,3,0,0,0,0|0,0,0]=3 15105 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100015525214_100000210401 [0,3,0,0,0,0|0,0,0]=3 15106 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 11a_100015525214_100000686462 [0,3,0,0,0,0|0,0,0]=3 15107 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 240690a_100015525214_100000686462 [0,3,0,0,0,0|0,0,0]=3 15108 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 527a_100015525214_100000686462 [0,3,0,0,0,0|0,0,0]=3 15109 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 11a_100015525214_100000684831 [0,3,0,0,0,0|0,0,0]=3 15110 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 240690a_100015525214_100000684831 [0,3,0,0,0,0|0,0,0]=3 15111 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 527a_100015525214_100000684831 [0,3,0,0,0,0|0,0,0]=3 15112 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100015525214_100000212196 [0,3,0,0,0,0|0,0,0]=3 15113 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 527a_100015525214_100000212196 [0,3,0,0,0,0|0,0,0]=3 15114 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 11a_100015525214_100000743946 [0,3,0,0,0,0|0,0,0]=3 15115 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 240690a_100015525214_100000743946 [0,3,0,0,0,0|0,0,0]=3 15116 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 527a_100015525214_100000743946 [0,3,0,0,0,0|0,0,0]=3 15117 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 11a_100015525214_100000212313 [0,3,0,0,0,0|0,0,0]=3 15118 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 240690a_100015525214_100000212313 [0,3,0,0,0,0|0,0,0]=3 15119 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 527a_100015525214_100000212313 [0,3,0,0,0,0|0,0,0]=3 15120 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 11a_100015525214_100000743183 [0,3,0,0,0,0|0,0,0]=3 15121 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 240690a_100015525214_100000743183 [0,3,0,0,0,0|0,0,0]=3 15122 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 527a_100015525214_100000743183 [0,3,0,0,0,0|0,0,0]=3 15123 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 11a_100015525214_100000209822 [0,3,0,0,0,0|0,0,0]=3 15124 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 240690a_100015525214_100000209822 [0,3,0,0,0,0|0,0,0]=3 15125 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 527a_100015525214_100000209822 [0,3,0,0,0,0|0,0,0]=3 15126 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 11a_100015525214_100000062624 [0,3,0,0,0,0|0,0,0]=3 15127 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 240690a_100015525214_100000062624 [0,3,0,0,0,0|0,0,0]=3 15128 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 527a_100015525214_100000062624 [0,3,0,0,0,0|0,0,0]=3 15129 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 240690a_100015525214_100000185466 [0,3,0,0,0,0|0,0,0]=3 15130 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 527a_100015525214_100000185466 [0,3,0,0,0,0|0,0,0]=3 15131 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 11a_100015525214_100012343876 [0,3,0,0,0,0|0,0,0]=3 15132 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 240690a_100015525214_100012343876 [0,3,0,0,0,0|0,0,0]=3 15133 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 527a_100015525214_100012343876 [0,3,0,0,0,0|0,0,0]=3 15134 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 11a_100015525214_100000751299 [0,3,0,0,0,0|0,0,0]=3 15135 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 240690a_100015525214_100000751299 [0,3,0,0,0,0|0,0,0]=3 15136 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 527a_100015525214_100000751299 [0,3,0,0,0,0|0,0,0]=3 15137 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 11a_100015525214_100000739381 [0,3,0,0,0,0|0,0,0]=3 15138 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 240690a_100015525214_100000739381 [0,3,0,0,0,0|0,0,0]=3 15139 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 527a_100015525214_100000739381 [0,3,0,0,0,0|0,0,0]=3 15140 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 11a_100015525214_100000688015 [0,3,0,0,0,0|0,0,0]=3 15141 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 240690a_100015525214_100000688015 [0,3,0,0,0,0|0,0,0]=3 15142 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 527a_100015525214_100000688015 [0,3,0,0,0,0|0,0,0]=3 15143 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 11a_100015525214_100000725830 [0,3,0,0,0,0|0,0,0]=3 15144 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 240690a_100015525214_100000725830 [0,3,0,0,0,0|0,0,0]=3 15145 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 527a_100015525214_100000725830 [0,3,0,0,0,0|0,0,0]=3 15146 B13R1.466 CCNC(=O)c1ccc(c(c1)I)O 240690a_100015525214_100000037485 [0,3,0,0,0,0|0,0,0]=3 15147 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 240690a_100015525214_100000689001 [0,3,0,0,0,0|0,0,0]=3 15148 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 527a_100015525214_100000689001 [0,3,0,0,0,0|0,0,0]=3 15149 B13R1.466 CCNC(=O)c1ccc(c(c1)O)C 240690a_100015525214_100000233767 [0,3,0,0,0,0|0,0,0]=3 15150 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100015525214_100011933997 [0,3,0,0,0,0|0,0,0]=3 15151 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 527a_100015525214_100011933997 [0,3,0,0,0,0|0,0,0]=3 15152 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 240690a_100015525214_100000035894 [0,3,0,0,0,0|0,0,0]=3 15153 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359900 [0,3,0,0,0,0|0,0,0]=3 15154 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 527a_100015525214_100000035894 [0,3,0,0,0,0|0,0,0]=3 15155 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 240690a_100015525214_100000239334 [0,3,0,0,0,0|0,0,0]=3 15156 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 527a_100015525214_100000239334 [0,3,0,0,0,0|0,0,0]=3 15157 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294787 [0,3,0,0,0,0|1,0,0]=4 15158 B13R1.466 CCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100012229600 [0,3,0,0,0,0|1,0,0]=4 15159 B13R1.466 CCOC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_200012351148 [0,3,0,0,0,0|1,0,0]=4 15160 B13R1.466 CCOC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100011533738 [0,3,0,0,0,0|1,0,0]=4 15161 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O 271570a_203496583355_200011450955 [0,3,0,0,0,0|1,0,0]=4 15162 B13R1.466 CCOC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100012359631 [0,3,0,0,0,0|1,0,0]=4 15163 B13R1.466 CCOC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011934563 [0,3,0,0,0,0|1,0,0]=4 15164 B13R1.466 CCOC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100161115259 [0,3,0,0,0,0|1,0,0]=4 15165 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [0,3,0,0,0,0|1,0,0]=4 15166 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [0,3,0,0,0,0|1,0,0]=4 15167 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 2230a_106832991635_100012346676 [0,3,0,0,0,0|0,0,0]=3 15168 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 34a_100102657272_100012346676 [0,3,0,0,0,0|0,0,0]=3 15169 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 7a_106832991635_100012346676 [0,3,0,0,0,0|0,0,0]=3 15170 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 2230a_106832991635_100011217175 [0,3,0,0,0,0|0,0,0]=3 15171 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 34a_100102657272_100011217175 [0,3,0,0,0,0|0,0,0]=3 15172 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 7a_106832991635_100011217175 [0,3,0,0,0,0|0,0,0]=3 15173 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 2230a_106832991635_100000183365 [0,3,0,0,0,0|0,0,0]=3 15174 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 7a_106832991635_100000183365 [0,3,0,0,0,0|0,0,0]=3 15175 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl 7a_106832991635_200011216723 [0,3,0,0,0,0|0,0,0]=3 15176 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 2230a_106832991635_200012349649 [0,3,0,0,0,0|0,0,0]=3 15177 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 34a_100102657272_200012349649 [0,3,0,0,0,0|0,0,0]=3 15178 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100000211430 [0,3,0,0,0,0|0,0,0]=3 15179 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100000211430 [0,3,0,0,0,0|0,0,0]=3 15180 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 2230a_106832991635_100000757878 [0,3,0,0,0,0|0,0,0]=3 15181 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 34a_100102657272_100000757878 [0,3,0,0,0,0|0,0,0]=3 15182 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 7a_106832991635_100000757878 [0,3,0,0,0,0|0,0,0]=3 15183 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)O 7a_106832991635_200010170092 [0,3,0,0,0,0|0,0,0]=3 15184 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 2230a_106832991635_100012361357 [0,3,0,0,0,0|0,0,0]=3 15185 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 34a_100102657272_100012361357 [0,3,0,0,0,0|0,0,0]=3 15186 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 7a_106832991635_100012361357 [0,3,0,0,0,0|0,0,0]=3 15187 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 2230a_106832991635_100011219196 [0,3,0,0,0,0|0,0,0]=3 15188 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 34a_100102657272_100011219196 [0,3,0,0,0,0|0,0,0]=3 15189 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 7a_106832991635_100011219196 [0,3,0,0,0,0|0,0,0]=3 15190 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 2230a_106832991635_100012351892 [0,3,0,0,0,0|0,0,0]=3 15191 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 34a_100102657272_100012351892 [0,3,0,0,0,0|0,0,0]=3 15192 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 7a_106832991635_100012351892 [0,3,0,0,0,0|0,0,0]=3 15193 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 2230a_106832991635_100000183380 [0,3,0,0,0,0|0,0,0]=3 15194 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 34a_100102657272_100000183380 [0,3,0,0,0,0|0,0,0]=3 15195 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 7a_106832991635_100000183380 [0,3,0,0,0,0|0,0,0]=3 15196 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [0,3,0,0,0,0|0,0,0]=3 15197 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Br 22a_100016993582_100012339404 [0,3,0,0,0,0|0,0,0]=3 15198 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)C 22a_100016993582_100000186397 [0,3,0,0,0,0|0,0,0]=3 15199 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Cl 22a_100016993582_100000691181 [0,3,0,0,0,0|0,0,0]=3 15200 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)F 22a_100016993582_100000760357 [0,3,0,0,0,0|0,0,0]=3 15201 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)I 22a_100016993582_100000739115 [0,3,0,0,0,0|0,0,0]=3 15202 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)O 22a_100016993582_100000189672 [0,3,0,0,0,0|0,0,0]=3 15203 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Br 22a_100016993582_100000692631 [0,3,0,0,0,0|0,0,0]=3 15204 B13R1.466 CNNC(=O)c1ccc(c(c1)C)C 22a_100016993582_100000210898 [0,3,0,0,0,0|0,0,0]=3 15205 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Cl 22a_100016993582_100000686306 [0,3,0,0,0,0|0,0,0]=3 15206 B13R1.466 CNNC(=O)c1ccc(c(c1)C)F 22a_100016993582_100000751819 [0,3,0,0,0,0|0,0,0]=3 15207 B13R1.466 CNNC(=O)c1ccc(c(c1)C)I 22a_100016993582_100000751300 [0,3,0,0,0,0|0,0,0]=3 15208 B13R1.466 CNNC(=O)c1ccc(c(c1)C)O 22a_100016993582_100000685612 [0,3,0,0,0,0|0,0,0]=3 15209 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Br 22a_100016993582_100000687082 [0,3,0,0,0,0|0,0,0]=3 15210 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)C 22a_100016993582_100000751740 [0,3,0,0,0,0|0,0,0]=3 15211 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100016993582_100000210401 [0,3,0,0,0,0|0,0,0]=3 15212 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)F 22a_100016993582_100000686462 [0,3,0,0,0,0|0,0,0]=3 15213 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)I 22a_100016993582_100000684831 [0,3,0,0,0,0|0,0,0]=3 15214 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)O 22a_100016993582_100000212196 [0,3,0,0,0,0|0,0,0]=3 15215 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Br 22a_100016993582_100000743946 [0,3,0,0,0,0|0,0,0]=3 15216 B13R1.466 CNNC(=O)c1ccc(c(c1)F)C 22a_100016993582_100000212313 [0,3,0,0,0,0|0,0,0]=3 15217 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Cl 22a_100016993582_100000743183 [0,3,0,0,0,0|0,0,0]=3 15218 B13R1.466 CNNC(=O)c1ccc(c(c1)F)F 22a_100016993582_100000209822 [0,3,0,0,0,0|0,0,0]=3 15219 B13R1.466 CNNC(=O)c1ccc(c(c1)F)I 22a_100016993582_100000062624 [0,3,0,0,0,0|0,0,0]=3 15220 B13R1.466 CNNC(=O)c1ccc(c(c1)F)O 22a_100016993582_100000185466 [0,3,0,0,0,0|0,0,0]=3 15221 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Br 22a_100016993582_100012343876 [0,3,0,0,0,0|0,0,0]=3 15222 B13R1.466 CNNC(=O)c1ccc(c(c1)I)C 22a_100016993582_100000751299 [0,3,0,0,0,0|0,0,0]=3 15223 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Cl 22a_100016993582_100000739381 [0,3,0,0,0,0|0,0,0]=3 15224 B13R1.466 CNNC(=O)c1ccc(c(c1)I)F 22a_100016993582_100000688015 [0,3,0,0,0,0|0,0,0]=3 15225 B13R1.466 CNNC(=O)c1ccc(c(c1)I)I 22a_100016993582_100000725830 [0,3,0,0,0,0|0,0,0]=3 15226 B13R1.466 CNNC(=O)c1ccc(c(c1)I)O 22a_100016993582_100000037485 [0,3,0,0,0,0|0,0,0]=3 15227 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Br 22a_100016993582_100000689001 [0,3,0,0,0,0|0,0,0]=3 15228 B13R1.466 CNNC(=O)c1ccc(c(c1)O)C 22a_100016993582_100000233767 [0,3,0,0,0,0|0,0,0]=3 15229 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Cl 22a_100016993582_100011933997 [0,3,0,0,0,0|0,0,0]=3 15230 B13R1.466 CNNC(=O)c1ccc(c(c1)O)F 22a_100016993582_100000035894 [0,3,0,0,0,0|0,0,0]=3 15231 B13R1.466 CNNC(=O)c1ccc(c(c1)O)I 22a_100016993582_100000239334 [0,3,0,0,0,0|0,0,0]=3 15232 B13R1.466 COCC(=O)c1ccc(c(c1)Br)C 34a_100138415774_100012346676 [0,3,0,0,0,0|1,0,0]=4 15233 B13R1.466 COCC(=O)c1ccc(c(c1)Br)F 34a_100138415774_100011217175 [0,3,0,0,0,0|1,0,0]=4 15234 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)Br 34a_100138415774_200012349649 [0,3,0,0,0,0|1,0,0]=4 15235 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200000210301 [0,3,0,0,0,0|1,0,0]=4 15236 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)F 34a_100138415774_100000757878 [0,3,0,0,0,0|1,0,0]=4 15237 B13R1.466 COCC(=O)c1ccc(c(c1)F)Br 34a_100138415774_100012361357 [0,3,0,0,0,0|1,0,0]=4 15238 B13R1.466 COCC(=O)c1ccc(c(c1)F)C 34a_100138415774_100011219196 [0,3,0,0,0,0|1,0,0]=4 15239 B13R1.466 COCC(=O)c1ccc(c(c1)F)Cl 34a_100138415774_100012351892 [0,3,0,0,0,0|1,0,0]=4 15240 B13R1.466 COCC(=O)c1ccc(c(c1)F)F 34a_100138415774_100000183380 [0,3,0,0,0,0|1,0,0]=4 15241 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)C 62a_100012346676_200000210301 [0,3,0,0,0,0|1,0,0]=4 15242 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)C 62a_200000210301_100012346676 [0,3,0,0,0,0|1,0,0]=4 15243 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)F 62a_100011217175_200000210301 [0,3,0,0,0,0|1,0,0]=4 15244 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)F 62a_200000210301_100011217175 [0,3,0,0,0,0|1,0,0]=4 15245 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_100000183365_200000210301 [0,3,0,0,0,0|1,0,0]=4 15246 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_200000210301_100000183365 [0,3,0,0,0,0|1,0,0]=4 15247 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200000210301_200011216723 [0,3,0,0,0,0|1,0,0]=4 15248 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_200000210301 [0,3,0,0,0,0|1,0,0]=4 15249 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Br 62a_200000210301_200012349649 [0,3,0,0,0,0|1,0,0]=4 15250 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Br 62a_200012349649_200000210301 [0,3,0,0,0,0|1,0,0]=4 15251 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200000210301 [0,3,0,0,0,0|1,0,0]=4 15252 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_200000210301_100000211430 [0,3,0,0,0,0|1,0,0]=4 15253 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)F 62a_100000757878_200000210301 [0,3,0,0,0,0|1,0,0]=4 15254 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)F 62a_200000210301_100000757878 [0,3,0,0,0,0|1,0,0]=4 15255 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200000210301_200010170092 [0,3,0,0,0,0|1,0,0]=4 15256 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200000210301 [0,3,0,0,0,0|1,0,0]=4 15257 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Br 62a_100012361357_200000210301 [0,3,0,0,0,0|1,0,0]=4 15258 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Br 62a_200000210301_100012361357 [0,3,0,0,0,0|1,0,0]=4 15259 B13R1.466 CSCC(=O)c1ccc(c(c1)F)C 62a_100011219196_200000210301 [0,3,0,0,0,0|1,0,0]=4 15260 B13R1.466 CSCC(=O)c1ccc(c(c1)F)C 62a_200000210301_100011219196 [0,3,0,0,0,0|1,0,0]=4 15261 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200000210301 [0,3,0,0,0,0|1,0,0]=4 15262 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_200000210301_100012351892 [0,3,0,0,0,0|1,0,0]=4 15263 B13R1.466 CSCC(=O)c1ccc(c(c1)F)F 62a_100000183380_200000210301 [0,3,0,0,0,0|1,0,0]=4 15264 B13R1.466 CSCC(=O)c1ccc(c(c1)F)F 62a_200000210301_100000183380 [0,3,0,0,0,0|1,0,0]=4 15265 B13R1.466 CSCC(=O)c1ccc(c(c1)O)O 62a_200000210301_100000183813 [0,3,0,0,0,0|1,0,0]=4 15266 B13R1.466 Cc1cc(ccc1Br)C(=O)CCF 1458a_100000692631_100011217306 [0,3,0,0,0,0|1,0,0]=4 15267 B13R1.466 Cc1cc(ccc1Br)C(=O)CCO 1458a_100000692631_100000211926 [0,3,0,0,0,0|1,0,0]=4 15268 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCF 1458a_100000686306_100011217306 [0,3,0,0,0,0|1,0,0]=4 15269 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCO 1458a_100000686306_100000211926 [0,3,0,0,0,0|1,0,0]=4 15270 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200011216723_200025704644 [0,3,0,0,0,0|1,0,0]=4 15271 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200025704644_200011216723 [0,3,0,0,0,0|1,0,0]=4 15272 B13R1.466 Cc1cc(ccc1F)C(=O)CCF 1458a_100000751819_100011217306 [0,3,0,0,0,0|1,0,0]=4 15273 B13R1.466 Cc1cc(ccc1F)C(=O)CCO 1458a_100000751819_100000211926 [0,3,0,0,0,0|1,0,0]=4 15274 B13R1.466 Cc1cc(ccc1I)C(=O)CCF 1458a_100000751300_100011217306 [0,3,0,0,0,0|1,0,0]=4 15275 B13R1.466 Cc1cc(ccc1I)C(=O)CCO 1458a_100000751300_100000211926 [0,3,0,0,0,0|1,0,0]=4 15276 B13R1.466 Cc1cc(ccc1O)C(=O)CCF 1458a_100000685612_100011217306 [0,3,0,0,0,0|1,0,0]=4 15277 B13R1.466 Cc1cc(ccc1O)C(=O)CCO 1458a_100000685612_100000211926 [0,3,0,0,0,0|1,0,0]=4 15278 B13R1.466 Cc1ccc(cc1Br)C(=O)CCF 1458a_100000186397_100011217306 [0,3,0,0,0,0|1,0,0]=4 15279 B13R1.466 Cc1ccc(cc1Br)C(=O)CCO 1458a_100000186397_100000211926 [0,3,0,0,0,0|1,0,0]=4 15280 B13R1.466 Cc1ccc(cc1Br)C(=O)CS[13CH3] 62a_100012346676_200025704644 [0,3,0,0,0,0|1,0,0]=4 15281 B13R1.466 Cc1ccc(cc1Br)C(=O)CS[13CH3] 62a_200025704644_100012346676 [0,3,0,0,0,0|1,0,0]=4 15282 B13R1.466 Cc1ccc(cc1C)C(=O)CCF 1458a_100000210898_100011217306 [0,3,0,0,0,0|1,0,0]=4 15283 B13R1.466 Cc1ccc(cc1C)C(=O)CCO 1458a_100000210898_100000211926 [0,3,0,0,0,0|1,0,0]=4 15284 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_100000183365_200025704644 [0,3,0,0,0,0|1,0,0]=4 15285 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_200025704644_100000183365 [0,3,0,0,0,0|1,0,0]=4 15286 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCF 1458a_100000751740_100011217306 [0,3,0,0,0,0|1,0,0]=4 15287 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCO 1458a_100000751740_100000211926 [0,3,0,0,0,0|1,0,0]=4 15288 B13R1.466 Cc1ccc(cc1F)C(=O)CCF 1458a_100000212313_100011217306 [0,3,0,0,0,0|1,0,0]=4 15289 B13R1.466 Cc1ccc(cc1F)C(=O)CCO 1458a_100000212313_100000211926 [0,3,0,0,0,0|1,0,0]=4 15290 B13R1.466 Cc1ccc(cc1F)C(=O)CS[13CH3] 62a_100011219196_200025704644 [0,3,0,0,0,0|1,0,0]=4 15291 B13R1.466 Cc1ccc(cc1F)C(=O)CS[13CH3] 62a_200025704644_100011219196 [0,3,0,0,0,0|1,0,0]=4 15292 B13R1.466 Cc1ccc(cc1I)C(=O)CCF 1458a_100000751299_100011217306 [0,3,0,0,0,0|1,0,0]=4 15293 B13R1.466 Cc1ccc(cc1I)C(=O)CCO 1458a_100000751299_100000211926 [0,3,0,0,0,0|1,0,0]=4 15294 B13R1.466 Cc1ccc(cc1O)C(=O)CCF 1458a_100000233767_100011217306 [0,3,0,0,0,0|1,0,0]=4 15295 B13R1.466 Cc1ccc(cc1O)C(=O)CCO 1458a_100000233767_100000211926 [0,3,0,0,0,0|1,0,0]=4 15296 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Br 1458a_100012339404_100011217306 [0,3,0,0,0,0|1,0,0]=4 15297 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011217306 [0,3,0,0,0,0|1,0,0]=4 15298 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)F 1458a_100000760357_100011217306 [0,3,0,0,0,0|1,0,0]=4 15299 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)I 1458a_100000739115_100011217306 [0,3,0,0,0,0|1,0,0]=4 15300 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011217306 [0,3,0,0,0,0|1,0,0]=4 15301 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011217306 [0,3,0,0,0,0|1,0,0]=4 15302 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011217306 [0,3,0,0,0,0|1,0,0]=4 15303 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)F 1458a_100000686462_100011217306 [0,3,0,0,0,0|1,0,0]=4 15304 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)I 1458a_100000684831_100011217306 [0,3,0,0,0,0|1,0,0]=4 15305 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011217306 [0,3,0,0,0,0|1,0,0]=4 15306 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Br 1458a_100000743946_100011217306 [0,3,0,0,0,0|1,0,0]=4 15307 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Cl 1458a_100000743183_100011217306 [0,3,0,0,0,0|1,0,0]=4 15308 B13R1.466 O=C(CCF)c1ccc(c(c1)F)F 1458a_100000209822_100011217306 [0,3,0,0,0,0|1,0,0]=4 15309 B13R1.466 O=C(CCF)c1ccc(c(c1)F)I 1458a_100000062624_100011217306 [0,3,0,0,0,0|1,0,0]=4 15310 B13R1.466 O=C(CCF)c1ccc(c(c1)F)O 1458a_100000185466_100011217306 [0,3,0,0,0,0|1,0,0]=4 15311 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Br 1458a_100012343876_100011217306 [0,3,0,0,0,0|1,0,0]=4 15312 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Cl 1458a_100000739381_100011217306 [0,3,0,0,0,0|1,0,0]=4 15313 B13R1.466 O=C(CCF)c1ccc(c(c1)I)F 1458a_100000688015_100011217306 [0,3,0,0,0,0|1,0,0]=4 15314 B13R1.466 O=C(CCF)c1ccc(c(c1)I)I 1458a_100000725830_100011217306 [0,3,0,0,0,0|1,0,0]=4 15315 B13R1.466 O=C(CCF)c1ccc(c(c1)I)O 1458a_100000037485_100011217306 [0,3,0,0,0,0|1,0,0]=4 15316 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011217306 [0,3,0,0,0,0|1,0,0]=4 15317 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011217306 [0,3,0,0,0,0|1,0,0]=4 15318 B13R1.466 O=C(CCF)c1ccc(c(c1)O)F 1458a_100000035894_100011217306 [0,3,0,0,0,0|1,0,0]=4 15319 B13R1.466 O=C(CCF)c1ccc(c(c1)O)I 1458a_100000239334_100011217306 [0,3,0,0,0,0|1,0,0]=4 15320 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [0,3,0,0,0,0|1,0,0]=4 15321 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Br 1458a_100012339404_100000211926 [0,3,0,0,0,0|1,0,0]=4 15322 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000211926 [0,3,0,0,0,0|1,0,0]=4 15323 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)F 1458a_100000760357_100000211926 [0,3,0,0,0,0|1,0,0]=4 15324 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)I 1458a_100000739115_100000211926 [0,3,0,0,0,0|1,0,0]=4 15325 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000211926 [0,3,0,0,0,0|1,0,0]=4 15326 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000211926 [0,3,0,0,0,0|1,0,0]=4 15327 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000211926 [0,3,0,0,0,0|1,0,0]=4 15328 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)F 1458a_100000686462_100000211926 [0,3,0,0,0,0|1,0,0]=4 15329 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)I 1458a_100000684831_100000211926 [0,3,0,0,0,0|1,0,0]=4 15330 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000211926 [0,3,0,0,0,0|1,0,0]=4 15331 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Br 1458a_100000743946_100000211926 [0,3,0,0,0,0|1,0,0]=4 15332 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Cl 1458a_100000743183_100000211926 [0,3,0,0,0,0|1,0,0]=4 15333 B13R1.466 O=C(CCO)c1ccc(c(c1)F)F 1458a_100000209822_100000211926 [0,3,0,0,0,0|1,0,0]=4 15334 B13R1.466 O=C(CCO)c1ccc(c(c1)F)I 1458a_100000062624_100000211926 [0,3,0,0,0,0|1,0,0]=4 15335 B13R1.466 O=C(CCO)c1ccc(c(c1)F)O 1458a_100000185466_100000211926 [0,3,0,0,0,0|1,0,0]=4 15336 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Br 1458a_100012343876_100000211926 [0,3,0,0,0,0|1,0,0]=4 15337 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Cl 1458a_100000739381_100000211926 [0,3,0,0,0,0|1,0,0]=4 15338 B13R1.466 O=C(CCO)c1ccc(c(c1)I)F 1458a_100000688015_100000211926 [0,3,0,0,0,0|1,0,0]=4 15339 B13R1.466 O=C(CCO)c1ccc(c(c1)I)I 1458a_100000725830_100000211926 [0,3,0,0,0,0|1,0,0]=4 15340 B13R1.466 O=C(CCO)c1ccc(c(c1)I)O 1458a_100000037485_100000211926 [0,3,0,0,0,0|1,0,0]=4 15341 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000211926 [0,3,0,0,0,0|1,0,0]=4 15342 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000211926 [0,3,0,0,0,0|1,0,0]=4 15343 B13R1.466 O=C(CCO)c1ccc(c(c1)O)F 1458a_100000035894_100000211926 [0,3,0,0,0,0|1,0,0]=4 15344 B13R1.466 O=C(CCO)c1ccc(c(c1)O)I 1458a_100000239334_100000211926 [0,3,0,0,0,0|1,0,0]=4 15345 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [0,3,0,0,0,0|1,0,0]=4 15346 B13R1.466 [13CH3]OCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200025704644 [0,3,0,0,0,0|1,0,0]=4 15347 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Br)F 62a_100011217175_200025704644 [0,3,0,0,0,0|1,0,0]=4 15348 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Br)F 62a_200025704644_100011217175 [0,3,0,0,0,0|1,0,0]=4 15349 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Br 62a_200012349649_200025704644 [0,3,0,0,0,0|1,0,0]=4 15350 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Br 62a_200025704644_200012349649 [0,3,0,0,0,0|1,0,0]=4 15351 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200025704644 [0,3,0,0,0,0|1,0,0]=4 15352 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_200025704644_100000211430 [0,3,0,0,0,0|1,0,0]=4 15353 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)F 62a_100000757878_200025704644 [0,3,0,0,0,0|1,0,0]=4 15354 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)F 62a_200025704644_100000757878 [0,3,0,0,0,0|1,0,0]=4 15355 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200025704644 [0,3,0,0,0,0|1,0,0]=4 15356 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200025704644_200010170092 [0,3,0,0,0,0|1,0,0]=4 15357 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Br 62a_100012361357_200025704644 [0,3,0,0,0,0|1,0,0]=4 15358 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Br 62a_200025704644_100012361357 [0,3,0,0,0,0|1,0,0]=4 15359 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200025704644 [0,3,0,0,0,0|1,0,0]=4 15360 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_200025704644_100012351892 [0,3,0,0,0,0|1,0,0]=4 15361 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)F 62a_100000183380_200025704644 [0,3,0,0,0,0|1,0,0]=4 15362 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)F 62a_200025704644_100000183380 [0,3,0,0,0,0|1,0,0]=4 15363 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)O)O 62a_200025704644_100000183813 [0,3,0,0,0,0|1,0,0]=4 15364 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210303 [0,3,0,0,0,0|1,0,0]=4 15365 B13R1.1511 CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210303 [0,3,0,0,0,0|1,0,0]=4 15366 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210303 [0,3,0,0,0,0|1,0,0]=4 15367 B13R1.1511 CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210303 [0,3,0,0,0,0|1,0,0]=4 15368 B13R1.1511 CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210303 [0,3,0,0,0,0|1,0,0]=4 15369 B13R1.1511 CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210303 [0,3,0,0,0,0|1,0,0]=4 15370 B13R1.1511 CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210303 [0,3,0,0,0,0|1,0,0]=4 15371 B13R1.1511 CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210303 [0,3,0,0,0,0|1,0,0]=4 15372 B13R1.1511 CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210303 [0,3,0,0,0,0|1,0,0]=4 15373 B13R1.1511 CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210303 [0,3,0,0,0,0|1,0,0]=4 15374 B13R1.1511 CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210303 [0,3,0,0,0,0|1,0,0]=4 15375 B13R1.1511 CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210303 [0,3,0,0,0,0|1,0,0]=4 15376 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210303 [0,3,0,0,0,0|1,0,0]=4 15377 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210303 [0,3,0,0,0,0|1,0,0]=4 15378 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210303 [0,3,0,0,0,0|1,0,0]=4 15379 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210303 [0,3,0,0,0,0|1,0,0]=4 15380 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210303 [0,3,0,0,0,0|1,0,0]=4 15381 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210303 [0,3,0,0,0,0|1,0,0]=4 15382 B13R1.1511 CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210303 [0,3,0,0,0,0|1,0,0]=4 15383 B13R1.1511 CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210303 [0,3,0,0,0,0|1,0,0]=4 15384 B13R1.1511 CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210303 [0,3,0,0,0,0|1,0,0]=4 15385 B13R1.1511 CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210303 [0,3,0,0,0,0|1,0,0]=4 15386 B13R1.1511 CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210303 [0,3,0,0,0,0|1,0,0]=4 15387 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210303 [0,3,0,0,0,0|1,0,0]=4 15388 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012345046 [0,3,0,0,0,0|1,0,0]=4 15389 B13R1.1511 CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210303 [0,3,0,0,0,0|1,0,0]=4 15390 B13R1.1511 CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210303 [0,3,0,0,0,0|1,0,0]=4 15391 B13R1.1511 CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210303 [0,3,0,0,0,0|1,0,0]=4 15392 B13R1.1511 CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210303 [0,3,0,0,0,0|1,0,0]=4 15393 B13R1.1511 CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210303 [0,3,0,0,0,0|1,0,0]=4 15394 B13R1.1511 CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210303 [0,3,0,0,0,0|1,0,0]=4 15395 B13R1.1511 CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210303 [0,3,0,0,0,0|1,0,0]=4 15396 B13R1.1511 CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210303 [0,3,0,0,0,0|1,0,0]=4 15397 B13R1.1511 CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210303 [0,3,0,0,0,0|1,0,0]=4 15398 B13R1.1511 CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210303 [0,3,0,0,0,0|1,0,0]=4 15399 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 11a_100015525214_100000762965 [0,3,0,0,0,0|0,0,0]=3 15400 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 240690a_100015525214_100000762965 [0,3,0,0,0,0|0,0,0]=3 15401 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 527a_100015525214_100000762965 [0,3,0,0,0,0|0,0,0]=3 15402 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 11a_100015525214_100000685072 [0,3,0,0,0,0|0,0,0]=3 15403 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 240690a_100015525214_100000685072 [0,3,0,0,0,0|0,0,0]=3 15404 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 527a_100015525214_100000685072 [0,3,0,0,0,0|0,0,0]=3 15405 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 11a_100015525214_100000766353 [0,3,0,0,0,0|0,0,0]=3 15406 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 240690a_100015525214_100000766353 [0,3,0,0,0,0|0,0,0]=3 15407 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 527a_100015525214_100000766353 [0,3,0,0,0,0|0,0,0]=3 15408 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 11a_100015525214_100000212304 [0,3,0,0,0,0|0,0,0]=3 15409 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 240690a_100015525214_100000212304 [0,3,0,0,0,0|0,0,0]=3 15410 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 527a_100015525214_100000212304 [0,3,0,0,0,0|0,0,0]=3 15411 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 11a_100015525214_100012360512 [0,3,0,0,0,0|0,0,0]=3 15412 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 240690a_100015525214_100012360512 [0,3,0,0,0,0|0,0,0]=3 15413 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 527a_100015525214_100012360512 [0,3,0,0,0,0|0,0,0]=3 15414 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 240690a_100015525214_100012344906 [0,3,0,0,0,0|0,0,0]=3 15415 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 527a_100015525214_100012344906 [0,3,0,0,0,0|0,0,0]=3 15416 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 11a_100015525214_100000741311 [0,3,0,0,0,0|0,0,0]=3 15417 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 240690a_100015525214_100000741311 [0,3,0,0,0,0|0,0,0]=3 15418 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 527a_100015525214_100000741311 [0,3,0,0,0,0|0,0,0]=3 15419 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 11a_100015525214_100000211164 [0,3,0,0,0,0|0,0,0]=3 15420 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 240690a_100015525214_100000211164 [0,3,0,0,0,0|0,0,0]=3 15421 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 527a_100015525214_100000211164 [0,3,0,0,0,0|0,0,0]=3 15422 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 11a_100015525214_100000688705 [0,3,0,0,0,0|0,0,0]=3 15423 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 240690a_100015525214_100000688705 [0,3,0,0,0,0|0,0,0]=3 15424 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 527a_100015525214_100000688705 [0,3,0,0,0,0|0,0,0]=3 15425 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 11a_100015525214_100000686989 [0,3,0,0,0,0|0,0,0]=3 15426 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 240690a_100015525214_100000686989 [0,3,0,0,0,0|0,0,0]=3 15427 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 527a_100015525214_100000686989 [0,3,0,0,0,0|0,0,0]=3 15428 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 11a_100015525214_100010189873 [0,3,0,0,0,0|0,0,0]=3 15429 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 240690a_100015525214_100010189873 [0,3,0,0,0,0|0,0,0]=3 15430 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 527a_100015525214_100010189873 [0,3,0,0,0,0|0,0,0]=3 15431 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 240690a_100015525214_100000692822 [0,3,0,0,0,0|0,0,0]=3 15432 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 527a_100015525214_100000692822 [0,3,0,0,0,0|0,0,0]=3 15433 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 11a_100015525214_100000741628 [0,3,0,0,0,0|0,0,0]=3 15434 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 240690a_100015525214_100000741628 [0,3,0,0,0,0|0,0,0]=3 15435 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 527a_100015525214_100000741628 [0,3,0,0,0,0|0,0,0]=3 15436 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 11a_100015525214_100000766932 [0,3,0,0,0,0|0,0,0]=3 15437 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 240690a_100015525214_100000766932 [0,3,0,0,0,0|0,0,0]=3 15438 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 527a_100015525214_100000766932 [0,3,0,0,0,0|0,0,0]=3 15439 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 11a_100015525214_100000185840 [0,3,0,0,0,0|0,0,0]=3 15440 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015525214_100000185840 [0,3,0,0,0,0|0,0,0]=3 15441 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 527a_100015525214_100000185840 [0,3,0,0,0,0|0,0,0]=3 15442 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 11a_100015525214_100000211397 [0,3,0,0,0,0|0,0,0]=3 15443 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 240690a_100015525214_100000211397 [0,3,0,0,0,0|0,0,0]=3 15444 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 527a_100015525214_100000211397 [0,3,0,0,0,0|0,0,0]=3 15445 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 11a_100015525214_100000751301 [0,3,0,0,0,0|0,0,0]=3 15446 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 240690a_100015525214_100000751301 [0,3,0,0,0,0|0,0,0]=3 15447 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 527a_100015525214_100000751301 [0,3,0,0,0,0|0,0,0]=3 15448 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 240690a_100015525214_100000702456 [0,3,0,0,0,0|0,0,0]=3 15449 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 527a_100015525214_100000702456 [0,3,0,0,0,0|0,0,0]=3 15450 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 11a_100015525214_100000214689 [0,3,0,0,0,0|0,0,0]=3 15451 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 240690a_100015525214_100000214689 [0,3,0,0,0,0|0,0,0]=3 15452 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 527a_100015525214_100000214689 [0,3,0,0,0,0|0,0,0]=3 15453 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 11a_100015525214_100000766033 [0,3,0,0,0,0|0,0,0]=3 15454 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 240690a_100015525214_100000766033 [0,3,0,0,0,0|0,0,0]=3 15455 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 527a_100015525214_100000766033 [0,3,0,0,0,0|0,0,0]=3 15456 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 11a_100015525214_100000212326 [0,3,0,0,0,0|0,0,0]=3 15457 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 240690a_100015525214_100000212326 [0,3,0,0,0,0|0,0,0]=3 15458 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 527a_100015525214_100000212326 [0,3,0,0,0,0|0,0,0]=3 15459 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 11a_100015525214_100000211022 [0,3,0,0,0,0|0,0,0]=3 15460 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 240690a_100015525214_100000211022 [0,3,0,0,0,0|0,0,0]=3 15461 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 527a_100015525214_100000211022 [0,3,0,0,0,0|0,0,0]=3 15462 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 11a_100015525214_100000037189 [0,3,0,0,0,0|0,0,0]=3 15463 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 240690a_100015525214_100000037189 [0,3,0,0,0,0|0,0,0]=3 15464 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 527a_100015525214_100000037189 [0,3,0,0,0,0|0,0,0]=3 15465 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 240690a_100015525214_100000689029 [0,3,0,0,0,0|0,0,0]=3 15466 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215476 [0,3,0,0,0,0|0,0,0]=3 15467 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 527a_100015525214_100000689029 [0,3,0,0,0,0|0,0,0]=3 15468 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 11a_100015525214_100000751167 [0,3,0,0,0,0|0,0,0]=3 15469 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 240690a_100015525214_100000751167 [0,3,0,0,0,0|0,0,0]=3 15470 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 527a_100015525214_100000751167 [0,3,0,0,0,0|0,0,0]=3 15471 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 11a_100015525214_100009999607 [0,3,0,0,0,0|0,0,0]=3 15472 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 240690a_100015525214_100009999607 [0,3,0,0,0,0|0,0,0]=3 15473 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 527a_100015525214_100009999607 [0,3,0,0,0,0|0,0,0]=3 15474 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 11a_100015525214_100000739380 [0,3,0,0,0,0|0,0,0]=3 15475 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 240690a_100015525214_100000739380 [0,3,0,0,0,0|0,0,0]=3 15476 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 527a_100015525214_100000739380 [0,3,0,0,0,0|0,0,0]=3 15477 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 11a_100015525214_100000739341 [0,3,0,0,0,0|0,0,0]=3 15478 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 240690a_100015525214_100000739341 [0,3,0,0,0,0|0,0,0]=3 15479 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 527a_100015525214_100000739341 [0,3,0,0,0,0|0,0,0]=3 15480 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 240690a_100015525214_100000744433 [0,3,0,0,0,0|0,0,0]=3 15481 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 527a_100015525214_100000744433 [0,3,0,0,0,0|0,0,0]=3 15482 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 240690a_100015525214_100000212137 [0,3,0,0,0,0|0,0,0]=3 15483 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 527a_100015525214_100000212137 [0,3,0,0,0,0|0,0,0]=3 15484 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 11a_100015525214_100000188622 [0,3,0,0,0,0|0,0,0]=3 15485 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 240690a_100015525214_100000188622 [0,3,0,0,0,0|0,0,0]=3 15486 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 527a_100015525214_100000188622 [0,3,0,0,0,0|0,0,0]=3 15487 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 240690a_100015525214_100000746061 [0,3,0,0,0,0|0,0,0]=3 15488 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203945 [0,3,0,0,0,0|0,0,0]=3 15489 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 527a_100015525214_100000746061 [0,3,0,0,0,0|0,0,0]=3 15490 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 240690a_100015525214_100000091984 [0,3,0,0,0,0|0,0,0]=3 15491 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 527a_100015525214_100000091984 [0,3,0,0,0,0|0,0,0]=3 15492 B13R1.1511 CCOC(=O)c1ccc(cc1C)O 271570a_203496583355_100011327926 [0,3,0,0,0,0|1,0,0]=4 15493 B13R1.1511 CCOC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060723 [0,3,0,0,0,0|1,0,0]=4 15494 B13R1.1511 CCOC(=O)c1ccc(cc1F)O 271570a_203496583355_100010244673 [0,3,0,0,0,0|1,0,0]=4 15495 B13R1.1511 CCOC(=O)c1ccc(cc1O)C 271570a_203496583355_200012185120 [0,3,0,0,0,0|1,0,0]=4 15496 B13R1.1511 CCOC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047509 [0,3,0,0,0,0|1,0,0]=4 15497 B13R1.1511 CCOC(=O)c1ccc(cc1O)F 271570a_203496583355_100011206307 [0,3,0,0,0,0|1,0,0]=4 15498 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 34a_100102657272_100012361341 [0,3,0,0,0,0|0,0,0]=3 15499 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 7a_106832991635_100012361341 [0,3,0,0,0,0|0,0,0]=3 15500 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 2230a_106832991635_100000229959 [0,3,0,0,0,0|0,0,0]=3 15501 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 34a_100102657272_100000229959 [0,3,0,0,0,0|0,0,0]=3 15502 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 7a_106832991635_100000229959 [0,3,0,0,0,0|0,0,0]=3 15503 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100011218845 [0,3,0,0,0,0|0,0,0]=3 15504 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 2230a_106832991635_100012056422 [0,3,0,0,0,0|0,0,0]=3 15505 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 34a_100102657272_100012056422 [0,3,0,0,0,0|0,0,0]=3 15506 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 34a_100102657272_200012361339 [0,3,0,0,0,0|0,0,0]=3 15507 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 7a_106832991635_200012361339 [0,3,0,0,0,0|0,0,0]=3 15508 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 34a_100102657272_100012351891 [0,3,0,0,0,0|0,0,0]=3 15509 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 7a_106832991635_100012351891 [0,3,0,0,0,0|0,0,0]=3 15510 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 34a_100102657272_100000229962 [0,3,0,0,0,0|0,0,0]=3 15511 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 7a_106832991635_100000229962 [0,3,0,0,0,0|0,0,0]=3 15512 B13R1.1511 CNCC(=O)c1ccc(cc1O)F 34a_100102657272_100009817053 [0,3,0,0,0,0|0,0,0]=3 15513 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 34a_100102657272_100009814262 [0,3,0,0,0,0|0,0,0]=3 15514 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 7a_106832991635_100009814262 [0,3,0,0,0,0|0,0,0]=3 15515 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Br 22a_100016993582_100000762965 [0,3,0,0,0,0|0,0,0]=3 15516 B13R1.1511 CNNC(=O)c1ccc(cc1Br)C 22a_100016993582_100000685072 [0,3,0,0,0,0|0,0,0]=3 15517 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Cl 22a_100016993582_100000766353 [0,3,0,0,0,0|0,0,0]=3 15518 B13R1.1511 CNNC(=O)c1ccc(cc1Br)F 22a_100016993582_100000212304 [0,3,0,0,0,0|0,0,0]=3 15519 B13R1.1511 CNNC(=O)c1ccc(cc1Br)I 22a_100016993582_100012360512 [0,3,0,0,0,0|0,0,0]=3 15520 B13R1.1511 CNNC(=O)c1ccc(cc1Br)O 22a_100016993582_100012344906 [0,3,0,0,0,0|0,0,0]=3 15521 B13R1.1511 CNNC(=O)c1ccc(cc1C)Br 22a_100016993582_100000741311 [0,3,0,0,0,0|0,0,0]=3 15522 B13R1.1511 CNNC(=O)c1ccc(cc1C)C 22a_100016993582_100000211164 [0,3,0,0,0,0|0,0,0]=3 15523 B13R1.1511 CNNC(=O)c1ccc(cc1C)Cl 22a_100016993582_100000688705 [0,3,0,0,0,0|0,0,0]=3 15524 B13R1.1511 CNNC(=O)c1ccc(cc1C)F 22a_100016993582_100000686989 [0,3,0,0,0,0|0,0,0]=3 15525 B13R1.1511 CNNC(=O)c1ccc(cc1C)I 22a_100016993582_100010189873 [0,3,0,0,0,0|0,0,0]=3 15526 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Br 22a_100016993582_100000741628 [0,3,0,0,0,0|0,0,0]=3 15527 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)C 22a_100016993582_100000766932 [0,3,0,0,0,0|0,0,0]=3 15528 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Cl 22a_100016993582_100000185840 [0,3,0,0,0,0|0,0,0]=3 15529 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)F 22a_100016993582_100000211397 [0,3,0,0,0,0|0,0,0]=3 15530 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)I 22a_100016993582_100000751301 [0,3,0,0,0,0|0,0,0]=3 15531 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)O 22a_100016993582_100000702456 [0,3,0,0,0,0|0,0,0]=3 15532 B13R1.1511 CNNC(=O)c1ccc(cc1F)Br 22a_100016993582_100000214689 [0,3,0,0,0,0|0,0,0]=3 15533 B13R1.1511 CNNC(=O)c1ccc(cc1F)C 22a_100016993582_100000766033 [0,3,0,0,0,0|0,0,0]=3 15534 B13R1.1511 CNNC(=O)c1ccc(cc1F)Cl 22a_100016993582_100000212326 [0,3,0,0,0,0|0,0,0]=3 15535 B13R1.1511 CNNC(=O)c1ccc(cc1F)F 22a_100016993582_100000211022 [0,3,0,0,0,0|0,0,0]=3 15536 B13R1.1511 CNNC(=O)c1ccc(cc1F)I 22a_100016993582_100000037189 [0,3,0,0,0,0|0,0,0]=3 15537 B13R1.1511 CNNC(=O)c1ccc(cc1F)O 22a_100016993582_100000689029 [0,3,0,0,0,0|0,0,0]=3 15538 B13R1.1511 CNNC(=O)c1ccc(cc1I)Br 22a_100016993582_100000751167 [0,3,0,0,0,0|0,0,0]=3 15539 B13R1.1511 CNNC(=O)c1ccc(cc1I)C 22a_100016993582_100009999607 [0,3,0,0,0,0|0,0,0]=3 15540 B13R1.1511 CNNC(=O)c1ccc(cc1I)Cl 22a_100016993582_100000739380 [0,3,0,0,0,0|0,0,0]=3 15541 B13R1.1511 CNNC(=O)c1ccc(cc1I)F 22a_100016993582_100000739341 [0,3,0,0,0,0|0,0,0]=3 15542 B13R1.1511 CNNC(=O)c1ccc(cc1O)Br 22a_100016993582_100000744433 [0,3,0,0,0,0|0,0,0]=3 15543 B13R1.1511 CNNC(=O)c1ccc(cc1O)C 22a_100016993582_100000212137 [0,3,0,0,0,0|0,0,0]=3 15544 B13R1.1511 CNNC(=O)c1ccc(cc1O)Cl 22a_100016993582_100000188622 [0,3,0,0,0,0|0,0,0]=3 15545 B13R1.1511 CNNC(=O)c1ccc(cc1O)F 22a_100016993582_100000746061 [0,3,0,0,0,0|0,0,0]=3 15546 B13R1.1511 CNNC(=O)c1ccc(cc1O)I 22a_100016993582_100000091984 [0,3,0,0,0,0|0,0,0]=3 15547 B13R1.1511 CNNC(=O)c1ccc(cc1O)O 22a_100016993582_100000212172 [0,3,0,0,0,0|0,0,0]=3 15548 B13R1.1511 COCC(=O)c1ccc(cc1Br)F 34a_100138415774_100012361341 [0,3,0,0,0,0|1,0,0]=4 15549 B13R1.1511 COCC(=O)c1ccc(cc1C)C 34a_100138415774_100000229959 [0,3,0,0,0,0|1,0,0]=4 15550 B13R1.1511 COCC(=O)c1ccc(cc1Cl)F 34a_100138415774_100012056422 [0,3,0,0,0,0|1,0,0]=4 15551 B13R1.1511 COCC(=O)c1ccc(cc1F)Br 34a_100138415774_200012361339 [0,3,0,0,0,0|1,0,0]=4 15552 B13R1.1511 COCC(=O)c1ccc(cc1F)Cl 34a_100138415774_100012351891 [0,3,0,0,0,0|1,0,0]=4 15553 B13R1.1511 COCC(=O)c1ccc(cc1F)F 34a_100138415774_100000229962 [0,3,0,0,0,0|1,0,0]=4 15554 B13R1.1511 COCC(=O)c1ccc(cc1O)F 34a_100138415774_100009817053 [0,3,0,0,0,0|1,0,0]=4 15555 B13R1.1511 COCC(=O)c1ccc(cc1O)O 34a_100138415774_100009814262 [0,3,0,0,0,0|1,0,0]=4 15556 B13R1.1511 CSCC(=O)c1ccc(cc1Br)F 62a_100012361341_200000210301 [0,3,0,0,0,0|1,0,0]=4 15557 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_100000229959_200000210301 [0,3,0,0,0,0|1,0,0]=4 15558 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_200000210301_100000229959 [0,3,0,0,0,0|1,0,0]=4 15559 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200000210301 [0,3,0,0,0,0|1,0,0]=4 15560 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200000210301 [0,3,0,0,0,0|1,0,0]=4 15561 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_200000210301_100012056422 [0,3,0,0,0,0|1,0,0]=4 15562 B13R1.1511 CSCC(=O)c1ccc(cc1F)Br 62a_200012361339_200000210301 [0,3,0,0,0,0|1,0,0]=4 15563 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200000210301 [0,3,0,0,0,0|1,0,0]=4 15564 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_200000210301_100012351891 [0,3,0,0,0,0|1,0,0]=4 15565 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_100000229962_200000210301 [0,3,0,0,0,0|1,0,0]=4 15566 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_200000210301_100000229962 [0,3,0,0,0,0|1,0,0]=4 15567 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_100009817053_200000210301 [0,3,0,0,0,0|1,0,0]=4 15568 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_200000210301_100009817053 [0,3,0,0,0,0|1,0,0]=4 15569 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_100009814262_200000210301 [0,3,0,0,0,0|1,0,0]=4 15570 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_200000210301_100009814262 [0,3,0,0,0,0|1,0,0]=4 15571 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Br 1458a_100000741311_100011217306 [0,3,0,0,0,0|1,0,0]=4 15572 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Cl 1458a_100000688705_100011217306 [0,3,0,0,0,0|1,0,0]=4 15573 B13R1.1511 Cc1cc(ccc1C(=O)CCF)F 1458a_100000686989_100011217306 [0,3,0,0,0,0|1,0,0]=4 15574 B13R1.1511 Cc1cc(ccc1C(=O)CCF)I 1458a_100010189873_100011217306 [0,3,0,0,0,0|1,0,0]=4 15575 B13R1.1511 Cc1cc(ccc1C(=O)CCF)O 1458a_100000692822_100011217306 [0,3,0,0,0,0|1,0,0]=4 15576 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Br 1458a_100000741311_100000211926 [0,3,0,0,0,0|1,0,0]=4 15577 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Cl 1458a_100000688705_100000211926 [0,3,0,0,0,0|1,0,0]=4 15578 B13R1.1511 Cc1cc(ccc1C(=O)CCO)F 1458a_100000686989_100000211926 [0,3,0,0,0,0|1,0,0]=4 15579 B13R1.1511 Cc1cc(ccc1C(=O)CCO)I 1458a_100010189873_100000211926 [0,3,0,0,0,0|1,0,0]=4 15580 B13R1.1511 Cc1cc(ccc1C(=O)CCO)O 1458a_100000692822_100000211926 [0,3,0,0,0,0|1,0,0]=4 15581 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCF 1458a_100000685072_100011217306 [0,3,0,0,0,0|1,0,0]=4 15582 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCO 1458a_100000685072_100000211926 [0,3,0,0,0,0|1,0,0]=4 15583 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCF 1458a_100000211164_100011217306 [0,3,0,0,0,0|1,0,0]=4 15584 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCO 1458a_100000211164_100000211926 [0,3,0,0,0,0|1,0,0]=4 15585 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_100000229959_200025704644 [0,3,0,0,0,0|1,0,0]=4 15586 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_200025704644_100000229959 [0,3,0,0,0,0|1,0,0]=4 15587 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCF 1458a_100000766932_100011217306 [0,3,0,0,0,0|1,0,0]=4 15588 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCO 1458a_100000766932_100000211926 [0,3,0,0,0,0|1,0,0]=4 15589 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCF 1458a_100000766033_100011217306 [0,3,0,0,0,0|1,0,0]=4 15590 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCO 1458a_100000766033_100000211926 [0,3,0,0,0,0|1,0,0]=4 15591 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCF 1458a_100009999607_100011217306 [0,3,0,0,0,0|1,0,0]=4 15592 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCO 1458a_100009999607_100000211926 [0,3,0,0,0,0|1,0,0]=4 15593 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCF 1458a_100000212137_100011217306 [0,3,0,0,0,0|1,0,0]=4 15594 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCO 1458a_100000212137_100000211926 [0,3,0,0,0,0|1,0,0]=4 15595 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Br 1458a_100000762965_100011217306 [0,3,0,0,0,0|1,0,0]=4 15596 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011217306 [0,3,0,0,0,0|1,0,0]=4 15597 B13R1.1511 O=C(CCF)c1ccc(cc1Br)F 1458a_100000212304_100011217306 [0,3,0,0,0,0|1,0,0]=4 15598 B13R1.1511 O=C(CCF)c1ccc(cc1Br)I 1458a_100012360512_100011217306 [0,3,0,0,0,0|1,0,0]=4 15599 B13R1.1511 O=C(CCF)c1ccc(cc1Br)O 1458a_100012344906_100011217306 [0,3,0,0,0,0|1,0,0]=4 15600 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011217306 [0,3,0,0,0,0|1,0,0]=4 15601 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011217306 [0,3,0,0,0,0|1,0,0]=4 15602 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)F 1458a_100000211397_100011217306 [0,3,0,0,0,0|1,0,0]=4 15603 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)I 1458a_100000751301_100011217306 [0,3,0,0,0,0|1,0,0]=4 15604 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)O 1458a_100000702456_100011217306 [0,3,0,0,0,0|1,0,0]=4 15605 B13R1.1511 O=C(CCF)c1ccc(cc1F)Br 1458a_100000214689_100011217306 [0,3,0,0,0,0|1,0,0]=4 15606 B13R1.1511 O=C(CCF)c1ccc(cc1F)Cl 1458a_100000212326_100011217306 [0,3,0,0,0,0|1,0,0]=4 15607 B13R1.1511 O=C(CCF)c1ccc(cc1F)F 1458a_100000211022_100011217306 [0,3,0,0,0,0|1,0,0]=4 15608 B13R1.1511 O=C(CCF)c1ccc(cc1F)I 1458a_100000037189_100011217306 [0,3,0,0,0,0|1,0,0]=4 15609 B13R1.1511 O=C(CCF)c1ccc(cc1F)O 1458a_100000689029_100011217306 [0,3,0,0,0,0|1,0,0]=4 15610 B13R1.1511 O=C(CCF)c1ccc(cc1I)Br 1458a_100000751167_100011217306 [0,3,0,0,0,0|1,0,0]=4 15611 B13R1.1511 O=C(CCF)c1ccc(cc1I)Cl 1458a_100000739380_100011217306 [0,3,0,0,0,0|1,0,0]=4 15612 B13R1.1511 O=C(CCF)c1ccc(cc1I)F 1458a_100000739341_100011217306 [0,3,0,0,0,0|1,0,0]=4 15613 B13R1.1511 O=C(CCF)c1ccc(cc1O)Br 1458a_100000744433_100011217306 [0,3,0,0,0,0|1,0,0]=4 15614 B13R1.1511 O=C(CCF)c1ccc(cc1O)Cl 1458a_100000188622_100011217306 [0,3,0,0,0,0|1,0,0]=4 15615 B13R1.1511 O=C(CCF)c1ccc(cc1O)F 1458a_100000746061_100011217306 [0,3,0,0,0,0|1,0,0]=4 15616 B13R1.1511 O=C(CCF)c1ccc(cc1O)I 1458a_100000091984_100011217306 [0,3,0,0,0,0|1,0,0]=4 15617 B13R1.1511 O=C(CCF)c1ccc(cc1O)O 1458a_100000212172_100011217306 [0,3,0,0,0,0|1,0,0]=4 15618 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Br 1458a_100000762965_100000211926 [0,3,0,0,0,0|1,0,0]=4 15619 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000211926 [0,3,0,0,0,0|1,0,0]=4 15620 B13R1.1511 O=C(CCO)c1ccc(cc1Br)F 1458a_100000212304_100000211926 [0,3,0,0,0,0|1,0,0]=4 15621 B13R1.1511 O=C(CCO)c1ccc(cc1Br)I 1458a_100012360512_100000211926 [0,3,0,0,0,0|1,0,0]=4 15622 B13R1.1511 O=C(CCO)c1ccc(cc1Br)O 1458a_100012344906_100000211926 [0,3,0,0,0,0|1,0,0]=4 15623 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000211926 [0,3,0,0,0,0|1,0,0]=4 15624 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000211926 [0,3,0,0,0,0|1,0,0]=4 15625 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)F 1458a_100000211397_100000211926 [0,3,0,0,0,0|1,0,0]=4 15626 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)I 1458a_100000751301_100000211926 [0,3,0,0,0,0|1,0,0]=4 15627 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)O 1458a_100000702456_100000211926 [0,3,0,0,0,0|1,0,0]=4 15628 B13R1.1511 O=C(CCO)c1ccc(cc1F)Br 1458a_100000214689_100000211926 [0,3,0,0,0,0|1,0,0]=4 15629 B13R1.1511 O=C(CCO)c1ccc(cc1F)Cl 1458a_100000212326_100000211926 [0,3,0,0,0,0|1,0,0]=4 15630 B13R1.1511 O=C(CCO)c1ccc(cc1F)F 1458a_100000211022_100000211926 [0,3,0,0,0,0|1,0,0]=4 15631 B13R1.1511 O=C(CCO)c1ccc(cc1F)I 1458a_100000037189_100000211926 [0,3,0,0,0,0|1,0,0]=4 15632 B13R1.1511 O=C(CCO)c1ccc(cc1F)O 1458a_100000689029_100000211926 [0,3,0,0,0,0|1,0,0]=4 15633 B13R1.1511 O=C(CCO)c1ccc(cc1I)Br 1458a_100000751167_100000211926 [0,3,0,0,0,0|1,0,0]=4 15634 B13R1.1511 O=C(CCO)c1ccc(cc1I)Cl 1458a_100000739380_100000211926 [0,3,0,0,0,0|1,0,0]=4 15635 B13R1.1511 O=C(CCO)c1ccc(cc1I)F 1458a_100000739341_100000211926 [0,3,0,0,0,0|1,0,0]=4 15636 B13R1.1511 O=C(CCO)c1ccc(cc1O)Br 1458a_100000744433_100000211926 [0,3,0,0,0,0|1,0,0]=4 15637 B13R1.1511 O=C(CCO)c1ccc(cc1O)Cl 1458a_100000188622_100000211926 [0,3,0,0,0,0|1,0,0]=4 15638 B13R1.1511 O=C(CCO)c1ccc(cc1O)F 1458a_100000746061_100000211926 [0,3,0,0,0,0|1,0,0]=4 15639 B13R1.1511 O=C(CCO)c1ccc(cc1O)I 1458a_100000091984_100000211926 [0,3,0,0,0,0|1,0,0]=4 15640 B13R1.1511 O=C(CCO)c1ccc(cc1O)O 1458a_100000212172_100000211926 [0,3,0,0,0,0|1,0,0]=4 15641 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Br)F 62a_100012361341_200025704644 [0,3,0,0,0,0|1,0,0]=4 15642 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200025704644 [0,3,0,0,0,0|1,0,0]=4 15643 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200025704644 [0,3,0,0,0,0|1,0,0]=4 15644 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_200025704644_100012056422 [0,3,0,0,0,0|1,0,0]=4 15645 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Br 62a_200012361339_200025704644 [0,3,0,0,0,0|1,0,0]=4 15646 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200025704644 [0,3,0,0,0,0|1,0,0]=4 15647 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_200025704644_100012351891 [0,3,0,0,0,0|1,0,0]=4 15648 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_100000229962_200025704644 [0,3,0,0,0,0|1,0,0]=4 15649 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_200025704644_100000229962 [0,3,0,0,0,0|1,0,0]=4 15650 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_100009817053_200025704644 [0,3,0,0,0,0|1,0,0]=4 15651 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_200025704644_100009817053 [0,3,0,0,0,0|1,0,0]=4 15652 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_100009814262_200025704644 [0,3,0,0,0,0|1,0,0]=4 15653 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_200025704644_100009814262 [0,3,0,0,0,0|1,0,0]=4 15654 B13R1.12 CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210303 [0,3,0,0,0,0|1,0,0]=4 15655 B13R1.12 CCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210303 [0,3,0,0,0,0|1,0,0]=4 15656 B13R1.12 CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210303 [0,3,0,0,0,0|1,0,0]=4 15657 B13R1.12 CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210303 [0,3,0,0,0,0|1,0,0]=4 15658 B13R1.12 CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210303 [0,3,0,0,0,0|1,0,0]=4 15659 B13R1.12 CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210303 [0,3,0,0,0,0|1,0,0]=4 15660 B13R1.12 CCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210303 [0,3,0,0,0,0|1,0,0]=4 15661 B13R1.12 CCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210303 [0,3,0,0,0,0|1,0,0]=4 15662 B13R1.12 CCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210303 [0,3,0,0,0,0|1,0,0]=4 15663 B13R1.12 CCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210303 [0,3,0,0,0,0|1,0,0]=4 15664 B13R1.12 CCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210303 [0,3,0,0,0,0|1,0,0]=4 15665 B13R1.12 CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210303 [0,3,0,0,0,0|1,0,0]=4 15666 B13R1.12 CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210303 [0,3,0,0,0,0|1,0,0]=4 15667 B13R1.12 CCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210303 [0,3,0,0,0,0|1,0,0]=4 15668 B13R1.12 CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210303 [0,3,0,0,0,0|1,0,0]=4 15669 B13R1.12 CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210303 [0,3,0,0,0,0|1,0,0]=4 15670 B13R1.12 CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210303 [0,3,0,0,0,0|1,0,0]=4 15671 B13R1.12 CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210303 [0,3,0,0,0,0|1,0,0]=4 15672 B13R1.12 CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210303 [0,3,0,0,0,0|1,0,0]=4 15673 B13R1.12 CCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210303 [0,3,0,0,0,0|1,0,0]=4 15674 B13R1.12 CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210303 [0,3,0,0,0,0|1,0,0]=4 15675 B13R1.12 CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210303 [0,3,0,0,0,0|1,0,0]=4 15676 B13R1.12 CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210303 [0,3,0,0,0,0|1,0,0]=4 15677 B13R1.12 CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210303 [0,3,0,0,0,0|1,0,0]=4 15678 B13R1.12 CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210303 [0,3,0,0,0,0|1,0,0]=4 15679 B13R1.12 CCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210303 [0,3,0,0,0,0|1,0,0]=4 15680 B13R1.12 CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210303 [0,3,0,0,0,0|1,0,0]=4 15681 B13R1.12 CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210303 [0,3,0,0,0,0|1,0,0]=4 15682 B13R1.12 CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210303 [0,3,0,0,0,0|1,0,0]=4 15683 B13R1.12 CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210303 [0,3,0,0,0,0|1,0,0]=4 15684 B13R1.12 CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210303 [0,3,0,0,0,0|1,0,0]=4 15685 B13R1.12 CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210303 [0,3,0,0,0,0|1,0,0]=4 15686 B13R1.12 CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210303 [0,3,0,0,0,0|1,0,0]=4 15687 B13R1.12 CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210303 [0,3,0,0,0,0|1,0,0]=4 15688 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 11a_100015525214_100012360534 [0,3,0,0,0,0|0,0,0]=3 15689 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 240690a_100015525214_100012360534 [0,3,0,0,0,0|0,0,0]=3 15690 B13R1.12 CCNC(=O)c1cccc(c1Br)Br 527a_100015525214_100012360534 [0,3,0,0,0,0|0,0,0]=3 15691 B13R1.12 CCNC(=O)c1cccc(c1Br)C 11a_100015525214_100000692419 [0,3,0,0,0,0|0,0,0]=3 15692 B13R1.12 CCNC(=O)c1cccc(c1Br)C 240690a_100015525214_100000692419 [0,3,0,0,0,0|0,0,0]=3 15693 B13R1.12 CCNC(=O)c1cccc(c1Br)C 527a_100015525214_100000692419 [0,3,0,0,0,0|0,0,0]=3 15694 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 11a_100015525214_100012339722 [0,3,0,0,0,0|0,0,0]=3 15695 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 240690a_100015525214_100012339722 [0,3,0,0,0,0|0,0,0]=3 15696 B13R1.12 CCNC(=O)c1cccc(c1Br)Cl 527a_100015525214_100012339722 [0,3,0,0,0,0|0,0,0]=3 15697 B13R1.12 CCNC(=O)c1cccc(c1Br)F 11a_100015525214_100011217547 [0,3,0,0,0,0|0,0,0]=3 15698 B13R1.12 CCNC(=O)c1cccc(c1Br)F 240690a_100015525214_100011217547 [0,3,0,0,0,0|0,0,0]=3 15699 B13R1.12 CCNC(=O)c1cccc(c1Br)F 527a_100015525214_100011217547 [0,3,0,0,0,0|0,0,0]=3 15700 B13R1.12 CCNC(=O)c1cccc(c1Br)I 11a_100015525214_100010232522 [0,3,0,0,0,0|0,0,0]=3 15701 B13R1.12 CCNC(=O)c1cccc(c1Br)I 240690a_100015525214_100010232522 [0,3,0,0,0,0|0,0,0]=3 15702 B13R1.12 CCNC(=O)c1cccc(c1Br)I 527a_100015525214_100010232522 [0,3,0,0,0,0|0,0,0]=3 15703 B13R1.12 CCNC(=O)c1cccc(c1Br)O 240690a_100015525214_100010230362 [0,3,0,0,0,0|0,0,0]=3 15704 B13R1.12 CCNC(=O)c1cccc(c1Br)O 527a_100015525214_100010230362 [0,3,0,0,0,0|0,0,0]=3 15705 B13R1.12 CCNC(=O)c1cccc(c1C)Br 11a_100015525214_100000760464 [0,3,0,0,0,0|0,0,0]=3 15706 B13R1.12 CCNC(=O)c1cccc(c1C)Br 240690a_100015525214_100000760464 [0,3,0,0,0,0|0,0,0]=3 15707 B13R1.12 CCNC(=O)c1cccc(c1C)Br 527a_100015525214_100000760464 [0,3,0,0,0,0|0,0,0]=3 15708 B13R1.12 CCNC(=O)c1cccc(c1C)C 11a_100015525214_100000183679 [0,3,0,0,0,0|0,0,0]=3 15709 B13R1.12 CCNC(=O)c1cccc(c1C)C 240690a_100015525214_100000183679 [0,3,0,0,0,0|0,0,0]=3 15710 B13R1.12 CCNC(=O)c1cccc(c1C)C 527a_100015525214_100000183679 [0,3,0,0,0,0|0,0,0]=3 15711 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 11a_100015525214_100000690184 [0,3,0,0,0,0|0,0,0]=3 15712 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 240690a_100015525214_100000690184 [0,3,0,0,0,0|0,0,0]=3 15713 B13R1.12 CCNC(=O)c1cccc(c1C)Cl 527a_100015525214_100000690184 [0,3,0,0,0,0|0,0,0]=3 15714 B13R1.12 CCNC(=O)c1cccc(c1C)F 11a_100015525214_100011218272 [0,3,0,0,0,0|0,0,0]=3 15715 B13R1.12 CCNC(=O)c1cccc(c1C)F 240690a_100015525214_100011218272 [0,3,0,0,0,0|0,0,0]=3 15716 B13R1.12 CCNC(=O)c1cccc(c1C)F 527a_100015525214_100011218272 [0,3,0,0,0,0|0,0,0]=3 15717 B13R1.12 CCNC(=O)c1cccc(c1C)I 11a_100015525214_100000751865 [0,3,0,0,0,0|0,0,0]=3 15718 B13R1.12 CCNC(=O)c1cccc(c1C)I 240690a_100015525214_100000751865 [0,3,0,0,0,0|0,0,0]=3 15719 B13R1.12 CCNC(=O)c1cccc(c1C)I 527a_100015525214_100000751865 [0,3,0,0,0,0|0,0,0]=3 15720 B13R1.12 CCNC(=O)c1cccc(c1C)O 240690a_100015525214_100000766327 [0,3,0,0,0,0|0,0,0]=3 15721 B13R1.12 CCNC(=O)c1cccc(c1C)O 527a_100015525214_100000766327 [0,3,0,0,0,0|0,0,0]=3 15722 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 11a_100015525214_100000760540 [0,3,0,0,0,0|0,0,0]=3 15723 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 240690a_100015525214_100000760540 [0,3,0,0,0,0|0,0,0]=3 15724 B13R1.12 CCNC(=O)c1cccc(c1Cl)Br 527a_100015525214_100000760540 [0,3,0,0,0,0|0,0,0]=3 15725 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 11a_100015525214_100000693142 [0,3,0,0,0,0|0,0,0]=3 15726 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 240690a_100015525214_100000693142 [0,3,0,0,0,0|0,0,0]=3 15727 B13R1.12 CCNC(=O)c1cccc(c1Cl)C 527a_100015525214_100000693142 [0,3,0,0,0,0|0,0,0]=3 15728 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 11a_100015525214_100000183631 [0,3,0,0,0,0|0,0,0]=3 15729 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 240690a_100015525214_100000183631 [0,3,0,0,0,0|0,0,0]=3 15730 B13R1.12 CCNC(=O)c1cccc(c1Cl)Cl 527a_100015525214_100000183631 [0,3,0,0,0,0|0,0,0]=3 15731 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 11a_100015525214_100000759904 [0,3,0,0,0,0|0,0,0]=3 15732 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 240690a_100015525214_100000759904 [0,3,0,0,0,0|0,0,0]=3 15733 B13R1.12 CCNC(=O)c1cccc(c1Cl)F 527a_100015525214_100000759904 [0,3,0,0,0,0|0,0,0]=3 15734 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 11a_100015525214_100010176783 [0,3,0,0,0,0|0,0,0]=3 15735 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 240690a_100015525214_100010176783 [0,3,0,0,0,0|0,0,0]=3 15736 B13R1.12 CCNC(=O)c1cccc(c1Cl)I 527a_100015525214_100010176783 [0,3,0,0,0,0|0,0,0]=3 15737 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 240690a_100015525214_100000092362 [0,3,0,0,0,0|0,0,0]=3 15738 B13R1.12 CCNC(=O)c1cccc(c1Cl)O 527a_100015525214_100000092362 [0,3,0,0,0,0|0,0,0]=3 15739 B13R1.12 CCNC(=O)c1cccc(c1F)Br 11a_100015525214_100000756403 [0,3,0,0,0,0|0,0,0]=3 15740 B13R1.12 CCNC(=O)c1cccc(c1F)Br 240690a_100015525214_100000756403 [0,3,0,0,0,0|0,0,0]=3 15741 B13R1.12 CCNC(=O)c1cccc(c1F)Br 527a_100015525214_100000756403 [0,3,0,0,0,0|0,0,0]=3 15742 B13R1.12 CCNC(=O)c1cccc(c1F)C 11a_100015525214_100000766181 [0,3,0,0,0,0|0,0,0]=3 15743 B13R1.12 CCNC(=O)c1cccc(c1F)C 240690a_100015525214_100000766181 [0,3,0,0,0,0|0,0,0]=3 15744 B13R1.12 CCNC(=O)c1cccc(c1F)C 527a_100015525214_100000766181 [0,3,0,0,0,0|0,0,0]=3 15745 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 11a_100015525214_100000688816 [0,3,0,0,0,0|0,0,0]=3 15746 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 240690a_100015525214_100000688816 [0,3,0,0,0,0|0,0,0]=3 15747 B13R1.12 CCNC(=O)c1cccc(c1F)Cl 527a_100015525214_100000688816 [0,3,0,0,0,0|0,0,0]=3 15748 B13R1.12 CCNC(=O)c1cccc(c1F)F 11a_100015525214_100000748134 [0,3,0,0,0,0|0,0,0]=3 15749 B13R1.12 CCNC(=O)c1cccc(c1F)F 240690a_100015525214_100000748134 [0,3,0,0,0,0|0,0,0]=3 15750 B13R1.12 CCNC(=O)c1cccc(c1F)F 527a_100015525214_100000748134 [0,3,0,0,0,0|0,0,0]=3 15751 B13R1.12 CCNC(=O)c1cccc(c1F)I 11a_100015525214_100010185205 [0,3,0,0,0,0|0,0,0]=3 15752 B13R1.12 CCNC(=O)c1cccc(c1F)I 240690a_100015525214_100010185205 [0,3,0,0,0,0|0,0,0]=3 15753 B13R1.12 CCNC(=O)c1cccc(c1F)I 527a_100015525214_100010185205 [0,3,0,0,0,0|0,0,0]=3 15754 B13R1.12 CCNC(=O)c1cccc(c1F)O 240690a_100015525214_100000037433 [0,3,0,0,0,0|0,0,0]=3 15755 B13R1.12 CCNC(=O)c1cccc(c1F)O 527a_100015525214_100000037433 [0,3,0,0,0,0|0,0,0]=3 15756 B13R1.12 CCNC(=O)c1cccc(c1I)Br 11a_100015525214_100000688019 [0,3,0,0,0,0|0,0,0]=3 15757 B13R1.12 CCNC(=O)c1cccc(c1I)Br 240690a_100015525214_100000688019 [0,3,0,0,0,0|0,0,0]=3 15758 B13R1.12 CCNC(=O)c1cccc(c1I)Br 527a_100015525214_100000688019 [0,3,0,0,0,0|0,0,0]=3 15759 B13R1.12 CCNC(=O)c1cccc(c1I)C 11a_100015525214_100000739377 [0,3,0,0,0,0|0,0,0]=3 15760 B13R1.12 CCNC(=O)c1cccc(c1I)C 240690a_100015525214_100000739377 [0,3,0,0,0,0|0,0,0]=3 15761 B13R1.12 CCNC(=O)c1cccc(c1I)C 527a_100015525214_100000739377 [0,3,0,0,0,0|0,0,0]=3 15762 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 11a_100015525214_100010176784 [0,3,0,0,0,0|0,0,0]=3 15763 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 240690a_100015525214_100010176784 [0,3,0,0,0,0|0,0,0]=3 15764 B13R1.12 CCNC(=O)c1cccc(c1I)Cl 527a_100015525214_100010176784 [0,3,0,0,0,0|0,0,0]=3 15765 B13R1.12 CCNC(=O)c1cccc(c1I)F 11a_100015525214_100000690930 [0,3,0,0,0,0|0,0,0]=3 15766 B13R1.12 CCNC(=O)c1cccc(c1I)F 240690a_100015525214_100000690930 [0,3,0,0,0,0|0,0,0]=3 15767 B13R1.12 CCNC(=O)c1cccc(c1I)F 527a_100015525214_100000690930 [0,3,0,0,0,0|0,0,0]=3 15768 B13R1.12 CCNC(=O)c1cccc(c1I)O 527a_100015525214_100010084636 [0,3,0,0,0,0|0,0,0]=3 15769 B13R1.12 CCNC(=O)c1cccc(c1O)Br 240690a_100015525214_100000752940 [0,3,0,0,0,0|0,0,0]=3 15770 B13R1.12 CCNC(=O)c1cccc(c1O)Br 527a_100015525214_100000752940 [0,3,0,0,0,0|0,0,0]=3 15771 B13R1.12 CCNC(=O)c1cccc(c1O)C 240690a_100015525214_100000183896 [0,3,0,0,0,0|0,0,0]=3 15772 B13R1.12 CCNC(=O)c1cccc(c1O)C 527a_100015525214_100000183896 [0,3,0,0,0,0|0,0,0]=3 15773 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 240690a_100015525214_100000742801 [0,3,0,0,0,0|0,0,0]=3 15774 B13R1.12 CCNC(=O)c1cccc(c1O)Cl 527a_100015525214_100000742801 [0,3,0,0,0,0|0,0,0]=3 15775 B13R1.12 CCNC(=O)c1cccc(c1O)F 240690a_100015525214_100011217230 [0,3,0,0,0,0|0,0,0]=3 15776 B13R1.12 CCNC(=O)c1cccc(c1O)F 527a_100015525214_100011217230 [0,3,0,0,0,0|0,0,0]=3 15777 B13R1.12 CCNC(=O)c1cccc(c1O)O 527a_100015525214_100000690420 [0,3,0,0,0,0|0,0,0]=3 15778 B13R1.12 CCOC(=O)c1cccc(c1C)O 271570a_203496583355_100012298221 [0,3,0,0,0,0|1,0,0]=4 15779 B13R1.12 CCOC(=O)c1cccc(c1F)O 271570a_203496583355_100012350793 [0,3,0,0,0,0|1,0,0]=4 15780 B13R1.12 CCOC(=O)c1cccc(c1N)O 271570a_203496583355_200011356557 [0,3,0,0,0,0|1,0,0]=4 15781 B13R1.12 CCOC(=O)c1cccc(c1O)C 271570a_203496583355_200012184857 [0,3,0,0,0,0|1,0,0]=4 15782 B13R1.12 CCOC(=O)c1cccc(c1O)F 271570a_203496583355_100012357632 [0,3,0,0,0,0|1,0,0]=4 15783 B13R1.12 CNCC(=O)c1cccc(c1C)I 34a_100102657272_100160470822 [0,3,0,0,0,0|0,0,0]=3 15784 B13R1.12 CNCC(=O)c1cccc(c1C)I 7a_106832991635_100160470822 [0,3,0,0,0,0|0,0,0]=3 15785 B13R1.12 CNCC(=O)c1cccc(c1F)Br 2230a_106832991635_100012356374 [0,3,0,0,0,0|0,0,0]=3 15786 B13R1.12 CNCC(=O)c1cccc(c1F)Br 34a_100102657272_100012356374 [0,3,0,0,0,0|0,0,0]=3 15787 B13R1.12 CNCC(=O)c1cccc(c1F)Br 7a_106832991635_100012356374 [0,3,0,0,0,0|0,0,0]=3 15788 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 2230a_106832991635_200012351890 [0,3,0,0,0,0|0,0,0]=3 15789 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 34a_100102657272_200012351890 [0,3,0,0,0,0|0,0,0]=3 15790 B13R1.12 CNCC(=O)c1cccc(c1F)Cl 7a_106832991635_200012351890 [0,3,0,0,0,0|0,0,0]=3 15791 B13R1.12 CNNC(=O)c1cccc(c1Br)Br 22a_100016993582_100012360534 [0,3,0,0,0,0|0,0,0]=3 15792 B13R1.12 CNNC(=O)c1cccc(c1Br)C 22a_100016993582_100000692419 [0,3,0,0,0,0|0,0,0]=3 15793 B13R1.12 CNNC(=O)c1cccc(c1Br)Cl 22a_100016993582_100012339722 [0,3,0,0,0,0|0,0,0]=3 15794 B13R1.12 CNNC(=O)c1cccc(c1Br)F 22a_100016993582_100011217547 [0,3,0,0,0,0|0,0,0]=3 15795 B13R1.12 CNNC(=O)c1cccc(c1Br)I 22a_100016993582_100010232522 [0,3,0,0,0,0|0,0,0]=3 15796 B13R1.12 CNNC(=O)c1cccc(c1Br)O 22a_100016993582_100010230362 [0,3,0,0,0,0|0,0,0]=3 15797 B13R1.12 CNNC(=O)c1cccc(c1C)Br 22a_100016993582_100000760464 [0,3,0,0,0,0|0,0,0]=3 15798 B13R1.12 CNNC(=O)c1cccc(c1C)C 22a_100016993582_100000183679 [0,3,0,0,0,0|0,0,0]=3 15799 B13R1.12 CNNC(=O)c1cccc(c1C)Cl 22a_100016993582_100000690184 [0,3,0,0,0,0|0,0,0]=3 15800 B13R1.12 CNNC(=O)c1cccc(c1C)F 22a_100016993582_100011218272 [0,3,0,0,0,0|0,0,0]=3 15801 B13R1.12 CNNC(=O)c1cccc(c1C)I 22a_100016993582_100000751865 [0,3,0,0,0,0|0,0,0]=3 15802 B13R1.12 CNNC(=O)c1cccc(c1C)O 22a_100016993582_100000766327 [0,3,0,0,0,0|0,0,0]=3 15803 B13R1.12 CNNC(=O)c1cccc(c1Cl)Br 22a_100016993582_100000760540 [0,3,0,0,0,0|0,0,0]=3 15804 B13R1.12 CNNC(=O)c1cccc(c1Cl)C 22a_100016993582_100000693142 [0,3,0,0,0,0|0,0,0]=3 15805 B13R1.12 CNNC(=O)c1cccc(c1Cl)Cl 22a_100016993582_100000183631 [0,3,0,0,0,0|0,0,0]=3 15806 B13R1.12 CNNC(=O)c1cccc(c1Cl)F 22a_100016993582_100000759904 [0,3,0,0,0,0|0,0,0]=3 15807 B13R1.12 CNNC(=O)c1cccc(c1Cl)I 22a_100016993582_100010176783 [0,3,0,0,0,0|0,0,0]=3 15808 B13R1.12 CNNC(=O)c1cccc(c1Cl)O 22a_100016993582_100000092362 [0,3,0,0,0,0|0,0,0]=3 15809 B13R1.12 CNNC(=O)c1cccc(c1F)Br 22a_100016993582_100000756403 [0,3,0,0,0,0|0,0,0]=3 15810 B13R1.12 CNNC(=O)c1cccc(c1F)C 22a_100016993582_100000766181 [0,3,0,0,0,0|0,0,0]=3 15811 B13R1.12 CNNC(=O)c1cccc(c1F)Cl 22a_100016993582_100000688816 [0,3,0,0,0,0|0,0,0]=3 15812 B13R1.12 CNNC(=O)c1cccc(c1F)F 22a_100016993582_100000748134 [0,3,0,0,0,0|0,0,0]=3 15813 B13R1.12 CNNC(=O)c1cccc(c1F)I 22a_100016993582_100010185205 [0,3,0,0,0,0|0,0,0]=3 15814 B13R1.12 CNNC(=O)c1cccc(c1F)O 22a_100016993582_100000037433 [0,3,0,0,0,0|0,0,0]=3 15815 B13R1.12 CNNC(=O)c1cccc(c1I)Br 22a_100016993582_100000688019 [0,3,0,0,0,0|0,0,0]=3 15816 B13R1.12 CNNC(=O)c1cccc(c1I)C 22a_100016993582_100000739377 [0,3,0,0,0,0|0,0,0]=3 15817 B13R1.12 CNNC(=O)c1cccc(c1I)Cl 22a_100016993582_100010176784 [0,3,0,0,0,0|0,0,0]=3 15818 B13R1.12 CNNC(=O)c1cccc(c1I)F 22a_100016993582_100000690930 [0,3,0,0,0,0|0,0,0]=3 15819 B13R1.12 CNNC(=O)c1cccc(c1I)O 22a_100016993582_100010084636 [0,3,0,0,0,0|0,0,0]=3 15820 B13R1.12 CNNC(=O)c1cccc(c1O)Br 22a_100016993582_100000752940 [0,3,0,0,0,0|0,0,0]=3 15821 B13R1.12 CNNC(=O)c1cccc(c1O)C 22a_100016993582_100000183896 [0,3,0,0,0,0|0,0,0]=3 15822 B13R1.12 CNNC(=O)c1cccc(c1O)Cl 22a_100016993582_100000742801 [0,3,0,0,0,0|0,0,0]=3 15823 B13R1.12 CNNC(=O)c1cccc(c1O)F 22a_100016993582_100011217230 [0,3,0,0,0,0|0,0,0]=3 15824 B13R1.12 CNNC(=O)c1cccc(c1O)O 22a_100016993582_100000690420 [0,3,0,0,0,0|0,0,0]=3 15825 B13R1.12 COCC(=O)c1cccc(c1C)I 34a_100138415774_100160470822 [0,3,0,0,0,0|1,0,0]=4 15826 B13R1.12 COCC(=O)c1cccc(c1F)Br 34a_100138415774_100012356374 [0,3,0,0,0,0|1,0,0]=4 15827 B13R1.12 COCC(=O)c1cccc(c1F)Cl 34a_100138415774_200012351890 [0,3,0,0,0,0|1,0,0]=4 15828 B13R1.12 CSCC(=O)c1cccc(c1C)I 62a_100160470822_200000210301 [0,3,0,0,0,0|1,0,0]=4 15829 B13R1.12 CSCC(=O)c1cccc(c1C)I 62a_200000210301_100160470822 [0,3,0,0,0,0|1,0,0]=4 15830 B13R1.12 CSCC(=O)c1cccc(c1F)Br 62a_100012356374_200000210301 [0,3,0,0,0,0|1,0,0]=4 15831 B13R1.12 CSCC(=O)c1cccc(c1F)Br 62a_200000210301_100012356374 [0,3,0,0,0,0|1,0,0]=4 15832 B13R1.12 CSCC(=O)c1cccc(c1F)Cl 62a_200000210301_200012351890 [0,3,0,0,0,0|1,0,0]=4 15833 B13R1.12 CSCC(=O)c1cccc(c1F)Cl 62a_200012351890_200000210301 [0,3,0,0,0,0|1,0,0]=4 15834 B13R1.12 Cc1c(cccc1C(=O)CCF)Br 1458a_100000760464_100011217306 [0,3,0,0,0,0|1,0,0]=4 15835 B13R1.12 Cc1c(cccc1C(=O)CCF)Cl 1458a_100000690184_100011217306 [0,3,0,0,0,0|1,0,0]=4 15836 B13R1.12 Cc1c(cccc1C(=O)CCF)F 1458a_100011218272_100011217306 [0,3,0,0,0,0|1,0,0]=4 15837 B13R1.12 Cc1c(cccc1C(=O)CCF)I 1458a_100000751865_100011217306 [0,3,0,0,0,0|1,0,0]=4 15838 B13R1.12 Cc1c(cccc1C(=O)CCF)O 1458a_100000766327_100011217306 [0,3,0,0,0,0|1,0,0]=4 15839 B13R1.12 Cc1c(cccc1C(=O)CCO)Br 1458a_100000760464_100000211926 [0,3,0,0,0,0|1,0,0]=4 15840 B13R1.12 Cc1c(cccc1C(=O)CCO)Cl 1458a_100000690184_100000211926 [0,3,0,0,0,0|1,0,0]=4 15841 B13R1.12 Cc1c(cccc1C(=O)CCO)F 1458a_100011218272_100000211926 [0,3,0,0,0,0|1,0,0]=4 15842 B13R1.12 Cc1c(cccc1C(=O)CCO)I 1458a_100000751865_100000211926 [0,3,0,0,0,0|1,0,0]=4 15843 B13R1.12 Cc1c(cccc1C(=O)CCO)O 1458a_100000766327_100000211926 [0,3,0,0,0,0|1,0,0]=4 15844 B13R1.12 Cc1c(cccc1C(=O)CS[13CH3])I 62a_100160470822_200025704644 [0,3,0,0,0,0|1,0,0]=4 15845 B13R1.12 Cc1c(cccc1C(=O)CS[13CH3])I 62a_200025704644_100160470822 [0,3,0,0,0,0|1,0,0]=4 15846 B13R1.12 Cc1cccc(c1Br)C(=O)CCF 1458a_100000692419_100011217306 [0,3,0,0,0,0|1,0,0]=4 15847 B13R1.12 Cc1cccc(c1Br)C(=O)CCO 1458a_100000692419_100000211926 [0,3,0,0,0,0|1,0,0]=4 15848 B13R1.12 Cc1cccc(c1C)C(=O)CCF 1458a_100000183679_100011217306 [0,3,0,0,0,0|1,0,0]=4 15849 B13R1.12 Cc1cccc(c1C)C(=O)CCO 1458a_100000183679_100000211926 [0,3,0,0,0,0|1,0,0]=4 15850 B13R1.12 Cc1cccc(c1Cl)C(=O)CCF 1458a_100000693142_100011217306 [0,3,0,0,0,0|1,0,0]=4 15851 B13R1.12 Cc1cccc(c1Cl)C(=O)CCO 1458a_100000693142_100000211926 [0,3,0,0,0,0|1,0,0]=4 15852 B13R1.12 Cc1cccc(c1F)C(=O)CCF 1458a_100000766181_100011217306 [0,3,0,0,0,0|1,0,0]=4 15853 B13R1.12 Cc1cccc(c1F)C(=O)CCO 1458a_100000766181_100000211926 [0,3,0,0,0,0|1,0,0]=4 15854 B13R1.12 Cc1cccc(c1I)C(=O)CCF 1458a_100000739377_100011217306 [0,3,0,0,0,0|1,0,0]=4 15855 B13R1.12 Cc1cccc(c1I)C(=O)CCO 1458a_100000739377_100000211926 [0,3,0,0,0,0|1,0,0]=4 15856 B13R1.12 Cc1cccc(c1O)C(=O)CCF 1458a_100000183896_100011217306 [0,3,0,0,0,0|1,0,0]=4 15857 B13R1.12 Cc1cccc(c1O)C(=O)CCO 1458a_100000183896_100000211926 [0,3,0,0,0,0|1,0,0]=4 15858 B13R1.12 O=C(CCF)c1cccc(c1Br)Br 1458a_100012360534_100011217306 [0,3,0,0,0,0|1,0,0]=4 15859 B13R1.12 O=C(CCF)c1cccc(c1Br)Cl 1458a_100012339722_100011217306 [0,3,0,0,0,0|1,0,0]=4 15860 B13R1.12 O=C(CCF)c1cccc(c1Br)F 1458a_100011217547_100011217306 [0,3,0,0,0,0|1,0,0]=4 15861 B13R1.12 O=C(CCF)c1cccc(c1Br)I 1458a_100010232522_100011217306 [0,3,0,0,0,0|1,0,0]=4 15862 B13R1.12 O=C(CCF)c1cccc(c1Br)O 1458a_100010230362_100011217306 [0,3,0,0,0,0|1,0,0]=4 15863 B13R1.12 O=C(CCF)c1cccc(c1Cl)Br 1458a_100000760540_100011217306 [0,3,0,0,0,0|1,0,0]=4 15864 B13R1.12 O=C(CCF)c1cccc(c1Cl)Cl 1458a_100000183631_100011217306 [0,3,0,0,0,0|1,0,0]=4 15865 B13R1.12 O=C(CCF)c1cccc(c1Cl)F 1458a_100000759904_100011217306 [0,3,0,0,0,0|1,0,0]=4 15866 B13R1.12 O=C(CCF)c1cccc(c1Cl)I 1458a_100010176783_100011217306 [0,3,0,0,0,0|1,0,0]=4 15867 B13R1.12 O=C(CCF)c1cccc(c1Cl)O 1458a_100000092362_100011217306 [0,3,0,0,0,0|1,0,0]=4 15868 B13R1.12 O=C(CCF)c1cccc(c1F)Br 1458a_100000756403_100011217306 [0,3,0,0,0,0|1,0,0]=4 15869 B13R1.12 O=C(CCF)c1cccc(c1F)Cl 1458a_100000688816_100011217306 [0,3,0,0,0,0|1,0,0]=4 15870 B13R1.12 O=C(CCF)c1cccc(c1F)F 1458a_100000748134_100011217306 [0,3,0,0,0,0|1,0,0]=4 15871 B13R1.12 O=C(CCF)c1cccc(c1F)I 1458a_100010185205_100011217306 [0,3,0,0,0,0|1,0,0]=4 15872 B13R1.12 O=C(CCF)c1cccc(c1F)O 1458a_100000037433_100011217306 [0,3,0,0,0,0|1,0,0]=4 15873 B13R1.12 O=C(CCF)c1cccc(c1I)Br 1458a_100000688019_100011217306 [0,3,0,0,0,0|1,0,0]=4 15874 B13R1.12 O=C(CCF)c1cccc(c1I)Cl 1458a_100010176784_100011217306 [0,3,0,0,0,0|1,0,0]=4 15875 B13R1.12 O=C(CCF)c1cccc(c1I)F 1458a_100000690930_100011217306 [0,3,0,0,0,0|1,0,0]=4 15876 B13R1.12 O=C(CCF)c1cccc(c1I)O 1458a_100010084636_100011217306 [0,3,0,0,0,0|1,0,0]=4 15877 B13R1.12 O=C(CCF)c1cccc(c1O)Br 1458a_100000752940_100011217306 [0,3,0,0,0,0|1,0,0]=4 15878 B13R1.12 O=C(CCF)c1cccc(c1O)Cl 1458a_100000742801_100011217306 [0,3,0,0,0,0|1,0,0]=4 15879 B13R1.12 O=C(CCF)c1cccc(c1O)F 1458a_100011217230_100011217306 [0,3,0,0,0,0|1,0,0]=4 15880 B13R1.12 O=C(CCF)c1cccc(c1O)O 1458a_100000690420_100011217306 [0,3,0,0,0,0|1,0,0]=4 15881 B13R1.12 O=C(CCO)c1cccc(c1Br)Br 1458a_100012360534_100000211926 [0,3,0,0,0,0|1,0,0]=4 15882 B13R1.12 O=C(CCO)c1cccc(c1Br)Cl 1458a_100012339722_100000211926 [0,3,0,0,0,0|1,0,0]=4 15883 B13R1.12 O=C(CCO)c1cccc(c1Br)F 1458a_100011217547_100000211926 [0,3,0,0,0,0|1,0,0]=4 15884 B13R1.12 O=C(CCO)c1cccc(c1Br)I 1458a_100010232522_100000211926 [0,3,0,0,0,0|1,0,0]=4 15885 B13R1.12 O=C(CCO)c1cccc(c1Br)O 1458a_100010230362_100000211926 [0,3,0,0,0,0|1,0,0]=4 15886 B13R1.12 O=C(CCO)c1cccc(c1Cl)Br 1458a_100000760540_100000211926 [0,3,0,0,0,0|1,0,0]=4 15887 B13R1.12 O=C(CCO)c1cccc(c1Cl)Cl 1458a_100000183631_100000211926 [0,3,0,0,0,0|1,0,0]=4 15888 B13R1.12 O=C(CCO)c1cccc(c1Cl)F 1458a_100000759904_100000211926 [0,3,0,0,0,0|1,0,0]=4 15889 B13R1.12 O=C(CCO)c1cccc(c1Cl)I 1458a_100010176783_100000211926 [0,3,0,0,0,0|1,0,0]=4 15890 B13R1.12 O=C(CCO)c1cccc(c1Cl)O 1458a_100000092362_100000211926 [0,3,0,0,0,0|1,0,0]=4 15891 B13R1.12 O=C(CCO)c1cccc(c1F)Br 1458a_100000756403_100000211926 [0,3,0,0,0,0|1,0,0]=4 15892 B13R1.12 O=C(CCO)c1cccc(c1F)Cl 1458a_100000688816_100000211926 [0,3,0,0,0,0|1,0,0]=4 15893 B13R1.12 O=C(CCO)c1cccc(c1F)F 1458a_100000748134_100000211926 [0,3,0,0,0,0|1,0,0]=4 15894 B13R1.12 O=C(CCO)c1cccc(c1F)I 1458a_100010185205_100000211926 [0,3,0,0,0,0|1,0,0]=4 15895 B13R1.12 O=C(CCO)c1cccc(c1F)O 1458a_100000037433_100000211926 [0,3,0,0,0,0|1,0,0]=4 15896 B13R1.12 O=C(CCO)c1cccc(c1I)Br 1458a_100000688019_100000211926 [0,3,0,0,0,0|1,0,0]=4 15897 B13R1.12 O=C(CCO)c1cccc(c1I)Cl 1458a_100010176784_100000211926 [0,3,0,0,0,0|1,0,0]=4 15898 B13R1.12 O=C(CCO)c1cccc(c1I)F 1458a_100000690930_100000211926 [0,3,0,0,0,0|1,0,0]=4 15899 B13R1.12 O=C(CCO)c1cccc(c1I)O 1458a_100010084636_100000211926 [0,3,0,0,0,0|1,0,0]=4 15900 B13R1.12 O=C(CCO)c1cccc(c1O)Br 1458a_100000752940_100000211926 [0,3,0,0,0,0|1,0,0]=4 15901 B13R1.12 O=C(CCO)c1cccc(c1O)Cl 1458a_100000742801_100000211926 [0,3,0,0,0,0|1,0,0]=4 15902 B13R1.12 O=C(CCO)c1cccc(c1O)F 1458a_100011217230_100000211926 [0,3,0,0,0,0|1,0,0]=4 15903 B13R1.12 O=C(CCO)c1cccc(c1O)O 1458a_100000690420_100000211926 [0,3,0,0,0,0|1,0,0]=4 15904 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Br 62a_100012356374_200025704644 [0,3,0,0,0,0|1,0,0]=4 15905 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Br 62a_200025704644_100012356374 [0,3,0,0,0,0|1,0,0]=4 15906 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Cl 62a_200012351890_200025704644 [0,3,0,0,0,0|1,0,0]=4 15907 B13R1.12 [13CH3]SCC(=O)c1cccc(c1F)Cl 62a_200025704644_200012351890 [0,3,0,0,0,0|1,0,0]=4 15908 B13R1.18 C#CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000753159 [0,3,0,0,0,0|1,0,0]=4 15909 B13R1.18 C#CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000753159 [0,3,0,0,0,0|1,0,0]=4 15910 B13R1.18 C#CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000753159 [0,3,0,0,0,0|1,0,0]=4 15911 B13R1.18 C#CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000753159 [0,3,0,0,0,0|1,0,0]=4 15912 B13R1.18 C#CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000753159 [0,3,0,0,0,0|1,0,0]=4 15913 B13R1.18 C#CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000753159 [0,3,0,0,0,0|1,0,0]=4 15914 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 11a_100000212058_100000210664 [0,3,0,0,0,0|0,0,0]=3 15915 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 1626a_100000212058_100000210664 [0,3,0,0,0,0|0,0,0]=3 15916 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 240690a_100000212058_100000210664 [0,3,0,0,0,0|0,0,0]=3 15917 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 527a_100000212058_100000210664 [0,3,0,0,0,0|0,0,0]=3 15918 B13R1.18 C#CCNC(=O)c1cccc(c1)C 11a_100000212058_100000189346 [0,3,0,0,0,0|0,0,0]=3 15919 B13R1.18 C#CCNC(=O)c1cccc(c1)C 1626a_100000212058_100000189346 [0,3,0,0,0,0|0,0,0]=3 15920 B13R1.18 C#CCNC(=O)c1cccc(c1)C 240690a_100000212058_100000189346 [0,3,0,0,0,0|0,0,0]=3 15921 B13R1.18 C#CCNC(=O)c1cccc(c1)C 527a_100000212058_100000189346 [0,3,0,0,0,0|0,0,0]=3 15922 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 11a_100000212058_100000210390 [0,3,0,0,0,0|0,0,0]=3 15923 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 1626a_100000212058_100000210390 [0,3,0,0,0,0|0,0,0]=3 15924 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 240690a_100000212058_100000210390 [0,3,0,0,0,0|0,0,0]=3 15925 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 527a_100000212058_100000210390 [0,3,0,0,0,0|0,0,0]=3 15926 B13R1.18 C#CCNC(=O)c1cccc(c1)F 11a_100000212058_100000210950 [0,3,0,0,0,0|0,0,0]=3 15927 B13R1.18 C#CCNC(=O)c1cccc(c1)F 1626a_100000212058_100000210950 [0,3,0,0,0,0|0,0,0]=3 15928 B13R1.18 C#CCNC(=O)c1cccc(c1)F 240690a_100000212058_100000210950 [0,3,0,0,0,0|0,0,0]=3 15929 B13R1.18 C#CCNC(=O)c1cccc(c1)F 527a_100000212058_100000210950 [0,3,0,0,0,0|0,0,0]=3 15930 B13R1.18 C#CCNC(=O)c1cccc(c1)I 11a_100000212058_100000184098 [0,3,0,0,0,0|0,0,0]=3 15931 B13R1.18 C#CCNC(=O)c1cccc(c1)I 1626a_100000212058_100000184098 [0,3,0,0,0,0|0,0,0]=3 15932 B13R1.18 C#CCNC(=O)c1cccc(c1)I 240690a_100000212058_100000184098 [0,3,0,0,0,0|0,0,0]=3 15933 B13R1.18 C#CCNC(=O)c1cccc(c1)I 527a_100000212058_100000184098 [0,3,0,0,0,0|0,0,0]=3 15934 B13R1.18 C#CCNC(=O)c1cccc(c1)O 240690a_100000212058_100000183914 [0,3,0,0,0,0|0,0,0]=3 15935 B13R1.18 C#CCNC(=O)c1cccc(c1)O 527a_100000212058_100000183914 [0,3,0,0,0,0|0,0,0]=3 15936 B13R1.18 C/C=C/CC(=O)c1cccc(c1)Br 1458a_100000210664_100102629194 [0,3,0,0,0,0|1,0,0]=4 15937 B13R1.18 C/C=C/CC(=O)c1cccc(c1)C 1458a_100000189346_100102629194 [0,3,0,0,0,0|1,0,0]=4 15938 B13R1.18 C/C=C/CC(=O)c1cccc(c1)Cl 1458a_100000210390_100102629194 [0,3,0,0,0,0|1,0,0]=4 15939 B13R1.18 C/C=C/CC(=O)c1cccc(c1)F 1458a_100000210950_100102629194 [0,3,0,0,0,0|1,0,0]=4 15940 B13R1.18 C/C=C/CC(=O)c1cccc(c1)I 1458a_100000184098_100102629194 [0,3,0,0,0,0|1,0,0]=4 15941 B13R1.18 C/C=C/CC(=O)c1cccc(c1)O 1458a_100000183914_100102629194 [0,3,0,0,0,0|1,0,0]=4 15942 B13R1.18 C=CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000754431 [0,3,0,0,0,0|1,0,0]=4 15943 B13R1.18 C=CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000754431 [0,3,0,0,0,0|1,0,0]=4 15944 B13R1.18 C=CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000754431 [0,3,0,0,0,0|1,0,0]=4 15945 B13R1.18 C=CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000754431 [0,3,0,0,0,0|1,0,0]=4 15946 B13R1.18 C=CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000754431 [0,3,0,0,0,0|1,0,0]=4 15947 B13R1.18 C=CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000754431 [0,3,0,0,0,0|1,0,0]=4 15948 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 1626a_100020586998_100000210664 [0,3,0,0,0,0|0,0,0]=3 15949 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 240690a_100020586998_100000210664 [0,3,0,0,0,0|0,0,0]=3 15950 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 527a_100020586998_100000210664 [0,3,0,0,0,0|0,0,0]=3 15951 B13R1.18 C=CCNC(=O)c1cccc(c1)C 1626a_100020586998_100000189346 [0,3,0,0,0,0|0,0,0]=3 15952 B13R1.18 C=CCNC(=O)c1cccc(c1)C 240690a_100020586998_100000189346 [0,3,0,0,0,0|0,0,0]=3 15953 B13R1.18 C=CCNC(=O)c1cccc(c1)C 527a_100020586998_100000189346 [0,3,0,0,0,0|0,0,0]=3 15954 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 1626a_100020586998_100000210390 [0,3,0,0,0,0|0,0,0]=3 15955 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 240690a_100020586998_100000210390 [0,3,0,0,0,0|0,0,0]=3 15956 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 527a_100020586998_100000210390 [0,3,0,0,0,0|0,0,0]=3 15957 B13R1.18 C=CCNC(=O)c1cccc(c1)F 1626a_100020586998_100000210950 [0,3,0,0,0,0|0,0,0]=3 15958 B13R1.18 C=CCNC(=O)c1cccc(c1)F 240690a_100020586998_100000210950 [0,3,0,0,0,0|0,0,0]=3 15959 B13R1.18 C=CCNC(=O)c1cccc(c1)F 527a_100020586998_100000210950 [0,3,0,0,0,0|0,0,0]=3 15960 B13R1.18 C=CCNC(=O)c1cccc(c1)I 1626a_100020586998_100000184098 [0,3,0,0,0,0|0,0,0]=3 15961 B13R1.18 C=CCNC(=O)c1cccc(c1)I 240690a_100020586998_100000184098 [0,3,0,0,0,0|0,0,0]=3 15962 B13R1.18 C=CCNC(=O)c1cccc(c1)I 527a_100020586998_100000184098 [0,3,0,0,0,0|0,0,0]=3 15963 B13R1.18 C=CCNC(=O)c1cccc(c1)O 240690a_100020586998_100000183914 [0,3,0,0,0,0|0,0,0]=3 15964 B13R1.18 C=CCNC(=O)c1cccc(c1)O 527a_100020586998_100000183914 [0,3,0,0,0,0|0,0,0]=3 15965 B13R1.18 CC#CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000748600 [0,3,0,0,0,0|1,0,0]=4 15966 B13R1.18 CC#CCC(=O)c1cccc(c1)C 1458a_100000189346_100000748600 [0,3,0,0,0,0|1,0,0]=4 15967 B13R1.18 CC#CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000748600 [0,3,0,0,0,0|1,0,0]=4 15968 B13R1.18 CC#CCC(=O)c1cccc(c1)F 1458a_100000210950_100000748600 [0,3,0,0,0,0|1,0,0]=4 15969 B13R1.18 CC#CCC(=O)c1cccc(c1)I 1458a_100000184098_100000748600 [0,3,0,0,0,0|1,0,0]=4 15970 B13R1.18 CC#CCC(=O)c1cccc(c1)O 1458a_100000183914_100000748600 [0,3,0,0,0,0|1,0,0]=4 15971 B13R1.18 CC=CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000070051 [0,3,0,0,0,0|1,0,0]=4 15972 B13R1.18 CC=CCC(=O)c1cccc(c1)C 1458a_100000189346_100000070051 [0,3,0,0,0,0|1,0,0]=4 15973 B13R1.18 CC=CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000070051 [0,3,0,0,0,0|1,0,0]=4 15974 B13R1.18 CC=CCC(=O)c1cccc(c1)F 1458a_100000210950_100000070051 [0,3,0,0,0,0|1,0,0]=4 15975 B13R1.18 CC=CCC(=O)c1cccc(c1)I 1458a_100000184098_100000070051 [0,3,0,0,0,0|1,0,0]=4 15976 B13R1.18 CC=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000070051 [0,3,0,0,0,0|1,0,0]=4 15977 B13R1.18 CC=NNC(=O)c1cc(ccn1)Br 4a_100010175343_200000210099 [0,3,0,0,0,0|1,0,0]=4 15978 B13R1.18 CC=NNC(=O)c1cc(ccn1)Cl 4a_100000017052_200000210099 [0,3,0,0,0,0|1,0,0]=4 15979 B13R1.18 CC=NNC(=O)c1cccc(=O)[nH]1 4a_200013023864_200000210099 [0,3,0,0,0,0|1,0,0]=4 15980 B13R1.18 CC=NNC(=O)c1cccc(c1)Br 4a_100000189783_200000210099 [0,3,0,0,0,0|0,0,0]=3 15981 B13R1.18 CC=NNC(=O)c1cccc(c1)C 4a_100000189845_200000210099 [0,3,0,0,0,0|0,0,0]=3 15982 B13R1.18 CC=NNC(=O)c1cccc(c1)Cl 4a_100000183659_200000210099 [0,3,0,0,0,0|0,0,0]=3 15983 B13R1.18 CC=NNC(=O)c1cccc(c1)F 4a_100000189798_200000210099 [0,3,0,0,0,0|0,0,0]=3 15984 B13R1.18 CC=NNC(=O)c1cccc(c1)I 4a_100000186306_200000210099 [0,3,0,0,0,0|0,0,0]=3 15985 B13R1.18 CC=NNC(=O)c1cccc(n1)C 4a_100000724394_200000210099 [0,3,0,0,0,0|1,0,0]=4 15986 B13R1.18 CC=NNC(=O)c1cccc(n1)Cl 4a_100011631096_200000210099 [0,3,0,0,0,0|1,0,0]=4 15987 B13R1.18 CC=NNC(=O)c1cccc(n1)F 4a_100025773536_200000210099 [0,3,0,0,0,0|1,0,0]=4 15988 B13R1.18 CC=NNC(=O)c1ccnc(c1)Br 4a_100010138526_200000210099 [0,3,0,0,0,0|1,0,0]=4 15989 B13R1.18 CC=NNC(=O)c1ccnc(c1)Cl 4a_100000021280_200000210099 [0,3,0,0,0,0|1,0,0]=4 15990 B13R1.18 CC=NNC(=O)c1cncc(c1)Br 4a_100000189809_200000210099 [0,3,0,0,0,0|1,0,0]=4 15991 B13R1.18 CCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210211 [0,3,0,0,0,0|1,0,0]=4 15992 B13R1.18 CCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210211 [0,3,0,0,0,0|1,0,0]=4 15993 B13R1.18 CCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210211 [0,3,0,0,0,0|1,0,0]=4 15994 B13R1.18 CCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210211 [0,3,0,0,0,0|1,0,0]=4 15995 B13R1.18 CCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210211 [0,3,0,0,0,0|1,0,0]=4 15996 B13R1.18 CCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210211 [0,3,0,0,0,0|1,0,0]=4 15997 B13R1.18 CCCNC(=O)c1cccc(c1)Br 11a_100020643023_100000210664 [0,3,0,0,0,0|0,0,0]=3 15998 B13R1.18 CCCNC(=O)c1cccc(c1)Br 1626a_100020643023_100000210664 [0,3,0,0,0,0|0,0,0]=3 15999 B13R1.18 CCCNC(=O)c1cccc(c1)Br 240690a_100020643023_100000210664 [0,3,0,0,0,0|0,0,0]=3 16000 B13R1.18 CCCNC(=O)c1cccc(c1)Br 527a_100020643023_100000210664 [0,3,0,0,0,0|0,0,0]=3 16001 B13R1.18 CCCNC(=O)c1cccc(c1)C 11a_100020643023_100000189346 [0,3,0,0,0,0|0,0,0]=3 16002 B13R1.18 CCCNC(=O)c1cccc(c1)C 1626a_100020643023_100000189346 [0,3,0,0,0,0|0,0,0]=3 16003 B13R1.18 CCCNC(=O)c1cccc(c1)C 240690a_100020643023_100000189346 [0,3,0,0,0,0|0,0,0]=3 16004 B13R1.18 CCCNC(=O)c1cccc(c1)C 527a_100020643023_100000189346 [0,3,0,0,0,0|0,0,0]=3 16005 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 11a_100020643023_100000210390 [0,3,0,0,0,0|0,0,0]=3 16006 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 1626a_100020643023_100000210390 [0,3,0,0,0,0|0,0,0]=3 16007 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 240690a_100020643023_100000210390 [0,3,0,0,0,0|0,0,0]=3 16008 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 527a_100020643023_100000210390 [0,3,0,0,0,0|0,0,0]=3 16009 B13R1.18 CCCNC(=O)c1cccc(c1)F 11a_100020643023_100000210950 [0,3,0,0,0,0|0,0,0]=3 16010 B13R1.18 CCCNC(=O)c1cccc(c1)F 1626a_100020643023_100000210950 [0,3,0,0,0,0|0,0,0]=3 16011 B13R1.18 CCCNC(=O)c1cccc(c1)F 240690a_100020643023_100000210950 [0,3,0,0,0,0|0,0,0]=3 16012 B13R1.18 CCCNC(=O)c1cccc(c1)F 527a_100020643023_100000210950 [0,3,0,0,0,0|0,0,0]=3 16013 B13R1.18 CCCNC(=O)c1cccc(c1)I 11a_100020643023_100000184098 [0,3,0,0,0,0|0,0,0]=3 16014 B13R1.18 CCCNC(=O)c1cccc(c1)I 1626a_100020643023_100000184098 [0,3,0,0,0,0|0,0,0]=3 16015 B13R1.18 CCCNC(=O)c1cccc(c1)I 240690a_100020643023_100000184098 [0,3,0,0,0,0|0,0,0]=3 16016 B13R1.18 CCCNC(=O)c1cccc(c1)I 527a_100020643023_100000184098 [0,3,0,0,0,0|0,0,0]=3 16017 B13R1.18 CCCNC(=O)c1cccc(c1)O 240690a_100020643023_100000183914 [0,3,0,0,0,0|0,0,0]=3 16018 B13R1.18 CCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000152271 [0,3,0,0,0,0|0,0,0]=3 16019 B13R1.18 CCCNC(=O)c1cccc(c1)O 527a_100020643023_100000183914 [0,3,0,0,0,0|0,0,0]=3 16020 B13R1.18 CCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000152275 [0,3,0,0,0,0|1,0,0]=4 16021 B13R1.18 CCNCC(=O)c1cccc(c1)Br 2230a_100015525214_100000212080 [0,3,0,0,0,0|0,0,0]=3 16022 B13R1.18 CCNCC(=O)c1cccc(c1)C 2230a_100015525214_100000739480 [0,3,0,0,0,0|0,0,0]=3 16023 B13R1.18 CCNCC(=O)c1cccc(c1)Cl 2230a_100015525214_100000211444 [0,3,0,0,0,0|0,0,0]=3 16024 B13R1.18 CCNCC(=O)c1cccc(c1)F 2230a_100015525214_100000215616 [0,3,0,0,0,0|0,0,0]=3 16025 B13R1.18 CCNN=C(C)c1cccc(c1)Br 4a_100000756455_100000210093 [0,3,0,0,0,0|1,0,0]=4 16026 B13R1.18 CCNN=C(C)c1cccc(c1)C 4a_100000756455_100000211476 [0,3,0,0,0,0|1,0,0]=4 16027 B13R1.18 CCNN=C(C)c1cccc(c1)Cl 4a_100000756455_200000210964 [0,3,0,0,0,0|1,0,0]=4 16028 B13R1.18 CCNN=C(C)c1cccc(c1)F 4a_100000756455_100000187083 [0,3,0,0,0,0|1,0,0]=4 16029 B13R1.18 CCNN=C(C)c1cccc(c1)I 4a_100000756455_100011356966 [0,3,0,0,0,0|1,0,0]=4 16030 B13R1.18 CCNN=C(C)c1cccc(c1)O 4a_100000756455_100000211620 [0,3,0,0,0,0|1,0,0]=4 16031 B13R1.18 CCNNC(=O)c1cccc(c1)Br 22a_100000756455_100000210664 [0,3,0,0,0,0|0,0,0]=3 16032 B13R1.18 CCNNC(=O)c1cccc(c1)C 22a_100000756455_100000189346 [0,3,0,0,0,0|0,0,0]=3 16033 B13R1.18 CCNNC(=O)c1cccc(c1)Cl 22a_100000756455_100000210390 [0,3,0,0,0,0|0,0,0]=3 16034 B13R1.18 CCNNC(=O)c1cccc(c1)F 22a_100000756455_100000210950 [0,3,0,0,0,0|0,0,0]=3 16035 B13R1.18 CCNNC(=O)c1cccc(c1)I 22a_100000756455_100000184098 [0,3,0,0,0,0|0,0,0]=3 16036 B13R1.18 CCNNC(=O)c1cccc(c1)O 22a_100000756455_100000183914 [0,3,0,0,0,0|0,0,0]=3 16037 B13R1.18 CCOCC(=O)c1cccc(c1)Br 34a_100121572206_100000212080 [0,3,0,0,0,0|1,0,0]=4 16038 B13R1.18 CCOCC(=O)c1cccc(c1)C 34a_100121572206_100000739480 [0,3,0,0,0,0|1,0,0]=4 16039 B13R1.18 CCOCC(=O)c1cccc(c1)Cl 34a_100121572206_100000211444 [0,3,0,0,0,0|1,0,0]=4 16040 B13R1.18 CCOCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210202 [0,3,0,0,0,0|1,0,0]=4 16041 B13R1.18 CCOCC(=O)c1cccc(c1)F 34a_100011592800_100000210202 [0,3,0,0,0,0|1,0,0]=4 16042 B13R1.18 CCOCC(=O)c1cccc(c1)F 34a_100121572206_100000215616 [0,3,0,0,0,0|1,0,0]=4 16043 B13R1.18 CCOCC(=O)c1cccc(c1)F 7a_100011592800_100000210202 [0,3,0,0,0,0|1,0,0]=4 16044 B13R1.18 CCOCC(=O)c1cccc(c1)O 34a_100121572206_100009813753 [0,3,0,0,0,0|1,0,0]=4 16045 B13R1.18 CCSCC(=O)c1cccc(c1)Br 62a_100000210202_100000212080 [0,3,0,0,0,0|1,0,0]=4 16046 B13R1.18 CCSCC(=O)c1cccc(c1)Br 62a_100000212080_100000210202 [0,3,0,0,0,0|1,0,0]=4 16047 B13R1.18 CCSCC(=O)c1cccc(c1)C 62a_100000210202_100000739480 [0,3,0,0,0,0|1,0,0]=4 16048 B13R1.18 CCSCC(=O)c1cccc(c1)C 62a_100000739480_100000210202 [0,3,0,0,0,0|1,0,0]=4 16049 B13R1.18 CCSCC(=O)c1cccc(c1)Cl 62a_100000210202_100000211444 [0,3,0,0,0,0|1,0,0]=4 16050 B13R1.18 CCSCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210202 [0,3,0,0,0,0|1,0,0]=4 16051 B13R1.18 CCSCC(=O)c1cccc(c1)F 62a_100000210202_100000215616 [0,3,0,0,0,0|1,0,0]=4 16052 B13R1.18 CCSCC(=O)c1cccc(c1)F 62a_100000215616_100000210202 [0,3,0,0,0,0|1,0,0]=4 16053 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100000210202_100009813753 [0,3,0,0,0,0|1,0,0]=4 16054 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100009813753_100000210202 [0,3,0,0,0,0|1,0,0]=4 16055 B13R1.18 COCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000233755 [0,3,0,0,0,0|1,0,0]=4 16056 B13R1.18 COCCC(=O)c1cccc(c1)C 1458a_100000189346_100000233755 [0,3,0,0,0,0|1,0,0]=4 16057 B13R1.18 COCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000233755 [0,3,0,0,0,0|1,0,0]=4 16058 B13R1.18 COCCC(=O)c1cccc(c1)F 1458a_100000210950_100000233755 [0,3,0,0,0,0|1,0,0]=4 16059 B13R1.18 COCCC(=O)c1cccc(c1)I 1458a_100000184098_100000233755 [0,3,0,0,0,0|1,0,0]=4 16060 B13R1.18 COCCC(=O)c1cccc(c1)O 1458a_100000183914_100000233755 [0,3,0,0,0,0|1,0,0]=4 16061 B13R1.18 CSCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000751147 [0,3,0,0,0,0|1,0,0]=4 16062 B13R1.18 CSCCC(=O)c1cccc(c1)C 1458a_100000189346_100000751147 [0,3,0,0,0,0|1,0,0]=4 16063 B13R1.18 CSCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000751147 [0,3,0,0,0,0|1,0,0]=4 16064 B13R1.18 CSCCC(=O)c1cccc(c1)F 1458a_100000210950_100000751147 [0,3,0,0,0,0|1,0,0]=4 16065 B13R1.18 CSCCC(=O)c1cccc(c1)I 1458a_100000184098_100000751147 [0,3,0,0,0,0|1,0,0]=4 16066 B13R1.18 CSCCC(=O)c1cccc(c1)O 1458a_100000183914_100000751147 [0,3,0,0,0,0|1,0,0]=4 16067 B13R1.18 Cc1cccc(c1)C(=O)CCC#N 1458a_100000189346_100011215226 [0,3,0,0,0,0|1,0,0]=4 16068 B13R1.18 Cc1cccc(c1)C(=O)CCCF 1458a_100000189346_100011934791 [0,3,0,0,0,0|1,0,0]=4 16069 B13R1.18 Cc1cccc(c1)C(=O)CCCO 1458a_100000189346_100011215043 [0,3,0,0,0,0|1,0,0]=4 16070 B13R1.18 Cc1cccc(c1)C(=O)CSCF 62a_100000739480_100015361967 [0,3,0,0,0,0|1,0,0]=4 16071 B13R1.18 Cc1cccc(c1)C(=O)CSCF 62a_100015361967_100000739480 [0,3,0,0,0,0|1,0,0]=4 16072 B13R1.18 Cc1cccc(c1)C(=O)NCC#N 1626a_100000734998_100000189346 [0,3,0,0,0,0|0,0,0]=3 16073 B13R1.18 Cc1cccc(c1)C(=O)NCC#N 527a_100000734998_100000189346 [0,3,0,0,0,0|0,0,0]=3 16074 B13R1.18 Cc1cccc(c1)C(=O)NCCF 11a_100000724931_100000189346 [0,3,0,0,0,0|0,0,0]=3 16075 B13R1.18 Cc1cccc(c1)C(=O)NCCF 1626a_100000724931_100000189346 [0,3,0,0,0,0|0,0,0]=3 16076 B13R1.18 Cc1cccc(c1)C(=O)NCCF 240690a_100000724931_100000189346 [0,3,0,0,0,0|0,0,0]=3 16077 B13R1.18 Cc1cccc(c1)C(=O)NCCF 527a_100000724931_100000189346 [0,3,0,0,0,0|0,0,0]=3 16078 B13R1.18 Cc1cccc(c1)C(=O)NCCO 240690a_100000210304_100000189346 [0,3,0,0,0,0|0,0,0]=3 16079 B13R1.18 Cc1cccc(c1)C(=O)NCCO 527a_100000210304_100000189346 [0,3,0,0,0,0|0,0,0]=3 16080 B13R1.18 N#CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100011215226 [0,3,0,0,0,0|1,0,0]=4 16081 B13R1.18 N#CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011215226 [0,3,0,0,0,0|1,0,0]=4 16082 B13R1.18 N#CCCC(=O)c1cccc(c1)F 1458a_100000210950_100011215226 [0,3,0,0,0,0|1,0,0]=4 16083 B13R1.18 N#CCCC(=O)c1cccc(c1)I 1458a_100000184098_100011215226 [0,3,0,0,0,0|1,0,0]=4 16084 B13R1.18 N#CCCC(=O)c1cccc(c1)O 1458a_100000183914_100011215226 [0,3,0,0,0,0|1,0,0]=4 16085 B13R1.18 N#CCNC(=O)c1cccc(c1)Br 1626a_100000734998_100000210664 [0,3,0,0,0,0|0,0,0]=3 16086 B13R1.18 N#CCNC(=O)c1cccc(c1)Br 527a_100000734998_100000210664 [0,3,0,0,0,0|0,0,0]=3 16087 B13R1.18 N#CCNC(=O)c1cccc(c1)Cl 1626a_100000734998_100000210390 [0,3,0,0,0,0|0,0,0]=3 16088 B13R1.18 N#CCNC(=O)c1cccc(c1)Cl 527a_100000734998_100000210390 [0,3,0,0,0,0|0,0,0]=3 16089 B13R1.18 N#CCNC(=O)c1cccc(c1)F 1626a_100000734998_100000210950 [0,3,0,0,0,0|0,0,0]=3 16090 B13R1.18 N#CCNC(=O)c1cccc(c1)F 527a_100000734998_100000210950 [0,3,0,0,0,0|0,0,0]=3 16091 B13R1.18 N#CCNC(=O)c1cccc(c1)I 1626a_100000734998_100000184098 [0,3,0,0,0,0|0,0,0]=3 16092 B13R1.18 N#CCNC(=O)c1cccc(c1)I 527a_100000734998_100000184098 [0,3,0,0,0,0|0,0,0]=3 16093 B13R1.18 N#CCNC(=O)c1cccc(c1)O 527a_100000734998_100000183914 [0,3,0,0,0,0|0,0,0]=3 16094 B13R1.18 O=C(CCCF)c1cccc(c1)Br 1458a_100000210664_100011934791 [0,3,0,0,0,0|1,0,0]=4 16095 B13R1.18 O=C(CCCF)c1cccc(c1)Cl 1458a_100000210390_100011934791 [0,3,0,0,0,0|1,0,0]=4 16096 B13R1.18 O=C(CCCF)c1cccc(c1)F 1458a_100000210950_100011934791 [0,3,0,0,0,0|1,0,0]=4 16097 B13R1.18 O=C(CCCF)c1cccc(c1)I 1458a_100000184098_100011934791 [0,3,0,0,0,0|1,0,0]=4 16098 B13R1.18 O=C(CCCF)c1cccc(c1)O 1458a_100000183914_100011934791 [0,3,0,0,0,0|1,0,0]=4 16099 B13R1.18 O=C(CCCO)c1cccc(c1)Br 1458a_100000210664_100011215043 [0,3,0,0,0,0|1,0,0]=4 16100 B13R1.18 O=C(CCCO)c1cccc(c1)Cl 1458a_100000210390_100011215043 [0,3,0,0,0,0|1,0,0]=4 16101 B13R1.18 O=C(CCCO)c1cccc(c1)F 1458a_100000210950_100011215043 [0,3,0,0,0,0|1,0,0]=4 16102 B13R1.18 O=C(CCCO)c1cccc(c1)I 1458a_100000184098_100011215043 [0,3,0,0,0,0|1,0,0]=4 16103 B13R1.18 O=C(CCCO)c1cccc(c1)O 1458a_100000183914_100011215043 [0,3,0,0,0,0|1,0,0]=4 16104 B13R1.18 O=C(COCF)c1cccc(c1)Cl 7a_200011592804_100015361967 [0,3,0,0,0,0|1,0,0]=4 16105 B13R1.18 O=C(COCF)c1cccc(c1)F 34a_100011592800_100015361967 [0,3,0,0,0,0|1,0,0]=4 16106 B13R1.18 O=C(COCF)c1cccc(c1)F 7a_100011592800_100015361967 [0,3,0,0,0,0|1,0,0]=4 16107 B13R1.18 O=C(CSCF)c1cccc(c1)Br 62a_100000212080_100015361967 [0,3,0,0,0,0|1,0,0]=4 16108 B13R1.18 O=C(CSCF)c1cccc(c1)Br 62a_100015361967_100000212080 [0,3,0,0,0,0|1,0,0]=4 16109 B13R1.18 O=C(CSCF)c1cccc(c1)Cl 62a_100000211444_100015361967 [0,3,0,0,0,0|1,0,0]=4 16110 B13R1.18 O=C(CSCF)c1cccc(c1)Cl 62a_100015361967_100000211444 [0,3,0,0,0,0|1,0,0]=4 16111 B13R1.18 O=C(CSCF)c1cccc(c1)F 62a_100000215616_100015361967 [0,3,0,0,0,0|1,0,0]=4 16112 B13R1.18 O=C(CSCF)c1cccc(c1)F 62a_100015361967_100000215616 [0,3,0,0,0,0|1,0,0]=4 16113 B13R1.18 O=C(CSCF)c1cccc(c1)O 62a_100009813753_100015361967 [0,3,0,0,0,0|1,0,0]=4 16114 B13R1.18 O=C(CSCF)c1cccc(c1)O 62a_100015361967_100009813753 [0,3,0,0,0,0|1,0,0]=4 16115 B13R1.18 O=C(NCCF)c1cccc(c1)Br 11a_100000724931_100000210664 [0,3,0,0,0,0|0,0,0]=3 16116 B13R1.18 O=C(NCCF)c1cccc(c1)Br 1626a_100000724931_100000210664 [0,3,0,0,0,0|0,0,0]=3 16117 B13R1.18 O=C(NCCF)c1cccc(c1)Br 240690a_100000724931_100000210664 [0,3,0,0,0,0|0,0,0]=3 16118 B13R1.18 O=C(NCCF)c1cccc(c1)Br 527a_100000724931_100000210664 [0,3,0,0,0,0|0,0,0]=3 16119 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 11a_100000724931_100000210390 [0,3,0,0,0,0|0,0,0]=3 16120 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 1626a_100000724931_100000210390 [0,3,0,0,0,0|0,0,0]=3 16121 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 240690a_100000724931_100000210390 [0,3,0,0,0,0|0,0,0]=3 16122 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 527a_100000724931_100000210390 [0,3,0,0,0,0|0,0,0]=3 16123 B13R1.18 O=C(NCCF)c1cccc(c1)F 11a_100000724931_100000210950 [0,3,0,0,0,0|0,0,0]=3 16124 B13R1.18 O=C(NCCF)c1cccc(c1)F 1626a_100000724931_100000210950 [0,3,0,0,0,0|0,0,0]=3 16125 B13R1.18 O=C(NCCF)c1cccc(c1)F 240690a_100000724931_100000210950 [0,3,0,0,0,0|0,0,0]=3 16126 B13R1.18 O=C(NCCF)c1cccc(c1)F 527a_100000724931_100000210950 [0,3,0,0,0,0|0,0,0]=3 16127 B13R1.18 O=C(NCCF)c1cccc(c1)I 11a_100000724931_100000184098 [0,3,0,0,0,0|0,0,0]=3 16128 B13R1.18 O=C(NCCF)c1cccc(c1)I 1626a_100000724931_100000184098 [0,3,0,0,0,0|0,0,0]=3 16129 B13R1.18 O=C(NCCF)c1cccc(c1)I 240690a_100000724931_100000184098 [0,3,0,0,0,0|0,0,0]=3 16130 B13R1.18 O=C(NCCF)c1cccc(c1)I 527a_100000724931_100000184098 [0,3,0,0,0,0|0,0,0]=3 16131 B13R1.18 O=C(NCCF)c1cccc(c1)O 240690a_100000724931_100000183914 [0,3,0,0,0,0|0,0,0]=3 16132 B13R1.18 O=C(NCCF)c1cccc(c1)O 527a_100000724931_100000183914 [0,3,0,0,0,0|0,0,0]=3 16133 B13R1.18 O=C(NCCO)c1cccc(c1)Br 240690a_100000210304_100000210664 [0,3,0,0,0,0|0,0,0]=3 16134 B13R1.18 O=C(NCCO)c1cccc(c1)Br 527a_100000210304_100000210664 [0,3,0,0,0,0|0,0,0]=3 16135 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 240690a_100000210304_100000210390 [0,3,0,0,0,0|0,0,0]=3 16136 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 527a_100000210304_100000210390 [0,3,0,0,0,0|0,0,0]=3 16137 B13R1.18 O=C(NCCO)c1cccc(c1)F 240690a_100000210304_100000210950 [0,3,0,0,0,0|0,0,0]=3 16138 B13R1.18 O=C(NCCO)c1cccc(c1)F 527a_100000210304_100000210950 [0,3,0,0,0,0|0,0,0]=3 16139 B13R1.18 O=C(NCCO)c1cccc(c1)I 240690a_100000210304_100000184098 [0,3,0,0,0,0|0,0,0]=3 16140 B13R1.18 O=C(NCCO)c1cccc(c1)I 527a_100000210304_100000184098 [0,3,0,0,0,0|0,0,0]=3 16141 B13R1.18 O=C(NCCO)c1cccc(c1)O 240690a_100000210304_100000183914 [0,3,0,0,0,0|0,0,0]=3 16142 B13R1.18 O=C(NCCO)c1cccc(c1)O 271570a_203496583355_200000158903 [0,3,0,0,0,0|0,0,0]=3 16143 B13R1.18 O=C(NCCO)c1cccc(c1)O 527a_100000210304_100000183914 [0,3,0,0,0,0|0,0,0]=3 16144 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000748629 [0,3,0,0,0,0|1,0,0]=4 16145 B13R1.147 C=C(C)CC(=O)c1cccc(c1)C 1458a_100000189346_100000748629 [0,3,0,0,0,0|1,0,0]=4 16146 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000748629 [0,3,0,0,0,0|1,0,0]=4 16147 B13R1.147 C=C(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000748629 [0,3,0,0,0,0|1,0,0]=4 16148 B13R1.147 C=C(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000748629 [0,3,0,0,0,0|1,0,0]=4 16149 B13R1.147 C=C(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000748629 [0,3,0,0,0,0|1,0,0]=4 16150 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Br 1458a_100000070787_100000212080 [0,3,0,0,0,0|1,0,0]=4 16151 B13R1.147 CC(=O)CC(=O)c1cccc(c1)C 1458a_100000070787_100000739480 [0,3,0,0,0,0|1,0,0]=4 16152 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000070787_100000211444 [0,3,0,0,0,0|1,0,0]=4 16153 B13R1.147 CC(=O)CC(=O)c1cccc(c1)F 1458a_100000070787_100000215616 [0,3,0,0,0,0|1,0,0]=4 16154 B13R1.147 CC(=O)CC(=O)c1cccc(c1)O 1458a_100000070787_100009813753 [0,3,0,0,0,0|1,0,0]=4 16155 B13R1.147 CC(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000210624 [0,3,0,0,0,0|1,0,0]=4 16156 B13R1.147 CC(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210624 [0,3,0,0,0,0|1,0,0]=4 16157 B13R1.147 CC(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000210624 [0,3,0,0,0,0|1,0,0]=4 16158 B13R1.147 CC(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000210624 [0,3,0,0,0,0|1,0,0]=4 16159 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000210624 [0,3,0,0,0,0|1,0,0]=4 16160 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 271570a_203496583355_100000723889 [0,3,0,0,0,0|1,0,0]=4 16161 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 11a_100138425928_100000210664 [0,3,0,0,0,0|0,0,0]=3 16162 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 1626a_100138425928_100000210664 [0,3,0,0,0,0|0,0,0]=3 16163 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 240690a_100138425928_100000210664 [0,3,0,0,0,0|0,0,0]=3 16164 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 527a_100138425928_100000210664 [0,3,0,0,0,0|0,0,0]=3 16165 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 11a_100138425928_100000210390 [0,3,0,0,0,0|0,0,0]=3 16166 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 1626a_100138425928_100000210390 [0,3,0,0,0,0|0,0,0]=3 16167 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 240690a_100138425928_100000210390 [0,3,0,0,0,0|0,0,0]=3 16168 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 527a_100138425928_100000210390 [0,3,0,0,0,0|0,0,0]=3 16169 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 11a_100138425928_100000210950 [0,3,0,0,0,0|0,0,0]=3 16170 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 1626a_100138425928_100000210950 [0,3,0,0,0,0|0,0,0]=3 16171 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 240690a_100138425928_100000210950 [0,3,0,0,0,0|0,0,0]=3 16172 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 527a_100138425928_100000210950 [0,3,0,0,0,0|0,0,0]=3 16173 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 11a_100138425928_100000184098 [0,3,0,0,0,0|0,0,0]=3 16174 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 1626a_100138425928_100000184098 [0,3,0,0,0,0|0,0,0]=3 16175 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 240690a_100138425928_100000184098 [0,3,0,0,0,0|0,0,0]=3 16176 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 527a_100138425928_100000184098 [0,3,0,0,0,0|0,0,0]=3 16177 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 240690a_100138425928_100000183914 [0,3,0,0,0,0|0,0,0]=3 16178 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 271570a_203496583355_200000152632 [0,3,0,0,0,0|0,0,0]=3 16179 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 527a_100138425928_100000183914 [0,3,0,0,0,0|0,0,0]=3 16180 B13R1.147 CC(C)NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229805 [0,3,0,0,0,0|1,0,0]=4 16181 B13R1.147 CC(C)NC(=O)c1cncc(c1)O 271570a_203496583355_200000152636 [0,3,0,0,0,0|1,0,0]=4 16182 B13R1.147 CC(O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100011218427 [0,3,0,0,0,0|1,0,0]=4 16183 B13R1.147 CC(O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100011218427 [0,3,0,0,0,0|1,0,0]=4 16184 B13R1.147 CC(O)CC(=O)c1cccc(c1)F 1458a_100000210950_100011218427 [0,3,0,0,0,0|1,0,0]=4 16185 B13R1.147 CC(O)CC(=O)c1cccc(c1)I 1458a_100000184098_100011218427 [0,3,0,0,0,0|1,0,0]=4 16186 B13R1.147 CC(O)CC(=O)c1cccc(c1)O 1458a_100000183914_100011218427 [0,3,0,0,0,0|1,0,0]=4 16187 B13R1.147 CN(C)CC(=O)c1cccc(c1)Br 2230a_100102631434_100000212080 [0,3,0,0,0,0|0,0,0]=3 16188 B13R1.147 CN(C)CC(=O)c1cccc(c1)Br 269982a_100102631434_100000212080 [0,3,0,0,0,0|0,0,0]=3 16189 B13R1.147 CN(C)CC(=O)c1cccc(c1)Cl 2230a_100102631434_100000211444 [0,3,0,0,0,0|0,0,0]=3 16190 B13R1.147 CN(C)CC(=O)c1cccc(c1)Cl 269982a_100102631434_100000211444 [0,3,0,0,0,0|0,0,0]=3 16191 B13R1.147 CN(C)CC(=O)c1cccc(c1)F 2230a_100102631434_100000215616 [0,3,0,0,0,0|0,0,0]=3 16192 B13R1.147 CN(C)CC(=O)c1cccc(c1)F 269982a_100102631434_100000215616 [0,3,0,0,0,0|0,0,0]=3 16193 B13R1.147 CN(C)CC(=O)c1cccc(c1)O 269982a_100102631434_100009813753 [0,3,0,0,0,0|0,0,0]=3 16194 B13R1.147 CN(C)CC(=O)c1ccnc(c1)Cl 269982a_100102631434_100009817076 [0,3,0,0,0,0|1,0,0]=4 16195 B13R1.147 Cc1cccc(c1)C(=O)CC(C)C 1458a_100000189346_100000210624 [0,3,0,0,0,0|1,0,0]=4 16196 B13R1.147 Cc1cccc(c1)C(=O)CC(C)O 1458a_100000189346_100011218427 [0,3,0,0,0,0|1,0,0]=4 16197 B13R1.147 Cc1cccc(c1)C(=O)CC(F)F 1458a_100000189346_100011934356 [0,3,0,0,0,0|1,0,0]=4 16198 B13R1.147 Cc1cccc(c1)C(=O)CN(C)C 2230a_100102631434_100000739480 [0,3,0,0,0,0|0,0,0]=3 16199 B13R1.147 Cc1cccc(c1)C(=O)CN(C)C 269982a_100102631434_100000739480 [0,3,0,0,0,0|0,0,0]=3 16200 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 11a_100138425928_100000189346 [0,3,0,0,0,0|0,0,0]=3 16201 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 1626a_100138425928_100000189346 [0,3,0,0,0,0|0,0,0]=3 16202 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 240690a_100138425928_100000189346 [0,3,0,0,0,0|0,0,0]=3 16203 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 527a_100138425928_100000189346 [0,3,0,0,0,0|0,0,0]=3 16204 B13R1.147 O=C(CC(F)F)c1cccc(c1)Br 1458a_100000210664_100011934356 [0,3,0,0,0,0|1,0,0]=4 16205 B13R1.147 O=C(CC(F)F)c1cccc(c1)Cl 1458a_100000210390_100011934356 [0,3,0,0,0,0|1,0,0]=4 16206 B13R1.147 O=C(CC(F)F)c1cccc(c1)F 1458a_100000210950_100011934356 [0,3,0,0,0,0|1,0,0]=4 16207 B13R1.147 O=C(CC(F)F)c1cccc(c1)I 1458a_100000184098_100011934356 [0,3,0,0,0,0|1,0,0]=4 16208 B13R1.147 O=C(CC(F)F)c1cccc(c1)O 1458a_100000183914_100011934356 [0,3,0,0,0,0|1,0,0]=4 16209 B13R1.446 CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210303 [0,3,0,0,0,0|1,0,0]=4 16210 B13R1.446 CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210303 [0,3,0,0,0,0|1,0,0]=4 16211 B13R1.446 CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210303 [0,3,0,0,0,0|1,0,0]=4 16212 B13R1.446 CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210303 [0,3,0,0,0,0|1,0,0]=4 16213 B13R1.446 CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210303 [0,3,0,0,0,0|1,0,0]=4 16214 B13R1.446 CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210303 [0,3,0,0,0,0|1,0,0]=4 16215 B13R1.446 CCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210303 [0,3,0,0,0,0|1,0,0]=4 16216 B13R1.446 CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210303 [0,3,0,0,0,0|1,0,0]=4 16217 B13R1.446 CCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210303 [0,3,0,0,0,0|1,0,0]=4 16218 B13R1.446 CCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210303 [0,3,0,0,0,0|1,0,0]=4 16219 B13R1.446 CCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210303 [0,3,0,0,0,0|1,0,0]=4 16220 B13R1.446 CCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210303 [0,3,0,0,0,0|1,0,0]=4 16221 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210303 [0,3,0,0,0,0|1,0,0]=4 16222 B13R1.446 CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210303 [0,3,0,0,0,0|1,0,0]=4 16223 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210303 [0,3,0,0,0,0|1,0,0]=4 16224 B13R1.446 CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210303 [0,3,0,0,0,0|1,0,0]=4 16225 B13R1.446 CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210303 [0,3,0,0,0,0|1,0,0]=4 16226 B13R1.446 CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210303 [0,3,0,0,0,0|1,0,0]=4 16227 B13R1.446 CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210303 [0,3,0,0,0,0|1,0,0]=4 16228 B13R1.446 CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210303 [0,3,0,0,0,0|1,0,0]=4 16229 B13R1.446 CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210303 [0,3,0,0,0,0|1,0,0]=4 16230 B13R1.446 CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210303 [0,3,0,0,0,0|1,0,0]=4 16231 B13R1.446 CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210303 [0,3,0,0,0,0|1,0,0]=4 16232 B13R1.446 CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210303 [0,3,0,0,0,0|1,0,0]=4 16233 B13R1.446 CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210303 [0,3,0,0,0,0|1,0,0]=4 16234 B13R1.446 CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210303 [0,3,0,0,0,0|1,0,0]=4 16235 B13R1.446 CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210303 [0,3,0,0,0,0|1,0,0]=4 16236 B13R1.446 CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210303 [0,3,0,0,0,0|1,0,0]=4 16237 B13R1.446 CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210303 [0,3,0,0,0,0|1,0,0]=4 16238 B13R1.446 CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210303 [0,3,0,0,0,0|1,0,0]=4 16239 B13R1.446 CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210303 [0,3,0,0,0,0|1,0,0]=4 16240 B13R1.446 CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210303 [0,3,0,0,0,0|1,0,0]=4 16241 B13R1.446 CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210303 [0,3,0,0,0,0|1,0,0]=4 16242 B13R1.446 CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210303 [0,3,0,0,0,0|1,0,0]=4 16243 B13R1.446 CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210303 [0,3,0,0,0,0|1,0,0]=4 16244 B13R1.446 CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210303 [0,3,0,0,0,0|1,0,0]=4 16245 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 11a_100015525214_100000690610 [0,3,0,0,0,0|0,0,0]=3 16246 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 240690a_100015525214_100000690610 [0,3,0,0,0,0|0,0,0]=3 16247 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 527a_100015525214_100000690610 [0,3,0,0,0,0|0,0,0]=3 16248 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 11a_100015525214_100000689033 [0,3,0,0,0,0|0,0,0]=3 16249 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 240690a_100015525214_100000689033 [0,3,0,0,0,0|0,0,0]=3 16250 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 527a_100015525214_100000689033 [0,3,0,0,0,0|0,0,0]=3 16251 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 11a_100015525214_100000736951 [0,3,0,0,0,0|0,0,0]=3 16252 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 240690a_100015525214_100000736951 [0,3,0,0,0,0|0,0,0]=3 16253 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 527a_100015525214_100000736951 [0,3,0,0,0,0|0,0,0]=3 16254 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 11a_100015525214_100000212315 [0,3,0,0,0,0|0,0,0]=3 16255 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 240690a_100015525214_100000212315 [0,3,0,0,0,0|0,0,0]=3 16256 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 527a_100015525214_100000212315 [0,3,0,0,0,0|0,0,0]=3 16257 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 11a_100015525214_100000698340 [0,3,0,0,0,0|0,0,0]=3 16258 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 240690a_100015525214_100000698340 [0,3,0,0,0,0|0,0,0]=3 16259 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 527a_100015525214_100000698340 [0,3,0,0,0,0|0,0,0]=3 16260 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 240690a_100015525214_100012352043 [0,3,0,0,0,0|0,0,0]=3 16261 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 527a_100015525214_100012352043 [0,3,0,0,0,0|0,0,0]=3 16262 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 11a_100015525214_100000759961 [0,3,0,0,0,0|0,0,0]=3 16263 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 240690a_100015525214_100000759961 [0,3,0,0,0,0|0,0,0]=3 16264 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 527a_100015525214_100000759961 [0,3,0,0,0,0|0,0,0]=3 16265 B13R1.446 CCNC(=O)c1cc(ccc1C)C 11a_100015525214_100000195421 [0,3,0,0,0,0|0,0,0]=3 16266 B13R1.446 CCNC(=O)c1cc(ccc1C)C 240690a_100015525214_100000195421 [0,3,0,0,0,0|0,0,0]=3 16267 B13R1.446 CCNC(=O)c1cc(ccc1C)C 527a_100015525214_100000195421 [0,3,0,0,0,0|0,0,0]=3 16268 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 11a_100015525214_100000692595 [0,3,0,0,0,0|0,0,0]=3 16269 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 240690a_100015525214_100000692595 [0,3,0,0,0,0|0,0,0]=3 16270 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 527a_100015525214_100000692595 [0,3,0,0,0,0|0,0,0]=3 16271 B13R1.446 CCNC(=O)c1cc(ccc1C)F 11a_100015525214_100000240043 [0,3,0,0,0,0|0,0,0]=3 16272 B13R1.446 CCNC(=O)c1cc(ccc1C)F 240690a_100015525214_100000240043 [0,3,0,0,0,0|0,0,0]=3 16273 B13R1.446 CCNC(=O)c1cc(ccc1C)F 527a_100015525214_100000240043 [0,3,0,0,0,0|0,0,0]=3 16274 B13R1.446 CCNC(=O)c1cc(ccc1C)I 11a_100015525214_100000688012 [0,3,0,0,0,0|0,0,0]=3 16275 B13R1.446 CCNC(=O)c1cc(ccc1C)I 240690a_100015525214_100000688012 [0,3,0,0,0,0|0,0,0]=3 16276 B13R1.446 CCNC(=O)c1cc(ccc1C)I 527a_100015525214_100000688012 [0,3,0,0,0,0|0,0,0]=3 16277 B13R1.446 CCNC(=O)c1cc(ccc1C)O 240690a_100015525214_100000687834 [0,3,0,0,0,0|0,0,0]=3 16278 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 11a_100015525214_100000211212 [0,3,0,0,0,0|0,0,0]=3 16279 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 240690a_100015525214_100000211212 [0,3,0,0,0,0|0,0,0]=3 16280 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 527a_100015525214_100000211212 [0,3,0,0,0,0|0,0,0]=3 16281 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 11a_100015525214_100011290873 [0,3,0,0,0,0|0,0,0]=3 16282 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 240690a_100015525214_100011290873 [0,3,0,0,0,0|0,0,0]=3 16283 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 527a_100015525214_100011290873 [0,3,0,0,0,0|0,0,0]=3 16284 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 11a_100015525214_100000210642 [0,3,0,0,0,0|0,0,0]=3 16285 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 240690a_100015525214_100000210642 [0,3,0,0,0,0|0,0,0]=3 16286 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 527a_100015525214_100000210642 [0,3,0,0,0,0|0,0,0]=3 16287 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 11a_100015525214_100011219680 [0,3,0,0,0,0|0,0,0]=3 16288 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 240690a_100015525214_100011219680 [0,3,0,0,0,0|0,0,0]=3 16289 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 527a_100015525214_100011219680 [0,3,0,0,0,0|0,0,0]=3 16290 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 11a_100015525214_100000688013 [0,3,0,0,0,0|0,0,0]=3 16291 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 240690a_100015525214_100000688013 [0,3,0,0,0,0|0,0,0]=3 16292 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 527a_100015525214_100000688013 [0,3,0,0,0,0|0,0,0]=3 16293 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 240690a_100015525214_100000719527 [0,3,0,0,0,0|0,0,0]=3 16294 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 527a_100015525214_100000719527 [0,3,0,0,0,0|0,0,0]=3 16295 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 11a_100015525214_100000212322 [0,3,0,0,0,0|0,0,0]=3 16296 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 240690a_100015525214_100000212322 [0,3,0,0,0,0|0,0,0]=3 16297 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 527a_100015525214_100000212322 [0,3,0,0,0,0|0,0,0]=3 16298 B13R1.446 CCNC(=O)c1cc(ccc1F)C 11a_100015525214_100000749327 [0,3,0,0,0,0|0,0,0]=3 16299 B13R1.446 CCNC(=O)c1cc(ccc1F)C 240690a_100015525214_100000749327 [0,3,0,0,0,0|0,0,0]=3 16300 B13R1.446 CCNC(=O)c1cc(ccc1F)C 527a_100015525214_100000749327 [0,3,0,0,0,0|0,0,0]=3 16301 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 11a_100015525214_100000214954 [0,3,0,0,0,0|0,0,0]=3 16302 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 240690a_100015525214_100000214954 [0,3,0,0,0,0|0,0,0]=3 16303 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 527a_100015525214_100000214954 [0,3,0,0,0,0|0,0,0]=3 16304 B13R1.446 CCNC(=O)c1cc(ccc1F)F 11a_100015525214_100000198512 [0,3,0,0,0,0|0,0,0]=3 16305 B13R1.446 CCNC(=O)c1cc(ccc1F)F 240690a_100015525214_100000198512 [0,3,0,0,0,0|0,0,0]=3 16306 B13R1.446 CCNC(=O)c1cc(ccc1F)F 527a_100015525214_100000198512 [0,3,0,0,0,0|0,0,0]=3 16307 B13R1.446 CCNC(=O)c1cc(ccc1F)I 11a_100015525214_100000688014 [0,3,0,0,0,0|0,0,0]=3 16308 B13R1.446 CCNC(=O)c1cc(ccc1F)I 240690a_100015525214_100000688014 [0,3,0,0,0,0|0,0,0]=3 16309 B13R1.446 CCNC(=O)c1cc(ccc1F)I 527a_100015525214_100000688014 [0,3,0,0,0,0|0,0,0]=3 16310 B13R1.446 CCNC(=O)c1cc(ccc1F)O 240690a_100015525214_100000037260 [0,3,0,0,0,0|0,0,0]=3 16311 B13R1.446 CCNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155167 [0,3,0,0,0,0|0,0,0]=3 16312 B13R1.446 CCNC(=O)c1cc(ccc1F)O 527a_100015525214_100000037260 [0,3,0,0,0,0|0,0,0]=3 16313 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 11a_100015525214_100000183945 [0,3,0,0,0,0|0,0,0]=3 16314 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 240690a_100015525214_100000183945 [0,3,0,0,0,0|0,0,0]=3 16315 B13R1.446 CCNC(=O)c1cc(ccc1I)C 11a_100015525214_100000057929 [0,3,0,0,0,0|0,0,0]=3 16316 B13R1.446 CCNC(=O)c1cc(ccc1I)C 240690a_100015525214_100000057929 [0,3,0,0,0,0|0,0,0]=3 16317 B13R1.446 CCNC(=O)c1cc(ccc1I)C 527a_100015525214_100000057929 [0,3,0,0,0,0|0,0,0]=3 16318 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 11a_100015525214_100000739379 [0,3,0,0,0,0|0,0,0]=3 16319 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 240690a_100015525214_100000739379 [0,3,0,0,0,0|0,0,0]=3 16320 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 527a_100015525214_100000739379 [0,3,0,0,0,0|0,0,0]=3 16321 B13R1.446 CCNC(=O)c1cc(ccc1I)F 11a_100015525214_100000748905 [0,3,0,0,0,0|0,0,0]=3 16322 B13R1.446 CCNC(=O)c1cc(ccc1I)F 240690a_100015525214_100000748905 [0,3,0,0,0,0|0,0,0]=3 16323 B13R1.446 CCNC(=O)c1cc(ccc1I)F 527a_100015525214_100000748905 [0,3,0,0,0,0|0,0,0]=3 16324 B13R1.446 CCNC(=O)c1cc(ccc1I)I 11a_100015525214_100000750460 [0,3,0,0,0,0|0,0,0]=3 16325 B13R1.446 CCNC(=O)c1cc(ccc1I)I 240690a_100015525214_100000750460 [0,3,0,0,0,0|0,0,0]=3 16326 B13R1.446 CCNC(=O)c1cc(ccc1I)I 527a_100015525214_100000750460 [0,3,0,0,0,0|0,0,0]=3 16327 B13R1.446 CCNC(=O)c1cc(ccc1I)O 240690a_100015525214_200009995701 [0,3,0,0,0,0|0,0,0]=3 16328 B13R1.446 CCNC(=O)c1cc(ccc1I)O 527a_100015525214_200009995701 [0,3,0,0,0,0|0,0,0]=3 16329 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 240690a_100015525214_100000212140 [0,3,0,0,0,0|0,0,0]=3 16330 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 527a_100015525214_100000212140 [0,3,0,0,0,0|0,0,0]=3 16331 B13R1.446 CCNC(=O)c1cc(ccc1O)C 240690a_100015525214_100000229998 [0,3,0,0,0,0|0,0,0]=3 16332 B13R1.446 CCNC(=O)c1cc(ccc1O)C 527a_100015525214_100000229998 [0,3,0,0,0,0|0,0,0]=3 16333 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 11a_100015525214_100000212143 [0,3,0,0,0,0|0,0,0]=3 16334 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 240690a_100015525214_100000212143 [0,3,0,0,0,0|0,0,0]=3 16335 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 527a_100015525214_100000212143 [0,3,0,0,0,0|0,0,0]=3 16336 B13R1.446 CCNC(=O)c1cc(ccc1O)F 240690a_100015525214_100000742286 [0,3,0,0,0,0|0,0,0]=3 16337 B13R1.446 CCNC(=O)c1cc(ccc1O)F 527a_100015525214_100000742286 [0,3,0,0,0,0|0,0,0]=3 16338 B13R1.446 CCNC(=O)c1cc(ccc1O)I 240690a_100015525214_100000212111 [0,3,0,0,0,0|0,0,0]=3 16339 B13R1.446 CCNC(=O)c1cc(ccc1O)I 527a_100015525214_100000212111 [0,3,0,0,0,0|0,0,0]=3 16340 B13R1.446 CCOC(=O)c1cc(ccc1Br)O 271570a_203496583355_200012360513 [0,3,0,0,0,0|1,0,0]=4 16341 B13R1.446 CCOC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360117 [0,3,0,0,0,0|1,0,0]=4 16342 B13R1.446 CCOC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200012339456 [0,3,0,0,0,0|1,0,0]=4 16343 B13R1.446 CCOC(=O)c1cc(ccc1F)O 271570a_203496583355_100000716760 [0,3,0,0,0,0|1,0,0]=4 16344 B13R1.446 CCOC(=O)c1cc(ccc1N)O 271570a_203496583355_100000747833 [0,3,0,0,0,0|1,0,0]=4 16345 B13R1.446 CCOC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000171027 [0,3,0,0,0,0|1,0,0]=4 16346 B13R1.446 CCOC(=O)c1cc(ccc1O)C 271570a_203496583355_200012353901 [0,3,0,0,0,0|1,0,0]=4 16347 B13R1.446 CCOC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294803 [0,3,0,0,0,0|1,0,0]=4 16348 B13R1.446 CCOC(=O)c1cc(ccc1O)F 271570a_203496583355_100011206316 [0,3,0,0,0,0|1,0,0]=4 16349 B13R1.446 CCOC(=O)c1cc(ccc1O)O 271570a_203496583355_200000174078 [0,3,0,0,0,0|1,0,0]=4 16350 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 2230a_106832991635_100012361344 [0,3,0,0,0,0|0,0,0]=3 16351 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 34a_100102657272_100012361344 [0,3,0,0,0,0|0,0,0]=3 16352 B13R1.446 CNCC(=O)c1cc(ccc1C)C 2230a_106832991635_100000183774 [0,3,0,0,0,0|0,0,0]=3 16353 B13R1.446 CNCC(=O)c1cc(ccc1C)C 34a_100102657272_100000183774 [0,3,0,0,0,0|0,0,0]=3 16354 B13R1.446 CNCC(=O)c1cc(ccc1C)C 7a_106832991635_100000183774 [0,3,0,0,0,0|0,0,0]=3 16355 B13R1.446 CNCC(=O)c1cc(ccc1Cl)Cl 2230a_106832991635_100000183120 [0,3,0,0,0,0|0,0,0]=3 16356 B13R1.446 CNCC(=O)c1cc(ccc1Cl)F 34a_100102657272_200010187420 [0,3,0,0,0,0|0,0,0]=3 16357 B13R1.446 CNCC(=O)c1cc(ccc1F)F 34a_100102657272_100000211571 [0,3,0,0,0,0|0,0,0]=3 16358 B13R1.446 CNCC(=O)c1cc(ccc1F)F 7a_106832991635_100000211571 [0,3,0,0,0,0|0,0,0]=3 16359 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 34a_100102657272_200009828000 [0,3,0,0,0,0|0,0,0]=3 16360 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 7a_106832991635_200009828000 [0,3,0,0,0,0|0,0,0]=3 16361 B13R1.446 CNCC(=O)c1cc(ccc1O)F 34a_100102657272_100009814381 [0,3,0,0,0,0|0,0,0]=3 16362 B13R1.446 CNCC(=O)c1cc(ccc1O)F 7a_106832991635_100000047744 [0,3,0,0,0,0|0,0,0]=3 16363 B13R1.446 CNCC(=O)c1cc(ccc1O)O 34a_100102657272_100009814097 [0,3,0,0,0,0|0,0,0]=3 16364 B13R1.446 CNCC(=O)c1cc(ccc1O)O 7a_106832991635_100009814097 [0,3,0,0,0,0|0,0,0]=3 16365 B13R1.446 CNNC(=O)c1cc(ccc1Br)Br 22a_100016993582_100000690610 [0,3,0,0,0,0|0,0,0]=3 16366 B13R1.446 CNNC(=O)c1cc(ccc1Br)C 22a_100016993582_100000689033 [0,3,0,0,0,0|0,0,0]=3 16367 B13R1.446 CNNC(=O)c1cc(ccc1Br)Cl 22a_100016993582_100000736951 [0,3,0,0,0,0|0,0,0]=3 16368 B13R1.446 CNNC(=O)c1cc(ccc1Br)F 22a_100016993582_100000212315 [0,3,0,0,0,0|0,0,0]=3 16369 B13R1.446 CNNC(=O)c1cc(ccc1Br)I 22a_100016993582_100000698340 [0,3,0,0,0,0|0,0,0]=3 16370 B13R1.446 CNNC(=O)c1cc(ccc1Br)O 22a_100016993582_100012352043 [0,3,0,0,0,0|0,0,0]=3 16371 B13R1.446 CNNC(=O)c1cc(ccc1C)Br 22a_100016993582_100000759961 [0,3,0,0,0,0|0,0,0]=3 16372 B13R1.446 CNNC(=O)c1cc(ccc1C)C 22a_100016993582_100000195421 [0,3,0,0,0,0|0,0,0]=3 16373 B13R1.446 CNNC(=O)c1cc(ccc1C)Cl 22a_100016993582_100000692595 [0,3,0,0,0,0|0,0,0]=3 16374 B13R1.446 CNNC(=O)c1cc(ccc1C)F 22a_100016993582_100000240043 [0,3,0,0,0,0|0,0,0]=3 16375 B13R1.446 CNNC(=O)c1cc(ccc1C)I 22a_100016993582_100000688012 [0,3,0,0,0,0|0,0,0]=3 16376 B13R1.446 CNNC(=O)c1cc(ccc1C)O 22a_100016993582_100000687834 [0,3,0,0,0,0|0,0,0]=3 16377 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Br 22a_100016993582_100000211212 [0,3,0,0,0,0|0,0,0]=3 16378 B13R1.446 CNNC(=O)c1cc(ccc1Cl)C 22a_100016993582_100011290873 [0,3,0,0,0,0|0,0,0]=3 16379 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Cl 22a_100016993582_100000210642 [0,3,0,0,0,0|0,0,0]=3 16380 B13R1.446 CNNC(=O)c1cc(ccc1Cl)F 22a_100016993582_100011219680 [0,3,0,0,0,0|0,0,0]=3 16381 B13R1.446 CNNC(=O)c1cc(ccc1Cl)I 22a_100016993582_100000688013 [0,3,0,0,0,0|0,0,0]=3 16382 B13R1.446 CNNC(=O)c1cc(ccc1Cl)O 22a_100016993582_100000719527 [0,3,0,0,0,0|0,0,0]=3 16383 B13R1.446 CNNC(=O)c1cc(ccc1F)Br 22a_100016993582_100000212322 [0,3,0,0,0,0|0,0,0]=3 16384 B13R1.446 CNNC(=O)c1cc(ccc1F)C 22a_100016993582_100000749327 [0,3,0,0,0,0|0,0,0]=3 16385 B13R1.446 CNNC(=O)c1cc(ccc1F)Cl 22a_100016993582_100000214954 [0,3,0,0,0,0|0,0,0]=3 16386 B13R1.446 CNNC(=O)c1cc(ccc1F)F 22a_100016993582_100000198512 [0,3,0,0,0,0|0,0,0]=3 16387 B13R1.446 CNNC(=O)c1cc(ccc1F)I 22a_100016993582_100000688014 [0,3,0,0,0,0|0,0,0]=3 16388 B13R1.446 CNNC(=O)c1cc(ccc1F)O 22a_100016993582_100000037260 [0,3,0,0,0,0|0,0,0]=3 16389 B13R1.446 CNNC(=O)c1cc(ccc1I)Br 22a_100016993582_100000183945 [0,3,0,0,0,0|0,0,0]=3 16390 B13R1.446 CNNC(=O)c1cc(ccc1I)C 22a_100016993582_100000057929 [0,3,0,0,0,0|0,0,0]=3 16391 B13R1.446 CNNC(=O)c1cc(ccc1I)Cl 22a_100016993582_100000739379 [0,3,0,0,0,0|0,0,0]=3 16392 B13R1.446 CNNC(=O)c1cc(ccc1I)F 22a_100016993582_100000748905 [0,3,0,0,0,0|0,0,0]=3 16393 B13R1.446 CNNC(=O)c1cc(ccc1I)I 22a_100016993582_100000750460 [0,3,0,0,0,0|0,0,0]=3 16394 B13R1.446 CNNC(=O)c1cc(ccc1I)O 22a_100016993582_200009995701 [0,3,0,0,0,0|0,0,0]=3 16395 B13R1.446 CNNC(=O)c1cc(ccc1O)Br 22a_100016993582_100000212140 [0,3,0,0,0,0|0,0,0]=3 16396 B13R1.446 CNNC(=O)c1cc(ccc1O)C 22a_100016993582_100000229998 [0,3,0,0,0,0|0,0,0]=3 16397 B13R1.446 CNNC(=O)c1cc(ccc1O)Cl 22a_100016993582_100000212143 [0,3,0,0,0,0|0,0,0]=3 16398 B13R1.446 CNNC(=O)c1cc(ccc1O)F 22a_100016993582_100000742286 [0,3,0,0,0,0|0,0,0]=3 16399 B13R1.446 CNNC(=O)c1cc(ccc1O)I 22a_100016993582_100000212111 [0,3,0,0,0,0|0,0,0]=3 16400 B13R1.446 COCC(=O)c1cc(ccc1Br)Cl 34a_100138415774_100012361344 [0,3,0,0,0,0|1,0,0]=4 16401 B13R1.446 COCC(=O)c1cc(ccc1C)C 34a_100138415774_100000183774 [0,3,0,0,0,0|1,0,0]=4 16402 B13R1.446 COCC(=O)c1cc(ccc1Cl)F 34a_100138415774_200010187420 [0,3,0,0,0,0|1,0,0]=4 16403 B13R1.446 COCC(=O)c1cc(ccc1F)F 34a_100138415774_100000211571 [0,3,0,0,0,0|1,0,0]=4 16404 B13R1.446 COCC(=O)c1cc(ccc1O)Br 34a_100138415774_200009828000 [0,3,0,0,0,0|1,0,0]=4 16405 B13R1.446 COCC(=O)c1cc(ccc1O)F 34a_100138415774_100009814381 [0,3,0,0,0,0|1,0,0]=4 16406 B13R1.446 COCC(=O)c1cc(ccc1O)O 34a_100138415774_100009814097 [0,3,0,0,0,0|1,0,0]=4 16407 B13R1.446 CSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200000210301 [0,3,0,0,0,0|1,0,0]=4 16408 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_100000183774_200000210301 [0,3,0,0,0,0|1,0,0]=4 16409 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_200000210301_100000183774 [0,3,0,0,0,0|1,0,0]=4 16410 B13R1.446 CSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200000210301 [0,3,0,0,0,0|1,0,0]=4 16411 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200000210301_200010187420 [0,3,0,0,0,0|1,0,0]=4 16412 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200000210301 [0,3,0,0,0,0|1,0,0]=4 16413 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_100000211571_200000210301 [0,3,0,0,0,0|1,0,0]=4 16414 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_200000210301_100000211571 [0,3,0,0,0,0|1,0,0]=4 16415 B13R1.446 CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_200000210301 [0,3,0,0,0,0|1,0,0]=4 16416 B13R1.446 CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200000210301 [0,3,0,0,0,0|1,0,0]=4 16417 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_100009814381_200000210301 [0,3,0,0,0,0|1,0,0]=4 16418 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_200000210301_100009814381 [0,3,0,0,0,0|1,0,0]=4 16419 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_100009814097_200000210301 [0,3,0,0,0,0|1,0,0]=4 16420 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_200000210301_100009814097 [0,3,0,0,0,0|1,0,0]=4 16421 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Br 1458a_100000689033_100011217306 [0,3,0,0,0,0|1,0,0]=4 16422 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)C 1458a_100000195421_100011217306 [0,3,0,0,0,0|1,0,0]=4 16423 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Cl 1458a_100011290873_100011217306 [0,3,0,0,0,0|1,0,0]=4 16424 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)F 1458a_100000749327_100011217306 [0,3,0,0,0,0|1,0,0]=4 16425 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)I 1458a_100000057929_100011217306 [0,3,0,0,0,0|1,0,0]=4 16426 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)O 1458a_100000229998_100011217306 [0,3,0,0,0,0|1,0,0]=4 16427 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Br 1458a_100000689033_100000211926 [0,3,0,0,0,0|1,0,0]=4 16428 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)C 1458a_100000195421_100000211926 [0,3,0,0,0,0|1,0,0]=4 16429 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Cl 1458a_100011290873_100000211926 [0,3,0,0,0,0|1,0,0]=4 16430 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)F 1458a_100000749327_100000211926 [0,3,0,0,0,0|1,0,0]=4 16431 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)I 1458a_100000057929_100000211926 [0,3,0,0,0,0|1,0,0]=4 16432 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)O 1458a_100000229998_100000211926 [0,3,0,0,0,0|1,0,0]=4 16433 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_100000183774_200025704644 [0,3,0,0,0,0|1,0,0]=4 16434 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_200025704644_100000183774 [0,3,0,0,0,0|1,0,0]=4 16435 B13R1.446 Cc1ccc(cc1C(=O)CCF)Br 1458a_100000759961_100011217306 [0,3,0,0,0,0|1,0,0]=4 16436 B13R1.446 Cc1ccc(cc1C(=O)CCF)Cl 1458a_100000692595_100011217306 [0,3,0,0,0,0|1,0,0]=4 16437 B13R1.446 Cc1ccc(cc1C(=O)CCF)F 1458a_100000240043_100011217306 [0,3,0,0,0,0|1,0,0]=4 16438 B13R1.446 Cc1ccc(cc1C(=O)CCF)I 1458a_100000688012_100011217306 [0,3,0,0,0,0|1,0,0]=4 16439 B13R1.446 Cc1ccc(cc1C(=O)CCF)O 1458a_100000687834_100011217306 [0,3,0,0,0,0|1,0,0]=4 16440 B13R1.446 Cc1ccc(cc1C(=O)CCO)Br 1458a_100000759961_100000211926 [0,3,0,0,0,0|1,0,0]=4 16441 B13R1.446 Cc1ccc(cc1C(=O)CCO)Cl 1458a_100000692595_100000211926 [0,3,0,0,0,0|1,0,0]=4 16442 B13R1.446 Cc1ccc(cc1C(=O)CCO)F 1458a_100000240043_100000211926 [0,3,0,0,0,0|1,0,0]=4 16443 B13R1.446 Cc1ccc(cc1C(=O)CCO)I 1458a_100000688012_100000211926 [0,3,0,0,0,0|1,0,0]=4 16444 B13R1.446 Cc1ccc(cc1C(=O)CCO)O 1458a_100000687834_100000211926 [0,3,0,0,0,0|1,0,0]=4 16445 B13R1.446 O=C(CCF)c1cc(ccc1Br)Br 1458a_100000690610_100011217306 [0,3,0,0,0,0|1,0,0]=4 16446 B13R1.446 O=C(CCF)c1cc(ccc1Br)Cl 1458a_100000736951_100011217306 [0,3,0,0,0,0|1,0,0]=4 16447 B13R1.446 O=C(CCF)c1cc(ccc1Br)F 1458a_100000212315_100011217306 [0,3,0,0,0,0|1,0,0]=4 16448 B13R1.446 O=C(CCF)c1cc(ccc1Br)I 1458a_100000698340_100011217306 [0,3,0,0,0,0|1,0,0]=4 16449 B13R1.446 O=C(CCF)c1cc(ccc1Br)O 1458a_100012352043_100011217306 [0,3,0,0,0,0|1,0,0]=4 16450 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Br 1458a_100000211212_100011217306 [0,3,0,0,0,0|1,0,0]=4 16451 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100011217306 [0,3,0,0,0,0|1,0,0]=4 16452 B13R1.446 O=C(CCF)c1cc(ccc1Cl)F 1458a_100011219680_100011217306 [0,3,0,0,0,0|1,0,0]=4 16453 B13R1.446 O=C(CCF)c1cc(ccc1Cl)I 1458a_100000688013_100011217306 [0,3,0,0,0,0|1,0,0]=4 16454 B13R1.446 O=C(CCF)c1cc(ccc1Cl)O 1458a_100000719527_100011217306 [0,3,0,0,0,0|1,0,0]=4 16455 B13R1.446 O=C(CCF)c1cc(ccc1F)Br 1458a_100000212322_100011217306 [0,3,0,0,0,0|1,0,0]=4 16456 B13R1.446 O=C(CCF)c1cc(ccc1F)Cl 1458a_100000214954_100011217306 [0,3,0,0,0,0|1,0,0]=4 16457 B13R1.446 O=C(CCF)c1cc(ccc1F)F 1458a_100000198512_100011217306 [0,3,0,0,0,0|1,0,0]=4 16458 B13R1.446 O=C(CCF)c1cc(ccc1F)I 1458a_100000688014_100011217306 [0,3,0,0,0,0|1,0,0]=4 16459 B13R1.446 O=C(CCF)c1cc(ccc1F)O 1458a_100000037260_100011217306 [0,3,0,0,0,0|1,0,0]=4 16460 B13R1.446 O=C(CCF)c1cc(ccc1I)Br 1458a_100000183945_100011217306 [0,3,0,0,0,0|1,0,0]=4 16461 B13R1.446 O=C(CCF)c1cc(ccc1I)Cl 1458a_100000739379_100011217306 [0,3,0,0,0,0|1,0,0]=4 16462 B13R1.446 O=C(CCF)c1cc(ccc1I)F 1458a_100000748905_100011217306 [0,3,0,0,0,0|1,0,0]=4 16463 B13R1.446 O=C(CCF)c1cc(ccc1I)I 1458a_100000750460_100011217306 [0,3,0,0,0,0|1,0,0]=4 16464 B13R1.446 O=C(CCF)c1cc(ccc1I)O 1458a_200009995701_100011217306 [0,3,0,0,0,0|1,0,0]=4 16465 B13R1.446 O=C(CCF)c1cc(ccc1O)Br 1458a_100000212140_100011217306 [0,3,0,0,0,0|1,0,0]=4 16466 B13R1.446 O=C(CCF)c1cc(ccc1O)Cl 1458a_100000212143_100011217306 [0,3,0,0,0,0|1,0,0]=4 16467 B13R1.446 O=C(CCF)c1cc(ccc1O)F 1458a_100000742286_100011217306 [0,3,0,0,0,0|1,0,0]=4 16468 B13R1.446 O=C(CCF)c1cc(ccc1O)I 1458a_100000212111_100011217306 [0,3,0,0,0,0|1,0,0]=4 16469 B13R1.446 O=C(CCF)c1cc(ccc1O)O 1458a_100000758025_100011217306 [0,3,0,0,0,0|1,0,0]=4 16470 B13R1.446 O=C(CCO)c1cc(ccc1Br)Br 1458a_100000690610_100000211926 [0,3,0,0,0,0|1,0,0]=4 16471 B13R1.446 O=C(CCO)c1cc(ccc1Br)Cl 1458a_100000736951_100000211926 [0,3,0,0,0,0|1,0,0]=4 16472 B13R1.446 O=C(CCO)c1cc(ccc1Br)F 1458a_100000212315_100000211926 [0,3,0,0,0,0|1,0,0]=4 16473 B13R1.446 O=C(CCO)c1cc(ccc1Br)I 1458a_100000698340_100000211926 [0,3,0,0,0,0|1,0,0]=4 16474 B13R1.446 O=C(CCO)c1cc(ccc1Br)O 1458a_100012352043_100000211926 [0,3,0,0,0,0|1,0,0]=4 16475 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Br 1458a_100000211212_100000211926 [0,3,0,0,0,0|1,0,0]=4 16476 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100000211926 [0,3,0,0,0,0|1,0,0]=4 16477 B13R1.446 O=C(CCO)c1cc(ccc1Cl)F 1458a_100011219680_100000211926 [0,3,0,0,0,0|1,0,0]=4 16478 B13R1.446 O=C(CCO)c1cc(ccc1Cl)I 1458a_100000688013_100000211926 [0,3,0,0,0,0|1,0,0]=4 16479 B13R1.446 O=C(CCO)c1cc(ccc1Cl)O 1458a_100000719527_100000211926 [0,3,0,0,0,0|1,0,0]=4 16480 B13R1.446 O=C(CCO)c1cc(ccc1F)Br 1458a_100000212322_100000211926 [0,3,0,0,0,0|1,0,0]=4 16481 B13R1.446 O=C(CCO)c1cc(ccc1F)Cl 1458a_100000214954_100000211926 [0,3,0,0,0,0|1,0,0]=4 16482 B13R1.446 O=C(CCO)c1cc(ccc1F)F 1458a_100000198512_100000211926 [0,3,0,0,0,0|1,0,0]=4 16483 B13R1.446 O=C(CCO)c1cc(ccc1F)I 1458a_100000688014_100000211926 [0,3,0,0,0,0|1,0,0]=4 16484 B13R1.446 O=C(CCO)c1cc(ccc1F)O 1458a_100000037260_100000211926 [0,3,0,0,0,0|1,0,0]=4 16485 B13R1.446 O=C(CCO)c1cc(ccc1I)Br 1458a_100000183945_100000211926 [0,3,0,0,0,0|1,0,0]=4 16486 B13R1.446 O=C(CCO)c1cc(ccc1I)Cl 1458a_100000739379_100000211926 [0,3,0,0,0,0|1,0,0]=4 16487 B13R1.446 O=C(CCO)c1cc(ccc1I)F 1458a_100000748905_100000211926 [0,3,0,0,0,0|1,0,0]=4 16488 B13R1.446 O=C(CCO)c1cc(ccc1I)I 1458a_100000750460_100000211926 [0,3,0,0,0,0|1,0,0]=4 16489 B13R1.446 O=C(CCO)c1cc(ccc1I)O 1458a_200009995701_100000211926 [0,3,0,0,0,0|1,0,0]=4 16490 B13R1.446 O=C(CCO)c1cc(ccc1O)Br 1458a_100000212140_100000211926 [0,3,0,0,0,0|1,0,0]=4 16491 B13R1.446 O=C(CCO)c1cc(ccc1O)Cl 1458a_100000212143_100000211926 [0,3,0,0,0,0|1,0,0]=4 16492 B13R1.446 O=C(CCO)c1cc(ccc1O)F 1458a_100000742286_100000211926 [0,3,0,0,0,0|1,0,0]=4 16493 B13R1.446 O=C(CCO)c1cc(ccc1O)I 1458a_100000212111_100000211926 [0,3,0,0,0,0|1,0,0]=4 16494 B13R1.446 O=C(CCO)c1cc(ccc1O)O 1458a_100000758025_100000211926 [0,3,0,0,0,0|1,0,0]=4 16495 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200025704644 [0,3,0,0,0,0|1,0,0]=4 16496 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200025704644 [0,3,0,0,0,0|1,0,0]=4 16497 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200025704644 [0,3,0,0,0,0|1,0,0]=4 16498 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200025704644_200010187420 [0,3,0,0,0,0|1,0,0]=4 16499 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_100000211571_200025704644 [0,3,0,0,0,0|1,0,0]=4 16500 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_200025704644_100000211571 [0,3,0,0,0,0|1,0,0]=4 16501 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Br 62a_200009828000_200025704644 [0,3,0,0,0,0|1,0,0]=4 16502 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200025704644 [0,3,0,0,0,0|1,0,0]=4 16503 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_100009814381_200025704644 [0,3,0,0,0,0|1,0,0]=4 16504 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_200025704644_100009814381 [0,3,0,0,0,0|1,0,0]=4 16505 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_100009814097_200025704644 [0,3,0,0,0,0|1,0,0]=4 16506 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_200025704644_100009814097 [0,3,0,0,0,0|1,0,0]=4 16507 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210303 [0,3,0,0,0,0|1,0,0]=4 16508 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_100000210303 [0,3,0,0,0,0|1,0,0]=4 16509 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210303 [0,3,0,0,0,0|1,0,0]=4 16510 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210303 [0,3,0,0,0,0|1,0,0]=4 16511 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210303 [0,3,0,0,0,0|1,0,0]=4 16512 B13R1.450 CCCC(=O)c1cc(cc(c1)C)C 1458a_100000210874_100000210303 [0,3,0,0,0,0|1,0,0]=4 16513 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_100000210303 [0,3,0,0,0,0|1,0,0]=4 16514 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210303 [0,3,0,0,0,0|1,0,0]=4 16515 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210303 [0,3,0,0,0,0|1,0,0]=4 16516 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210303 [0,3,0,0,0,0|1,0,0]=4 16517 B13R1.450 CCCC(=O)c1cc(cc(c1)F)C 1458a_100000763163_100000210303 [0,3,0,0,0,0|1,0,0]=4 16518 B13R1.450 CCCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210303 [0,3,0,0,0,0|1,0,0]=4 16519 B13R1.450 CCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210303 [0,3,0,0,0,0|1,0,0]=4 16520 B13R1.450 CCCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210303 [0,3,0,0,0,0|1,0,0]=4 16521 B13R1.450 CCCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210303 [0,3,0,0,0,0|1,0,0]=4 16522 B13R1.450 CCCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210303 [0,3,0,0,0,0|1,0,0]=4 16523 B13R1.450 CCCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210303 [0,3,0,0,0,0|1,0,0]=4 16524 B13R1.450 CCCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210303 [0,3,0,0,0,0|1,0,0]=4 16525 B13R1.450 CCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210303 [0,3,0,0,0,0|1,0,0]=4 16526 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Br 11a_100015525214_100000687083 [0,3,0,0,0,0|0,0,0]=3 16527 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Br 240690a_100015525214_100000687083 [0,3,0,0,0,0|0,0,0]=3 16528 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Br 527a_100015525214_100000687083 [0,3,0,0,0,0|0,0,0]=3 16529 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)C 11a_100015525214_100000760426 [0,3,0,0,0,0|0,0,0]=3 16530 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)C 240690a_100015525214_100000760426 [0,3,0,0,0,0|0,0,0]=3 16531 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)C 527a_100015525214_100000760426 [0,3,0,0,0,0|0,0,0]=3 16532 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Cl 11a_100015525214_100000687899 [0,3,0,0,0,0|0,0,0]=3 16533 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Cl 240690a_100015525214_100000687899 [0,3,0,0,0,0|0,0,0]=3 16534 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)Cl 527a_100015525214_100000687899 [0,3,0,0,0,0|0,0,0]=3 16535 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)F 11a_100015525214_100000739618 [0,3,0,0,0,0|0,0,0]=3 16536 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)F 240690a_100015525214_100000739618 [0,3,0,0,0,0|0,0,0]=3 16537 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)F 527a_100015525214_100000739618 [0,3,0,0,0,0|0,0,0]=3 16538 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)O 240690a_100015525214_100011934545 [0,3,0,0,0,0|0,0,0]=3 16539 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)O 527a_100015525214_100011934545 [0,3,0,0,0,0|0,0,0]=3 16540 B13R1.450 CCNC(=O)c1cc(cc(c1)C)C 11a_100015525214_100000210874 [0,3,0,0,0,0|0,0,0]=3 16541 B13R1.450 CCNC(=O)c1cc(cc(c1)C)C 240690a_100015525214_100000210874 [0,3,0,0,0,0|0,0,0]=3 16542 B13R1.450 CCNC(=O)c1cc(cc(c1)C)C 527a_100015525214_100000210874 [0,3,0,0,0,0|0,0,0]=3 16543 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)C 11a_100015525214_100000684526 [0,3,0,0,0,0|0,0,0]=3 16544 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)C 240690a_100015525214_100000684526 [0,3,0,0,0,0|0,0,0]=3 16545 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)C 527a_100015525214_100000684526 [0,3,0,0,0,0|0,0,0]=3 16546 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)Cl 11a_100015525214_100000210701 [0,3,0,0,0,0|0,0,0]=3 16547 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100015525214_100000210701 [0,3,0,0,0,0|0,0,0]=3 16548 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)Cl 527a_100015525214_100000210701 [0,3,0,0,0,0|0,0,0]=3 16549 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)F 11a_100015525214_100000685768 [0,3,0,0,0,0|0,0,0]=3 16550 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)F 240690a_100015525214_100000685768 [0,3,0,0,0,0|0,0,0]=3 16551 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)F 527a_100015525214_100000685768 [0,3,0,0,0,0|0,0,0]=3 16552 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)O 240690a_100015525214_100011997059 [0,3,0,0,0,0|0,0,0]=3 16553 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)O 527a_100015525214_100011997059 [0,3,0,0,0,0|0,0,0]=3 16554 B13R1.450 CCNC(=O)c1cc(cc(c1)F)C 11a_100015525214_100000763163 [0,3,0,0,0,0|0,0,0]=3 16555 B13R1.450 CCNC(=O)c1cc(cc(c1)F)C 240690a_100015525214_100000763163 [0,3,0,0,0,0|0,0,0]=3 16556 B13R1.450 CCNC(=O)c1cc(cc(c1)F)C 527a_100015525214_100000763163 [0,3,0,0,0,0|0,0,0]=3 16557 B13R1.450 CCNC(=O)c1cc(cc(c1)F)F 11a_100015525214_100000211655 [0,3,0,0,0,0|0,0,0]=3 16558 B13R1.450 CCNC(=O)c1cc(cc(c1)F)F 240690a_100015525214_100000211655 [0,3,0,0,0,0|0,0,0]=3 16559 B13R1.450 CCNC(=O)c1cc(cc(c1)F)F 527a_100015525214_100000211655 [0,3,0,0,0,0|0,0,0]=3 16560 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 11a_100015525214_100012017291 [0,3,0,0,0,0|0,0,0]=3 16561 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 240690a_100015525214_100012017291 [0,3,0,0,0,0|0,0,0]=3 16562 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 527a_100015525214_100012017291 [0,3,0,0,0,0|0,0,0]=3 16563 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Br 11a_100015525214_100000689235 [0,3,0,0,0,0|0,0,0]=3 16564 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Br 240690a_100015525214_100000689235 [0,3,0,0,0,0|0,0,0]=3 16565 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Br 527a_100015525214_100000689235 [0,3,0,0,0,0|0,0,0]=3 16566 B13R1.450 CCNC(=O)c1cc(cc(c1)I)C 11a_100015525214_100000729426 [0,3,0,0,0,0|0,0,0]=3 16567 B13R1.450 CCNC(=O)c1cc(cc(c1)I)C 240690a_100015525214_100000729426 [0,3,0,0,0,0|0,0,0]=3 16568 B13R1.450 CCNC(=O)c1cc(cc(c1)I)C 527a_100015525214_100000729426 [0,3,0,0,0,0|0,0,0]=3 16569 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Cl 11a_100015525214_100012047205 [0,3,0,0,0,0|0,0,0]=3 16570 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Cl 240690a_100015525214_100012047205 [0,3,0,0,0,0|0,0,0]=3 16571 B13R1.450 CCNC(=O)c1cc(cc(c1)I)Cl 527a_100015525214_100012047205 [0,3,0,0,0,0|0,0,0]=3 16572 B13R1.450 CCNC(=O)c1cc(cc(c1)I)F 11a_100015525214_100012047268 [0,3,0,0,0,0|0,0,0]=3 16573 B13R1.450 CCNC(=O)c1cc(cc(c1)I)F 240690a_100015525214_100012047268 [0,3,0,0,0,0|0,0,0]=3 16574 B13R1.450 CCNC(=O)c1cc(cc(c1)I)F 527a_100015525214_100012047268 [0,3,0,0,0,0|0,0,0]=3 16575 B13R1.450 CCNC(=O)c1cc(cc(c1)I)I 11a_100015525214_100011204819 [0,3,0,0,0,0|0,0,0]=3 16576 B13R1.450 CCNC(=O)c1cc(cc(c1)I)I 240690a_100015525214_100011204819 [0,3,0,0,0,0|0,0,0]=3 16577 B13R1.450 CCNC(=O)c1cc(cc(c1)I)I 527a_100015525214_100011204819 [0,3,0,0,0,0|0,0,0]=3 16578 B13R1.450 CCNC(=O)c1cc(cc(c1)O)C 240690a_100015525214_100000094094 [0,3,0,0,0,0|0,0,0]=3 16579 B13R1.450 CCNC(=O)c1cc(cc(c1)O)C 527a_100015525214_100000094094 [0,3,0,0,0,0|0,0,0]=3 16580 B13R1.450 CCNC(=O)c1cc(cc(c1)O)O 240690a_100015525214_100000690292 [0,3,0,0,0,0|0,0,0]=3 16581 B13R1.450 CCNC(=O)c1cc(cc(c1)O)O 527a_100015525214_100000690292 [0,3,0,0,0,0|0,0,0]=3 16582 B13R1.450 CCOC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_200012351389 [0,3,0,0,0,0|1,0,0]=4 16583 B13R1.450 CCOC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011295119 [0,3,0,0,0,0|1,0,0]=4 16584 B13R1.450 CNCC(=O)c1cc(cc(c1)Cl)Cl 2230a_106832991635_200012340517 [0,3,0,0,0,0|0,0,0]=3 16585 B13R1.450 CNCC(=O)c1cc(cc(c1)Cl)Cl 34a_100102657272_200012340517 [0,3,0,0,0,0|0,0,0]=3 16586 B13R1.450 CNCC(=O)c1cc(cc(c1)Cl)Cl 7a_106832991635_200012340517 [0,3,0,0,0,0|0,0,0]=3 16587 B13R1.450 CNCC(=O)c1cc(cc(c1)F)F 2230a_106832991635_100011216790 [0,3,0,0,0,0|0,0,0]=3 16588 B13R1.450 CNCC(=O)c1cc(cc(c1)F)F 34a_100102657272_100011216790 [0,3,0,0,0,0|0,0,0]=3 16589 B13R1.450 CNCC(=O)c1cc(cc(c1)F)F 7a_106832991635_100011216790 [0,3,0,0,0,0|0,0,0]=3 16590 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 2230a_106832991635_100010006762 [0,3,0,0,0,0|0,0,0]=3 16591 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 34a_100102657272_100010006762 [0,3,0,0,0,0|0,0,0]=3 16592 B13R1.450 CNNC(=O)c1cc(cc(c1)Br)Br 22a_100016993582_100000687083 [0,3,0,0,0,0|0,0,0]=3 16593 B13R1.450 CNNC(=O)c1cc(cc(c1)Br)C 22a_100016993582_100000760426 [0,3,0,0,0,0|0,0,0]=3 16594 B13R1.450 CNNC(=O)c1cc(cc(c1)Br)Cl 22a_100016993582_100000687899 [0,3,0,0,0,0|0,0,0]=3 16595 B13R1.450 CNNC(=O)c1cc(cc(c1)Br)F 22a_100016993582_100000739618 [0,3,0,0,0,0|0,0,0]=3 16596 B13R1.450 CNNC(=O)c1cc(cc(c1)Br)O 22a_100016993582_100011934545 [0,3,0,0,0,0|0,0,0]=3 16597 B13R1.450 CNNC(=O)c1cc(cc(c1)C)C 22a_100016993582_100000210874 [0,3,0,0,0,0|0,0,0]=3 16598 B13R1.450 CNNC(=O)c1cc(cc(c1)Cl)C 22a_100016993582_100000684526 [0,3,0,0,0,0|0,0,0]=3 16599 B13R1.450 CNNC(=O)c1cc(cc(c1)Cl)Cl 22a_100016993582_100000210701 [0,3,0,0,0,0|0,0,0]=3 16600 B13R1.450 CNNC(=O)c1cc(cc(c1)Cl)F 22a_100016993582_100000685768 [0,3,0,0,0,0|0,0,0]=3 16601 B13R1.450 CNNC(=O)c1cc(cc(c1)Cl)O 22a_100016993582_100011997059 [0,3,0,0,0,0|0,0,0]=3 16602 B13R1.450 CNNC(=O)c1cc(cc(c1)F)C 22a_100016993582_100000763163 [0,3,0,0,0,0|0,0,0]=3 16603 B13R1.450 CNNC(=O)c1cc(cc(c1)F)F 22a_100016993582_100000211655 [0,3,0,0,0,0|0,0,0]=3 16604 B13R1.450 CNNC(=O)c1cc(cc(c1)F)O 22a_100016993582_100012017291 [0,3,0,0,0,0|0,0,0]=3 16605 B13R1.450 CNNC(=O)c1cc(cc(c1)I)Br 22a_100016993582_100000689235 [0,3,0,0,0,0|0,0,0]=3 16606 B13R1.450 CNNC(=O)c1cc(cc(c1)I)C 22a_100016993582_100000729426 [0,3,0,0,0,0|0,0,0]=3 16607 B13R1.450 CNNC(=O)c1cc(cc(c1)I)Cl 22a_100016993582_100012047205 [0,3,0,0,0,0|0,0,0]=3 16608 B13R1.450 CNNC(=O)c1cc(cc(c1)I)F 22a_100016993582_100012047268 [0,3,0,0,0,0|0,0,0]=3 16609 B13R1.450 CNNC(=O)c1cc(cc(c1)I)I 22a_100016993582_100011204819 [0,3,0,0,0,0|0,0,0]=3 16610 B13R1.450 CNNC(=O)c1cc(cc(c1)O)C 22a_100016993582_100000094094 [0,3,0,0,0,0|0,0,0]=3 16611 B13R1.450 CNNC(=O)c1cc(cc(c1)O)O 22a_100016993582_100000690292 [0,3,0,0,0,0|0,0,0]=3 16612 B13R1.450 COCC(=O)c1cc(cc(c1)Cl)Cl 34a_100138415774_200012340517 [0,3,0,0,0,0|1,0,0]=4 16613 B13R1.450 COCC(=O)c1cc(cc(c1)F)F 34a_100012568930_200000210301 [0,3,0,0,0,0|1,0,0]=4 16614 B13R1.450 COCC(=O)c1cc(cc(c1)F)F 34a_100138415774_100011216790 [0,3,0,0,0,0|1,0,0]=4 16615 B13R1.450 COCC(=O)c1cc(cc(c1)F)F 7a_100012568930_200000210301 [0,3,0,0,0,0|1,0,0]=4 16616 B13R1.450 COCC(=O)c1cc(cc(c1)O)O 34a_100138415774_100010006762 [0,3,0,0,0,0|1,0,0]=4 16617 B13R1.450 CSCC(=O)c1cc(cc(c1)Cl)Cl 62a_200000210301_200012340517 [0,3,0,0,0,0|1,0,0]=4 16618 B13R1.450 CSCC(=O)c1cc(cc(c1)Cl)Cl 62a_200012340517_200000210301 [0,3,0,0,0,0|1,0,0]=4 16619 B13R1.450 CSCC(=O)c1cc(cc(c1)F)F 62a_100011216790_200000210301 [0,3,0,0,0,0|1,0,0]=4 16620 B13R1.450 CSCC(=O)c1cc(cc(c1)F)F 62a_200000210301_100011216790 [0,3,0,0,0,0|1,0,0]=4 16621 B13R1.450 CSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_200000210301 [0,3,0,0,0,0|1,0,0]=4 16622 B13R1.450 CSCC(=O)c1cc(cc(c1)O)O 62a_200000210301_100010006762 [0,3,0,0,0,0|1,0,0]=4 16623 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)Br 1458a_100000760426_100011217306 [0,3,0,0,0,0|1,0,0]=4 16624 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)C 1458a_100000210874_100011217306 [0,3,0,0,0,0|1,0,0]=4 16625 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)Cl 1458a_100000684526_100011217306 [0,3,0,0,0,0|1,0,0]=4 16626 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)F 1458a_100000763163_100011217306 [0,3,0,0,0,0|1,0,0]=4 16627 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)I 1458a_100000729426_100011217306 [0,3,0,0,0,0|1,0,0]=4 16628 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)O 1458a_100000094094_100011217306 [0,3,0,0,0,0|1,0,0]=4 16629 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)Br 1458a_100000760426_100000211926 [0,3,0,0,0,0|1,0,0]=4 16630 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)C 1458a_100000210874_100000211926 [0,3,0,0,0,0|1,0,0]=4 16631 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)Cl 1458a_100000684526_100000211926 [0,3,0,0,0,0|1,0,0]=4 16632 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)F 1458a_100000763163_100000211926 [0,3,0,0,0,0|1,0,0]=4 16633 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)I 1458a_100000729426_100000211926 [0,3,0,0,0,0|1,0,0]=4 16634 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)O 1458a_100000094094_100000211926 [0,3,0,0,0,0|1,0,0]=4 16635 B13R1.450 O=C(CCF)c1cc(cc(c1)Br)Br 1458a_100000687083_100011217306 [0,3,0,0,0,0|1,0,0]=4 16636 B13R1.450 O=C(CCF)c1cc(cc(c1)Br)Cl 1458a_100000687899_100011217306 [0,3,0,0,0,0|1,0,0]=4 16637 B13R1.450 O=C(CCF)c1cc(cc(c1)Br)F 1458a_100000739618_100011217306 [0,3,0,0,0,0|1,0,0]=4 16638 B13R1.450 O=C(CCF)c1cc(cc(c1)Br)O 1458a_100011934545_100011217306 [0,3,0,0,0,0|1,0,0]=4 16639 B13R1.450 O=C(CCF)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100011217306 [0,3,0,0,0,0|1,0,0]=4 16640 B13R1.450 O=C(CCF)c1cc(cc(c1)Cl)F 1458a_100000685768_100011217306 [0,3,0,0,0,0|1,0,0]=4 16641 B13R1.450 O=C(CCF)c1cc(cc(c1)Cl)O 1458a_100011997059_100011217306 [0,3,0,0,0,0|1,0,0]=4 16642 B13R1.450 O=C(CCF)c1cc(cc(c1)F)F 1458a_100000211655_100011217306 [0,3,0,0,0,0|1,0,0]=4 16643 B13R1.450 O=C(CCF)c1cc(cc(c1)F)O 1458a_100012017291_100011217306 [0,3,0,0,0,0|1,0,0]=4 16644 B13R1.450 O=C(CCF)c1cc(cc(c1)I)Br 1458a_100000689235_100011217306 [0,3,0,0,0,0|1,0,0]=4 16645 B13R1.450 O=C(CCF)c1cc(cc(c1)I)Cl 1458a_100012047205_100011217306 [0,3,0,0,0,0|1,0,0]=4 16646 B13R1.450 O=C(CCF)c1cc(cc(c1)I)F 1458a_100012047268_100011217306 [0,3,0,0,0,0|1,0,0]=4 16647 B13R1.450 O=C(CCF)c1cc(cc(c1)I)I 1458a_100011204819_100011217306 [0,3,0,0,0,0|1,0,0]=4 16648 B13R1.450 O=C(CCO)c1cc(cc(c1)Br)Br 1458a_100000687083_100000211926 [0,3,0,0,0,0|1,0,0]=4 16649 B13R1.450 O=C(CCO)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000211926 [0,3,0,0,0,0|1,0,0]=4 16650 B13R1.450 O=C(CCO)c1cc(cc(c1)Br)F 1458a_100000739618_100000211926 [0,3,0,0,0,0|1,0,0]=4 16651 B13R1.450 O=C(CCO)c1cc(cc(c1)Br)O 1458a_100011934545_100000211926 [0,3,0,0,0,0|1,0,0]=4 16652 B13R1.450 O=C(CCO)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000211926 [0,3,0,0,0,0|1,0,0]=4 16653 B13R1.450 O=C(CCO)c1cc(cc(c1)Cl)F 1458a_100000685768_100000211926 [0,3,0,0,0,0|1,0,0]=4 16654 B13R1.450 O=C(CCO)c1cc(cc(c1)Cl)O 1458a_100011997059_100000211926 [0,3,0,0,0,0|1,0,0]=4 16655 B13R1.450 O=C(CCO)c1cc(cc(c1)F)F 1458a_100000211655_100000211926 [0,3,0,0,0,0|1,0,0]=4 16656 B13R1.450 O=C(CCO)c1cc(cc(c1)F)O 1458a_100012017291_100000211926 [0,3,0,0,0,0|1,0,0]=4 16657 B13R1.450 O=C(CCO)c1cc(cc(c1)I)Br 1458a_100000689235_100000211926 [0,3,0,0,0,0|1,0,0]=4 16658 B13R1.450 O=C(CCO)c1cc(cc(c1)I)Cl 1458a_100012047205_100000211926 [0,3,0,0,0,0|1,0,0]=4 16659 B13R1.450 O=C(CCO)c1cc(cc(c1)I)F 1458a_100012047268_100000211926 [0,3,0,0,0,0|1,0,0]=4 16660 B13R1.450 O=C(CCO)c1cc(cc(c1)I)I 1458a_100011204819_100000211926 [0,3,0,0,0,0|1,0,0]=4 16661 B13R1.450 [13CH3]OCC(=O)c1cc(cc(c1)F)F 34a_100012568930_200025704644 [0,3,0,0,0,0|1,0,0]=4 16662 B13R1.450 [13CH3]OCC(=O)c1cc(cc(c1)F)F 7a_100012568930_200025704644 [0,3,0,0,0,0|1,0,0]=4 16663 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)Cl)Cl 62a_200012340517_200025704644 [0,3,0,0,0,0|1,0,0]=4 16664 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)Cl)Cl 62a_200025704644_200012340517 [0,3,0,0,0,0|1,0,0]=4 16665 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)F)F 62a_100011216790_200025704644 [0,3,0,0,0,0|1,0,0]=4 16666 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)F)F 62a_200025704644_100011216790 [0,3,0,0,0,0|1,0,0]=4 16667 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)O)O 62a_100010006762_200025704644 [0,3,0,0,0,0|1,0,0]=4 16668 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)O)O 62a_200025704644_100010006762 [0,3,0,0,0,0|1,0,0]=4 16669 B13R1.460 C#Cc1cccc(c1)C(=O)CCC 1458a_100011997762_100000210303 [0,3,0,0,0,0|1,0,0]=4 16670 B13R1.460 C#Cc1cccc(c1)C(=O)CCF 1458a_100011997762_100011217306 [0,3,0,0,0,0|1,0,0]=4 16671 B13R1.460 C#Cc1cccc(c1)C(=O)CCO 1458a_100011997762_100000211926 [0,3,0,0,0,0|1,0,0]=4 16672 B13R1.460 C#Cc1cccc(c1)C(=O)NCC 11a_100015525214_100011997762 [0,3,0,0,0,0|0,0,0]=3 16673 B13R1.460 C#Cc1cccc(c1)C(=O)NCC 240690a_100015525214_100011997762 [0,3,0,0,0,0|0,0,0]=3 16674 B13R1.460 C#Cc1cccc(c1)C(=O)NCC 527a_100015525214_100011997762 [0,3,0,0,0,0|0,0,0]=3 16675 B13R1.460 C#Cc1cccc(c1)C(=O)NNC 22a_100016993582_100011997762 [0,3,0,0,0,0|0,0,0]=3 16676 B13R1.460 C=Cc1cc(ccn1)C(=O)NCC 271570a_100011290941_100000229823 [0,3,0,0,0,0|1,0,0]=4 16677 B13R1.460 C=Cc1cccc(c1)C(=O)CCC 1458a_100011215009_100000210303 [0,3,0,0,0,0|1,0,0]=4 16678 B13R1.460 C=Cc1cccc(c1)C(=O)CCF 1458a_100011215009_100011217306 [0,3,0,0,0,0|1,0,0]=4 16679 B13R1.460 C=Cc1cccc(c1)C(=O)CCO 1458a_100011215009_100000211926 [0,3,0,0,0,0|1,0,0]=4 16680 B13R1.460 C=Cc1cccc(c1)C(=O)NCC 11a_100015525214_100011215009 [0,3,0,0,0,0|0,0,0]=3 16681 B13R1.460 C=Cc1cccc(c1)C(=O)NCC 240690a_100015525214_100011215009 [0,3,0,0,0,0|0,0,0]=3 16682 B13R1.460 C=Cc1cccc(c1)C(=O)NCC 271570a_100011290941_100000155180 [0,3,0,0,0,0|0,0,0]=3 16683 B13R1.460 C=Cc1cccc(c1)C(=O)NCC 527a_100015525214_100011215009 [0,3,0,0,0,0|0,0,0]=3 16684 B13R1.460 C=Cc1cccc(c1)C(=O)NNC 22a_100016993582_100011215009 [0,3,0,0,0,0|0,0,0]=3 16685 B13R1.460 C=Cc1cccc(c1)C(=O)OCC 271570a_100011290941_100000170211 [0,3,0,0,0,0|1,0,0]=4 16686 B13R1.460 C=Cc1ccnc(c1)C(=O)NCC 271570a_100011290941_100000194128 [0,3,0,0,0,0|1,0,0]=4 16687 B13R1.460 C=Cc1cncc(c1)C(=O)NCC 271570a_100011290941_200000155184 [0,3,0,0,0,0|1,0,0]=4 16688 B13R1.460 CCCC(=O)c1cccc(c1)C#N 1458a_100000183950_100000210303 [0,3,0,0,0,0|1,0,0]=4 16689 B13R1.460 CCCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210303 [0,3,0,0,0,0|1,0,0]=4 16690 B13R1.460 CCCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210303 [0,3,0,0,0,0|1,0,0]=4 16691 B13R1.460 CCCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210303 [0,3,0,0,0,0|1,0,0]=4 16692 B13R1.460 CCCC(=O)c1cccc(c1)SC 1458a_100011217804_100000210303 [0,3,0,0,0,0|1,0,0]=4 16693 B13R1.460 CCNC(=O)c1cc(ccn1)NC 27a_100102657272_100000194128 [0,3,0,0,0,0|1,0,0]=4 16694 B13R1.460 CCNC(=O)c1cc(ccn1)SC 62a_100000194128_200000210301 [0,3,0,0,0,0|1,0,0]=4 16695 B13R1.460 CCNC(=O)c1cc(ccn1)SC 62a_200000210301_100000194128 [0,3,0,0,0,0|1,0,0]=4 16696 B13R1.460 CCNC(=O)c1cc(ccn1)S[13CH3] 62a_100000194128_200025704644 [0,3,0,0,0,0|1,0,0]=4 16697 B13R1.460 CCNC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000194128 [0,3,0,0,0,0|1,0,0]=4 16698 B13R1.460 CCNC(=O)c1cccc(c1)C#N 11a_100015525214_100000183950 [0,3,0,0,0,0|0,0,0]=3 16699 B13R1.460 CCNC(=O)c1cccc(c1)C#N 240690a_100015525214_100000183950 [0,3,0,0,0,0|0,0,0]=3 16700 B13R1.460 CCNC(=O)c1cccc(c1)C#N 527a_100015525214_100000183950 [0,3,0,0,0,0|0,0,0]=3 16701 B13R1.460 CCNC(=O)c1cccc(c1)CC 11a_100015525214_100011933908 [0,3,0,0,0,0|0,0,0]=3 16702 B13R1.460 CCNC(=O)c1cccc(c1)CC 240690a_100015525214_100011933908 [0,3,0,0,0,0|0,0,0]=3 16703 B13R1.460 CCNC(=O)c1cccc(c1)CC 527a_100015525214_100011933908 [0,3,0,0,0,0|0,0,0]=3 16704 B13R1.460 CCNC(=O)c1cccc(c1)CO 240690a_100015525214_100000746274 [0,3,0,0,0,0|0,0,0]=3 16705 B13R1.460 CCNC(=O)c1cccc(c1)NC 34a_100000181407_200000210301 [0,3,0,0,0,0|0,0,0]=3 16706 B13R1.460 CCNC(=O)c1cccc(c1)NC 7a_100000181407_200000210301 [0,3,0,0,0,0|0,0,0]=3 16707 B13R1.460 CCNC(=O)c1cccc(c1)N[13CH3] 34a_100000181407_200025704644 [0,3,0,0,0,0|0,0,0]=3 16708 B13R1.460 CCNC(=O)c1cccc(c1)N[13CH3] 7a_100000181407_200025704644 [0,3,0,0,0,0|0,0,0]=3 16709 B13R1.460 CCNC(=O)c1cccc(c1)OC 11a_100015525214_100000188888 [0,3,0,0,0,0|0,0,0]=3 16710 B13R1.460 CCNC(=O)c1cccc(c1)OC 240690a_100015525214_100000188888 [0,3,0,0,0,0|0,0,0]=3 16711 B13R1.460 CCNC(=O)c1cccc(c1)OC 527a_100015525214_100000188888 [0,3,0,0,0,0|0,0,0]=3 16712 B13R1.460 CCNC(=O)c1cccc(c1)OC 7a_100000160095_200000210301 [0,3,0,0,0,0|0,0,0]=3 16713 B13R1.460 CCNC(=O)c1cccc(c1)O[13CH3] 7a_100000160095_200025704644 [0,3,0,0,0,0|0,0,0]=3 16714 B13R1.460 CCNC(=O)c1cccc(c1)SC 11a_100015525214_100011217804 [0,3,0,0,0,0|0,0,0]=3 16715 B13R1.460 CCNC(=O)c1cccc(c1)SC 240690a_100015525214_100011217804 [0,3,0,0,0,0|0,0,0]=3 16716 B13R1.460 CCNC(=O)c1cccc(c1)SC 527a_100015525214_100011217804 [0,3,0,0,0,0|0,0,0]=3 16717 B13R1.460 CCNC(=O)c1cccc(c1)SC 62a_100000155180_200000210301 [0,3,0,0,0,0|0,0,0]=3 16718 B13R1.460 CCNC(=O)c1cccc(c1)SC 62a_200000210301_100000155180 [0,3,0,0,0,0|0,0,0]=3 16719 B13R1.460 CCNC(=O)c1cccc(c1)S[13CH3] 62a_100000155180_200025704644 [0,3,0,0,0,0|0,0,0]=3 16720 B13R1.460 CCNC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000155180 [0,3,0,0,0,0|0,0,0]=3 16721 B13R1.460 CCNC(=O)c1ccnc(c1)NC 27a_100102657272_100000229823 [0,3,0,0,0,0|1,0,0]=4 16722 B13R1.460 CCNC(=O)c1ccnc(c1)SC 62a_100000229823_200000210301 [0,3,0,0,0,0|1,0,0]=4 16723 B13R1.460 CCNC(=O)c1ccnc(c1)SC 62a_200000210301_100000229823 [0,3,0,0,0,0|1,0,0]=4 16724 B13R1.460 CCNC(=O)c1ccnc(c1)S[13CH3] 62a_100000229823_200025704644 [0,3,0,0,0,0|1,0,0]=4 16725 B13R1.460 CCNC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000229823 [0,3,0,0,0,0|1,0,0]=4 16726 B13R1.460 CCNC(=O)c1cncc(c1)NC 27a_100102657272_200000155184 [0,3,0,0,0,0|1,0,0]=4 16727 B13R1.460 CCNC(=O)c1cncc(c1)SC 62a_200000155184_200000210301 [0,3,0,0,0,0|1,0,0]=4 16728 B13R1.460 CCNC(=O)c1cncc(c1)SC 62a_200000210301_200000155184 [0,3,0,0,0,0|1,0,0]=4 16729 B13R1.460 CCNC(=O)c1cncc(c1)S[13CH3] 62a_200000155184_200025704644 [0,3,0,0,0,0|1,0,0]=4 16730 B13R1.460 CCNC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_200000155184 [0,3,0,0,0,0|1,0,0]=4 16731 B13R1.460 CCOC(=O)c1cccc(c1)OC 7a_100000169910_200000210301 [0,3,0,0,0,0|1,0,0]=4 16732 B13R1.460 CCOC(=O)c1cccc(c1)O[13CH3] 7a_100000169910_200025704644 [0,3,0,0,0,0|1,0,0]=4 16733 B13R1.460 CCOC(=O)c1cccc(c1)SC 62a_100000170211_200000210301 [0,3,0,0,0,0|1,0,0]=4 16734 B13R1.460 CCOC(=O)c1cccc(c1)SC 62a_200000210301_100000170211 [0,3,0,0,0,0|1,0,0]=4 16735 B13R1.460 CCOC(=O)c1cccc(c1)S[13CH3] 62a_100000170211_200025704644 [0,3,0,0,0,0|1,0,0]=4 16736 B13R1.460 CCOC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000170211 [0,3,0,0,0,0|1,0,0]=4 16737 B13R1.460 CCc1cccc(c1)C(=O)CCF 1458a_100011933908_100011217306 [0,3,0,0,0,0|1,0,0]=4 16738 B13R1.460 CCc1cccc(c1)C(=O)CCO 1458a_100011933908_100000211926 [0,3,0,0,0,0|1,0,0]=4 16739 B13R1.460 CCc1cccc(c1)C(=O)NNC 22a_100016993582_100011933908 [0,3,0,0,0,0|0,0,0]=3 16740 B13R1.460 CNCC(=O)c1cccc(c1)C#N 2230a_106832991635_100000751541 [0,3,0,0,0,0|0,0,0]=3 16741 B13R1.460 CNCC(=O)c1cccc(c1)C#N 34a_100102657272_100000751541 [0,3,0,0,0,0|0,0,0]=3 16742 B13R1.460 CNCC(=O)c1cccc(c1)C#N 7a_106832991635_100000751541 [0,3,0,0,0,0|0,0,0]=3 16743 B13R1.460 CNCC(=O)c1cccc(c1)OC 34a_100102657272_100000211451 [0,3,0,0,0,0|0,0,0]=3 16744 B13R1.460 CNCC(=O)c1cccc(c1)OC 7a_106832991635_100000211451 [0,3,0,0,0,0|0,0,0]=3 16745 B13R1.460 CNNC(=O)c1cccc(c1)C#N 22a_100016993582_100000183950 [0,3,0,0,0,0|0,0,0]=3 16746 B13R1.460 CNNC(=O)c1cccc(c1)CO 22a_100016993582_100000746274 [0,3,0,0,0,0|0,0,0]=3 16747 B13R1.460 CNNC(=O)c1cccc(c1)OC 22a_100016993582_100000188888 [0,3,0,0,0,0|0,0,0]=3 16748 B13R1.460 CNNC(=O)c1cccc(c1)SC 22a_100016993582_100011217804 [0,3,0,0,0,0|0,0,0]=3 16749 B13R1.460 COCC(=O)c1cccc(c1)C#N 34a_100138415774_100000751541 [0,3,0,0,0,0|1,0,0]=4 16750 B13R1.460 COCC(=O)c1cccc(c1)OC 34a_100138415774_100000211451 [0,3,0,0,0,0|1,0,0]=4 16751 B13R1.460 COc1cccc(c1)C(=O)CCF 1458a_100000188888_100011217306 [0,3,0,0,0,0|1,0,0]=4 16752 B13R1.460 COc1cccc(c1)C(=O)CCO 1458a_100000188888_100000211926 [0,3,0,0,0,0|1,0,0]=4 16753 B13R1.460 COc1cccc(c1)C(=O)CSC 62a_100000211451_200000210301 [0,3,0,0,0,0|1,0,0]=4 16754 B13R1.460 COc1cccc(c1)C(=O)CSC 62a_200000210301_100000211451 [0,3,0,0,0,0|1,0,0]=4 16755 B13R1.460 COc1cccc(c1)C(=O)CS[13CH3] 62a_100000211451_200025704644 [0,3,0,0,0,0|1,0,0]=4 16756 B13R1.460 COc1cccc(c1)C(=O)CS[13CH3] 62a_200025704644_100000211451 [0,3,0,0,0,0|1,0,0]=4 16757 B13R1.460 CSCC(=O)c1cccc(c1)C#N 62a_200000210301_100000751541 [0,3,0,0,0,0|1,0,0]=4 16758 B13R1.460 CSc1cccc(c1)C(=O)CCF 1458a_100011217804_100011217306 [0,3,0,0,0,0|1,0,0]=4 16759 B13R1.460 CSc1cccc(c1)C(=O)CCO 1458a_100011217804_100000211926 [0,3,0,0,0,0|1,0,0]=4 16760 B13R1.460 N#Cc1cccc(c1)C(=O)CCF 1458a_100000183950_100011217306 [0,3,0,0,0,0|1,0,0]=4 16761 B13R1.460 N#Cc1cccc(c1)C(=O)CCO 1458a_100000183950_100000211926 [0,3,0,0,0,0|1,0,0]=4 16762 B13R1.460 O=C(CCF)c1cccc(c1)CO 1458a_100000746274_100011217306 [0,3,0,0,0,0|1,0,0]=4 16763 B13R1.460 O=C(CCO)c1cccc(c1)CO 1458a_100000746274_100000211926 [0,3,0,0,0,0|1,0,0]=4 16764 B13R1.460 [13CH3]SCC(=O)c1cccc(c1)C#N 62a_200025704644_100000751541 [0,3,0,0,0,0|1,0,0]=4 16765 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [0,3,0,0,0,0|1,0,0]=4 16766 B13R1.24 C#CCCNC(=O)c1ccccc1 11a_100000755551_100000185807 [0,3,0,0,0,0|0,0,0]=3 16767 B13R1.24 C#CCCNC(=O)c1ccccc1 1626a_100000755551_100000185807 [0,3,0,0,0,0|0,0,0]=3 16768 B13R1.24 C#CCCNC(=O)c1ccccc1 240690a_100000755551_100000185807 [0,3,0,0,0,0|0,0,0]=3 16769 B13R1.24 C#CCCNC(=O)c1ccccc1 527a_100000755551_100000185807 [0,3,0,0,0,0|0,0,0]=3 16770 B13R1.24 C#CCNCC(=O)c1ccccn1 34a_100000212058_100000027445 [0,3,0,0,0,0|1,0,0]=4 16771 B13R1.24 C#CCSCC(=O)c1ccccc1 62a_100000038162_100000211460 [0,3,0,0,0,0|1,0,0]=4 16772 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [0,3,0,0,0,0|1,0,0]=4 16773 B13R1.24 C=CCCNC(=O)c1ccccc1 11a_100015191253_100000185807 [0,3,0,0,0,0|0,0,0]=3 16774 B13R1.24 C=CCCNC(=O)c1ccccc1 1626a_100015191253_100000185807 [0,3,0,0,0,0|0,0,0]=3 16775 B13R1.24 C=CCCNC(=O)c1ccccc1 240690a_100015191253_100000185807 [0,3,0,0,0,0|0,0,0]=3 16776 B13R1.24 C=CCCNC(=O)c1ccccc1 527a_100015191253_100000185807 [0,3,0,0,0,0|0,0,0]=3 16777 B13R1.24 C=CCNNC(=O)c1ccccc1 22a_100020588587_100000185807 [0,3,0,0,0,0|0,0,0]=3 16778 B13R1.24 C=CCSCC(=O)c1ccccc1 62a_100000210623_100000211460 [0,3,0,0,0,0|1,0,0]=4 16779 B13R1.24 C=CCSCC(=O)c1ccccc1 62a_100000211460_100000210623 [0,3,0,0,0,0|1,0,0]=4 16780 B13R1.24 C=COCCC(=O)c1ccccc1 1458a_100000185807_100000039644 [0,3,0,0,0,0|1,0,0]=4 16781 B13R1.24 CC#CCNC(=O)c1ccccc1 11a_100000685387_100000185807 [0,3,0,0,0,0|0,0,0]=3 16782 B13R1.24 CC#CCNC(=O)c1ccccc1 1626a_100000685387_100000185807 [0,3,0,0,0,0|0,0,0]=3 16783 B13R1.24 CC#CCNC(=O)c1ccccc1 527a_100000685387_100000185807 [0,3,0,0,0,0|0,0,0]=3 16784 B13R1.24 CC(=NNCCO)c1ccccc1 4a_100000210001_100000185851 [0,3,0,0,0,0|1,0,0]=4 16785 B13R1.24 CC/C=C\CC(=O)c1ccccc1 1458a_100000185807_100103147603 [0,3,0,0,0,0|1,0,0]=4 16786 B13R1.24 CCC#CCC(=O)c1ccccc1 1458a_100000185807_100009813939 [0,3,0,0,0,0|1,0,0]=4 16787 B13R1.24 CCC=NNC(=O)c1ccccc1 4a_100000184135_100000210100 [0,3,0,0,0,0|0,0,0]=3 16788 B13R1.24 CCC=NNC(=O)c1ccccn1 4a_100000184044_100000210100 [0,3,0,0,0,0|1,0,0]=4 16789 B13R1.24 CCC=NNC(=O)c1cccnc1 4a_100000189771_100000210100 [0,3,0,0,0,0|1,0,0]=4 16790 B13R1.24 CCC=NNC(=O)c1ccncc1 4a_100000189768_100000210100 [0,3,0,0,0,0|1,0,0]=4 16791 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [0,3,0,0,0,0|1,0,0]=4 16792 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16793 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16794 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16795 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16796 B13R1.24 CCCNN=C(C)c1ccccc1 4a_100000740057_100000185851 [0,3,0,0,0,0|1,0,0]=4 16797 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [0,3,0,0,0,0|0,0,0]=3 16798 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [0,3,0,0,0,0|1,0,0]=4 16799 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [0,3,0,0,0,0|1,0,0]=4 16800 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [0,3,0,0,0,0|0,0,0]=3 16801 B13R1.24 CCNCCS(=O)c1ccccc1 2230a_100015525214_100000740319 [0,3,0,0,0,0|1,0,0]=4 16802 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [0,3,0,0,0,0|1,0,0]=4 16803 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [0,3,0,0,0,0|1,0,0]=4 16804 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [0,3,0,0,0,0|1,0,0]=4 16805 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [0,3,0,0,0,0|1,0,0]=4 16806 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [0,3,0,0,0,0|1,0,0]=4 16807 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [0,3,0,0,0,0|1,0,0]=4 16808 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [0,3,0,0,0,0|0,0,0]=3 16809 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [0,3,0,0,0,0|0,0,0]=3 16810 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [0,3,0,0,0,0|0,0,0]=3 16811 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [0,3,0,0,0,0|0,0,0]=3 16812 B13R1.24 CNCCNC(=O)c1ccncc1 2230a_200011198449_200000210301 [0,3,0,0,0,0|1,0,0]=4 16813 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [0,3,0,0,0,0|0,0,0]=3 16814 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [0,3,0,0,0,0|0,0,0]=3 16815 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [0,3,0,0,0,0|1,0,0]=4 16816 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [0,3,0,0,0,0|0,0,0]=3 16817 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [0,3,0,0,0,0|0,0,0]=3 16818 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [0,3,0,0,0,0|0,0,0]=3 16819 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [0,3,0,0,0,0|0,0,0]=3 16820 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [0,3,0,0,0,0|0,0,0]=3 16821 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [0,3,0,0,0,0|1,0,0]=4 16822 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [0,3,0,0,0,0|1,0,0]=4 16823 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [0,3,0,0,0,0|1,0,0]=4 16824 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [0,3,0,0,0,0|1,0,0]=4 16825 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [0,3,0,0,0,0|1,0,0]=4 16826 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [0,3,0,0,0,0|1,0,0]=4 16827 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [0,3,0,0,0,0|0,0,0]=3 16828 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [0,3,0,0,0,0|0,0,0]=3 16829 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [0,3,0,0,0,0|0,0,0]=3 16830 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [0,3,0,0,0,0|0,0,0]=3 16831 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [0,3,0,0,0,0|0,0,0]=3 16832 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [0,3,0,0,0,0|0,0,0]=3 16833 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [0,3,0,0,0,0|1,0,0]=4 16834 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [0,3,0,0,0,0|1,0,0]=4 16835 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100000211460_100011218213 [0,3,0,0,0,0|1,0,0]=4 16836 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100011218213_100000211460 [0,3,0,0,0,0|1,0,0]=4 16837 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [0,3,0,0,0,0|1,0,0]=4 16838 B13R1.24 N#CCCNC(=O)c1ccccc1 11a_100000720768_100000185807 [0,3,0,0,0,0|0,0,0]=3 16839 B13R1.24 N#CCCNC(=O)c1ccccc1 1626a_100000720768_100000185807 [0,3,0,0,0,0|0,0,0]=3 16840 B13R1.24 N#CCCNC(=O)c1ccccc1 240690a_100000720768_100000185807 [0,3,0,0,0,0|0,0,0]=3 16841 B13R1.24 N#CCCNC(=O)c1ccccc1 527a_100000720768_100000185807 [0,3,0,0,0,0|0,0,0]=3 16842 B13R1.24 N#CCSCC(=O)c1ccccc1 62a_100000211460_100011215382 [0,3,0,0,0,0|1,0,0]=4 16843 B13R1.24 N#CCSCC(=O)c1ccccc1 62a_100011215382_100000211460 [0,3,0,0,0,0|1,0,0]=4 16844 B13R1.24 O=C(CC#CCO)c1ccccc1 1458a_100000185807_200000047223 [0,3,0,0,0,0|1,0,0]=4 16845 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [0,3,0,0,0,0|1,0,0]=4 16846 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [0,3,0,0,0,0|1,0,0]=4 16847 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [0,3,0,0,0,0|1,0,0]=4 16848 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [0,3,0,0,0,0|1,0,0]=4 16849 B13R1.24 O=C(CNCCF)c1ccccn1 34a_100000724931_100000027445 [0,3,0,0,0,0|1,0,0]=4 16850 B13R1.24 O=C(CNCCO)c1ccccn1 34a_100016990907_100000027445 [0,3,0,0,0,0|1,0,0]=4 16851 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [0,3,0,0,0,0|1,0,0]=4 16852 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [0,3,0,0,0,0|1,0,0]=4 16853 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [0,3,0,0,0,0|1,0,0]=4 16854 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [0,3,0,0,0,0|1,0,0]=4 16855 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [0,3,0,0,0,0|0,0,0]=3 16856 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [0,3,0,0,0,0|0,0,0]=3 16857 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [0,3,0,0,0,0|0,0,0]=3 16858 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [0,3,0,0,0,0|0,0,0]=3 16859 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [0,3,0,0,0,0|0,0,0]=3 16860 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [0,3,0,0,0,0|0,0,0]=3 16861 B13R1.24 O=C(NNCCO)c1ccccc1 22a_100000210001_100000185807 [0,3,0,0,0,0|0,0,0]=3 16862 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100000073877_100015361967 [0,3,0,0,0,0|1,0,0]=4 16863 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100015361967_100000073877 [0,3,0,0,0,0|1,0,0]=4 16864 B13R1.24 O=CCSCC(=O)c1ccccc1 62a_100000211460_200015260668 [0,3,0,0,0,0|1,0,0]=4 16865 B13R1.24 O=CCSCC(=O)c1ccccc1 62a_200015260668_100000211460 [0,3,0,0,0,0|1,0,0]=4 16866 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [0,3,0,0,0,0|0,0,0]=3 16867 B13R1.24 [13CH3]NCCNC(=O)c1ccncc1 2230a_200011198449_200025704644 [0,3,0,0,0,0|1,0,0]=4 16868 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [0,3,0,0,0,0|0,0,0]=3 16869 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [0,3,0,0,0,0|0,0,0]=3 16870 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [0,3,0,0,0,0|1,0,0]=4 16871 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [0,3,0,0,0,0|1,0,0]=4 16872 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [0,3,0,0,0,0|1,0,0]=4 16873 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [0,3,0,0,0,0|0,0,0]=3 16874 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [0,3,0,0,0,0|0,0,0]=3 16875 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [0,3,0,0,0,0|1,0,0]=4 16876 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [0,3,0,0,0,0|1,0,0]=4 16877 B13R1.45 C=C(C)CCC(=O)c1ccccc1 1458a_100000185807_100000730704 [0,3,0,0,0,0|1,0,0]=4 16878 B13R1.45 C=C(C)CNC(=O)c1ccccc1 11a_100000765925_100000185807 [0,3,0,0,0,0|0,0,0]=3 16879 B13R1.45 C=C(C)CNC(=O)c1ccccc1 1626a_100000765925_100000185807 [0,3,0,0,0,0|0,0,0]=3 16880 B13R1.45 C=C(C)CNC(=O)c1ccccc1 240690a_100000765925_100000185807 [0,3,0,0,0,0|0,0,0]=3 16881 B13R1.45 C=C(C)CNC(=O)c1ccccc1 527a_100000765925_100000185807 [0,3,0,0,0,0|0,0,0]=3 16882 B13R1.45 CC(=CCC(=O)c1ccccc1)C 1458a_100000185807_100000761012 [0,3,0,0,0,0|1,0,0]=4 16883 B13R1.45 CC(=NNC(C)C)c1ccccc1 4a_100000741168_100000185851 [0,3,0,0,0,0|1,0,0]=4 16884 B13R1.45 CC(=O)CCC(=O)c1ccccc1 1458a_100000070787_100000750707 [0,3,0,0,0,0|1,0,0]=4 16885 B13R1.45 CC(=O)CNC(=O)c1ccccc1 1458a_100000182045_200000210301 [0,3,0,0,0,0|0,0,0]=3 16886 B13R1.45 CC(=O)CNC(=O)c1cccnc1 1458a_100000688122_200000210301 [0,3,0,0,0,0|1,0,0]=4 16887 B13R1.45 CC(=O)COC(=O)c1ccccc1 1458a_100000070787_100000073877 [0,3,0,0,0,0|1,0,0]=4 16888 B13R1.45 CC(=O)NN=C(C)c1ccccc1 4a_100000189765_100000185851 [0,3,0,0,0,0|1,0,0]=4 16889 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000184135_100000070787 [0,3,0,0,0,0|0,0,0]=3 16890 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000189765_100000185807 [0,3,0,0,0,0|0,0,0]=3 16891 B13R1.45 CC(=O)NNC(=O)c1ccccn1 22a_100000184044_100000070787 [0,3,0,0,0,0|1,0,0]=4 16892 B13R1.45 CC(=O)NNC(=O)c1cccnc1 22a_100000189771_100000070787 [0,3,0,0,0,0|1,0,0]=4 16893 B13R1.45 CC(=O)NNC(=O)c1ccncc1 22a_100000189768_100000070787 [0,3,0,0,0,0|1,0,0]=4 16894 B13R1.45 CC(C)CCC(=O)c1ccccc1 1458a_100000185807_100000210312 [0,3,0,0,0,0|1,0,0]=4 16895 B13R1.45 CC(C)CNC(=O)c1ccccc1 11a_100000210953_100000185807 [0,3,0,0,0,0|0,0,0]=3 16896 B13R1.45 CC(C)CNC(=O)c1ccccc1 1626a_100000210953_100000185807 [0,3,0,0,0,0|0,0,0]=3 16897 B13R1.45 CC(C)CNC(=O)c1ccccc1 240690a_100000210953_100000185807 [0,3,0,0,0,0|0,0,0]=3 16898 B13R1.45 CC(C)CNC(=O)c1ccccc1 527a_100000210953_100000185807 [0,3,0,0,0,0|0,0,0]=3 16899 B13R1.45 CC(C)NCC(=O)c1ccccn1 34a_100138425928_100000027445 [0,3,0,0,0,0|1,0,0]=4 16900 B13R1.45 CC(C)NNC(=O)c1ccccc1 22a_100000741168_100000185807 [0,3,0,0,0,0|0,0,0]=3 16901 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000210206_100000211460 [0,3,0,0,0,0|1,0,0]=4 16902 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000211460_100000210206 [0,3,0,0,0,0|1,0,0]=4 16903 B13R1.45 CC(O)CCC(=O)c1ccccc1 1458a_100000185807_100012276601 [0,3,0,0,0,0|1,0,0]=4 16904 B13R1.45 CC(O)CNC(=O)c1ccccc1 11a_100000210904_100000185807 [0,3,0,0,0,0|0,0,0]=3 16905 B13R1.45 CC(O)CNC(=O)c1ccccc1 240690a_100000210904_100000185807 [0,3,0,0,0,0|0,0,0]=3 16906 B13R1.45 CC(O)CNC(=O)c1ccccc1 527a_100000210904_100000185807 [0,3,0,0,0,0|0,0,0]=3 16907 B13R1.45 CN(C)CCC(=O)c1ccccc1 2230a_100102631434_100000750707 [0,3,0,0,0,0|0,0,0]=3 16908 B13R1.45 CN(C)CCC(=O)c1ccccc1 269982a_100102631434_100000750707 [0,3,0,0,0,0|0,0,0]=3 16909 B13R1.45 CN(C)CCS(=O)c1ccccc1 2230a_100102631434_100000740319 [0,3,0,0,0,0|1,0,0]=4 16910 B13R1.45 CN(C)CCS(=O)c1ccccc1 269982a_100102631434_100000740319 [0,3,0,0,0,0|1,0,0]=4 16911 B13R1.45 CN(C)COC(=O)c1ccccc1 269982a_100102631434_100000073877 [0,3,0,0,0,0|0,0,0]=3 16912 B13R1.45 NC(=O)CNC(=O)c1ccccc1 11a_100000711301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16913 B13R1.45 NC(=O)CNC(=O)c1ccccc1 240690a_100000711301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16914 B13R1.45 NC(=O)CNC(=O)c1ccccc1 527a_100000711301_100000185807 [0,3,0,0,0,0|0,0,0]=3 16915 B13R1.45 O=C(NCC(F)F)c1ccccc1 11a_100000765723_100000185807 [0,3,0,0,0,0|0,0,0]=3 16916 B13R1.45 O=C(NCC(F)F)c1ccccc1 1626a_100000765723_100000185807 [0,3,0,0,0,0|0,0,0]=3 16917 B13R1.45 O=C(NCC(F)F)c1ccccc1 240690a_100000765723_100000185807 [0,3,0,0,0,0|0,0,0]=3 16918 B13R1.45 O=C(NCC(F)F)c1ccccc1 527a_100000765723_100000185807 [0,3,0,0,0,0|0,0,0]=3 16919 B13R1.45 [13CH3]C(=O)CNC(=O)c1ccccc1 1458a_100000182045_200025704644 [0,3,0,0,0,0|0,0,0]=3 16920 B13R1.45 [13CH3]C(=O)CNC(=O)c1cccnc1 1458a_100000688122_200025704644 [0,3,0,0,0,0|1,0,0]=4 16921 B13R1.674 C#CCCC(=O)c1ccccc1Br 1458a_100000188424_100000753159 [0,3,0,0,0,0|1,0,0]=4 16922 B13R1.674 C#CCCC(=O)c1ccccc1C 1458a_100000212026_100000753159 [0,3,0,0,0,0|1,0,0]=4 16923 B13R1.674 C#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000753159 [0,3,0,0,0,0|1,0,0]=4 16924 B13R1.674 C#CCCC(=O)c1ccccc1F 1458a_100000188656_100000753159 [0,3,0,0,0,0|1,0,0]=4 16925 B13R1.674 C#CCCC(=O)c1ccccc1I 1458a_100000187884_100000753159 [0,3,0,0,0,0|1,0,0]=4 16926 B13R1.674 C#CCCC(=O)c1ccccc1O 1458a_100015234032_100000753159 [0,3,0,0,0,0|1,0,0]=4 16927 B13R1.674 C#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000753159 [0,3,0,0,0,0|1,0,0]=4 16928 B13R1.674 C#CCNC(=O)c1ccccc1Br 11a_100000212058_100000188424 [0,3,0,0,0,0|0,0,0]=3 16929 B13R1.674 C#CCNC(=O)c1ccccc1Br 1626a_100000212058_100000188424 [0,3,0,0,0,0|0,0,0]=3 16930 B13R1.674 C#CCNC(=O)c1ccccc1Br 240690a_100000212058_100000188424 [0,3,0,0,0,0|0,0,0]=3 16931 B13R1.674 C#CCNC(=O)c1ccccc1Br 527a_100000212058_100000188424 [0,3,0,0,0,0|0,0,0]=3 16932 B13R1.674 C#CCNC(=O)c1ccccc1C 11a_100000212058_100000212026 [0,3,0,0,0,0|0,0,0]=3 16933 B13R1.674 C#CCNC(=O)c1ccccc1C 1626a_100000212058_100000212026 [0,3,0,0,0,0|0,0,0]=3 16934 B13R1.674 C#CCNC(=O)c1ccccc1C 240690a_100000212058_100000212026 [0,3,0,0,0,0|0,0,0]=3 16935 B13R1.674 C#CCNC(=O)c1ccccc1C 527a_100000212058_100000212026 [0,3,0,0,0,0|0,0,0]=3 16936 B13R1.674 C#CCNC(=O)c1ccccc1Cl 11a_100000212058_100000185844 [0,3,0,0,0,0|0,0,0]=3 16937 B13R1.674 C#CCNC(=O)c1ccccc1Cl 1626a_100000212058_100000185844 [0,3,0,0,0,0|0,0,0]=3 16938 B13R1.674 C#CCNC(=O)c1ccccc1Cl 240690a_100000212058_100000185844 [0,3,0,0,0,0|0,0,0]=3 16939 B13R1.674 C#CCNC(=O)c1ccccc1Cl 527a_100000212058_100000185844 [0,3,0,0,0,0|0,0,0]=3 16940 B13R1.674 C#CCNC(=O)c1ccccc1F 11a_100000212058_100000188656 [0,3,0,0,0,0|0,0,0]=3 16941 B13R1.674 C#CCNC(=O)c1ccccc1F 1626a_100000212058_100000188656 [0,3,0,0,0,0|0,0,0]=3 16942 B13R1.674 C#CCNC(=O)c1ccccc1F 240690a_100000212058_100000188656 [0,3,0,0,0,0|0,0,0]=3 16943 B13R1.674 C#CCNC(=O)c1ccccc1F 527a_100000212058_100000188656 [0,3,0,0,0,0|0,0,0]=3 16944 B13R1.674 C#CCNC(=O)c1ccccc1I 11a_100000212058_100000187884 [0,3,0,0,0,0|0,0,0]=3 16945 B13R1.674 C#CCNC(=O)c1ccccc1I 1626a_100000212058_100000187884 [0,3,0,0,0,0|0,0,0]=3 16946 B13R1.674 C#CCNC(=O)c1ccccc1I 240690a_100000212058_100000187884 [0,3,0,0,0,0|0,0,0]=3 16947 B13R1.674 C#CCNC(=O)c1ccccc1I 527a_100000212058_100000187884 [0,3,0,0,0,0|0,0,0]=3 16948 B13R1.674 C#CCNC(=O)c1ccccc1O 240690a_100000212058_100015234032 [0,3,0,0,0,0|0,0,0]=3 16949 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 1626a_100000212058_100009911694 [0,3,0,0,0,0|0,0,0]=3 16950 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 240690a_100000212058_100009911694 [0,3,0,0,0,0|0,0,0]=3 16951 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 527a_100000212058_100009911694 [0,3,0,0,0,0|0,0,0]=3 16952 B13R1.674 C/C=C/CC(=O)c1ccccc1Br 1458a_100000188424_100102629194 [0,3,0,0,0,0|1,0,0]=4 16953 B13R1.674 C/C=C/CC(=O)c1ccccc1C 1458a_100000212026_100102629194 [0,3,0,0,0,0|1,0,0]=4 16954 B13R1.674 C/C=C/CC(=O)c1ccccc1Cl 1458a_100000185844_100102629194 [0,3,0,0,0,0|1,0,0]=4 16955 B13R1.674 C/C=C/CC(=O)c1ccccc1F 1458a_100000188656_100102629194 [0,3,0,0,0,0|1,0,0]=4 16956 B13R1.674 C/C=C/CC(=O)c1ccccc1I 1458a_100000187884_100102629194 [0,3,0,0,0,0|1,0,0]=4 16957 B13R1.674 C/C=C/CC(=O)c1ccccc1O 1458a_100015234032_100102629194 [0,3,0,0,0,0|1,0,0]=4 16958 B13R1.674 C/C=C/CC(=O)c1ccccc1[O-] 1458a_100009911694_100102629194 [0,3,0,0,0,0|1,0,0]=4 16959 B13R1.674 C=CCCC(=O)c1ccccc1Br 1458a_100000188424_100000754431 [0,3,0,0,0,0|1,0,0]=4 16960 B13R1.674 C=CCCC(=O)c1ccccc1C 1458a_100000212026_100000754431 [0,3,0,0,0,0|1,0,0]=4 16961 B13R1.674 C=CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000754431 [0,3,0,0,0,0|1,0,0]=4 16962 B13R1.674 C=CCCC(=O)c1ccccc1F 1458a_100000188656_100000754431 [0,3,0,0,0,0|1,0,0]=4 16963 B13R1.674 C=CCCC(=O)c1ccccc1I 1458a_100000187884_100000754431 [0,3,0,0,0,0|1,0,0]=4 16964 B13R1.674 C=CCCC(=O)c1ccccc1O 1458a_100015234032_100000754431 [0,3,0,0,0,0|1,0,0]=4 16965 B13R1.674 C=CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000754431 [0,3,0,0,0,0|1,0,0]=4 16966 B13R1.674 C=CCNC(=O)c1ccccc1Br 1626a_100020586998_100000188424 [0,3,0,0,0,0|0,0,0]=3 16967 B13R1.674 C=CCNC(=O)c1ccccc1Br 240690a_100020586998_100000188424 [0,3,0,0,0,0|0,0,0]=3 16968 B13R1.674 C=CCNC(=O)c1ccccc1Br 527a_100020586998_100000188424 [0,3,0,0,0,0|0,0,0]=3 16969 B13R1.674 C=CCNC(=O)c1ccccc1C 1626a_100020586998_100000212026 [0,3,0,0,0,0|0,0,0]=3 16970 B13R1.674 C=CCNC(=O)c1ccccc1C 240690a_100020586998_100000212026 [0,3,0,0,0,0|0,0,0]=3 16971 B13R1.674 C=CCNC(=O)c1ccccc1C 527a_100020586998_100000212026 [0,3,0,0,0,0|0,0,0]=3 16972 B13R1.674 C=CCNC(=O)c1ccccc1Cl 1626a_100020586998_100000185844 [0,3,0,0,0,0|0,0,0]=3 16973 B13R1.674 C=CCNC(=O)c1ccccc1Cl 240690a_100020586998_100000185844 [0,3,0,0,0,0|0,0,0]=3 16974 B13R1.674 C=CCNC(=O)c1ccccc1Cl 527a_100020586998_100000185844 [0,3,0,0,0,0|0,0,0]=3 16975 B13R1.674 C=CCNC(=O)c1ccccc1F 1626a_100020586998_100000188656 [0,3,0,0,0,0|0,0,0]=3 16976 B13R1.674 C=CCNC(=O)c1ccccc1F 240690a_100020586998_100000188656 [0,3,0,0,0,0|0,0,0]=3 16977 B13R1.674 C=CCNC(=O)c1ccccc1F 527a_100020586998_100000188656 [0,3,0,0,0,0|0,0,0]=3 16978 B13R1.674 C=CCNC(=O)c1ccccc1I 1626a_100020586998_100000187884 [0,3,0,0,0,0|0,0,0]=3 16979 B13R1.674 C=CCNC(=O)c1ccccc1I 240690a_100020586998_100000187884 [0,3,0,0,0,0|0,0,0]=3 16980 B13R1.674 C=CCNC(=O)c1ccccc1I 527a_100020586998_100000187884 [0,3,0,0,0,0|0,0,0]=3 16981 B13R1.674 C=CCNC(=O)c1ccccc1O 240690a_100020586998_100015234032 [0,3,0,0,0,0|0,0,0]=3 16982 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 1626a_100020586998_100009911694 [0,3,0,0,0,0|0,0,0]=3 16983 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 240690a_100020586998_100009911694 [0,3,0,0,0,0|0,0,0]=3 16984 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 527a_100020586998_100009911694 [0,3,0,0,0,0|0,0,0]=3 16985 B13R1.674 CC#CCC(=O)c1ccccc1Br 1458a_100000188424_100000748600 [0,3,0,0,0,0|1,0,0]=4 16986 B13R1.674 CC#CCC(=O)c1ccccc1C 1458a_100000212026_100000748600 [0,3,0,0,0,0|1,0,0]=4 16987 B13R1.674 CC#CCC(=O)c1ccccc1Cl 1458a_100000185844_100000748600 [0,3,0,0,0,0|1,0,0]=4 16988 B13R1.674 CC#CCC(=O)c1ccccc1F 1458a_100000188656_100000748600 [0,3,0,0,0,0|1,0,0]=4 16989 B13R1.674 CC#CCC(=O)c1ccccc1I 1458a_100000187884_100000748600 [0,3,0,0,0,0|1,0,0]=4 16990 B13R1.674 CC#CCC(=O)c1ccccc1O 1458a_100015234032_100000748600 [0,3,0,0,0,0|1,0,0]=4 16991 B13R1.674 CC#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000748600 [0,3,0,0,0,0|1,0,0]=4 16992 B13R1.674 CC=CCC(=O)c1ccccc1Br 1458a_100000188424_100000070051 [0,3,0,0,0,0|1,0,0]=4 16993 B13R1.674 CC=CCC(=O)c1ccccc1C 1458a_100000212026_100000070051 [0,3,0,0,0,0|1,0,0]=4 16994 B13R1.674 CC=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000070051 [0,3,0,0,0,0|1,0,0]=4 16995 B13R1.674 CC=CCC(=O)c1ccccc1F 1458a_100000188656_100000070051 [0,3,0,0,0,0|1,0,0]=4 16996 B13R1.674 CC=CCC(=O)c1ccccc1I 1458a_100000187884_100000070051 [0,3,0,0,0,0|1,0,0]=4 16997 B13R1.674 CC=CCC(=O)c1ccccc1O 1458a_100015234032_100000070051 [0,3,0,0,0,0|1,0,0]=4 16998 B13R1.674 CC=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000070051 [0,3,0,0,0,0|1,0,0]=4 16999 B13R1.674 CC=NNC(=O)c1ccccc1Br 4a_100000183644_200000210099 [0,3,0,0,0,0|0,0,0]=3 17000 B13R1.674 CC=NNC(=O)c1ccccc1C 4a_100000181371_200000210099 [0,3,0,0,0,0|0,0,0]=3 17001 B13R1.674 CC=NNC(=O)c1ccccc1Cl 4a_100000186534_200000210099 [0,3,0,0,0,0|0,0,0]=3 17002 B13R1.674 CC=NNC(=O)c1ccccc1F 4a_100000183521_200000210099 [0,3,0,0,0,0|0,0,0]=3 17003 B13R1.674 CC=NNC(=O)c1ccccc1I 4a_100000190081_200000210099 [0,3,0,0,0,0|0,0,0]=3 17004 B13R1.674 CC=NNC(=O)c1cccnc1C 4a_100012021714_200000210099 [0,3,0,0,0,0|1,0,0]=4 17005 B13R1.674 CC=NNC(=O)c1ccncc1C 4a_100011996471_200000210099 [0,3,0,0,0,0|1,0,0]=4 17006 B13R1.674 CC=NNC(=O)c1ccncc1F 4a_100000702518_200000210099 [0,3,0,0,0,0|1,0,0]=4 17007 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [0,3,0,0,0,0|1,0,0]=4 17008 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [0,3,0,0,0,0|1,0,0]=4 17009 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [0,3,0,0,0,0|1,0,0]=4 17010 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [0,3,0,0,0,0|1,0,0]=4 17011 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [0,3,0,0,0,0|1,0,0]=4 17012 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [0,3,0,0,0,0|1,0,0]=4 17013 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [0,3,0,0,0,0|1,0,0]=4 17014 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [0,3,0,0,0,0|0,0,0]=3 17015 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [0,3,0,0,0,0|0,0,0]=3 17016 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [0,3,0,0,0,0|0,0,0]=3 17017 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [0,3,0,0,0,0|0,0,0]=3 17018 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [0,3,0,0,0,0|0,0,0]=3 17019 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [0,3,0,0,0,0|0,0,0]=3 17020 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [0,3,0,0,0,0|0,0,0]=3 17021 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [0,3,0,0,0,0|0,0,0]=3 17022 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [0,3,0,0,0,0|0,0,0]=3 17023 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [0,3,0,0,0,0|0,0,0]=3 17024 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [0,3,0,0,0,0|0,0,0]=3 17025 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [0,3,0,0,0,0|0,0,0]=3 17026 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [0,3,0,0,0,0|0,0,0]=3 17027 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [0,3,0,0,0,0|0,0,0]=3 17028 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [0,3,0,0,0,0|0,0,0]=3 17029 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [0,3,0,0,0,0|0,0,0]=3 17030 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [0,3,0,0,0,0|0,0,0]=3 17031 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [0,3,0,0,0,0|0,0,0]=3 17032 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [0,3,0,0,0,0|0,0,0]=3 17033 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [0,3,0,0,0,0|0,0,0]=3 17034 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [0,3,0,0,0,0|0,0,0]=3 17035 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [0,3,0,0,0,0|0,0,0]=3 17036 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [0,3,0,0,0,0|0,0,0]=3 17037 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [0,3,0,0,0,0|0,0,0]=3 17038 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [0,3,0,0,0,0|0,0,0]=3 17039 B13R1.674 CCCNC(=O)c1cccnc1O 271570a_203496583355_100000161721 [0,3,0,0,0,0|1,0,0]=4 17040 B13R1.674 CCNCC(=O)c1ccccc1C 2230a_100015525214_100000741374 [0,3,0,0,0,0|0,0,0]=3 17041 B13R1.674 CCNN=C(C)c1ccccc1Br 4a_100000756455_100000187085 [0,3,0,0,0,0|1,0,0]=4 17042 B13R1.674 CCNN=C(C)c1ccccc1C 4a_100000756455_100000211656 [0,3,0,0,0,0|1,0,0]=4 17043 B13R1.674 CCNN=C(C)c1ccccc1Cl 4a_100000756455_100000210134 [0,3,0,0,0,0|1,0,0]=4 17044 B13R1.674 CCNN=C(C)c1ccccc1F 4a_100000756455_100000210632 [0,3,0,0,0,0|1,0,0]=4 17045 B13R1.674 CCNN=C(C)c1ccccc1I 4a_100000756455_100000751169 [0,3,0,0,0,0|1,0,0]=4 17046 B13R1.674 CCNN=C(C)c1ccccc1O 4a_100000756455_100000188907 [0,3,0,0,0,0|1,0,0]=4 17047 B13R1.674 CCNNC(=O)c1ccccc1Br 22a_100000756455_100000188424 [0,3,0,0,0,0|0,0,0]=3 17048 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [0,3,0,0,0,0|0,0,0]=3 17049 B13R1.674 CCNNC(=O)c1ccccc1Cl 22a_100000756455_100000185844 [0,3,0,0,0,0|0,0,0]=3 17050 B13R1.674 CCNNC(=O)c1ccccc1F 22a_100000756455_100000188656 [0,3,0,0,0,0|0,0,0]=3 17051 B13R1.674 CCNNC(=O)c1ccccc1I 22a_100000756455_100000187884 [0,3,0,0,0,0|0,0,0]=3 17052 B13R1.674 CCNNC(=O)c1ccccc1O 22a_100000756455_100015234032 [0,3,0,0,0,0|0,0,0]=3 17053 B13R1.674 CCNNC(=O)c1ccccc1[O-] 22a_100000756455_100009911694 [0,3,0,0,0,0|0,0,0]=3 17054 B13R1.674 CCOCC(=O)c1ccccc1Br 34a_100121572206_100000199116 [0,3,0,0,0,0|1,0,0]=4 17055 B13R1.674 CCOCC(=O)c1ccccc1C 34a_100121572206_100000741374 [0,3,0,0,0,0|1,0,0]=4 17056 B13R1.674 CCOCC(=O)c1ccccc1Cl 34a_100121572206_100000211432 [0,3,0,0,0,0|1,0,0]=4 17057 B13R1.674 CCOCC(=O)c1ccccc1F 34a_100121572206_100000204681 [0,3,0,0,0,0|1,0,0]=4 17058 B13R1.674 CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210202 [0,3,0,0,0,0|1,0,0]=4 17059 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000210202_100000741374 [0,3,0,0,0,0|1,0,0]=4 17060 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000741374_100000210202 [0,3,0,0,0,0|1,0,0]=4 17061 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000210202_100000211432 [0,3,0,0,0,0|1,0,0]=4 17062 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210202 [0,3,0,0,0,0|1,0,0]=4 17063 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000204681_100000210202 [0,3,0,0,0,0|1,0,0]=4 17064 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000210202_100000204681 [0,3,0,0,0,0|1,0,0]=4 17065 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000188908_100000210202 [0,3,0,0,0,0|1,0,0]=4 17066 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000210202_100000188908 [0,3,0,0,0,0|1,0,0]=4 17067 B13R1.674 CNCCC(=O)c1ccccc1F 2230a_106832991635_100000086012 [0,3,0,0,0,0|0,0,0]=3 17068 B13R1.674 CNCCC(=O)c1ccccc1F 7a_106832991635_100000086012 [0,3,0,0,0,0|0,0,0]=3 17069 B13R1.674 CNCCC(=O)c1ccccc1O 7a_106832991635_100009873196 [0,3,0,0,0,0|0,0,0]=3 17070 B13R1.674 COCCC(=O)c1ccccc1Br 1458a_100000188424_100000233755 [0,3,0,0,0,0|1,0,0]=4 17071 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [0,3,0,0,0,0|1,0,0]=4 17072 B13R1.674 COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000233755 [0,3,0,0,0,0|1,0,0]=4 17073 B13R1.674 COCCC(=O)c1ccccc1F 1458a_100000188656_100000233755 [0,3,0,0,0,0|1,0,0]=4 17074 B13R1.674 COCCC(=O)c1ccccc1I 1458a_100000187884_100000233755 [0,3,0,0,0,0|1,0,0]=4 17075 B13R1.674 COCCC(=O)c1ccccc1O 1458a_100015234032_100000233755 [0,3,0,0,0,0|1,0,0]=4 17076 B13R1.674 COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000233755 [0,3,0,0,0,0|1,0,0]=4 17077 B13R1.674 CSCCC(=O)c1ccccc1Br 1458a_100000188424_100000751147 [0,3,0,0,0,0|1,0,0]=4 17078 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [0,3,0,0,0,0|1,0,0]=4 17079 B13R1.674 CSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000751147 [0,3,0,0,0,0|1,0,0]=4 17080 B13R1.674 CSCCC(=O)c1ccccc1F 1458a_100000188656_100000751147 [0,3,0,0,0,0|1,0,0]=4 17081 B13R1.674 CSCCC(=O)c1ccccc1F 62a_100000086012_200000210301 [0,3,0,0,0,0|1,0,0]=4 17082 B13R1.674 CSCCC(=O)c1ccccc1F 62a_200000210301_100000086012 [0,3,0,0,0,0|1,0,0]=4 17083 B13R1.674 CSCCC(=O)c1ccccc1I 1458a_100000187884_100000751147 [0,3,0,0,0,0|1,0,0]=4 17084 B13R1.674 CSCCC(=O)c1ccccc1O 1458a_100015234032_100000751147 [0,3,0,0,0,0|1,0,0]=4 17085 B13R1.674 CSCCC(=O)c1ccccc1O 62a_200000210301_100009873196 [0,3,0,0,0,0|1,0,0]=4 17086 B13R1.674 CSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000751147 [0,3,0,0,0,0|1,0,0]=4 17087 B13R1.674 Cc1ccccc1C(=O)CCC#N 1458a_100000212026_100011215226 [0,3,0,0,0,0|1,0,0]=4 17088 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [0,3,0,0,0,0|1,0,0]=4 17089 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [0,3,0,0,0,0|1,0,0]=4 17090 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100000741374_100015361967 [0,3,0,0,0,0|1,0,0]=4 17091 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100015361967_100000741374 [0,3,0,0,0,0|1,0,0]=4 17092 B13R1.674 Cc1ccccc1C(=O)NCC#N 1626a_100000734998_100000212026 [0,3,0,0,0,0|0,0,0]=3 17093 B13R1.674 Cc1ccccc1C(=O)NCC#N 527a_100000734998_100000212026 [0,3,0,0,0,0|0,0,0]=3 17094 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [0,3,0,0,0,0|0,0,0]=3 17095 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [0,3,0,0,0,0|0,0,0]=3 17096 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [0,3,0,0,0,0|0,0,0]=3 17097 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [0,3,0,0,0,0|0,0,0]=3 17098 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [0,3,0,0,0,0|0,0,0]=3 17099 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [0,3,0,0,0,0|0,0,0]=3 17100 B13R1.674 N#CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215226 [0,3,0,0,0,0|1,0,0]=4 17101 B13R1.674 N#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215226 [0,3,0,0,0,0|1,0,0]=4 17102 B13R1.674 N#CCCC(=O)c1ccccc1F 1458a_100000188656_100011215226 [0,3,0,0,0,0|1,0,0]=4 17103 B13R1.674 N#CCCC(=O)c1ccccc1I 1458a_100000187884_100011215226 [0,3,0,0,0,0|1,0,0]=4 17104 B13R1.674 N#CCCC(=O)c1ccccc1O 1458a_100015234032_100011215226 [0,3,0,0,0,0|1,0,0]=4 17105 B13R1.674 N#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215226 [0,3,0,0,0,0|1,0,0]=4 17106 B13R1.674 N#CCNC(=O)c1ccccc1Br 1626a_100000734998_100000188424 [0,3,0,0,0,0|0,0,0]=3 17107 B13R1.674 N#CCNC(=O)c1ccccc1Br 527a_100000734998_100000188424 [0,3,0,0,0,0|0,0,0]=3 17108 B13R1.674 N#CCNC(=O)c1ccccc1Cl 1626a_100000734998_100000185844 [0,3,0,0,0,0|0,0,0]=3 17109 B13R1.674 N#CCNC(=O)c1ccccc1Cl 527a_100000734998_100000185844 [0,3,0,0,0,0|0,0,0]=3 17110 B13R1.674 N#CCNC(=O)c1ccccc1F 1626a_100000734998_100000188656 [0,3,0,0,0,0|0,0,0]=3 17111 B13R1.674 N#CCNC(=O)c1ccccc1F 527a_100000734998_100000188656 [0,3,0,0,0,0|0,0,0]=3 17112 B13R1.674 N#CCNC(=O)c1ccccc1I 1626a_100000734998_100000187884 [0,3,0,0,0,0|0,0,0]=3 17113 B13R1.674 N#CCNC(=O)c1ccccc1I 527a_100000734998_100000187884 [0,3,0,0,0,0|0,0,0]=3 17114 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 1626a_100000734998_100009911694 [0,3,0,0,0,0|0,0,0]=3 17115 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 527a_100000734998_100009911694 [0,3,0,0,0,0|0,0,0]=3 17116 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [0,3,0,0,0,0|1,0,0]=4 17117 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [0,3,0,0,0,0|1,0,0]=4 17118 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [0,3,0,0,0,0|1,0,0]=4 17119 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [0,3,0,0,0,0|1,0,0]=4 17120 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [0,3,0,0,0,0|1,0,0]=4 17121 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [0,3,0,0,0,0|1,0,0]=4 17122 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [0,3,0,0,0,0|1,0,0]=4 17123 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [0,3,0,0,0,0|1,0,0]=4 17124 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [0,3,0,0,0,0|1,0,0]=4 17125 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [0,3,0,0,0,0|1,0,0]=4 17126 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [0,3,0,0,0,0|1,0,0]=4 17127 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [0,3,0,0,0,0|1,0,0]=4 17128 B13R1.674 O=C(CSCF)c1ccccc1Br 62a_100000199116_100015361967 [0,3,0,0,0,0|1,0,0]=4 17129 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100000211432_100015361967 [0,3,0,0,0,0|1,0,0]=4 17130 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100015361967_100000211432 [0,3,0,0,0,0|1,0,0]=4 17131 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100000204681_100015361967 [0,3,0,0,0,0|1,0,0]=4 17132 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100015361967_100000204681 [0,3,0,0,0,0|1,0,0]=4 17133 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100000188908_100015361967 [0,3,0,0,0,0|1,0,0]=4 17134 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100015361967_100000188908 [0,3,0,0,0,0|1,0,0]=4 17135 B13R1.674 O=C(NCCF)c1ccccc1Br 11a_100000724931_100000188424 [0,3,0,0,0,0|0,0,0]=3 17136 B13R1.674 O=C(NCCF)c1ccccc1Br 1626a_100000724931_100000188424 [0,3,0,0,0,0|0,0,0]=3 17137 B13R1.674 O=C(NCCF)c1ccccc1Br 240690a_100000724931_100000188424 [0,3,0,0,0,0|0,0,0]=3 17138 B13R1.674 O=C(NCCF)c1ccccc1Br 527a_100000724931_100000188424 [0,3,0,0,0,0|0,0,0]=3 17139 B13R1.674 O=C(NCCF)c1ccccc1Cl 11a_100000724931_100000185844 [0,3,0,0,0,0|0,0,0]=3 17140 B13R1.674 O=C(NCCF)c1ccccc1Cl 1626a_100000724931_100000185844 [0,3,0,0,0,0|0,0,0]=3 17141 B13R1.674 O=C(NCCF)c1ccccc1Cl 240690a_100000724931_100000185844 [0,3,0,0,0,0|0,0,0]=3 17142 B13R1.674 O=C(NCCF)c1ccccc1Cl 527a_100000724931_100000185844 [0,3,0,0,0,0|0,0,0]=3 17143 B13R1.674 O=C(NCCF)c1ccccc1F 11a_100000724931_100000188656 [0,3,0,0,0,0|0,0,0]=3 17144 B13R1.674 O=C(NCCF)c1ccccc1F 1626a_100000724931_100000188656 [0,3,0,0,0,0|0,0,0]=3 17145 B13R1.674 O=C(NCCF)c1ccccc1F 240690a_100000724931_100000188656 [0,3,0,0,0,0|0,0,0]=3 17146 B13R1.674 O=C(NCCF)c1ccccc1F 527a_100000724931_100000188656 [0,3,0,0,0,0|0,0,0]=3 17147 B13R1.674 O=C(NCCF)c1ccccc1I 11a_100000724931_100000187884 [0,3,0,0,0,0|0,0,0]=3 17148 B13R1.674 O=C(NCCF)c1ccccc1I 1626a_100000724931_100000187884 [0,3,0,0,0,0|0,0,0]=3 17149 B13R1.674 O=C(NCCF)c1ccccc1I 240690a_100000724931_100000187884 [0,3,0,0,0,0|0,0,0]=3 17150 B13R1.674 O=C(NCCF)c1ccccc1I 527a_100000724931_100000187884 [0,3,0,0,0,0|0,0,0]=3 17151 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [0,3,0,0,0,0|0,0,0]=3 17152 B13R1.674 O=C(NCCF)c1ccccc1[O-] 1626a_100000724931_100009911694 [0,3,0,0,0,0|0,0,0]=3 17153 B13R1.674 O=C(NCCF)c1ccccc1[O-] 240690a_100000724931_100009911694 [0,3,0,0,0,0|0,0,0]=3 17154 B13R1.674 O=C(NCCF)c1ccccc1[O-] 527a_100000724931_100009911694 [0,3,0,0,0,0|0,0,0]=3 17155 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [0,3,0,0,0,0|0,0,0]=3 17156 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [0,3,0,0,0,0|0,0,0]=3 17157 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [0,3,0,0,0,0|0,0,0]=3 17158 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [0,3,0,0,0,0|0,0,0]=3 17159 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [0,3,0,0,0,0|0,0,0]=3 17160 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [0,3,0,0,0,0|0,0,0]=3 17161 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [0,3,0,0,0,0|0,0,0]=3 17162 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [0,3,0,0,0,0|0,0,0]=3 17163 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [0,3,0,0,0,0|0,0,0]=3 17164 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [0,3,0,0,0,0|0,0,0]=3 17165 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [0,3,0,0,0,0|0,0,0]=3 17166 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [0,3,0,0,0,0|0,0,0]=3 17167 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_100000086012_200025704644 [0,3,0,0,0,0|1,0,0]=4 17168 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_200025704644_100000086012 [0,3,0,0,0,0|1,0,0]=4 17169 B13R1.674 [13CH3]SCCC(=O)c1ccccc1O 62a_200025704644_100009873196 [0,3,0,0,0,0|1,0,0]=4 17170 B13R1.201 C=C(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748629 [0,3,0,0,0,0|1,0,0]=4 17171 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [0,3,0,0,0,0|1,0,0]=4 17172 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748629 [0,3,0,0,0,0|1,0,0]=4 17173 B13R1.201 C=C(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748629 [0,3,0,0,0,0|1,0,0]=4 17174 B13R1.201 C=C(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748629 [0,3,0,0,0,0|1,0,0]=4 17175 B13R1.201 C=C(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748629 [0,3,0,0,0,0|1,0,0]=4 17176 B13R1.201 C=C(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748629 [0,3,0,0,0,0|1,0,0]=4 17177 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,3,0,0,0,0|1,0,0]=4 17178 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,3,0,0,0,0|1,0,0]=4 17179 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,3,0,0,0,0|1,0,0]=4 17180 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,3,0,0,0,0|1,0,0]=4 17181 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,3,0,0,0,0|1,0,0]=4 17182 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,3,0,0,0,0|1,0,0]=4 17183 B13R1.201 CC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000210624 [0,3,0,0,0,0|1,0,0]=4 17184 B13R1.201 CC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000210624 [0,3,0,0,0,0|1,0,0]=4 17185 B13R1.201 CC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000210624 [0,3,0,0,0,0|1,0,0]=4 17186 B13R1.201 CC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000210624 [0,3,0,0,0,0|1,0,0]=4 17187 B13R1.201 CC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000210624 [0,3,0,0,0,0|1,0,0]=4 17188 B13R1.201 CC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000210624 [0,3,0,0,0,0|1,0,0]=4 17189 B13R1.201 CC(C)NC(=O)c1ccccc1Br 11a_100138425928_100000188424 [0,3,0,0,0,0|0,0,0]=3 17190 B13R1.201 CC(C)NC(=O)c1ccccc1Br 1626a_100138425928_100000188424 [0,3,0,0,0,0|0,0,0]=3 17191 B13R1.201 CC(C)NC(=O)c1ccccc1Br 240690a_100138425928_100000188424 [0,3,0,0,0,0|0,0,0]=3 17192 B13R1.201 CC(C)NC(=O)c1ccccc1Br 527a_100138425928_100000188424 [0,3,0,0,0,0|0,0,0]=3 17193 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 11a_100138425928_100000185844 [0,3,0,0,0,0|0,0,0]=3 17194 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 1626a_100138425928_100000185844 [0,3,0,0,0,0|0,0,0]=3 17195 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 240690a_100138425928_100000185844 [0,3,0,0,0,0|0,0,0]=3 17196 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 527a_100138425928_100000185844 [0,3,0,0,0,0|0,0,0]=3 17197 B13R1.201 CC(C)NC(=O)c1ccccc1F 11a_100138425928_100000188656 [0,3,0,0,0,0|0,0,0]=3 17198 B13R1.201 CC(C)NC(=O)c1ccccc1F 1626a_100138425928_100000188656 [0,3,0,0,0,0|0,0,0]=3 17199 B13R1.201 CC(C)NC(=O)c1ccccc1F 240690a_100138425928_100000188656 [0,3,0,0,0,0|0,0,0]=3 17200 B13R1.201 CC(C)NC(=O)c1ccccc1F 527a_100138425928_100000188656 [0,3,0,0,0,0|0,0,0]=3 17201 B13R1.201 CC(C)NC(=O)c1ccccc1I 11a_100138425928_100000187884 [0,3,0,0,0,0|0,0,0]=3 17202 B13R1.201 CC(C)NC(=O)c1ccccc1I 1626a_100138425928_100000187884 [0,3,0,0,0,0|0,0,0]=3 17203 B13R1.201 CC(C)NC(=O)c1ccccc1I 240690a_100138425928_100000187884 [0,3,0,0,0,0|0,0,0]=3 17204 B13R1.201 CC(C)NC(=O)c1ccccc1I 527a_100138425928_100000187884 [0,3,0,0,0,0|0,0,0]=3 17205 B13R1.201 CC(C)NC(=O)c1ccccc1O 240690a_100138425928_100015234032 [0,3,0,0,0,0|0,0,0]=3 17206 B13R1.201 CC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152627 [0,3,0,0,0,0|0,0,0]=3 17207 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 1626a_100138425928_100009911694 [0,3,0,0,0,0|0,0,0]=3 17208 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 240690a_100138425928_100009911694 [0,3,0,0,0,0|0,0,0]=3 17209 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 527a_100138425928_100009911694 [0,3,0,0,0,0|0,0,0]=3 17210 B13R1.201 CC(C)OC(=O)c1ccccc1O 271570a_203496583355_100000169877 [0,3,0,0,0,0|1,0,0]=4 17211 B13R1.201 CC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218427 [0,3,0,0,0,0|1,0,0]=4 17212 B13R1.201 CC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218427 [0,3,0,0,0,0|1,0,0]=4 17213 B13R1.201 CC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218427 [0,3,0,0,0,0|1,0,0]=4 17214 B13R1.201 CC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218427 [0,3,0,0,0,0|1,0,0]=4 17215 B13R1.201 CC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218427 [0,3,0,0,0,0|1,0,0]=4 17216 B13R1.201 CC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218427 [0,3,0,0,0,0|1,0,0]=4 17217 B13R1.201 CN(C)CC(=O)c1ccccc1Br 269982a_100102631434_100000199116 [0,3,0,0,0,0|0,0,0]=3 17218 B13R1.201 CN(C)CC(=O)c1ccccc1Cl 269982a_100102631434_100000211432 [0,3,0,0,0,0|0,0,0]=3 17219 B13R1.201 CN(C)CC(=O)c1ccccc1F 269982a_100102631434_100000204681 [0,3,0,0,0,0|0,0,0]=3 17220 B13R1.201 CN(C)CC(=O)c1ccccc1O 269982a_100102631434_100000188908 [0,3,0,0,0,0|0,0,0]=3 17221 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [0,3,0,0,0,0|1,0,0]=4 17222 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [0,3,0,0,0,0|1,0,0]=4 17223 B13R1.201 Cc1ccccc1C(=O)CC(F)F 1458a_100000212026_100011934356 [0,3,0,0,0,0|1,0,0]=4 17224 B13R1.201 Cc1ccccc1C(=O)CN(C)C 2230a_100102631434_100000741374 [0,3,0,0,0,0|0,0,0]=3 17225 B13R1.201 Cc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000741374 [0,3,0,0,0,0|0,0,0]=3 17226 B13R1.201 Cc1ccccc1C(=O)NC(C)C 11a_100138425928_100000212026 [0,3,0,0,0,0|0,0,0]=3 17227 B13R1.201 Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000212026 [0,3,0,0,0,0|0,0,0]=3 17228 B13R1.201 Cc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000212026 [0,3,0,0,0,0|0,0,0]=3 17229 B13R1.201 Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100000212026 [0,3,0,0,0,0|0,0,0]=3 17230 B13R1.201 O=C(CC(F)F)c1ccccc1Br 1458a_100000188424_100011934356 [0,3,0,0,0,0|1,0,0]=4 17231 B13R1.201 O=C(CC(F)F)c1ccccc1Cl 1458a_100000185844_100011934356 [0,3,0,0,0,0|1,0,0]=4 17232 B13R1.201 O=C(CC(F)F)c1ccccc1F 1458a_100000188656_100011934356 [0,3,0,0,0,0|1,0,0]=4 17233 B13R1.201 O=C(CC(F)F)c1ccccc1I 1458a_100000187884_100011934356 [0,3,0,0,0,0|1,0,0]=4 17234 B13R1.201 O=C(CC(F)F)c1ccccc1O 1458a_100015234032_100011934356 [0,3,0,0,0,0|1,0,0]=4 17235 B13R1.201 O=C(CC(F)F)c1ccccc1[O-] 1458a_100009911694_100011934356 [0,3,0,0,0,0|1,0,0]=4 17236 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 11a_100000715429_100000185807 [0,3,0,0,0,0|0,0,0]=3 17237 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 1626a_100000715429_100000185807 [0,3,0,0,0,0|0,0,0]=3 17238 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 240690a_100000715429_100000185807 [0,3,0,0,0,0|0,0,0]=3 17239 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 527a_100000715429_100000185807 [0,3,0,0,0,0|0,0,0]=3 17240 B13R1.352 CS(=O)(=O)NC(=O)c1ccccc1 2740a_100000171171_100000185807 [0,3,0,0,0,0|0,0,0]=3 17241 B13R1.352 C[Si](C)(C)CC(=O)c1ccccc1 1458a_100000185807_100000233785 [0,3,0,0,0,0|1,0,0]=4 17242 B13R1.464 C#Cc1ccccc1C(=O)CCC 1458a_100011243808_100000210303 [0,3,0,0,0,0|1,0,0]=4 17243 B13R1.464 C#Cc1ccccc1C(=O)CCF 1458a_100011243808_100011217306 [0,3,0,0,0,0|1,0,0]=4 17244 B13R1.464 C#Cc1ccccc1C(=O)CCO 1458a_100011243808_100000211926 [0,3,0,0,0,0|1,0,0]=4 17245 B13R1.464 C#Cc1ccccc1C(=O)NCC 527a_100015525214_100011243808 [0,3,0,0,0,0|0,0,0]=3 17246 B13R1.464 C#Cc1ccccc1C(=O)NNC 22a_100016993582_100011243808 [0,3,0,0,0,0|0,0,0]=3 17247 B13R1.464 C=Cc1ccccc1C(=O)CCC 1458a_100011830265_100000210303 [0,3,0,0,0,0|1,0,0]=4 17248 B13R1.464 C=Cc1ccccc1C(=O)CCF 1458a_100011830265_100011217306 [0,3,0,0,0,0|1,0,0]=4 17249 B13R1.464 C=Cc1ccccc1C(=O)CCO 1458a_100011830265_100000211926 [0,3,0,0,0,0|1,0,0]=4 17250 B13R1.464 C=Cc1ccccc1C(=O)NCC 271570a_100011290941_200000155173 [0,3,0,0,0,0|0,0,0]=3 17251 B13R1.464 C=Cc1ccccc1C(=O)NNC 22a_100016993582_100011830265 [0,3,0,0,0,0|0,0,0]=3 17252 B13R1.464 C=Cc1ccccc1C(=O)OCC 271570a_100011290941_100000169879 [0,3,0,0,0,0|1,0,0]=4 17253 B13R1.464 C=Cc1ncccc1C(=O)NCC 271570a_100011290941_100000160120 [0,3,0,0,0,0|1,0,0]=4 17254 B13R1.464 CCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210303 [0,3,0,0,0,0|1,0,0]=4 17255 B13R1.464 CCCC(=O)c1ccccc1CC 1458a_100000689120_100000210303 [0,3,0,0,0,0|1,0,0]=4 17256 B13R1.464 CCCC(=O)c1ccccc1CO 1458a_100011301526_100000210303 [0,3,0,0,0,0|1,0,0]=4 17257 B13R1.464 CCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210303 [0,3,0,0,0,0|1,0,0]=4 17258 B13R1.464 CCCC(=O)c1ccccc1OC 1458a_100000185835_100000210303 [0,3,0,0,0,0|1,0,0]=4 17259 B13R1.464 CCCC(=O)c1ccccc1OC 34a_200000073644_200000210301 [0,3,0,0,0,0|1,0,0]=4 17260 B13R1.464 CCCC(=O)c1ccccc1OC 7a_200000073644_200000210301 [0,3,0,0,0,0|1,0,0]=4 17261 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 34a_200000073644_200025704644 [0,3,0,0,0,0|1,0,0]=4 17262 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 7a_200000073644_200025704644 [0,3,0,0,0,0|1,0,0]=4 17263 B13R1.464 CCCC(=O)c1ccccc1SC 1458a_100000183967_100000210303 [0,3,0,0,0,0|1,0,0]=4 17264 B13R1.464 CCNC(=O)c1ccccc1C#N 11a_100015525214_100000742908 [0,3,0,0,0,0|0,0,0]=3 17265 B13R1.464 CCNC(=O)c1ccccc1C#N 527a_100015525214_100000742908 [0,3,0,0,0,0|0,0,0]=3 17266 B13R1.464 CCNC(=O)c1ccccc1CC 11a_100015525214_100000689120 [0,3,0,0,0,0|0,0,0]=3 17267 B13R1.464 CCNC(=O)c1ccccc1CC 240690a_100015525214_100000689120 [0,3,0,0,0,0|0,0,0]=3 17268 B13R1.464 CCNC(=O)c1ccccc1CC 527a_100015525214_100000689120 [0,3,0,0,0,0|0,0,0]=3 17269 B13R1.464 CCNC(=O)c1ccccc1I=O 240690a_100015525214_100000032414 [0,3,0,0,0,0|0,0,0]=3 17270 B13R1.464 CCNC(=O)c1ccccc1I=O 527a_100015525214_100000032414 [0,3,0,0,0,0|0,0,0]=3 17271 B13R1.464 CCNC(=O)c1ccccc1NC 27a_100102657272_200000155173 [0,3,0,0,0,0|0,0,0]=3 17272 B13R1.464 CCNC(=O)c1ccccc1NC 34a_100000205978_200000210301 [0,3,0,0,0,0|0,0,0]=3 17273 B13R1.464 CCNC(=O)c1ccccc1N[13CH3] 34a_100000205978_200025704644 [0,3,0,0,0,0|0,0,0]=3 17274 B13R1.464 CCNC(=O)c1ccccc1OC 11a_100015525214_100000185835 [0,3,0,0,0,0|0,0,0]=3 17275 B13R1.464 CCNC(=O)c1ccccc1OC 240690a_100015525214_100000185835 [0,3,0,0,0,0|0,0,0]=3 17276 B13R1.464 CCNC(=O)c1ccccc1OC 34a_100000192205_200000210301 [0,3,0,0,0,0|0,0,0]=3 17277 B13R1.464 CCNC(=O)c1ccccc1OC 527a_100015525214_100000185835 [0,3,0,0,0,0|0,0,0]=3 17278 B13R1.464 CCNC(=O)c1ccccc1OC 7a_100000192205_200000210301 [0,3,0,0,0,0|0,0,0]=3 17279 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 34a_100000192205_200025704644 [0,3,0,0,0,0|0,0,0]=3 17280 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 7a_100000192205_200025704644 [0,3,0,0,0,0|0,0,0]=3 17281 B13R1.464 CCNC(=O)c1ccccc1SC 11a_100015525214_100000183967 [0,3,0,0,0,0|0,0,0]=3 17282 B13R1.464 CCNC(=O)c1ccccc1SC 240690a_100015525214_100000183967 [0,3,0,0,0,0|0,0,0]=3 17283 B13R1.464 CCNC(=O)c1ccccc1SC 527a_100015525214_100000183967 [0,3,0,0,0,0|0,0,0]=3 17284 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000155173_200000210301 [0,3,0,0,0,0|0,0,0]=3 17285 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000210301_200000155173 [0,3,0,0,0,0|0,0,0]=3 17286 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200000155173_200025704644 [0,3,0,0,0,0|0,0,0]=3 17287 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000155173 [0,3,0,0,0,0|0,0,0]=3 17288 B13R1.464 CCNC(=O)c1cccnc1NC 27a_100102657272_100000160120 [0,3,0,0,0,0|1,0,0]=4 17289 B13R1.464 CCNC(=O)c1cccnc1SC 62a_200000210301_100000160120 [0,3,0,0,0,0|1,0,0]=4 17290 B13R1.464 CCNC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000160120 [0,3,0,0,0,0|1,0,0]=4 17291 B13R1.464 CCOC(=O)c1ccccc1OC 7a_100000169922_200000210301 [0,3,0,0,0,0|1,0,0]=4 17292 B13R1.464 CCOC(=O)c1ccccc1O[13CH3] 7a_100000169922_200025704644 [0,3,0,0,0,0|1,0,0]=4 17293 B13R1.464 CCOC(=O)c1ccccc1SC 62a_100000169876_200000210301 [0,3,0,0,0,0|1,0,0]=4 17294 B13R1.464 CCOC(=O)c1ccccc1SC 62a_200000210301_100000169879 [0,3,0,0,0,0|1,0,0]=4 17295 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_100000169876_200025704644 [0,3,0,0,0,0|1,0,0]=4 17296 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000169879 [0,3,0,0,0,0|1,0,0]=4 17297 B13R1.464 CCc1ccccc1C(=O)CCF 1458a_100000689120_100011217306 [0,3,0,0,0,0|1,0,0]=4 17298 B13R1.464 CCc1ccccc1C(=O)CCO 1458a_100000689120_100000211926 [0,3,0,0,0,0|1,0,0]=4 17299 B13R1.464 CCc1ccccc1C(=O)NNC 22a_100016993582_100000689120 [0,3,0,0,0,0|0,0,0]=3 17300 B13R1.464 CNCC(=O)c1ccccc1OC 34a_100102657272_100000195505 [0,3,0,0,0,0|0,0,0]=3 17301 B13R1.464 CNCC(=O)c1ccccc1OC 7a_106832991635_100000195505 [0,3,0,0,0,0|0,0,0]=3 17302 B13R1.464 CNNC(=O)c1ccccc1C#N 22a_100016993582_100000742908 [0,3,0,0,0,0|0,0,0]=3 17303 B13R1.464 CNNC(=O)c1ccccc1I=O 22a_100016993582_100000032414 [0,3,0,0,0,0|0,0,0]=3 17304 B13R1.464 CNNC(=O)c1ccccc1OC 22a_100016993582_100000185835 [0,3,0,0,0,0|0,0,0]=3 17305 B13R1.464 CNNC(=O)c1ccccc1SC 22a_100016993582_100000183967 [0,3,0,0,0,0|0,0,0]=3 17306 B13R1.464 CNc1ccccc1C(=O)NOC 34a_100011599994_200000210301 [0,3,0,0,0,0|0,0,0]=3 17307 B13R1.464 COCC(=O)c1ccccc1OC 34a_100138415774_100000195505 [0,3,0,0,0,0|1,0,0]=4 17308 B13R1.464 CONC(=O)c1ccccc1N[13CH3] 34a_100011599994_200025704644 [0,3,0,0,0,0|0,0,0]=3 17309 B13R1.464 COc1ccccc1C(=O)CCCl 7a_100009873196_200000210301 [0,3,0,0,0,0|1,0,0]=4 17310 B13R1.464 COc1ccccc1C(=O)CCF 1458a_100000185835_100011217306 [0,3,0,0,0,0|1,0,0]=4 17311 B13R1.464 COc1ccccc1C(=O)CCO 1458a_100000185835_100000211926 [0,3,0,0,0,0|1,0,0]=4 17312 B13R1.464 COc1ccccc1C(=O)CSC 62a_100000195505_200000210301 [0,3,0,0,0,0|1,0,0]=4 17313 B13R1.464 COc1ccccc1C(=O)CS[13CH3] 62a_100000195505_200025704644 [0,3,0,0,0,0|1,0,0]=4 17314 B13R1.464 CSc1ccccc1C(=O)CCF 1458a_100000183967_100011217306 [0,3,0,0,0,0|1,0,0]=4 17315 B13R1.464 CSc1ccccc1C(=O)CCO 1458a_100000183967_100000211926 [0,3,0,0,0,0|1,0,0]=4 17316 B13R1.464 N#Cc1ccccc1C(=O)CCF 1458a_100000742908_100011217306 [0,3,0,0,0,0|1,0,0]=4 17317 B13R1.464 N#Cc1ccccc1C(=O)CCO 1458a_100000742908_100000211926 [0,3,0,0,0,0|1,0,0]=4 17318 B13R1.464 O=C(CCF)c1ccccc1CO 1458a_100011301526_100011217306 [0,3,0,0,0,0|1,0,0]=4 17319 B13R1.464 O=C(CCO)c1ccccc1CO 1458a_100011301526_100000211926 [0,3,0,0,0,0|1,0,0]=4 17320 B13R1.464 O=Ic1ccccc1C(=O)CCF 1458a_100000032414_100011217306 [0,3,0,0,0,0|1,0,0]=4 17321 B13R1.464 O=Ic1ccccc1C(=O)CCO 1458a_100000032414_100000211926 [0,3,0,0,0,0|1,0,0]=4 17322 B13R1.464 [13CH3]Oc1ccccc1C(=O)CCCl 7a_100009873196_200025704644 [0,3,0,0,0,0|1,0,0]=4 17323 B13R1.4453 CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210303 [0,3,0,0,0,0|1,0,0]=4 17324 B13R1.4453 CCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210303 [0,3,0,0,0,0|1,0,0]=4 17325 B13R1.4453 CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210303 [0,3,0,0,0,0|1,0,0]=4 17326 B13R1.4453 CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210303 [0,3,0,0,0,0|1,0,0]=4 17327 B13R1.4453 CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210303 [0,3,0,0,0,0|1,0,0]=4 17328 B13R1.4453 CCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210303 [0,3,0,0,0,0|1,0,0]=4 17329 B13R1.4453 CCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210303 [0,3,0,0,0,0|1,0,0]=4 17330 B13R1.4453 CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210303 [0,3,0,0,0,0|1,0,0]=4 17331 B13R1.4453 CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210303 [0,3,0,0,0,0|1,0,0]=4 17332 B13R1.4453 CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210303 [0,3,0,0,0,0|1,0,0]=4 17333 B13R1.4453 CCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210303 [0,3,0,0,0,0|1,0,0]=4 17334 B13R1.4453 CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210303 [0,3,0,0,0,0|1,0,0]=4 17335 B13R1.4453 CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210303 [0,3,0,0,0,0|1,0,0]=4 17336 B13R1.4453 CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210303 [0,3,0,0,0,0|1,0,0]=4 17337 B13R1.4453 CCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210303 [0,3,0,0,0,0|1,0,0]=4 17338 B13R1.4453 CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210303 [0,3,0,0,0,0|1,0,0]=4 17339 B13R1.4453 CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210303 [0,3,0,0,0,0|1,0,0]=4 17340 B13R1.4453 CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210303 [0,3,0,0,0,0|1,0,0]=4 17341 B13R1.4453 CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210303 [0,3,0,0,0,0|1,0,0]=4 17342 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 11a_100015525214_100000690891 [0,3,0,0,0,0|0,0,0]=3 17343 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 240690a_100015525214_100000690891 [0,3,0,0,0,0|0,0,0]=3 17344 B13R1.4453 CCNC(=O)c1c(cccc1Br)Br 527a_100015525214_100000690891 [0,3,0,0,0,0|0,0,0]=3 17345 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 11a_100015525214_100000701904 [0,3,0,0,0,0|0,0,0]=3 17346 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 240690a_100015525214_100000701904 [0,3,0,0,0,0|0,0,0]=3 17347 B13R1.4453 CCNC(=O)c1c(cccc1Br)C 527a_100015525214_100000701904 [0,3,0,0,0,0|0,0,0]=3 17348 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 11a_100015525214_100011253703 [0,3,0,0,0,0|0,0,0]=3 17349 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 240690a_100015525214_100011253703 [0,3,0,0,0,0|0,0,0]=3 17350 B13R1.4453 CCNC(=O)c1c(cccc1Br)Cl 527a_100015525214_100011253703 [0,3,0,0,0,0|0,0,0]=3 17351 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 11a_100015525214_100000752694 [0,3,0,0,0,0|0,0,0]=3 17352 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 240690a_100015525214_100000752694 [0,3,0,0,0,0|0,0,0]=3 17353 B13R1.4453 CCNC(=O)c1c(cccc1Br)F 527a_100015525214_100000752694 [0,3,0,0,0,0|0,0,0]=3 17354 B13R1.4453 CCNC(=O)c1c(cccc1Br)O 240690a_100015525214_100011935254 [0,3,0,0,0,0|0,0,0]=3 17355 B13R1.4453 CCNC(=O)c1c(cccc1Br)O 527a_100015525214_100011935254 [0,3,0,0,0,0|0,0,0]=3 17356 B13R1.4453 CCNC(=O)c1c(cccc1C)C 11a_100015525214_100000758298 [0,3,0,0,0,0|0,0,0]=3 17357 B13R1.4453 CCNC(=O)c1c(cccc1C)C 240690a_100015525214_100000758298 [0,3,0,0,0,0|0,0,0]=3 17358 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 11a_100015525214_100000692601 [0,3,0,0,0,0|0,0,0]=3 17359 B13R1.4453 CCNC(=O)c1c(cccc1Cl)C 240690a_100015525214_100000692601 [0,3,0,0,0,0|0,0,0]=3 17360 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 11a_100015525214_100000210656 [0,3,0,0,0,0|0,0,0]=3 17361 B13R1.4453 CCNC(=O)c1c(cccc1Cl)Cl 240690a_100015525214_100000210656 [0,3,0,0,0,0|0,0,0]=3 17362 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 11a_100015525214_100000210369 [0,3,0,0,0,0|0,0,0]=3 17363 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 240690a_100015525214_100000210369 [0,3,0,0,0,0|0,0,0]=3 17364 B13R1.4453 CCNC(=O)c1c(cccc1Cl)F 527a_100015525214_100000210369 [0,3,0,0,0,0|0,0,0]=3 17365 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 240690a_100015525214_100000745519 [0,3,0,0,0,0|0,0,0]=3 17366 B13R1.4453 CCNC(=O)c1c(cccc1Cl)O 527a_100015525214_100000745519 [0,3,0,0,0,0|0,0,0]=3 17367 B13R1.4453 CCNC(=O)c1c(cccc1F)C 11a_100015525214_100000762013 [0,3,0,0,0,0|0,0,0]=3 17368 B13R1.4453 CCNC(=O)c1c(cccc1F)C 240690a_100015525214_100000762013 [0,3,0,0,0,0|0,0,0]=3 17369 B13R1.4453 CCNC(=O)c1c(cccc1F)C 527a_100015525214_100000762013 [0,3,0,0,0,0|0,0,0]=3 17370 B13R1.4453 CCNC(=O)c1c(cccc1F)F 11a_100015525214_100000210804 [0,3,0,0,0,0|0,0,0]=3 17371 B13R1.4453 CCNC(=O)c1c(cccc1F)F 240690a_100015525214_100000210804 [0,3,0,0,0,0|0,0,0]=3 17372 B13R1.4453 CCNC(=O)c1c(cccc1F)F 527a_100015525214_100000210804 [0,3,0,0,0,0|0,0,0]=3 17373 B13R1.4453 CCNC(=O)c1c(cccc1F)O 527a_100015525214_100000763259 [0,3,0,0,0,0|0,0,0]=3 17374 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 11a_100015525214_100010232521 [0,3,0,0,0,0|0,0,0]=3 17375 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 240690a_100015525214_100010232521 [0,3,0,0,0,0|0,0,0]=3 17376 B13R1.4453 CCNC(=O)c1c(cccc1I)Br 527a_100015525214_100010232521 [0,3,0,0,0,0|0,0,0]=3 17377 B13R1.4453 CCNC(=O)c1c(cccc1I)C 11a_100015525214_100000688020 [0,3,0,0,0,0|0,0,0]=3 17378 B13R1.4453 CCNC(=O)c1c(cccc1I)C 240690a_100015525214_100000688020 [0,3,0,0,0,0|0,0,0]=3 17379 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 11a_100015525214_100000702859 [0,3,0,0,0,0|0,0,0]=3 17380 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 240690a_100015525214_100000702859 [0,3,0,0,0,0|0,0,0]=3 17381 B13R1.4453 CCNC(=O)c1c(cccc1I)Cl 527a_100015525214_100000702859 [0,3,0,0,0,0|0,0,0]=3 17382 B13R1.4453 CCNC(=O)c1c(cccc1I)F 11a_100015525214_100000023732 [0,3,0,0,0,0|0,0,0]=3 17383 B13R1.4453 CCNC(=O)c1c(cccc1I)F 240690a_100015525214_100000023732 [0,3,0,0,0,0|0,0,0]=3 17384 B13R1.4453 CCNC(=O)c1c(cccc1O)O 527a_100015525214_100000755285 [0,3,0,0,0,0|0,0,0]=3 17385 B13R1.4453 CCOC(=O)c1c(cccc1F)O 271570a_203496583355_100012357633 [0,3,0,0,0,0|1,0,0]=4 17386 B13R1.4453 CNCC(=O)c1c(cccc1Cl)Cl 2230a_106832991635_100012340516 [0,3,0,0,0,0|0,0,0]=3 17387 B13R1.4453 CNCC(=O)c1c(cccc1Cl)Cl 34a_100102657272_100012340516 [0,3,0,0,0,0|0,0,0]=3 17388 B13R1.4453 CNCC(=O)c1c(cccc1Cl)F 2230a_106832991635_100011219195 [0,3,0,0,0,0|0,0,0]=3 17389 B13R1.4453 CNCC(=O)c1c(cccc1Cl)F 34a_100102657272_100011219195 [0,3,0,0,0,0|0,0,0]=3 17390 B13R1.4453 CNCC(=O)c1c(cccc1F)F 34a_100102657272_100000199083 [0,3,0,0,0,0|0,0,0]=3 17391 B13R1.4453 CNNC(=O)c1c(cccc1Br)Br 22a_100016993582_100000690891 [0,3,0,0,0,0|0,0,0]=3 17392 B13R1.4453 CNNC(=O)c1c(cccc1Br)C 22a_100016993582_100000701904 [0,3,0,0,0,0|0,0,0]=3 17393 B13R1.4453 CNNC(=O)c1c(cccc1Br)Cl 22a_100016993582_100011253703 [0,3,0,0,0,0|0,0,0]=3 17394 B13R1.4453 CNNC(=O)c1c(cccc1Br)F 22a_100016993582_100000752694 [0,3,0,0,0,0|0,0,0]=3 17395 B13R1.4453 CNNC(=O)c1c(cccc1Br)O 22a_100016993582_100011935254 [0,3,0,0,0,0|0,0,0]=3 17396 B13R1.4453 CNNC(=O)c1c(cccc1C)C 22a_100016993582_100000758298 [0,3,0,0,0,0|0,0,0]=3 17397 B13R1.4453 CNNC(=O)c1c(cccc1Cl)C 22a_100016993582_100000692601 [0,3,0,0,0,0|0,0,0]=3 17398 B13R1.4453 CNNC(=O)c1c(cccc1Cl)Cl 22a_100016993582_100000210656 [0,3,0,0,0,0|0,0,0]=3 17399 B13R1.4453 CNNC(=O)c1c(cccc1Cl)F 22a_100016993582_100000210369 [0,3,0,0,0,0|0,0,0]=3 17400 B13R1.4453 CNNC(=O)c1c(cccc1Cl)O 22a_100016993582_100000745519 [0,3,0,0,0,0|0,0,0]=3 17401 B13R1.4453 CNNC(=O)c1c(cccc1F)C 22a_100016993582_100000762013 [0,3,0,0,0,0|0,0,0]=3 17402 B13R1.4453 CNNC(=O)c1c(cccc1F)F 22a_100016993582_100000210804 [0,3,0,0,0,0|0,0,0]=3 17403 B13R1.4453 CNNC(=O)c1c(cccc1F)O 22a_100016993582_100000763259 [0,3,0,0,0,0|0,0,0]=3 17404 B13R1.4453 CNNC(=O)c1c(cccc1I)Br 22a_100016993582_100010232521 [0,3,0,0,0,0|0,0,0]=3 17405 B13R1.4453 CNNC(=O)c1c(cccc1I)C 22a_100016993582_100000688020 [0,3,0,0,0,0|0,0,0]=3 17406 B13R1.4453 CNNC(=O)c1c(cccc1I)Cl 22a_100016993582_100000702859 [0,3,0,0,0,0|0,0,0]=3 17407 B13R1.4453 CNNC(=O)c1c(cccc1I)F 22a_100016993582_100000023732 [0,3,0,0,0,0|0,0,0]=3 17408 B13R1.4453 CNNC(=O)c1c(cccc1O)C 22a_100016993582_100011934116 [0,3,0,0,0,0|0,0,0]=3 17409 B13R1.4453 COCC(=O)c1c(cccc1Cl)Cl 34a_100138415774_100012340516 [0,3,0,0,0,0|1,0,0]=4 17410 B13R1.4453 COCC(=O)c1c(cccc1Cl)F 34a_100138415774_100011219195 [0,3,0,0,0,0|1,0,0]=4 17411 B13R1.4453 COCC(=O)c1c(cccc1F)F 34a_100138415774_100000199083 [0,3,0,0,0,0|1,0,0]=4 17412 B13R1.4453 CSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_200000210301 [0,3,0,0,0,0|1,0,0]=4 17413 B13R1.4453 CSCC(=O)c1c(cccc1Cl)F 62a_100011219195_200000210301 [0,3,0,0,0,0|1,0,0]=4 17414 B13R1.4453 CSCC(=O)c1c(cccc1Cl)F 62a_200000210301_100011219195 [0,3,0,0,0,0|1,0,0]=4 17415 B13R1.4453 CSCC(=O)c1c(cccc1F)F 62a_100000199083_200000210301 [0,3,0,0,0,0|1,0,0]=4 17416 B13R1.4453 CSCC(=O)c1c(cccc1F)F 62a_200000210301_100000199083 [0,3,0,0,0,0|1,0,0]=4 17417 B13R1.4453 Cc1cccc(c1C(=O)CCF)Br 1458a_100000701904_100011217306 [0,3,0,0,0,0|1,0,0]=4 17418 B13R1.4453 Cc1cccc(c1C(=O)CCF)C 1458a_100000758298_100011217306 [0,3,0,0,0,0|1,0,0]=4 17419 B13R1.4453 Cc1cccc(c1C(=O)CCF)Cl 1458a_100000692601_100011217306 [0,3,0,0,0,0|1,0,0]=4 17420 B13R1.4453 Cc1cccc(c1C(=O)CCF)F 1458a_100000762013_100011217306 [0,3,0,0,0,0|1,0,0]=4 17421 B13R1.4453 Cc1cccc(c1C(=O)CCF)I 1458a_100000688020_100011217306 [0,3,0,0,0,0|1,0,0]=4 17422 B13R1.4453 Cc1cccc(c1C(=O)CCF)O 1458a_100011934116_100011217306 [0,3,0,0,0,0|1,0,0]=4 17423 B13R1.4453 Cc1cccc(c1C(=O)CCO)Br 1458a_100000701904_100000211926 [0,3,0,0,0,0|1,0,0]=4 17424 B13R1.4453 Cc1cccc(c1C(=O)CCO)C 1458a_100000758298_100000211926 [0,3,0,0,0,0|1,0,0]=4 17425 B13R1.4453 Cc1cccc(c1C(=O)CCO)Cl 1458a_100000692601_100000211926 [0,3,0,0,0,0|1,0,0]=4 17426 B13R1.4453 Cc1cccc(c1C(=O)CCO)F 1458a_100000762013_100000211926 [0,3,0,0,0,0|1,0,0]=4 17427 B13R1.4453 Cc1cccc(c1C(=O)CCO)I 1458a_100000688020_100000211926 [0,3,0,0,0,0|1,0,0]=4 17428 B13R1.4453 Cc1cccc(c1C(=O)CCO)O 1458a_100011934116_100000211926 [0,3,0,0,0,0|1,0,0]=4 17429 B13R1.4453 O=C(CCF)c1c(cccc1Br)Br 1458a_100000690891_100011217306 [0,3,0,0,0,0|1,0,0]=4 17430 B13R1.4453 O=C(CCF)c1c(cccc1Br)Cl 1458a_100011253703_100011217306 [0,3,0,0,0,0|1,0,0]=4 17431 B13R1.4453 O=C(CCF)c1c(cccc1Br)F 1458a_100000752694_100011217306 [0,3,0,0,0,0|1,0,0]=4 17432 B13R1.4453 O=C(CCF)c1c(cccc1Br)O 1458a_100011935254_100011217306 [0,3,0,0,0,0|1,0,0]=4 17433 B13R1.4453 O=C(CCF)c1c(cccc1Cl)Cl 1458a_100000210656_100011217306 [0,3,0,0,0,0|1,0,0]=4 17434 B13R1.4453 O=C(CCF)c1c(cccc1Cl)F 1458a_100000210369_100011217306 [0,3,0,0,0,0|1,0,0]=4 17435 B13R1.4453 O=C(CCF)c1c(cccc1Cl)O 1458a_100000745519_100011217306 [0,3,0,0,0,0|1,0,0]=4 17436 B13R1.4453 O=C(CCF)c1c(cccc1F)F 1458a_100000210804_100011217306 [0,3,0,0,0,0|1,0,0]=4 17437 B13R1.4453 O=C(CCF)c1c(cccc1F)O 1458a_100000763259_100011217306 [0,3,0,0,0,0|1,0,0]=4 17438 B13R1.4453 O=C(CCF)c1c(cccc1I)Br 1458a_100010232521_100011217306 [0,3,0,0,0,0|1,0,0]=4 17439 B13R1.4453 O=C(CCF)c1c(cccc1I)Cl 1458a_100000702859_100011217306 [0,3,0,0,0,0|1,0,0]=4 17440 B13R1.4453 O=C(CCF)c1c(cccc1I)F 1458a_100000023732_100011217306 [0,3,0,0,0,0|1,0,0]=4 17441 B13R1.4453 O=C(CCF)c1c(cccc1O)O 1458a_100000755285_100011217306 [0,3,0,0,0,0|1,0,0]=4 17442 B13R1.4453 O=C(CCO)c1c(cccc1Br)Br 1458a_100000690891_100000211926 [0,3,0,0,0,0|1,0,0]=4 17443 B13R1.4453 O=C(CCO)c1c(cccc1Br)Cl 1458a_100011253703_100000211926 [0,3,0,0,0,0|1,0,0]=4 17444 B13R1.4453 O=C(CCO)c1c(cccc1Br)F 1458a_100000752694_100000211926 [0,3,0,0,0,0|1,0,0]=4 17445 B13R1.4453 O=C(CCO)c1c(cccc1Br)O 1458a_100011935254_100000211926 [0,3,0,0,0,0|1,0,0]=4 17446 B13R1.4453 O=C(CCO)c1c(cccc1Cl)Cl 1458a_100000210656_100000211926 [0,3,0,0,0,0|1,0,0]=4 17447 B13R1.4453 O=C(CCO)c1c(cccc1Cl)F 1458a_100000210369_100000211926 [0,3,0,0,0,0|1,0,0]=4 17448 B13R1.4453 O=C(CCO)c1c(cccc1Cl)O 1458a_100000745519_100000211926 [0,3,0,0,0,0|1,0,0]=4 17449 B13R1.4453 O=C(CCO)c1c(cccc1F)F 1458a_100000210804_100000211926 [0,3,0,0,0,0|1,0,0]=4 17450 B13R1.4453 O=C(CCO)c1c(cccc1F)O 1458a_100000763259_100000211926 [0,3,0,0,0,0|1,0,0]=4 17451 B13R1.4453 O=C(CCO)c1c(cccc1I)Br 1458a_100010232521_100000211926 [0,3,0,0,0,0|1,0,0]=4 17452 B13R1.4453 O=C(CCO)c1c(cccc1I)Cl 1458a_100000702859_100000211926 [0,3,0,0,0,0|1,0,0]=4 17453 B13R1.4453 O=C(CCO)c1c(cccc1I)F 1458a_100000023732_100000211926 [0,3,0,0,0,0|1,0,0]=4 17454 B13R1.4453 O=C(CCO)c1c(cccc1O)O 1458a_100000755285_100000211926 [0,3,0,0,0,0|1,0,0]=4 17455 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_200025704644 [0,3,0,0,0,0|1,0,0]=4 17456 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)F 62a_100011219195_200025704644 [0,3,0,0,0,0|1,0,0]=4 17457 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1Cl)F 62a_200025704644_100011219195 [0,3,0,0,0,0|1,0,0]=4 17458 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1F)F 62a_100000199083_200025704644 [0,3,0,0,0,0|1,0,0]=4 17459 B13R1.4453 [13CH3]SCC(=O)c1c(cccc1F)F 62a_200025704644_100000199083 [0,3,0,0,0,0|1,0,0]=4 17460 B13R1.36 C#Cc1ccc(cc1)C(=O)C(C)C 1458a_100011217615_100000210206 [0,3,0,0,0,0|1,0,0]=4 17461 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100011217615 [0,3,0,0,0,0|0,0,0]=3 17462 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100011217615 [0,3,0,0,0,0|0,0,0]=3 17463 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100011217615 [0,3,0,0,0,0|0,0,0]=3 17464 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100011217615 [0,3,0,0,0,0|0,0,0]=3 17465 B13R1.36 C=Cc1ccc(cc1)C(=O)C(C)C 1458a_100000687532_100000210206 [0,3,0,0,0,0|1,0,0]=4 17466 B13R1.36 C=Cc1ccc(cc1)C(=O)C(C)C 271570a_100011290941_100011220430 [0,3,0,0,0,0|1,0,0]=4 17467 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000687532 [0,3,0,0,0,0|0,0,0]=3 17468 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000687532 [0,3,0,0,0,0|0,0,0]=3 17469 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000687532 [0,3,0,0,0,0|0,0,0]=3 17470 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 271570a_100011290941_100000159574 [0,3,0,0,0,0|0,0,0]=3 17471 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000687532 [0,3,0,0,0,0|0,0,0]=3 17472 B13R1.36 C=Cc1ccc(cn1)C(=O)N(C)C 271570a_100011290941_100000159593 [0,3,0,0,0,0|1,0,0]=4 17473 B13R1.36 C=Cc1ccc(nc1)C(=O)N(C)C 271570a_100011290941_200011781295 [0,3,0,0,0,0|1,0,0]=4 17474 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 34a_200010205864_200025704644 [0,3,0,0,0,0|1,0,0]=4 17475 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 7a_200010205864_200025704644 [0,3,0,0,0,0|1,0,0]=4 17476 B13R1.36 CC(C)C(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210206 [0,3,0,0,0,0|1,0,0]=4 17477 B13R1.36 CC(C)C(=O)c1ccc(cc1)CO 1458a_100000183892_100000210206 [0,3,0,0,0,0|1,0,0]=4 17478 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100011995950_200025704644 [0,3,0,0,0,0|1,0,0]=4 17479 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100011995950_200025704644 [0,3,0,0,0,0|1,0,0]=4 17480 B13R1.36 CC(C)C(=O)c1ccc(cc1)S[13CH3] 62a_100011220430_200025704644 [0,3,0,0,0,0|1,0,0]=4 17481 B13R1.36 CC(C)C(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011220430 [0,3,0,0,0,0|1,0,0]=4 17482 B13R1.36 CCc1ccc(cc1)C(=O)C(C)C 1458a_100000211226_100000210206 [0,3,0,0,0,0|1,0,0]=4 17483 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000211226 [0,3,0,0,0,0|0,0,0]=3 17484 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000211226 [0,3,0,0,0,0|0,0,0]=3 17485 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000211226 [0,3,0,0,0,0|0,0,0]=3 17486 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000211226 [0,3,0,0,0,0|0,0,0]=3 17487 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 11a_100102631434_100000210717 [0,3,0,0,0,0|0,0,0]=3 17488 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 1626a_100102631434_100000210717 [0,3,0,0,0,0|0,0,0]=3 17489 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 240690a_100102631434_100000210717 [0,3,0,0,0,0|0,0,0]=3 17490 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 527a_100102631434_100000210717 [0,3,0,0,0,0|0,0,0]=3 17491 B13R1.36 CN(C)C(=O)c1ccc(cc1)CO 1626a_100102631434_100000183892 [0,3,0,0,0,0|0,0,0]=3 17492 B13R1.36 CN(C)C(=O)c1ccc(cc1)CO 240690a_100102631434_100000183892 [0,3,0,0,0,0|0,0,0]=3 17493 B13R1.36 CN(C)C(=O)c1ccc(cc1)N[13CH3] 34a_100000184784_200025704644 [0,3,0,0,0,0|0,0,0]=3 17494 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100000192105_200025704644 [0,3,0,0,0,0|0,0,0]=3 17495 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100000192105_200025704644 [0,3,0,0,0,0|0,0,0]=3 17496 B13R1.36 CN(C)C(=O)c1ccc(cc1)S[13CH3] 62a_100000159574_200025704644 [0,3,0,0,0,0|0,0,0]=3 17497 B13R1.36 CN(C)C(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000159574 [0,3,0,0,0,0|0,0,0]=3 17498 B13R1.36 CN(C)C(=O)c1ccc(cn1)S[13CH3] 62a_200011781295_200025704644 [0,3,0,0,0,0|1,0,0]=4 17499 B13R1.36 CN(C)C(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_200011781295 [0,3,0,0,0,0|1,0,0]=4 17500 B13R1.36 CN(C)C(=O)c1ccc(nc1)S[13CH3] 62a_100000159593_200025704644 [0,3,0,0,0,0|1,0,0]=4 17501 B13R1.36 CN(C)C(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000159593 [0,3,0,0,0,0|1,0,0]=4 17502 B13R1.36 CNc1ccc(cc1)C(=O)C(C)C 27a_100102657272_100011220430 [0,3,0,0,0,0|1,0,0]=4 17503 B13R1.36 CNc1ccc(cc1)C(=O)N(C)C 27a_100102657272_100000159574 [0,3,0,0,0,0|0,0,0]=3 17504 B13R1.36 CNc1ccc(cc1)C(=O)N(C)C 34a_100000184784_200000210301 [0,3,0,0,0,0|0,0,0]=3 17505 B13R1.36 CNc1ccc(cn1)C(=O)N(C)C 27a_100102657272_100000159593 [0,3,0,0,0,0|1,0,0]=4 17506 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_200000210301 [0,3,0,0,0,0|1,0,0]=4 17507 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_200000210301 [0,3,0,0,0,0|1,0,0]=4 17508 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 1458a_100000184203_100000210206 [0,3,0,0,0,0|1,0,0]=4 17509 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 34a_100011995950_200000210301 [0,3,0,0,0,0|1,0,0]=4 17510 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 7a_100011995950_200000210301 [0,3,0,0,0,0|1,0,0]=4 17511 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000184203 [0,3,0,0,0,0|0,0,0]=3 17512 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000184203 [0,3,0,0,0,0|0,0,0]=3 17513 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000184203 [0,3,0,0,0,0|0,0,0]=3 17514 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 34a_100000192105_200000210301 [0,3,0,0,0,0|0,0,0]=3 17515 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000184203 [0,3,0,0,0,0|0,0,0]=3 17516 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 7a_100000192105_200000210301 [0,3,0,0,0,0|0,0,0]=3 17517 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 1458a_100000189692_100000210206 [0,3,0,0,0,0|1,0,0]=4 17518 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 62a_100011220430_200000210301 [0,3,0,0,0,0|1,0,0]=4 17519 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 62a_200000210301_100011220430 [0,3,0,0,0,0|1,0,0]=4 17520 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000189692 [0,3,0,0,0,0|0,0,0]=3 17521 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000189692 [0,3,0,0,0,0|0,0,0]=3 17522 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000189692 [0,3,0,0,0,0|0,0,0]=3 17523 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000189692 [0,3,0,0,0,0|0,0,0]=3 17524 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 62a_100000159574_200000210301 [0,3,0,0,0,0|0,0,0]=3 17525 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 62a_200000210301_100000159574 [0,3,0,0,0,0|0,0,0]=3 17526 B13R1.36 CSc1ccc(cn1)C(=O)N(C)C 62a_100000159593_200000210301 [0,3,0,0,0,0|1,0,0]=4 17527 B13R1.36 CSc1ccc(cn1)C(=O)N(C)C 62a_200000210301_100000159593 [0,3,0,0,0,0|1,0,0]=4 17528 B13R1.36 CSc1ccc(nc1)C(=O)N(C)C 62a_200000210301_200011781295 [0,3,0,0,0,0|1,0,0]=4 17529 B13R1.36 CSc1ccc(nc1)C(=O)N(C)C 62a_200011781295_200000210301 [0,3,0,0,0,0|1,0,0]=4 17530 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)CC 1458a_100103168756_100000210202 [0,3,0,0,0,0|1,0,0]=4 17531 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 11a_106832991635_100103168756 [0,3,0,0,0,0|0,0,0]=3 17532 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 1626a_100102657272_100103168756 [0,3,0,0,0,0|0,0,0]=3 17533 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 240690a_100102657272_100103168756 [0,3,0,0,0,0|0,0,0]=3 17534 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 527a_100102657272_100103168756 [0,3,0,0,0,0|0,0,0]=3 17535 B13R1.95 C=Cc1ccc(c(c1)Br)C(=O)OC 271570a_100011290941_100010247156 [0,3,0,0,0,0|1,0,0]=4 17536 B13R1.95 C=Cc1ccc(c(c1)C)C(=O)CC 271570a_100011290941_200012361375 [0,3,0,0,0,0|1,0,0]=4 17537 B13R1.95 C=Cc1ccc(c(c1)C)C(=O)OC 271570a_100011290941_100000747612 [0,3,0,0,0,0|1,0,0]=4 17538 B13R1.95 C=Cc1ccc(c(c1)Cl)C(=O)OC 271570a_100011290941_100000060724 [0,3,0,0,0,0|1,0,0]=4 17539 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)CC 271570a_100011290941_100012360378 [0,3,0,0,0,0|1,0,0]=4 17540 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)NC 271570a_100011290941_100000233932 [0,3,0,0,0,0|0,0,0]=3 17541 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)OC 271570a_100011290941_100000216654 [0,3,0,0,0,0|1,0,0]=4 17542 B13R1.95 C=Cc1ccc(c(c1)N)C(=O)OC 271570a_100011290941_100011373473 [0,3,0,0,0,0|1,0,0]=4 17543 B13R1.95 C=Cc1ccc(c(c1)O)C(=O)OC 271570a_100011290941_100000062286 [0,3,0,0,0,0|1,0,0]=4 17544 B13R1.95 CCC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_100000210202 [0,3,0,0,0,0|1,0,0]=4 17545 B13R1.95 CCC(=O)c1ccc(cc1Br)OC 1458a_100000748873_100000210202 [0,3,0,0,0,0|1,0,0]=4 17546 B13R1.95 CCC(=O)c1ccc(cc1C)C#N 1458a_100000691869_100000210202 [0,3,0,0,0,0|1,0,0]=4 17547 B13R1.95 CCC(=O)c1ccc(cc1C)OC 1458a_100000763155_100000210202 [0,3,0,0,0,0|1,0,0]=4 17548 B13R1.95 CCC(=O)c1ccc(cc1C)SC 1458a_100012278374_100000210202 [0,3,0,0,0,0|1,0,0]=4 17549 B13R1.95 CCC(=O)c1ccc(cc1C)SC 62a_200000210301_200012361375 [0,3,0,0,0,0|1,0,0]=4 17550 B13R1.95 CCC(=O)c1ccc(cc1C)SC 62a_200012361375_200000210301 [0,3,0,0,0,0|1,0,0]=4 17551 B13R1.95 CCC(=O)c1ccc(cc1C)S[13CH3] 62a_200012361375_200025704644 [0,3,0,0,0,0|1,0,0]=4 17552 B13R1.95 CCC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_200012361375 [0,3,0,0,0,0|1,0,0]=4 17553 B13R1.95 CCC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_100000210202 [0,3,0,0,0,0|1,0,0]=4 17554 B13R1.95 CCC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_100000210202 [0,3,0,0,0,0|1,0,0]=4 17555 B13R1.95 CCC(=O)c1ccc(cc1Cl)OC 1458a_100000753557_100000210202 [0,3,0,0,0,0|1,0,0]=4 17556 B13R1.95 CCC(=O)c1ccc(cc1F)C#N 1458a_100000238375_100000210202 [0,3,0,0,0,0|1,0,0]=4 17557 B13R1.95 CCC(=O)c1ccc(cc1F)CC 1458a_200009867912_100000210202 [0,3,0,0,0,0|1,0,0]=4 17558 B13R1.95 CCC(=O)c1ccc(cc1F)CO 1458a_100011934814_100000210202 [0,3,0,0,0,0|1,0,0]=4 17559 B13R1.95 CCC(=O)c1ccc(cc1F)NC 27a_100102657272_100012360378 [0,3,0,0,0,0|1,0,0]=4 17560 B13R1.95 CCC(=O)c1ccc(cc1F)OC 1458a_100000198494_100000210202 [0,3,0,0,0,0|1,0,0]=4 17561 B13R1.95 CCC(=O)c1ccc(cc1F)SC 62a_100012360378_200000210301 [0,3,0,0,0,0|1,0,0]=4 17562 B13R1.95 CCC(=O)c1ccc(cc1F)SC 62a_200000210301_100012360378 [0,3,0,0,0,0|1,0,0]=4 17563 B13R1.95 CCC(=O)c1ccc(cc1F)S[13CH3] 62a_100012360378_200025704644 [0,3,0,0,0,0|1,0,0]=4 17564 B13R1.95 CCC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100012360378 [0,3,0,0,0,0|1,0,0]=4 17565 B13R1.95 CCC(=O)c1ccc(cc1I)OC 1458a_100000688016_100000210202 [0,3,0,0,0,0|1,0,0]=4 17566 B13R1.95 CCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210202 [0,3,0,0,0,0|1,0,0]=4 17567 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 11a_106832991635_200009867912 [0,3,0,0,0,0|0,0,0]=3 17568 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 1626a_100102657272_200009867912 [0,3,0,0,0,0|0,0,0]=3 17569 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 240690a_100102657272_200009867912 [0,3,0,0,0,0|0,0,0]=3 17570 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 527a_100102657272_200009867912 [0,3,0,0,0,0|0,0,0]=3 17571 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 11a_106832991635_100010244945 [0,3,0,0,0,0|0,0,0]=3 17572 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 1626a_100102657272_100010244945 [0,3,0,0,0,0|0,0,0]=3 17573 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 240690a_100102657272_100010244945 [0,3,0,0,0,0|0,0,0]=3 17574 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 527a_100102657272_100010244945 [0,3,0,0,0,0|0,0,0]=3 17575 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 11a_106832991635_100000748873 [0,3,0,0,0,0|0,0,0]=3 17576 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 1626a_100102657272_100000748873 [0,3,0,0,0,0|0,0,0]=3 17577 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 240690a_100102657272_100000748873 [0,3,0,0,0,0|0,0,0]=3 17578 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 527a_100102657272_100000748873 [0,3,0,0,0,0|0,0,0]=3 17579 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 11a_106832991635_100000691869 [0,3,0,0,0,0|0,0,0]=3 17580 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 1626a_100102657272_100000691869 [0,3,0,0,0,0|0,0,0]=3 17581 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 240690a_100102657272_100000691869 [0,3,0,0,0,0|0,0,0]=3 17582 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 527a_100102657272_100000691869 [0,3,0,0,0,0|0,0,0]=3 17583 B13R1.95 CNC(=O)c1ccc(cc1C)OC 11a_106832991635_100000763155 [0,3,0,0,0,0|0,0,0]=3 17584 B13R1.95 CNC(=O)c1ccc(cc1C)OC 1626a_100102657272_100000763155 [0,3,0,0,0,0|0,0,0]=3 17585 B13R1.95 CNC(=O)c1ccc(cc1C)OC 240690a_100102657272_100000763155 [0,3,0,0,0,0|0,0,0]=3 17586 B13R1.95 CNC(=O)c1ccc(cc1C)OC 527a_100102657272_100000763155 [0,3,0,0,0,0|0,0,0]=3 17587 B13R1.95 CNC(=O)c1ccc(cc1C)SC 11a_106832991635_100012278374 [0,3,0,0,0,0|0,0,0]=3 17588 B13R1.95 CNC(=O)c1ccc(cc1C)SC 1626a_100102657272_100012278374 [0,3,0,0,0,0|0,0,0]=3 17589 B13R1.95 CNC(=O)c1ccc(cc1C)SC 240690a_100102657272_100012278374 [0,3,0,0,0,0|0,0,0]=3 17590 B13R1.95 CNC(=O)c1ccc(cc1C)SC 527a_100102657272_100012278374 [0,3,0,0,0,0|0,0,0]=3 17591 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 11a_106832991635_100000100588 [0,3,0,0,0,0|0,0,0]=3 17592 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 1626a_100102657272_100000100588 [0,3,0,0,0,0|0,0,0]=3 17593 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 240690a_100102657272_100000100588 [0,3,0,0,0,0|0,0,0]=3 17594 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 527a_100102657272_100000100588 [0,3,0,0,0,0|0,0,0]=3 17595 B13R1.95 CNC(=O)c1ccc(cc1Cl)CO 240690a_100102657272_100015659073 [0,3,0,0,0,0|0,0,0]=3 17596 B13R1.95 CNC(=O)c1ccc(cc1Cl)NC 34a_100000742945_200000210301 [0,3,0,0,0,0|0,0,0]=3 17597 B13R1.95 CNC(=O)c1ccc(cc1Cl)NC 7a_100000742945_200000210301 [0,3,0,0,0,0|0,0,0]=3 17598 B13R1.95 CNC(=O)c1ccc(cc1Cl)N[13CH3] 34a_100000742945_200025704644 [0,3,0,0,0,0|0,0,0]=3 17599 B13R1.95 CNC(=O)c1ccc(cc1Cl)N[13CH3] 7a_100000742945_200025704644 [0,3,0,0,0,0|0,0,0]=3 17600 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 11a_106832991635_100000753557 [0,3,0,0,0,0|0,0,0]=3 17601 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 1626a_100102657272_100000753557 [0,3,0,0,0,0|0,0,0]=3 17602 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 240690a_100102657272_100000753557 [0,3,0,0,0,0|0,0,0]=3 17603 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 527a_100102657272_100000753557 [0,3,0,0,0,0|0,0,0]=3 17604 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 11a_106832991635_100000238375 [0,3,0,0,0,0|0,0,0]=3 17605 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 1626a_100102657272_100000238375 [0,3,0,0,0,0|0,0,0]=3 17606 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 240690a_100102657272_100000238375 [0,3,0,0,0,0|0,0,0]=3 17607 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 527a_100102657272_100000238375 [0,3,0,0,0,0|0,0,0]=3 17608 B13R1.95 CNC(=O)c1ccc(cc1F)CO 240690a_100102657272_100011934814 [0,3,0,0,0,0|0,0,0]=3 17609 B13R1.95 CNC(=O)c1ccc(cc1F)NC 27a_100102657272_100000233932 [0,3,0,0,0,0|0,0,0]=3 17610 B13R1.95 CNC(=O)c1ccc(cc1F)NC 34a_100011533607_200000210301 [0,3,0,0,0,0|0,0,0]=3 17611 B13R1.95 CNC(=O)c1ccc(cc1F)NC 7a_100011533607_200000210301 [0,3,0,0,0,0|0,0,0]=3 17612 B13R1.95 CNC(=O)c1ccc(cc1F)N[13CH3] 34a_100011533607_200025704644 [0,3,0,0,0,0|0,0,0]=3 17613 B13R1.95 CNC(=O)c1ccc(cc1F)N[13CH3] 7a_100011533607_200025704644 [0,3,0,0,0,0|0,0,0]=3 17614 B13R1.95 CNC(=O)c1ccc(cc1F)OC 11a_106832991635_100000198494 [0,3,0,0,0,0|0,0,0]=3 17615 B13R1.95 CNC(=O)c1ccc(cc1F)OC 1626a_100102657272_100000198494 [0,3,0,0,0,0|0,0,0]=3 17616 B13R1.95 CNC(=O)c1ccc(cc1F)OC 240690a_100102657272_100000198494 [0,3,0,0,0,0|0,0,0]=3 17617 B13R1.95 CNC(=O)c1ccc(cc1F)OC 527a_100102657272_100000198494 [0,3,0,0,0,0|0,0,0]=3 17618 B13R1.95 CNC(=O)c1ccc(cc1F)SC 62a_100000233932_200000210301 [0,3,0,0,0,0|0,0,0]=3 17619 B13R1.95 CNC(=O)c1ccc(cc1F)SC 62a_200000210301_100000233932 [0,3,0,0,0,0|0,0,0]=3 17620 B13R1.95 CNC(=O)c1ccc(cc1F)S[13CH3] 62a_100000233932_200025704644 [0,3,0,0,0,0|0,0,0]=3 17621 B13R1.95 CNC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000233932 [0,3,0,0,0,0|0,0,0]=3 17622 B13R1.95 CNC(=O)c1ccc(cc1I)OC 11a_106832991635_100000688016 [0,3,0,0,0,0|0,0,0]=3 17623 B13R1.95 CNC(=O)c1ccc(cc1I)OC 1626a_100102657272_100000688016 [0,3,0,0,0,0|0,0,0]=3 17624 B13R1.95 CNC(=O)c1ccc(cc1I)OC 240690a_100102657272_100000688016 [0,3,0,0,0,0|0,0,0]=3 17625 B13R1.95 CNC(=O)c1ccc(cc1I)OC 527a_100102657272_100000688016 [0,3,0,0,0,0|0,0,0]=3 17626 B13R1.95 CNC(=O)c1ccc(cc1O)NC 34a_100000223174_200000210301 [0,3,0,0,0,0|0,0,0]=3 17627 B13R1.95 CNC(=O)c1ccc(cc1O)N[13CH3] 34a_100000223174_200025704644 [0,3,0,0,0,0|0,0,0]=3 17628 B13R1.95 CNC(=O)c1ccc(cc1O)OC 11a_106832991635_100000212123 [0,3,0,0,0,0|0,0,0]=3 17629 B13R1.95 CNC(=O)c1ccc(cc1O)OC 240690a_100102657272_100000212123 [0,3,0,0,0,0|0,0,0]=3 17630 B13R1.95 CNC(=O)c1ccc(cc1O)OC 527a_100102657272_100000212123 [0,3,0,0,0,0|0,0,0]=3 17631 B13R1.95 COC(=O)c1ccc(cc1Br)OC 34a_100010150825_200000210301 [0,3,0,0,0,0|1,0,0]=4 17632 B13R1.95 COC(=O)c1ccc(cc1Br)OC 7a_100010150825_200000210301 [0,3,0,0,0,0|1,0,0]=4 17633 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 34a_100010150825_200025704644 [0,3,0,0,0,0|1,0,0]=4 17634 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 7a_100010150825_200025704644 [0,3,0,0,0,0|1,0,0]=4 17635 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_100010247156_200000210301 [0,3,0,0,0,0|1,0,0]=4 17636 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_200000210301_100010247156 [0,3,0,0,0,0|1,0,0]=4 17637 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_100010247156_200025704644 [0,3,0,0,0,0|1,0,0]=4 17638 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_200025704644_100010247156 [0,3,0,0,0,0|1,0,0]=4 17639 B13R1.95 COC(=O)c1ccc(cc1C)OC 34a_100012000157_200000210301 [0,3,0,0,0,0|1,0,0]=4 17640 B13R1.95 COC(=O)c1ccc(cc1C)OC 7a_100012000157_200000210301 [0,3,0,0,0,0|1,0,0]=4 17641 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 34a_100012000157_200025704644 [0,3,0,0,0,0|1,0,0]=4 17642 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 7a_100012000157_200025704644 [0,3,0,0,0,0|1,0,0]=4 17643 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_100000747612_200000210301 [0,3,0,0,0,0|1,0,0]=4 17644 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_200000210301_100000747612 [0,3,0,0,0,0|1,0,0]=4 17645 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_100000747612_200025704644 [0,3,0,0,0,0|1,0,0]=4 17646 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100000747612 [0,3,0,0,0,0|1,0,0]=4 17647 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 34a_100000081488_200000210301 [0,3,0,0,0,0|1,0,0]=4 17648 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 7a_100000081488_200000210301 [0,3,0,0,0,0|1,0,0]=4 17649 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100000081488_200025704644 [0,3,0,0,0,0|1,0,0]=4 17650 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100000081488_200025704644 [0,3,0,0,0,0|1,0,0]=4 17651 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_100000060724_200000210301 [0,3,0,0,0,0|1,0,0]=4 17652 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_200000210301_100000060724 [0,3,0,0,0,0|1,0,0]=4 17653 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_100000060724_200025704644 [0,3,0,0,0,0|1,0,0]=4 17654 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_200025704644_100000060724 [0,3,0,0,0,0|1,0,0]=4 17655 B13R1.95 COC(=O)c1ccc(cc1F)OC 34a_100011999631_200000210301 [0,3,0,0,0,0|1,0,0]=4 17656 B13R1.95 COC(=O)c1ccc(cc1F)OC 7a_100011999631_200000210301 [0,3,0,0,0,0|1,0,0]=4 17657 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 34a_100011999631_200025704644 [0,3,0,0,0,0|1,0,0]=4 17658 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 7a_100011999631_200025704644 [0,3,0,0,0,0|1,0,0]=4 17659 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_100000216654_200000210301 [0,3,0,0,0,0|1,0,0]=4 17660 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_200000210301_100000216654 [0,3,0,0,0,0|1,0,0]=4 17661 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_100000216654_200025704644 [0,3,0,0,0,0|1,0,0]=4 17662 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000216654 [0,3,0,0,0,0|1,0,0]=4 17663 B13R1.95 COC(=O)c1ccc(cc1N)OC 34a_100000701581_200000210301 [0,3,0,0,0,0|1,0,0]=4 17664 B13R1.95 COC(=O)c1ccc(cc1N)OC 7a_100000701581_200000210301 [0,3,0,0,0,0|1,0,0]=4 17665 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 34a_100000701581_200025704644 [0,3,0,0,0,0|1,0,0]=4 17666 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 7a_100000701581_200025704644 [0,3,0,0,0,0|1,0,0]=4 17667 B13R1.95 COC(=O)c1ccc(cc1N)SC 62a_100011373473_200000210301 [0,3,0,0,0,0|1,0,0]=4 17668 B13R1.95 COC(=O)c1ccc(cc1N)S[13CH3] 62a_100011373473_200025704644 [0,3,0,0,0,0|1,0,0]=4 17669 B13R1.95 COC(=O)c1ccc(cc1O)C#N 271570a_203496583355_100009832033 [0,3,0,0,0,0|1,0,0]=4 17670 B13R1.95 COC(=O)c1ccc(cc1O)C=O 271570a_203496583355_100010630601 [0,3,0,0,0,0|1,0,0]=4 17671 B13R1.95 COC(=O)c1ccc(cc1O)OC 271570a_203496583355_100009815674 [0,3,0,0,0,0|1,0,0]=4 17672 B13R1.95 COC(=O)c1ccc(cc1O)SC 62a_200000210301_100000062286 [0,3,0,0,0,0|1,0,0]=4 17673 B13R1.95 COC(=O)c1ccc(cc1O)S[13CH3] 62a_200025704644_100000062286 [0,3,0,0,0,0|1,0,0]=4 17674 B13R1.139 C=C=Cc1ccc(cc1)C(=O)CC 271570a_100015277604_100000211647 [0,3,0,0,0,0|1,0,0]=4 17675 B13R1.139 C=C=Cc1ccc(cc1)C(=O)NC 271570a_100015277604_100000155074 [0,3,0,0,0,0|0,0,0]=3 17676 B13R1.139 C=C=Cc1ccc(cc1)C(=O)NN 271570a_100015277604_100000183614 [0,3,0,0,0,0|1,0,0]=4 17677 B13R1.139 C=C=Cc1ccc(cc1)C(=O)OC 271570a_100015277604_100000150774 [0,3,0,0,0,0|1,0,0]=4 17678 B13R1.139 C=C=Cc1ccc(cn1)C(=O)NC 271570a_100015277604_100000159860 [0,3,0,0,0,0|1,0,0]=4 17679 B13R1.139 C=C=Cc1ccc(nc1)C(=O)NC 271570a_100015277604_100011781262 [0,3,0,0,0,0|1,0,0]=4 17680 B13R1.139 CC#Cc1ccc(cc1)C(=O)CC 1458a_100009923575_100000210202 [0,3,0,0,0,0|1,0,0]=4 17681 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 11a_106832991635_100009923575 [0,3,0,0,0,0|0,0,0]=3 17682 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100009923575 [0,3,0,0,0,0|0,0,0]=3 17683 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100009923575 [0,3,0,0,0,0|0,0,0]=3 17684 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 527a_100102657272_100009923575 [0,3,0,0,0,0|0,0,0]=3 17685 B13R1.139 CC=Cc1ccc(cc1)C(=O)CC 271570a_100016259895_100000211647 [0,3,0,0,0,0|1,0,0]=4 17686 B13R1.139 CC=Cc1ccc(cc1)C(=O)NC 271570a_100016259895_100000155074 [0,3,0,0,0,0|0,0,0]=3 17687 B13R1.139 CC=Cc1ccc(cc1)C(=O)NN 271570a_100016259895_100000183614 [0,3,0,0,0,0|1,0,0]=4 17688 B13R1.139 CC=Cc1ccc(cc1)C(=O)OC 271570a_100016259895_100000150774 [0,3,0,0,0,0|1,0,0]=4 17689 B13R1.139 CC=Cc1ccc(cn1)C(=O)NC 271570a_100016259895_100000159860 [0,3,0,0,0,0|1,0,0]=4 17690 B13R1.139 CC=Cc1ccc(nc1)C(=O)NC 271570a_100016259895_100011781262 [0,3,0,0,0,0|1,0,0]=4 17691 B13R1.139 CCC(=O)c1ccc(cc1)CC#N 1458a_100000693995_100000210202 [0,3,0,0,0,0|1,0,0]=4 17692 B13R1.139 CCC(=O)c1ccc(cc1)CCO 1458a_100000078963_100000210202 [0,3,0,0,0,0|1,0,0]=4 17693 B13R1.139 CCC(=O)c1ccc(cc1)CNC 26a_100102657272_100000212119 [0,3,0,0,0,0|1,0,0]=4 17694 B13R1.139 CCC(=O)c1ccc(cc1)COC 1458a_100000189608_100000210202 [0,3,0,0,0,0|1,0,0]=4 17695 B13R1.139 CCC(=O)c1ccc(cc1)CSC 1458a_100000175442_100000210202 [0,3,0,0,0,0|1,0,0]=4 17696 B13R1.139 CCC(=O)c1ccc(cc1)N=[N+]=[N-] 1458a_100000039380_100000210202 [0,3,0,0,0,0|1,0,0]=4 17697 B13R1.139 CCC(=O)c1ccc(cc1)OCF 34a_100000212119_100015361967 [0,3,0,0,0,0|1,0,0]=4 17698 B13R1.139 CCC(=O)c1ccc(cc1)OCF 7a_100000212119_100015361967 [0,3,0,0,0,0|1,0,0]=4 17699 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100000211647_100015361967 [0,3,0,0,0,0|1,0,0]=4 17700 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100015361967_100000211647 [0,3,0,0,0,0|1,0,0]=4 17701 B13R1.139 CCCc1ccc(cc1)C(=O)CC 1458a_100011207308_100000210202 [0,3,0,0,0,0|1,0,0]=4 17702 B13R1.139 CCCc1ccc(cc1)C(=O)NC 11a_106832991635_100011207308 [0,3,0,0,0,0|0,0,0]=3 17703 B13R1.139 CCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100011207308 [0,3,0,0,0,0|0,0,0]=3 17704 B13R1.139 CCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100011207308 [0,3,0,0,0,0|0,0,0]=3 17705 B13R1.139 CCCc1ccc(cc1)C(=O)NC 527a_100102657272_100011207308 [0,3,0,0,0,0|0,0,0]=3 17706 B13R1.139 CCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210202 [0,3,0,0,0,0|0,0,0]=3 17707 B13R1.139 CCNc1ccc(cc1)C(=O)NC 27a_100015525214_100000155074 [0,3,0,0,0,0|0,0,0]=3 17708 B13R1.139 CCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210202 [0,3,0,0,0,0|0,0,0]=3 17709 B13R1.139 CCNc1ccc(cc1)C(=O)NN 27a_100015525214_100000183614 [0,3,0,0,0,0|1,0,0]=4 17710 B13R1.139 CCNc1ccc(cn1)C(=O)NC 27a_100015525214_100000159860 [0,3,0,0,0,0|1,0,0]=4 17711 B13R1.139 CCNc1ccc(nc1)C(=O)NC 27a_100015525214_100011781262 [0,3,0,0,0,0|1,0,0]=4 17712 B13R1.139 CCOc1ccc(cc1)C(=O)CC 1458a_100000181891_100000210202 [0,3,0,0,0,0|1,0,0]=4 17713 B13R1.139 CCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210202 [0,3,0,0,0,0|1,0,0]=4 17714 B13R1.139 CCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210202 [0,3,0,0,0,0|1,0,0]=4 17715 B13R1.139 CCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000181891 [0,3,0,0,0,0|0,0,0]=3 17716 B13R1.139 CCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000181891 [0,3,0,0,0,0|0,0,0]=3 17717 B13R1.139 CCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000181891 [0,3,0,0,0,0|0,0,0]=3 17718 B13R1.139 CCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210202 [0,3,0,0,0,0|0,0,0]=3 17719 B13R1.139 CCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000181891 [0,3,0,0,0,0|0,0,0]=3 17720 B13R1.139 CCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210202 [0,3,0,0,0,0|0,0,0]=3 17721 B13R1.139 CCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210202 [0,3,0,0,0,0|1,0,0]=4 17722 B13R1.139 CCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210202 [0,3,0,0,0,0|1,0,0]=4 17723 B13R1.139 CCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210202 [0,3,0,0,0,0|1,0,0]=4 17724 B13R1.139 CCOc1ccc(nc1)C(=O)NC 34a_100009861314_100000210202 [0,3,0,0,0,0|1,0,0]=4 17725 B13R1.139 CCOc1ccc(nc1)C(=O)NC 7a_100009861314_100000210202 [0,3,0,0,0,0|1,0,0]=4 17726 B13R1.139 CCSc1ccc(cc1)C(=O)CC 1458a_100000244969_100000210202 [0,3,0,0,0,0|1,0,0]=4 17727 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000210202_100000211647 [0,3,0,0,0,0|1,0,0]=4 17728 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210202 [0,3,0,0,0,0|1,0,0]=4 17729 B13R1.139 CCSc1ccc(cc1)C(=O)NC 11a_106832991635_100000244969 [0,3,0,0,0,0|0,0,0]=3 17730 B13R1.139 CCSc1ccc(cc1)C(=O)NC 1626a_100102657272_100000244969 [0,3,0,0,0,0|0,0,0]=3 17731 B13R1.139 CCSc1ccc(cc1)C(=O)NC 240690a_100102657272_100000244969 [0,3,0,0,0,0|0,0,0]=3 17732 B13R1.139 CCSc1ccc(cc1)C(=O)NC 527a_100102657272_100000244969 [0,3,0,0,0,0|0,0,0]=3 17733 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210202 [0,3,0,0,0,0|0,0,0]=3 17734 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000210202_100000155074 [0,3,0,0,0,0|0,0,0]=3 17735 B13R1.139 CCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000210202 [0,3,0,0,0,0|1,0,0]=4 17736 B13R1.139 CCSc1ccc(cc1)C(=O)NN 62a_100000210202_100000183614 [0,3,0,0,0,0|1,0,0]=4 17737 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210202 [0,3,0,0,0,0|1,0,0]=4 17738 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000210202_100000150774 [0,3,0,0,0,0|1,0,0]=4 17739 B13R1.139 CCSc1ccc(cn1)C(=O)NC 62a_100000159860_100000210202 [0,3,0,0,0,0|1,0,0]=4 17740 B13R1.139 CCSc1ccc(cn1)C(=O)NC 62a_100000210202_100000159860 [0,3,0,0,0,0|1,0,0]=4 17741 B13R1.139 CCSc1ccc(nc1)C(=O)NC 62a_100000210202_100011781262 [0,3,0,0,0,0|1,0,0]=4 17742 B13R1.139 CCSc1ccc(nc1)C(=O)NC 62a_100011781262_100000210202 [0,3,0,0,0,0|1,0,0]=4 17743 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 11a_106832991635_100000693995 [0,3,0,0,0,0|0,0,0]=3 17744 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 1626a_100102657272_100000693995 [0,3,0,0,0,0|0,0,0]=3 17745 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 240690a_100102657272_100000693995 [0,3,0,0,0,0|0,0,0]=3 17746 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 527a_100102657272_100000693995 [0,3,0,0,0,0|0,0,0]=3 17747 B13R1.139 CNC(=O)c1ccc(cc1)CCO 1626a_100102657272_100000078963 [0,3,0,0,0,0|0,0,0]=3 17748 B13R1.139 CNC(=O)c1ccc(cc1)CCO 240690a_100102657272_100000078963 [0,3,0,0,0,0|0,0,0]=3 17749 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 2230a_100000743749_200025704644 [0,3,0,0,0,0|0,0,0]=3 17750 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 34a_100000743749_200025704644 [0,3,0,0,0,0|0,0,0]=3 17751 B13R1.139 CNC(=O)c1ccc(cc1)COC 11a_106832991635_100000189608 [0,3,0,0,0,0|0,0,0]=3 17752 B13R1.139 CNC(=O)c1ccc(cc1)COC 1626a_100102657272_100000189608 [0,3,0,0,0,0|0,0,0]=3 17753 B13R1.139 CNC(=O)c1ccc(cc1)COC 240690a_100102657272_100000189608 [0,3,0,0,0,0|0,0,0]=3 17754 B13R1.139 CNC(=O)c1ccc(cc1)COC 34a_100138415774_100000753832 [0,3,0,0,0,0|0,0,0]=3 17755 B13R1.139 CNC(=O)c1ccc(cc1)COC 527a_100102657272_100000189608 [0,3,0,0,0,0|0,0,0]=3 17756 B13R1.139 CNC(=O)c1ccc(cc1)CSC 11a_106832991635_100000175442 [0,3,0,0,0,0|0,0,0]=3 17757 B13R1.139 CNC(=O)c1ccc(cc1)CSC 1626a_100102657272_100000175442 [0,3,0,0,0,0|0,0,0]=3 17758 B13R1.139 CNC(=O)c1ccc(cc1)CSC 240690a_100102657272_100000175442 [0,3,0,0,0,0|0,0,0]=3 17759 B13R1.139 CNC(=O)c1ccc(cc1)CSC 527a_100102657272_100000175442 [0,3,0,0,0,0|0,0,0]=3 17760 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_100000753832_200000210301 [0,3,0,0,0,0|0,0,0]=3 17761 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_200000210301_100000753832 [0,3,0,0,0,0|0,0,0]=3 17762 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_100000753832_200025704644 [0,3,0,0,0,0|0,0,0]=3 17763 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000753832 [0,3,0,0,0,0|0,0,0]=3 17764 B13R1.139 CNC(=O)c1ccc(cc1)N=[N+]=[N-] 11a_106832991635_100000039380 [0,3,0,0,0,0|0,0,0]=3 17765 B13R1.139 CNC(=O)c1ccc(cc1)N=[N+]=[N-] 240690a_100102657272_100000039380 [0,3,0,0,0,0|0,0,0]=3 17766 B13R1.139 CNC(=O)c1ccc(cc1)NCF 34a_100000184841_100015361967 [0,3,0,0,0,0|0,0,0]=3 17767 B13R1.139 CNC(=O)c1ccc(cc1)OCF 34a_100000192141_100015361967 [0,3,0,0,0,0|0,0,0]=3 17768 B13R1.139 CNC(=O)c1ccc(cc1)OCF 7a_100000192141_100015361967 [0,3,0,0,0,0|0,0,0]=3 17769 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100000155074_100015361967 [0,3,0,0,0,0|0,0,0]=3 17770 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100015361967_100000155074 [0,3,0,0,0,0|0,0,0]=3 17771 B13R1.139 CNC(=O)c1ccc(cn1)OCF 34a_100009861314_100015361967 [0,3,0,0,0,0|1,0,0]=4 17772 B13R1.139 CNC(=O)c1ccc(cn1)OCF 7a_100009861314_100015361967 [0,3,0,0,0,0|1,0,0]=4 17773 B13R1.139 CNC(=O)c1ccc(cn1)SCF 62a_100011781262_100015361967 [0,3,0,0,0,0|1,0,0]=4 17774 B13R1.139 CNC(=O)c1ccc(cn1)SCF 62a_100015361967_100011781262 [0,3,0,0,0,0|1,0,0]=4 17775 B13R1.139 CNC(=O)c1ccc(nc1)SCF 62a_100000159860_100015361967 [0,3,0,0,0,0|1,0,0]=4 17776 B13R1.139 CNC(=O)c1ccc(nc1)SCF 62a_100015361967_100000159860 [0,3,0,0,0,0|1,0,0]=4 17777 B13R1.139 CNCc1ccc(cc1)C(=O)NC 207a_100102657272_100000043907 [0,3,0,0,0,0|0,0,0]=3 17778 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_200000210301 [0,3,0,0,0,0|0,0,0]=3 17779 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_106832991635_100000753832 [0,3,0,0,0,0|0,0,0]=3 17780 B13R1.139 CNCc1ccc(cc1)C(=O)NC 270004a_106832991635_100000043907 [0,3,0,0,0,0|0,0,0]=3 17781 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100000743749_200000210301 [0,3,0,0,0,0|0,0,0]=3 17782 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100102657272_100000753832 [0,3,0,0,0,0|0,0,0]=3 17783 B13R1.139 CNCc1ccc(cc1)C(=O)NC 7a_106832991635_100000753832 [0,3,0,0,0,0|0,0,0]=3 17784 B13R1.139 CNCc1ccc(cc1)C(=O)OC 2230a_106832991635_100000735637 [0,3,0,0,0,0|1,0,0]=4 17785 B13R1.139 CNCc1ccc(cc1)C(=O)OC 26a_100102657272_100000150123 [0,3,0,0,0,0|1,0,0]=4 17786 B13R1.139 CNCc1ccc(cc1)C(=O)OC 270004a_106832991635_100000148700 [0,3,0,0,0,0|1,0,0]=4 17787 B13R1.139 CNCc1ccc(cc1)C(=O)OC 34a_100102657272_100000735637 [0,3,0,0,0,0|1,0,0]=4 17788 B13R1.139 CNCc1ccc(cc1)C(=O)OC 7a_106832991635_100000735637 [0,3,0,0,0,0|1,0,0]=4 17789 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 34a_100000151488_200025704644 [0,3,0,0,0,0|1,0,0]=4 17790 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 7a_100000151488_200025704644 [0,3,0,0,0,0|1,0,0]=4 17791 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_100000735637_200000210301 [0,3,0,0,0,0|1,0,0]=4 17792 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_200000210301_100000187170 [0,3,0,0,0,0|1,0,0]=4 17793 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_100000735637_200025704644 [0,3,0,0,0,0|1,0,0]=4 17794 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000187170 [0,3,0,0,0,0|1,0,0]=4 17795 B13R1.139 COC(=O)c1ccc(cc1)OCF 34a_100000150123_100015361967 [0,3,0,0,0,0|1,0,0]=4 17796 B13R1.139 COC(=O)c1ccc(cc1)OCF 7a_100000150123_100015361967 [0,3,0,0,0,0|1,0,0]=4 17797 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100000150774_100015361967 [0,3,0,0,0,0|1,0,0]=4 17798 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100015361967_100000150774 [0,3,0,0,0,0|1,0,0]=4 17799 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100000151488_200000210301 [0,3,0,0,0,0|1,0,0]=4 17800 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100138415774_100000735637 [0,3,0,0,0,0|1,0,0]=4 17801 B13R1.139 COCc1ccc(cc1)C(=O)OC 7a_100000151488_200000210301 [0,3,0,0,0,0|1,0,0]=4 17802 B13R1.139 NNC(=O)c1ccc(cc1)OCF 34a_100000185078_100015361967 [0,3,0,0,0,0|1,0,0]=4 17803 B13R1.139 NNC(=O)c1ccc(cc1)SCF 62a_100000183614_100015361967 [0,3,0,0,0,0|1,0,0]=4 17804 B13R1.139 NNC(=O)c1ccc(cc1)SCF 62a_100015361967_100000183614 [0,3,0,0,0,0|1,0,0]=4 17805 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 1458a_200009908186_100000210202 [0,3,0,0,0,0|1,0,0]=4 17806 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 271570a_100000694244_100000211647 [0,3,0,0,0,0|1,0,0]=4 17807 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 11a_106832991635_200009908186 [0,3,0,0,0,0|0,0,0]=3 17808 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 1626a_100102657272_200009908186 [0,3,0,0,0,0|0,0,0]=3 17809 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 240690a_100102657272_200009908186 [0,3,0,0,0,0|0,0,0]=3 17810 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 271570a_100000694244_100000155074 [0,3,0,0,0,0|0,0,0]=3 17811 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 527a_100102657272_200009908186 [0,3,0,0,0,0|0,0,0]=3 17812 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NN 271570a_100000694244_100000183614 [0,3,0,0,0,0|1,0,0]=4 17813 B13R1.537 C=C(C)c1ccc(cc1)C(=O)OC 271570a_100000694244_100000150774 [0,3,0,0,0,0|1,0,0]=4 17814 B13R1.537 C=C(C)c1ccc(cn1)C(=O)NC 271570a_100000694244_100000159860 [0,3,0,0,0,0|1,0,0]=4 17815 B13R1.537 C=C(C)c1ccc(nc1)C(=O)NC 271570a_100000694244_100011781262 [0,3,0,0,0,0|1,0,0]=4 17816 B13R1.537 CCC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_100000210202 [0,3,0,0,0,0|1,0,0]=4 17817 B13R1.537 CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210202 [0,3,0,0,0,0|1,0,0]=4 17818 B13R1.537 CCC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_100000210202 [0,3,0,0,0,0|1,0,0]=4 17819 B13R1.537 CCC(=O)c1ccc(cc1)C(F)F 1458a_100011735500_100000210202 [0,3,0,0,0,0|1,0,0]=4 17820 B13R1.537 CCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000210202 [0,3,0,0,0,0|1,0,0]=4 17821 B13R1.537 CCC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_100000210202 [0,3,0,0,0,0|1,0,0]=4 17822 B13R1.537 CCC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100000210202 [0,3,0,0,0,0|1,0,0]=4 17823 B13R1.537 CN(C)c1ccc(cc1)C(=O)NN 27a_100102631434_100000183614 [0,3,0,0,0,0|1,0,0]=4 17824 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)C 1458a_100011298788_200000210301 [0,3,0,0,0,0|0,0,0]=3 17825 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 11a_106832991635_100000230133 [0,3,0,0,0,0|0,0,0]=3 17826 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 1626a_100102657272_100000230133 [0,3,0,0,0,0|0,0,0]=3 17827 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 240690a_100102657272_100000230133 [0,3,0,0,0,0|0,0,0]=3 17828 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100011298788_200025704644 [0,3,0,0,0,0|0,0,0]=3 17829 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 11a_106832991635_100000210772 [0,3,0,0,0,0|0,0,0]=3 17830 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 1626a_100102657272_100000210772 [0,3,0,0,0,0|0,0,0]=3 17831 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 240690a_100102657272_100000210772 [0,3,0,0,0,0|0,0,0]=3 17832 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 527a_100102657272_100000210772 [0,3,0,0,0,0|0,0,0]=3 17833 B13R1.537 CNC(=O)c1ccc(cc1)C(C)O 240690a_100102657272_100000076921 [0,3,0,0,0,0|0,0,0]=3 17834 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 11a_106832991635_100011735500 [0,3,0,0,0,0|0,0,0]=3 17835 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 1626a_100102657272_100011735500 [0,3,0,0,0,0|0,0,0]=3 17836 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 240690a_100102657272_100011735500 [0,3,0,0,0,0|0,0,0]=3 17837 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 527a_100102657272_100011735500 [0,3,0,0,0,0|0,0,0]=3 17838 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 11a_106832991635_100000210873 [0,3,0,0,0,0|0,0,0]=3 17839 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 1626a_100102657272_100000210873 [0,3,0,0,0,0|0,0,0]=3 17840 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 240690a_100102657272_100000210873 [0,3,0,0,0,0|0,0,0]=3 17841 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 27a_100102631434_100000155074 [0,3,0,0,0,0|0,0,0]=3 17842 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 527a_100102657272_100000210873 [0,3,0,0,0,0|0,0,0]=3 17843 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 1626a_100102657272_200000217594 [0,3,0,0,0,0|0,0,0]=3 17844 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 240690a_100102657272_200000217594 [0,3,0,0,0,0|0,0,0]=3 17845 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 527a_100102657272_200000217594 [0,3,0,0,0,0|0,0,0]=3 17846 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000185811 [0,3,0,0,0,0|0,0,0]=3 17847 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000185811 [0,3,0,0,0,0|0,0,0]=3 17848 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000185811 [0,3,0,0,0,0|0,0,0]=3 17849 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000185811 [0,3,0,0,0,0|0,0,0]=3 17850 B13R1.537 CNC(=O)c1ccc(cn1)N(C)C 27a_100102631434_100011781262 [0,3,0,0,0,0|1,0,0]=4 17851 B13R1.537 CNC(=O)c1ccc(nc1)C(F)F 11a_106832991635_100009846429 [0,3,0,0,0,0|1,0,0]=4 17852 B13R1.537 CNC(=O)c1ccc(nc1)C(F)F 1626a_100102657272_100009846429 [0,3,0,0,0,0|1,0,0]=4 17853 B13R1.537 CNC(=O)c1ccc(nc1)C(F)F 240690a_100102657272_100009846429 [0,3,0,0,0,0|1,0,0]=4 17854 B13R1.537 CNC(=O)c1ccc(nc1)C(F)F 527a_100102657272_100009846429 [0,3,0,0,0,0|1,0,0]=4 17855 B13R1.537 CNC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000159860 [0,3,0,0,0,0|1,0,0]=4 17856 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C 1458a_100000211811_200000210301 [0,3,0,0,0,0|1,0,0]=4 17857 B13R1.537 COC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000211811_200025704644 [0,3,0,0,0,0|1,0,0]=4 17858 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 2230a_100000220287_200000210301 [0,3,0,0,0,0|1,0,0]=4 17859 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 269982a_100000220287_200000210301 [0,3,0,0,0,0|1,0,0]=4 17860 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 34a_100000220287_200000210301 [0,3,0,0,0,0|1,0,0]=4 17861 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 2230a_100000220287_200025704644 [0,3,0,0,0,0|1,0,0]=4 17862 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 269982a_100000220287_200025704644 [0,3,0,0,0,0|1,0,0]=4 17863 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 34a_100000220287_200025704644 [0,3,0,0,0,0|1,0,0]=4 17864 B13R1.3088 C#Cc1ccc(cc1C)C(=O)CC 1458a_100013243528_100000210202 [0,3,0,0,0,0|1,0,0]=4 17865 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 11a_106832991635_100013243528 [0,3,0,0,0,0|0,0,0]=3 17866 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 1626a_100102657272_100013243528 [0,3,0,0,0,0|0,0,0]=3 17867 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 527a_100102657272_100013243528 [0,3,0,0,0,0|0,0,0]=3 17868 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)CC 1458a_100014797261_100000210202 [0,3,0,0,0,0|1,0,0]=4 17869 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 11a_106832991635_100014797261 [0,3,0,0,0,0|0,0,0]=3 17870 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 1626a_100102657272_100014797261 [0,3,0,0,0,0|0,0,0]=3 17871 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 527a_100102657272_100014797261 [0,3,0,0,0,0|0,0,0]=3 17872 B13R1.3088 C=Cc1ccc(cc1Br)C(=O)OC 271570a_100011290941_100011294788 [0,3,0,0,0,0|1,0,0]=4 17873 B13R1.3088 C=Cc1ccc(cc1C)C(=O)CC 271570a_100011290941_200012349626 [0,3,0,0,0,0|1,0,0]=4 17874 B13R1.3088 C=Cc1ccc(cc1C)C(=O)NC 271570a_100011290941_200013065384 [0,3,0,0,0,0|0,0,0]=3 17875 B13R1.3088 C=Cc1ccc(cc1C)C(=O)NN 271570a_100011290941_100012339724 [0,3,0,0,0,0|1,0,0]=4 17876 B13R1.3088 C=Cc1ccc(cc1C)C(=O)OC 271570a_100011290941_100011215878 [0,3,0,0,0,0|1,0,0]=4 17877 B13R1.3088 C=Cc1ccc(cc1Cl)C(=O)OC 271570a_100011290941_100012356344 [0,3,0,0,0,0|1,0,0]=4 17878 B13R1.3088 C=Cc1ccc(cc1F)C(=O)OC 271570a_100011290941_100000703229 [0,3,0,0,0,0|1,0,0]=4 17879 B13R1.3088 C=Cc1ccc(cc1N)C(=O)OC 271570a_100011290941_100011450966 [0,3,0,0,0,0|1,0,0]=4 17880 B13R1.3088 C=Cc1ccc(cc1O)C(=O)OC 271570a_100011290941_100012350776 [0,3,0,0,0,0|1,0,0]=4 17881 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_100000210202 [0,3,0,0,0,0|1,0,0]=4 17882 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)CC 1458a_100012340589_100000210202 [0,3,0,0,0,0|1,0,0]=4 17883 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)OC 1458a_100000187947_100000210202 [0,3,0,0,0,0|1,0,0]=4 17884 B13R1.3088 CCC(=O)c1ccc(c(c1)C)C#N 1458a_100012180287_100000210202 [0,3,0,0,0,0|1,0,0]=4 17885 B13R1.3088 CCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210202 [0,3,0,0,0,0|1,0,0]=4 17886 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200012349626 [0,3,0,0,0,0|1,0,0]=4 17887 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200012349626_200000210301 [0,3,0,0,0,0|1,0,0]=4 17888 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200012349626_200025704644 [0,3,0,0,0,0|1,0,0]=4 17889 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200012349626 [0,3,0,0,0,0|1,0,0]=4 17890 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_100000210202 [0,3,0,0,0,0|1,0,0]=4 17891 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 1458a_100000188346_100000210202 [0,3,0,0,0,0|1,0,0]=4 17892 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 34a_100011218862_200000210301 [0,3,0,0,0,0|1,0,0]=4 17893 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 7a_100011218862_200000210301 [0,3,0,0,0,0|1,0,0]=4 17894 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100011218862_200025704644 [0,3,0,0,0,0|1,0,0]=4 17895 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100011218862_200025704644 [0,3,0,0,0,0|1,0,0]=4 17896 B13R1.3088 CCC(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_100000210202 [0,3,0,0,0,0|1,0,0]=4 17897 B13R1.3088 CCC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_100000210202 [0,3,0,0,0,0|1,0,0]=4 17898 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC 1458a_100000186160_100000210202 [0,3,0,0,0,0|1,0,0]=4 17899 B13R1.3088 CCC(=O)c1ccc(c(c1)I)OC 1458a_100000188716_100000210202 [0,3,0,0,0,0|1,0,0]=4 17900 B13R1.3088 CCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210202 [0,3,0,0,0,0|1,0,0]=4 17901 B13R1.3088 CCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210202 [0,3,0,0,0,0|1,0,0]=4 17902 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 11a_106832991635_100012340589 [0,3,0,0,0,0|0,0,0]=3 17903 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 1626a_100102657272_100012340589 [0,3,0,0,0,0|0,0,0]=3 17904 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 240690a_100102657272_100012340589 [0,3,0,0,0,0|0,0,0]=3 17905 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 527a_100102657272_100012340589 [0,3,0,0,0,0|0,0,0]=3 17906 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 240690a_100102657272_100000089006 [0,3,0,0,0,0|0,0,0]=3 17907 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 527a_100102657272_100000089006 [0,3,0,0,0,0|0,0,0]=3 17908 B13R1.3088 CCc1ccc(cc1O)C(=O)OC 271570a_203496583355_200012360130 [0,3,0,0,0,0|1,0,0]=4 17909 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 11a_106832991635_100012355661 [0,3,0,0,0,0|0,0,0]=3 17910 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 1626a_100102657272_100012355661 [0,3,0,0,0,0|0,0,0]=3 17911 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 240690a_100102657272_100012355661 [0,3,0,0,0,0|0,0,0]=3 17912 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 527a_100102657272_100012355661 [0,3,0,0,0,0|0,0,0]=3 17913 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 11a_106832991635_100000187947 [0,3,0,0,0,0|0,0,0]=3 17914 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 1626a_100102657272_100000187947 [0,3,0,0,0,0|0,0,0]=3 17915 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 240690a_100102657272_100000187947 [0,3,0,0,0,0|0,0,0]=3 17916 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 527a_100102657272_100000187947 [0,3,0,0,0,0|0,0,0]=3 17917 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 11a_106832991635_100012180287 [0,3,0,0,0,0|0,0,0]=3 17918 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 1626a_100102657272_100012180287 [0,3,0,0,0,0|0,0,0]=3 17919 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 240690a_100102657272_100012180287 [0,3,0,0,0,0|0,0,0]=3 17920 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 527a_100102657272_100012180287 [0,3,0,0,0,0|0,0,0]=3 17921 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 2230a_100000739472_200000210301 [0,3,0,0,0,0|0,0,0]=3 17922 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200013065384 [0,3,0,0,0,0|0,0,0]=3 17923 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 34a_100000739472_200000210301 [0,3,0,0,0,0|0,0,0]=3 17924 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 7a_100000739472_200000210301 [0,3,0,0,0,0|0,0,0]=3 17925 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 2230a_100000739472_200025704644 [0,3,0,0,0,0|0,0,0]=3 17926 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 34a_100000739472_200025704644 [0,3,0,0,0,0|0,0,0]=3 17927 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 7a_100000739472_200025704644 [0,3,0,0,0,0|0,0,0]=3 17928 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 11a_106832991635_100011202886 [0,3,0,0,0,0|0,0,0]=3 17929 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 1626a_100102657272_100011202886 [0,3,0,0,0,0|0,0,0]=3 17930 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 240690a_100102657272_100011202886 [0,3,0,0,0,0|0,0,0]=3 17931 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 527a_100102657272_100011202886 [0,3,0,0,0,0|0,0,0]=3 17932 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200013065384 [0,3,0,0,0,0|0,0,0]=3 17933 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200013065384_200000210301 [0,3,0,0,0,0|0,0,0]=3 17934 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200013065384_200025704644 [0,3,0,0,0,0|0,0,0]=3 17935 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200013065384 [0,3,0,0,0,0|0,0,0]=3 17936 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 11a_106832991635_100000694585 [0,3,0,0,0,0|0,0,0]=3 17937 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 1626a_100102657272_100000694585 [0,3,0,0,0,0|0,0,0]=3 17938 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 527a_100102657272_100000694585 [0,3,0,0,0,0|0,0,0]=3 17939 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 11a_106832991635_100000188346 [0,3,0,0,0,0|0,0,0]=3 17940 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 1626a_100102657272_100000188346 [0,3,0,0,0,0|0,0,0]=3 17941 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 240690a_100102657272_100000188346 [0,3,0,0,0,0|0,0,0]=3 17942 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 527a_100102657272_100000188346 [0,3,0,0,0,0|0,0,0]=3 17943 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 11a_106832991635_100011217213 [0,3,0,0,0,0|0,0,0]=3 17944 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 1626a_100102657272_100011217213 [0,3,0,0,0,0|0,0,0]=3 17945 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 527a_100102657272_100011217213 [0,3,0,0,0,0|0,0,0]=3 17946 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 1626a_100102657272_100000687192 [0,3,0,0,0,0|0,0,0]=3 17947 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 240690a_100102657272_100000687192 [0,3,0,0,0,0|0,0,0]=3 17948 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 11a_106832991635_100000186160 [0,3,0,0,0,0|0,0,0]=3 17949 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 1626a_100102657272_100000186160 [0,3,0,0,0,0|0,0,0]=3 17950 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 240690a_100102657272_100000186160 [0,3,0,0,0,0|0,0,0]=3 17951 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 527a_100102657272_100000186160 [0,3,0,0,0,0|0,0,0]=3 17952 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 11a_106832991635_100000188716 [0,3,0,0,0,0|0,0,0]=3 17953 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 1626a_100102657272_100000188716 [0,3,0,0,0,0|0,0,0]=3 17954 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 240690a_100102657272_100000188716 [0,3,0,0,0,0|0,0,0]=3 17955 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 527a_100102657272_100000188716 [0,3,0,0,0,0|0,0,0]=3 17956 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 240690a_100102657272_100000766810 [0,3,0,0,0,0|0,0,0]=3 17957 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 527a_100102657272_100000766810 [0,3,0,0,0,0|0,0,0]=3 17958 B13R1.3088 CNc1ccc(cc1C)C(=O)NN 27a_100102657272_100012339724 [0,3,0,0,0,0|1,0,0]=4 17959 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 34a_100000216328_200000210301 [0,3,0,0,0,0|1,0,0]=4 17960 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 7a_100000216328_200000210301 [0,3,0,0,0,0|1,0,0]=4 17961 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100000216328_200025704644 [0,3,0,0,0,0|1,0,0]=4 17962 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100000216328_200025704644 [0,3,0,0,0,0|1,0,0]=4 17963 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_100011294788_200000210301 [0,3,0,0,0,0|1,0,0]=4 17964 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_200000210301_100011294788 [0,3,0,0,0,0|1,0,0]=4 17965 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100011294788_200025704644 [0,3,0,0,0,0|1,0,0]=4 17966 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100011294788 [0,3,0,0,0,0|1,0,0]=4 17967 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 34a_100011997373_200000210301 [0,3,0,0,0,0|1,0,0]=4 17968 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 7a_100011997373_200000210301 [0,3,0,0,0,0|1,0,0]=4 17969 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100011997373_200025704644 [0,3,0,0,0,0|1,0,0]=4 17970 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100011997373_200025704644 [0,3,0,0,0,0|1,0,0]=4 17971 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_100011215878_200000210301 [0,3,0,0,0,0|1,0,0]=4 17972 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100011215878 [0,3,0,0,0,0|1,0,0]=4 17973 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100011215878_200025704644 [0,3,0,0,0,0|1,0,0]=4 17974 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011215878 [0,3,0,0,0,0|1,0,0]=4 17975 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 34a_100000151454_200000210301 [0,3,0,0,0,0|1,0,0]=4 17976 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 7a_100000151454_200000210301 [0,3,0,0,0,0|1,0,0]=4 17977 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000151454_200025704644 [0,3,0,0,0,0|1,0,0]=4 17978 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000151454_200025704644 [0,3,0,0,0,0|1,0,0]=4 17979 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_100012356344_200000210301 [0,3,0,0,0,0|1,0,0]=4 17980 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_200000210301_100012356344 [0,3,0,0,0,0|1,0,0]=4 17981 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_100012356344_200025704644 [0,3,0,0,0,0|1,0,0]=4 17982 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100012356344 [0,3,0,0,0,0|1,0,0]=4 17983 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 34a_100000075456_200000210301 [0,3,0,0,0,0|1,0,0]=4 17984 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 7a_100000075456_200000210301 [0,3,0,0,0,0|1,0,0]=4 17985 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000075456_200025704644 [0,3,0,0,0,0|1,0,0]=4 17986 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000075456_200025704644 [0,3,0,0,0,0|1,0,0]=4 17987 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_100000703229_200000210301 [0,3,0,0,0,0|1,0,0]=4 17988 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_200000210301_100000703229 [0,3,0,0,0,0|1,0,0]=4 17989 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000703229_200025704644 [0,3,0,0,0,0|1,0,0]=4 17990 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000703229 [0,3,0,0,0,0|1,0,0]=4 17991 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 34a_100010162523_200000210301 [0,3,0,0,0,0|1,0,0]=4 17992 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 7a_100010162523_200000210301 [0,3,0,0,0,0|1,0,0]=4 17993 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 34a_100010162523_200025704644 [0,3,0,0,0,0|1,0,0]=4 17994 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 7a_100010162523_200025704644 [0,3,0,0,0,0|1,0,0]=4 17995 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 34a_100000724433_200000210301 [0,3,0,0,0,0|1,0,0]=4 17996 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 7a_100000724433_200000210301 [0,3,0,0,0,0|1,0,0]=4 17997 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000724433_200025704644 [0,3,0,0,0,0|1,0,0]=4 17998 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000724433_200025704644 [0,3,0,0,0,0|1,0,0]=4 17999 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_100011450966_200000210301 [0,3,0,0,0,0|1,0,0]=4 18000 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_200000210301_100011450966 [0,3,0,0,0,0|1,0,0]=4 18001 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100011450966_200025704644 [0,3,0,0,0,0|1,0,0]=4 18002 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011450966 [0,3,0,0,0,0|1,0,0]=4 18003 B13R1.3088 COC(=O)c1ccc(c(c1)O)C#N 271570a_203496583355_100009861381 [0,3,0,0,0,0|1,0,0]=4 18004 B13R1.3088 COC(=O)c1ccc(c(c1)O)C=O 271570a_203496583355_100012179231 [0,3,0,0,0,0|1,0,0]=4 18005 B13R1.3088 COC(=O)c1ccc(c(c1)O)CO 271570a_203496583355_100012355398 [0,3,0,0,0,0|1,0,0]=4 18006 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100000189012 [0,3,0,0,0,0|1,0,0]=4 18007 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_100012350776_200000210301 [0,3,0,0,0,0|1,0,0]=4 18008 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012350776 [0,3,0,0,0,0|1,0,0]=4 18009 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_100012350776_200025704644 [0,3,0,0,0,0|1,0,0]=4 18010 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012350776 [0,3,0,0,0,0|1,0,0]=4 18011 B13R1.3088 COc1ccc(cc1N)C(=O)NN 34a_200000039609_200000210301 [0,3,0,0,0,0|1,0,0]=4 18012 B13R1.3088 COc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000186317 [0,3,0,0,0,0|1,0,0]=4 18013 B13R1.3088 CSc1ccc(cc1C)C(=O)NN 62a_100012339724_200000210301 [0,3,0,0,0,0|1,0,0]=4 18014 B13R1.3088 CSc1ccc(cc1C)C(=O)NN 62a_200000210301_100012339724 [0,3,0,0,0,0|1,0,0]=4 18015 B13R1.3088 Cc1cc(ccc1S[13CH3])C(=O)NN 62a_100012339724_200025704644 [0,3,0,0,0,0|1,0,0]=4 18016 B13R1.3088 Cc1cc(ccc1S[13CH3])C(=O)NN 62a_200025704644_100012339724 [0,3,0,0,0,0|1,0,0]=4 18017 B13R1.3088 [13CH3]Oc1ccc(cc1N)C(=O)NN 34a_200000039609_200025704644 [0,3,0,0,0,0|1,0,0]=4 18018 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210206 [0,3,0,0,0,0|1,0,0]=4 18019 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210206 [0,3,0,0,0,0|1,0,0]=4 18020 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210206 [0,3,0,0,0,0|1,0,0]=4 18021 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210206 [0,3,0,0,0,0|1,0,0]=4 18022 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210206 [0,3,0,0,0,0|1,0,0]=4 18023 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210206 [0,3,0,0,0,0|1,0,0]=4 18024 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210206 [0,3,0,0,0,0|1,0,0]=4 18025 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210206 [0,3,0,0,0,0|1,0,0]=4 18026 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210206 [0,3,0,0,0,0|1,0,0]=4 18027 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210206 [0,3,0,0,0,0|1,0,0]=4 18028 B13R1.163 CC(C)C(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210206 [0,3,0,0,0,0|1,0,0]=4 18029 B13R1.163 CC(C)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210206 [0,3,0,0,0,0|1,0,0]=4 18030 B13R1.163 CC(C)C(=O)c1ccc(cc1F)F 1458a_100000211022_100000210206 [0,3,0,0,0,0|1,0,0]=4 18031 B13R1.163 CC(C)C(=O)c1ccc(cc1F)I 1458a_100000037189_100000210206 [0,3,0,0,0,0|1,0,0]=4 18032 B13R1.163 CC(C)C(=O)c1ccc(cc1F)O 1458a_100000689029_100000210206 [0,3,0,0,0,0|1,0,0]=4 18033 B13R1.163 CC(C)C(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210206 [0,3,0,0,0,0|1,0,0]=4 18034 B13R1.163 CC(C)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210206 [0,3,0,0,0,0|1,0,0]=4 18035 B13R1.163 CC(C)C(=O)c1ccc(cc1I)F 1458a_100000739341_100000210206 [0,3,0,0,0,0|1,0,0]=4 18036 B13R1.163 CC(C)C(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210206 [0,3,0,0,0,0|1,0,0]=4 18037 B13R1.163 CC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210206 [0,3,0,0,0,0|1,0,0]=4 18038 B13R1.163 CC(C)C(=O)c1ccc(cc1O)F 1458a_100000746061_100000210206 [0,3,0,0,0,0|1,0,0]=4 18039 B13R1.163 CC(C)C(=O)c1ccc(cc1O)I 1458a_100000091984_100000210206 [0,3,0,0,0,0|1,0,0]=4 18040 B13R1.163 CC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_100000210206 [0,3,0,0,0,0|1,0,0]=4 18041 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 11a_100102631434_100000762965 [0,3,0,0,0,0|0,0,0]=3 18042 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 1626a_100102631434_100000762965 [0,3,0,0,0,0|0,0,0]=3 18043 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 240690a_100102631434_100000762965 [0,3,0,0,0,0|0,0,0]=3 18044 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 527a_100102631434_100000762965 [0,3,0,0,0,0|0,0,0]=3 18045 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 11a_100102631434_100000766353 [0,3,0,0,0,0|0,0,0]=3 18046 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100102631434_100000766353 [0,3,0,0,0,0|0,0,0]=3 18047 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100102631434_100000766353 [0,3,0,0,0,0|0,0,0]=3 18048 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 527a_100102631434_100000766353 [0,3,0,0,0,0|0,0,0]=3 18049 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 11a_100102631434_100000212304 [0,3,0,0,0,0|0,0,0]=3 18050 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 1626a_100102631434_100000212304 [0,3,0,0,0,0|0,0,0]=3 18051 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 240690a_100102631434_100000212304 [0,3,0,0,0,0|0,0,0]=3 18052 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 527a_100102631434_100000212304 [0,3,0,0,0,0|0,0,0]=3 18053 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 11a_100102631434_100012360512 [0,3,0,0,0,0|0,0,0]=3 18054 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 1626a_100102631434_100012360512 [0,3,0,0,0,0|0,0,0]=3 18055 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 240690a_100102631434_100012360512 [0,3,0,0,0,0|0,0,0]=3 18056 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 527a_100102631434_100012360512 [0,3,0,0,0,0|0,0,0]=3 18057 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)O 240690a_100102631434_100012344906 [0,3,0,0,0,0|0,0,0]=3 18058 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)O 527a_100102631434_100012344906 [0,3,0,0,0,0|0,0,0]=3 18059 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 11a_100102631434_100000741628 [0,3,0,0,0,0|0,0,0]=3 18060 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 1626a_100102631434_100000741628 [0,3,0,0,0,0|0,0,0]=3 18061 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 240690a_100102631434_100000741628 [0,3,0,0,0,0|0,0,0]=3 18062 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 527a_100102631434_100000741628 [0,3,0,0,0,0|0,0,0]=3 18063 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100102631434_100000185840 [0,3,0,0,0,0|0,0,0]=3 18064 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100102631434_100000185840 [0,3,0,0,0,0|0,0,0]=3 18065 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100102631434_100000185840 [0,3,0,0,0,0|0,0,0]=3 18066 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100102631434_100000185840 [0,3,0,0,0,0|0,0,0]=3 18067 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 11a_100102631434_100000211397 [0,3,0,0,0,0|0,0,0]=3 18068 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 1626a_100102631434_100000211397 [0,3,0,0,0,0|0,0,0]=3 18069 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 240690a_100102631434_100000211397 [0,3,0,0,0,0|0,0,0]=3 18070 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 527a_100102631434_100000211397 [0,3,0,0,0,0|0,0,0]=3 18071 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 11a_100102631434_100000751301 [0,3,0,0,0,0|0,0,0]=3 18072 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 1626a_100102631434_100000751301 [0,3,0,0,0,0|0,0,0]=3 18073 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 240690a_100102631434_100000751301 [0,3,0,0,0,0|0,0,0]=3 18074 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 527a_100102631434_100000751301 [0,3,0,0,0,0|0,0,0]=3 18075 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)O 240690a_100102631434_100000702456 [0,3,0,0,0,0|0,0,0]=3 18076 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)O 527a_100102631434_100000702456 [0,3,0,0,0,0|0,0,0]=3 18077 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 11a_100102631434_100000214689 [0,3,0,0,0,0|0,0,0]=3 18078 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 1626a_100102631434_100000214689 [0,3,0,0,0,0|0,0,0]=3 18079 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 240690a_100102631434_100000214689 [0,3,0,0,0,0|0,0,0]=3 18080 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 527a_100102631434_100000214689 [0,3,0,0,0,0|0,0,0]=3 18081 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 11a_100102631434_100000212326 [0,3,0,0,0,0|0,0,0]=3 18082 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 1626a_100102631434_100000212326 [0,3,0,0,0,0|0,0,0]=3 18083 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 240690a_100102631434_100000212326 [0,3,0,0,0,0|0,0,0]=3 18084 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 527a_100102631434_100000212326 [0,3,0,0,0,0|0,0,0]=3 18085 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 11a_100102631434_100000211022 [0,3,0,0,0,0|0,0,0]=3 18086 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 1626a_100102631434_100000211022 [0,3,0,0,0,0|0,0,0]=3 18087 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 240690a_100102631434_100000211022 [0,3,0,0,0,0|0,0,0]=3 18088 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 527a_100102631434_100000211022 [0,3,0,0,0,0|0,0,0]=3 18089 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 11a_100102631434_100000037189 [0,3,0,0,0,0|0,0,0]=3 18090 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 1626a_100102631434_100000037189 [0,3,0,0,0,0|0,0,0]=3 18091 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 240690a_100102631434_100000037189 [0,3,0,0,0,0|0,0,0]=3 18092 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 527a_100102631434_100000037189 [0,3,0,0,0,0|0,0,0]=3 18093 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 240690a_100102631434_100000689029 [0,3,0,0,0,0|0,0,0]=3 18094 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 271570a_203496583355_200000216859 [0,3,0,0,0,0|0,0,0]=3 18095 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 527a_100102631434_100000689029 [0,3,0,0,0,0|0,0,0]=3 18096 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 11a_100102631434_100000751167 [0,3,0,0,0,0|0,0,0]=3 18097 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 1626a_100102631434_100000751167 [0,3,0,0,0,0|0,0,0]=3 18098 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 240690a_100102631434_100000751167 [0,3,0,0,0,0|0,0,0]=3 18099 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 527a_100102631434_100000751167 [0,3,0,0,0,0|0,0,0]=3 18100 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 11a_100102631434_100000739380 [0,3,0,0,0,0|0,0,0]=3 18101 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 1626a_100102631434_100000739380 [0,3,0,0,0,0|0,0,0]=3 18102 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 240690a_100102631434_100000739380 [0,3,0,0,0,0|0,0,0]=3 18103 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 527a_100102631434_100000739380 [0,3,0,0,0,0|0,0,0]=3 18104 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 11a_100102631434_100000739341 [0,3,0,0,0,0|0,0,0]=3 18105 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 1626a_100102631434_100000739341 [0,3,0,0,0,0|0,0,0]=3 18106 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 240690a_100102631434_100000739341 [0,3,0,0,0,0|0,0,0]=3 18107 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 527a_100102631434_100000739341 [0,3,0,0,0,0|0,0,0]=3 18108 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Br 240690a_100102631434_100000744433 [0,3,0,0,0,0|0,0,0]=3 18109 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Br 527a_100102631434_100000744433 [0,3,0,0,0,0|0,0,0]=3 18110 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 11a_100102631434_100000188622 [0,3,0,0,0,0|0,0,0]=3 18111 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 240690a_100102631434_100000188622 [0,3,0,0,0,0|0,0,0]=3 18112 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 527a_100102631434_100000188622 [0,3,0,0,0,0|0,0,0]=3 18113 B13R1.163 CN(C)C(=O)c1ccc(cc1O)F 240690a_100102631434_100000746061 [0,3,0,0,0,0|0,0,0]=3 18114 B13R1.163 CN(C)C(=O)c1ccc(cc1O)F 527a_100102631434_100000746061 [0,3,0,0,0,0|0,0,0]=3 18115 B13R1.163 CN(C)C(=O)c1ccc(cc1O)I 240690a_100102631434_100000091984 [0,3,0,0,0,0|0,0,0]=3 18116 B13R1.163 CN(C)C(=O)c1ccc(cc1O)I 527a_100102631434_100000091984 [0,3,0,0,0,0|0,0,0]=3 18117 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)Br 1458a_100000741311_100000210206 [0,3,0,0,0,0|1,0,0]=4 18118 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)Cl 1458a_100000688705_100000210206 [0,3,0,0,0,0|1,0,0]=4 18119 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)F 1458a_100000686989_100000210206 [0,3,0,0,0,0|1,0,0]=4 18120 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)I 1458a_100010189873_100000210206 [0,3,0,0,0,0|1,0,0]=4 18121 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)O 1458a_100000692822_100000210206 [0,3,0,0,0,0|1,0,0]=4 18122 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 11a_100102631434_100000741311 [0,3,0,0,0,0|0,0,0]=3 18123 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 1626a_100102631434_100000741311 [0,3,0,0,0,0|0,0,0]=3 18124 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 240690a_100102631434_100000741311 [0,3,0,0,0,0|0,0,0]=3 18125 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 527a_100102631434_100000741311 [0,3,0,0,0,0|0,0,0]=3 18126 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 11a_100102631434_100000688705 [0,3,0,0,0,0|0,0,0]=3 18127 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 1626a_100102631434_100000688705 [0,3,0,0,0,0|0,0,0]=3 18128 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 240690a_100102631434_100000688705 [0,3,0,0,0,0|0,0,0]=3 18129 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 527a_100102631434_100000688705 [0,3,0,0,0,0|0,0,0]=3 18130 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 11a_100102631434_100000686989 [0,3,0,0,0,0|0,0,0]=3 18131 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 1626a_100102631434_100000686989 [0,3,0,0,0,0|0,0,0]=3 18132 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 240690a_100102631434_100000686989 [0,3,0,0,0,0|0,0,0]=3 18133 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 527a_100102631434_100000686989 [0,3,0,0,0,0|0,0,0]=3 18134 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 11a_100102631434_100010189873 [0,3,0,0,0,0|0,0,0]=3 18135 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 1626a_100102631434_100010189873 [0,3,0,0,0,0|0,0,0]=3 18136 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 240690a_100102631434_100010189873 [0,3,0,0,0,0|0,0,0]=3 18137 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 527a_100102631434_100010189873 [0,3,0,0,0,0|0,0,0]=3 18138 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)O 240690a_100102631434_100000692822 [0,3,0,0,0,0|0,0,0]=3 18139 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)O 527a_100102631434_100000692822 [0,3,0,0,0,0|0,0,0]=3 18140 B13R1.163 Cc1ccc(c(c1)Br)C(=O)C(C)C 1458a_100000685072_100000210206 [0,3,0,0,0,0|1,0,0]=4 18141 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 11a_100102631434_100000685072 [0,3,0,0,0,0|0,0,0]=3 18142 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 1626a_100102631434_100000685072 [0,3,0,0,0,0|0,0,0]=3 18143 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 240690a_100102631434_100000685072 [0,3,0,0,0,0|0,0,0]=3 18144 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 527a_100102631434_100000685072 [0,3,0,0,0,0|0,0,0]=3 18145 B13R1.163 Cc1ccc(c(c1)C)C(=O)C(C)C 1458a_100000211164_100000210206 [0,3,0,0,0,0|1,0,0]=4 18146 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 11a_100102631434_100000211164 [0,3,0,0,0,0|0,0,0]=3 18147 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 1626a_100102631434_100000211164 [0,3,0,0,0,0|0,0,0]=3 18148 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 240690a_100102631434_100000211164 [0,3,0,0,0,0|0,0,0]=3 18149 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 527a_100102631434_100000211164 [0,3,0,0,0,0|0,0,0]=3 18150 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)C(C)C 1458a_100000766932_100000210206 [0,3,0,0,0,0|1,0,0]=4 18151 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 11a_100102631434_100000766932 [0,3,0,0,0,0|0,0,0]=3 18152 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 1626a_100102631434_100000766932 [0,3,0,0,0,0|0,0,0]=3 18153 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 240690a_100102631434_100000766932 [0,3,0,0,0,0|0,0,0]=3 18154 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 527a_100102631434_100000766932 [0,3,0,0,0,0|0,0,0]=3 18155 B13R1.163 Cc1ccc(c(c1)F)C(=O)C(C)C 1458a_100000766033_100000210206 [0,3,0,0,0,0|1,0,0]=4 18156 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 11a_100102631434_100000766033 [0,3,0,0,0,0|0,0,0]=3 18157 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 1626a_100102631434_100000766033 [0,3,0,0,0,0|0,0,0]=3 18158 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 240690a_100102631434_100000766033 [0,3,0,0,0,0|0,0,0]=3 18159 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 527a_100102631434_100000766033 [0,3,0,0,0,0|0,0,0]=3 18160 B13R1.163 Cc1ccc(c(c1)I)C(=O)C(C)C 1458a_100009999607_100000210206 [0,3,0,0,0,0|1,0,0]=4 18161 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 11a_100102631434_100009999607 [0,3,0,0,0,0|0,0,0]=3 18162 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 1626a_100102631434_100009999607 [0,3,0,0,0,0|0,0,0]=3 18163 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 240690a_100102631434_100009999607 [0,3,0,0,0,0|0,0,0]=3 18164 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 527a_100102631434_100009999607 [0,3,0,0,0,0|0,0,0]=3 18165 B13R1.163 Cc1ccc(c(c1)O)C(=O)C(C)C 1458a_100000212137_100000210206 [0,3,0,0,0,0|1,0,0]=4 18166 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 1626a_100102631434_100000212137 [0,3,0,0,0,0|0,0,0]=3 18167 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 240690a_100102631434_100000212137 [0,3,0,0,0,0|0,0,0]=3 18168 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 527a_100102631434_100000212137 [0,3,0,0,0,0|0,0,0]=3 18169 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210206 [0,3,0,0,0,0|1,0,0]=4 18170 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210206 [0,3,0,0,0,0|1,0,0]=4 18171 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210206 [0,3,0,0,0,0|1,0,0]=4 18172 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210206 [0,3,0,0,0,0|1,0,0]=4 18173 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210206 [0,3,0,0,0,0|1,0,0]=4 18174 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210206 [0,3,0,0,0,0|1,0,0]=4 18175 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210206 [0,3,0,0,0,0|1,0,0]=4 18176 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210206 [0,3,0,0,0,0|1,0,0]=4 18177 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210206 [0,3,0,0,0,0|1,0,0]=4 18178 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210206 [0,3,0,0,0,0|1,0,0]=4 18179 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210206 [0,3,0,0,0,0|1,0,0]=4 18180 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210206 [0,3,0,0,0,0|1,0,0]=4 18181 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210206 [0,3,0,0,0,0|1,0,0]=4 18182 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210206 [0,3,0,0,0,0|1,0,0]=4 18183 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210206 [0,3,0,0,0,0|1,0,0]=4 18184 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210206 [0,3,0,0,0,0|1,0,0]=4 18185 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210206 [0,3,0,0,0,0|1,0,0]=4 18186 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210206 [0,3,0,0,0,0|1,0,0]=4 18187 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210206 [0,3,0,0,0,0|1,0,0]=4 18188 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210206 [0,3,0,0,0,0|1,0,0]=4 18189 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210206 [0,3,0,0,0,0|1,0,0]=4 18190 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210206 [0,3,0,0,0,0|1,0,0]=4 18191 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210206 [0,3,0,0,0,0|1,0,0]=4 18192 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210206 [0,3,0,0,0,0|1,0,0]=4 18193 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [0,3,0,0,0,0|1,0,0]=4 18194 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 11a_100102631434_100012339404 [0,3,0,0,0,0|0,0,0]=3 18195 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 1626a_100102631434_100012339404 [0,3,0,0,0,0|0,0,0]=3 18196 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 240690a_100102631434_100012339404 [0,3,0,0,0,0|0,0,0]=3 18197 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 527a_100102631434_100012339404 [0,3,0,0,0,0|0,0,0]=3 18198 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 11a_100102631434_100000691181 [0,3,0,0,0,0|0,0,0]=3 18199 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 1626a_100102631434_100000691181 [0,3,0,0,0,0|0,0,0]=3 18200 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 240690a_100102631434_100000691181 [0,3,0,0,0,0|0,0,0]=3 18201 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 527a_100102631434_100000691181 [0,3,0,0,0,0|0,0,0]=3 18202 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 11a_100102631434_100000760357 [0,3,0,0,0,0|0,0,0]=3 18203 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 1626a_100102631434_100000760357 [0,3,0,0,0,0|0,0,0]=3 18204 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 240690a_100102631434_100000760357 [0,3,0,0,0,0|0,0,0]=3 18205 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 527a_100102631434_100000760357 [0,3,0,0,0,0|0,0,0]=3 18206 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 11a_100102631434_100000739115 [0,3,0,0,0,0|0,0,0]=3 18207 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 1626a_100102631434_100000739115 [0,3,0,0,0,0|0,0,0]=3 18208 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 240690a_100102631434_100000739115 [0,3,0,0,0,0|0,0,0]=3 18209 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 527a_100102631434_100000739115 [0,3,0,0,0,0|0,0,0]=3 18210 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)O 240690a_100102631434_100000189672 [0,3,0,0,0,0|0,0,0]=3 18211 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 11a_100102631434_100000687082 [0,3,0,0,0,0|0,0,0]=3 18212 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 1626a_100102631434_100000687082 [0,3,0,0,0,0|0,0,0]=3 18213 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 240690a_100102631434_100000687082 [0,3,0,0,0,0|0,0,0]=3 18214 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 527a_100102631434_100000687082 [0,3,0,0,0,0|0,0,0]=3 18215 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 11a_100102631434_100000210401 [0,3,0,0,0,0|0,0,0]=3 18216 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100102631434_100000210401 [0,3,0,0,0,0|0,0,0]=3 18217 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 240690a_100102631434_100000210401 [0,3,0,0,0,0|0,0,0]=3 18218 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 527a_100102631434_100000210401 [0,3,0,0,0,0|0,0,0]=3 18219 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 11a_100102631434_100000686462 [0,3,0,0,0,0|0,0,0]=3 18220 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 1626a_100102631434_100000686462 [0,3,0,0,0,0|0,0,0]=3 18221 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 240690a_100102631434_100000686462 [0,3,0,0,0,0|0,0,0]=3 18222 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 527a_100102631434_100000686462 [0,3,0,0,0,0|0,0,0]=3 18223 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 11a_100102631434_100000684831 [0,3,0,0,0,0|0,0,0]=3 18224 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 1626a_100102631434_100000684831 [0,3,0,0,0,0|0,0,0]=3 18225 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 240690a_100102631434_100000684831 [0,3,0,0,0,0|0,0,0]=3 18226 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 527a_100102631434_100000684831 [0,3,0,0,0,0|0,0,0]=3 18227 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)O 240690a_100102631434_100000212196 [0,3,0,0,0,0|0,0,0]=3 18228 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)O 527a_100102631434_100000212196 [0,3,0,0,0,0|0,0,0]=3 18229 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 11a_100102631434_100000743946 [0,3,0,0,0,0|0,0,0]=3 18230 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 1626a_100102631434_100000743946 [0,3,0,0,0,0|0,0,0]=3 18231 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 240690a_100102631434_100000743946 [0,3,0,0,0,0|0,0,0]=3 18232 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 527a_100102631434_100000743946 [0,3,0,0,0,0|0,0,0]=3 18233 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 11a_100102631434_100000743183 [0,3,0,0,0,0|0,0,0]=3 18234 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 1626a_100102631434_100000743183 [0,3,0,0,0,0|0,0,0]=3 18235 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 240690a_100102631434_100000743183 [0,3,0,0,0,0|0,0,0]=3 18236 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 527a_100102631434_100000743183 [0,3,0,0,0,0|0,0,0]=3 18237 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 11a_100102631434_100000209822 [0,3,0,0,0,0|0,0,0]=3 18238 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 1626a_100102631434_100000209822 [0,3,0,0,0,0|0,0,0]=3 18239 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 240690a_100102631434_100000209822 [0,3,0,0,0,0|0,0,0]=3 18240 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 527a_100102631434_100000209822 [0,3,0,0,0,0|0,0,0]=3 18241 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 11a_100102631434_100000062624 [0,3,0,0,0,0|0,0,0]=3 18242 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 1626a_100102631434_100000062624 [0,3,0,0,0,0|0,0,0]=3 18243 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 240690a_100102631434_100000062624 [0,3,0,0,0,0|0,0,0]=3 18244 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 527a_100102631434_100000062624 [0,3,0,0,0,0|0,0,0]=3 18245 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)O 240690a_100102631434_100000185466 [0,3,0,0,0,0|0,0,0]=3 18246 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)O 527a_100102631434_100000185466 [0,3,0,0,0,0|0,0,0]=3 18247 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 11a_100102631434_100012343876 [0,3,0,0,0,0|0,0,0]=3 18248 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 1626a_100102631434_100012343876 [0,3,0,0,0,0|0,0,0]=3 18249 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 240690a_100102631434_100012343876 [0,3,0,0,0,0|0,0,0]=3 18250 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 527a_100102631434_100012343876 [0,3,0,0,0,0|0,0,0]=3 18251 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 11a_100102631434_100000739381 [0,3,0,0,0,0|0,0,0]=3 18252 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 1626a_100102631434_100000739381 [0,3,0,0,0,0|0,0,0]=3 18253 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 240690a_100102631434_100000739381 [0,3,0,0,0,0|0,0,0]=3 18254 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 527a_100102631434_100000739381 [0,3,0,0,0,0|0,0,0]=3 18255 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 11a_100102631434_100000688015 [0,3,0,0,0,0|0,0,0]=3 18256 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 1626a_100102631434_100000688015 [0,3,0,0,0,0|0,0,0]=3 18257 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 240690a_100102631434_100000688015 [0,3,0,0,0,0|0,0,0]=3 18258 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 527a_100102631434_100000688015 [0,3,0,0,0,0|0,0,0]=3 18259 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 11a_100102631434_100000725830 [0,3,0,0,0,0|0,0,0]=3 18260 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 1626a_100102631434_100000725830 [0,3,0,0,0,0|0,0,0]=3 18261 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 240690a_100102631434_100000725830 [0,3,0,0,0,0|0,0,0]=3 18262 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 527a_100102631434_100000725830 [0,3,0,0,0,0|0,0,0]=3 18263 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)O 1626a_100102631434_100000037485 [0,3,0,0,0,0|0,0,0]=3 18264 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)O 240690a_100102631434_100000037485 [0,3,0,0,0,0|0,0,0]=3 18265 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Br 240690a_100102631434_100000689001 [0,3,0,0,0,0|0,0,0]=3 18266 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Br 527a_100102631434_100000689001 [0,3,0,0,0,0|0,0,0]=3 18267 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Cl 240690a_100102631434_100011933997 [0,3,0,0,0,0|0,0,0]=3 18268 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100102631434_100011933997 [0,3,0,0,0,0|0,0,0]=3 18269 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)F 240690a_100102631434_100000035894 [0,3,0,0,0,0|0,0,0]=3 18270 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)F 527a_100102631434_100000035894 [0,3,0,0,0,0|0,0,0]=3 18271 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 1626a_100102631434_100000239334 [0,3,0,0,0,0|0,0,0]=3 18272 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 240690a_100102631434_100000239334 [0,3,0,0,0,0|0,0,0]=3 18273 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 527a_100102631434_100000239334 [0,3,0,0,0,0|0,0,0]=3 18274 B13R1.510 Cc1cc(ccc1Br)C(=O)C(C)C 1458a_100000692631_100000210206 [0,3,0,0,0,0|1,0,0]=4 18275 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 11a_100102631434_100000692631 [0,3,0,0,0,0|0,0,0]=3 18276 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 1626a_100102631434_100000692631 [0,3,0,0,0,0|0,0,0]=3 18277 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 240690a_100102631434_100000692631 [0,3,0,0,0,0|0,0,0]=3 18278 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 527a_100102631434_100000692631 [0,3,0,0,0,0|0,0,0]=3 18279 B13R1.510 Cc1cc(ccc1Cl)C(=O)C(C)C 1458a_100000686306_100000210206 [0,3,0,0,0,0|1,0,0]=4 18280 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 11a_100102631434_100000686306 [0,3,0,0,0,0|0,0,0]=3 18281 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 1626a_100102631434_100000686306 [0,3,0,0,0,0|0,0,0]=3 18282 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 240690a_100102631434_100000686306 [0,3,0,0,0,0|0,0,0]=3 18283 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 527a_100102631434_100000686306 [0,3,0,0,0,0|0,0,0]=3 18284 B13R1.510 Cc1cc(ccc1F)C(=O)C(C)C 1458a_100000751819_100000210206 [0,3,0,0,0,0|1,0,0]=4 18285 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 11a_100102631434_100000751819 [0,3,0,0,0,0|0,0,0]=3 18286 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 1626a_100102631434_100000751819 [0,3,0,0,0,0|0,0,0]=3 18287 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 240690a_100102631434_100000751819 [0,3,0,0,0,0|0,0,0]=3 18288 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 527a_100102631434_100000751819 [0,3,0,0,0,0|0,0,0]=3 18289 B13R1.510 Cc1cc(ccc1I)C(=O)C(C)C 1458a_100000751300_100000210206 [0,3,0,0,0,0|1,0,0]=4 18290 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 11a_100102631434_100000751300 [0,3,0,0,0,0|0,0,0]=3 18291 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 1626a_100102631434_100000751300 [0,3,0,0,0,0|0,0,0]=3 18292 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 240690a_100102631434_100000751300 [0,3,0,0,0,0|0,0,0]=3 18293 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 527a_100102631434_100000751300 [0,3,0,0,0,0|0,0,0]=3 18294 B13R1.510 Cc1cc(ccc1O)C(=O)C(C)C 1458a_100000685612_100000210206 [0,3,0,0,0,0|1,0,0]=4 18295 B13R1.510 Cc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000685612 [0,3,0,0,0,0|0,0,0]=3 18296 B13R1.510 Cc1ccc(cc1Br)C(=O)C(C)C 1458a_100000186397_100000210206 [0,3,0,0,0,0|1,0,0]=4 18297 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 11a_100102631434_100000186397 [0,3,0,0,0,0|0,0,0]=3 18298 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 1626a_100102631434_100000186397 [0,3,0,0,0,0|0,0,0]=3 18299 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 240690a_100102631434_100000186397 [0,3,0,0,0,0|0,0,0]=3 18300 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 527a_100102631434_100000186397 [0,3,0,0,0,0|0,0,0]=3 18301 B13R1.510 Cc1ccc(cc1C)C(=O)C(C)C 1458a_100000210898_100000210206 [0,3,0,0,0,0|1,0,0]=4 18302 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 11a_100102631434_100000210898 [0,3,0,0,0,0|0,0,0]=3 18303 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 1626a_100102631434_100000210898 [0,3,0,0,0,0|0,0,0]=3 18304 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 240690a_100102631434_100000210898 [0,3,0,0,0,0|0,0,0]=3 18305 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 527a_100102631434_100000210898 [0,3,0,0,0,0|0,0,0]=3 18306 B13R1.510 Cc1ccc(cc1Cl)C(=O)C(C)C 1458a_100000751740_100000210206 [0,3,0,0,0,0|1,0,0]=4 18307 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 11a_100102631434_100000751740 [0,3,0,0,0,0|0,0,0]=3 18308 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 1626a_100102631434_100000751740 [0,3,0,0,0,0|0,0,0]=3 18309 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 240690a_100102631434_100000751740 [0,3,0,0,0,0|0,0,0]=3 18310 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 527a_100102631434_100000751740 [0,3,0,0,0,0|0,0,0]=3 18311 B13R1.510 Cc1ccc(cc1F)C(=O)C(C)C 1458a_100000212313_100000210206 [0,3,0,0,0,0|1,0,0]=4 18312 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 11a_100102631434_100000212313 [0,3,0,0,0,0|0,0,0]=3 18313 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 1626a_100102631434_100000212313 [0,3,0,0,0,0|0,0,0]=3 18314 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 240690a_100102631434_100000212313 [0,3,0,0,0,0|0,0,0]=3 18315 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 527a_100102631434_100000212313 [0,3,0,0,0,0|0,0,0]=3 18316 B13R1.510 Cc1ccc(cc1I)C(=O)C(C)C 1458a_100000751299_100000210206 [0,3,0,0,0,0|1,0,0]=4 18317 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 11a_100102631434_100000751299 [0,3,0,0,0,0|0,0,0]=3 18318 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 1626a_100102631434_100000751299 [0,3,0,0,0,0|0,0,0]=3 18319 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 240690a_100102631434_100000751299 [0,3,0,0,0,0|0,0,0]=3 18320 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 527a_100102631434_100000751299 [0,3,0,0,0,0|0,0,0]=3 18321 B13R1.510 Cc1ccc(cc1O)C(=O)C(C)C 1458a_100000233767_100000210206 [0,3,0,0,0,0|1,0,0]=4 18322 B13R1.510 Cc1ccc(cc1O)C(=O)N(C)C 240690a_100102631434_100000233767 [0,3,0,0,0,0|0,0,0]=3 18323 B13R1.525 CC(C)(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000701730 [0,3,0,0,0,0|1,0,0]=4 18324 B13R1.49 C#Cc1cc(ccc1C)C(=O)CC 1458a_200012278110_100000210202 [0,3,0,0,0,0|1,0,0]=4 18325 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 11a_106832991635_200012278110 [0,3,0,0,0,0|0,0,0]=3 18326 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 1626a_100102657272_200012278110 [0,3,0,0,0,0|0,0,0]=3 18327 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 527a_100102657272_200012278110 [0,3,0,0,0,0|0,0,0]=3 18328 B13R1.49 C=Cc1cc(ccc1Br)C(=O)OC 271570a_100011290941_100012349818 [0,3,0,0,0,0|1,0,0]=4 18329 B13R1.49 C=Cc1cc(ccc1C)C(=O)NN 271570a_100011290941_100000188075 [0,3,0,0,0,0|1,0,0]=4 18330 B13R1.49 C=Cc1cc(ccc1C)C(=O)OC 271570a_100011290941_100011218856 [0,3,0,0,0,0|1,0,0]=4 18331 B13R1.49 C=Cc1cc(ccc1Cl)C(=O)NN 271570a_100011290941_100000046573 [0,3,0,0,0,0|1,0,0]=4 18332 B13R1.49 C=Cc1cc(ccc1Cl)C(=O)OC 271570a_100011290941_100011294800 [0,3,0,0,0,0|1,0,0]=4 18333 B13R1.49 C=Cc1cc(ccc1F)C(=O)CC 271570a_100011290941_100011216493 [0,3,0,0,0,0|1,0,0]=4 18334 B13R1.49 C=Cc1cc(ccc1F)C(=O)NC 271570a_100011290941_200012359898 [0,3,0,0,0,0|0,0,0]=3 18335 B13R1.49 C=Cc1cc(ccc1F)C(=O)OC 271570a_100011290941_100000722584 [0,3,0,0,0,0|1,0,0]=4 18336 B13R1.49 C=Cc1cc(ccc1N)C(=O)OC 271570a_100011290941_100000187552 [0,3,0,0,0,0|1,0,0]=4 18337 B13R1.49 C=Cc1cc(ccc1O)C(=O)OC 271570a_100011290941_100000216328 [0,3,0,0,0,0|1,0,0]=4 18338 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_100000210202 [0,3,0,0,0,0|1,0,0]=4 18339 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_100000210202 [0,3,0,0,0,0|1,0,0]=4 18340 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_100000210202 [0,3,0,0,0,0|1,0,0]=4 18341 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_100000210202 [0,3,0,0,0,0|1,0,0]=4 18342 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Br 1458a_100010152358_100000210202 [0,3,0,0,0,0|1,0,0]=4 18343 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210202 [0,3,0,0,0,0|1,0,0]=4 18344 B13R1.49 CCC(=O)c1ccc(c(c1)CC)F 1458a_100009883079_100000210202 [0,3,0,0,0,0|1,0,0]=4 18345 B13R1.49 CCC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_100000210202 [0,3,0,0,0,0|1,0,0]=4 18346 B13R1.49 CCC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_100000210202 [0,3,0,0,0,0|1,0,0]=4 18347 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [0,3,0,0,0,0|1,0,0]=4 18348 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [0,3,0,0,0,0|1,0,0]=4 18349 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [0,3,0,0,0,0|1,0,0]=4 18350 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [0,3,0,0,0,0|1,0,0]=4 18351 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [0,3,0,0,0,0|1,0,0]=4 18352 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [0,3,0,0,0,0|1,0,0]=4 18353 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_100011216493_200000210301 [0,3,0,0,0,0|1,0,0]=4 18354 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100011216493 [0,3,0,0,0,0|1,0,0]=4 18355 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_100011216493_200025704644 [0,3,0,0,0,0|1,0,0]=4 18356 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011216493 [0,3,0,0,0,0|1,0,0]=4 18357 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 11a_106832991635_100010152358 [0,3,0,0,0,0|0,0,0]=3 18358 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 1626a_100102657272_100010152358 [0,3,0,0,0,0|0,0,0]=3 18359 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 240690a_100102657272_100010152358 [0,3,0,0,0,0|0,0,0]=3 18360 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 527a_100102657272_100010152358 [0,3,0,0,0,0|0,0,0]=3 18361 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 11a_106832991635_100000102533 [0,3,0,0,0,0|0,0,0]=3 18362 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 1626a_100102657272_100000102533 [0,3,0,0,0,0|0,0,0]=3 18363 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 240690a_100102657272_100000102533 [0,3,0,0,0,0|0,0,0]=3 18364 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 527a_100102657272_100000102533 [0,3,0,0,0,0|0,0,0]=3 18365 B13R1.49 CCc1cc(ccc1F)C(=O)NC 11a_106832991635_100009883079 [0,3,0,0,0,0|0,0,0]=3 18366 B13R1.49 CCc1cc(ccc1F)C(=O)NC 1626a_100102657272_100009883079 [0,3,0,0,0,0|0,0,0]=3 18367 B13R1.49 CCc1cc(ccc1F)C(=O)NC 240690a_100102657272_100009883079 [0,3,0,0,0,0|0,0,0]=3 18368 B13R1.49 CCc1cc(ccc1F)C(=O)NC 527a_100102657272_100009883079 [0,3,0,0,0,0|0,0,0]=3 18369 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 11a_106832991635_100010253904 [0,3,0,0,0,0|0,0,0]=3 18370 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 1626a_100102657272_100010253904 [0,3,0,0,0,0|0,0,0]=3 18371 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 240690a_100102657272_100010253904 [0,3,0,0,0,0|0,0,0]=3 18372 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 527a_100102657272_100010253904 [0,3,0,0,0,0|0,0,0]=3 18373 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 11a_106832991635_100000696165 [0,3,0,0,0,0|0,0,0]=3 18374 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100102657272_100000696165 [0,3,0,0,0,0|0,0,0]=3 18375 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 240690a_100102657272_100000696165 [0,3,0,0,0,0|0,0,0]=3 18376 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 527a_100102657272_100000696165 [0,3,0,0,0,0|0,0,0]=3 18377 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)F 11a_106832991635_100000697239 [0,3,0,0,0,0|0,0,0]=3 18378 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)F 1626a_100102657272_100000697239 [0,3,0,0,0,0|0,0,0]=3 18379 B13R1.49 CNC(=O)c1ccc(c(c1)CO)Br 1626a_100102657272_100010218026 [0,3,0,0,0,0|0,0,0]=3 18380 B13R1.49 CNC(=O)c1ccc(c(c1)CO)Br 240690a_100102657272_100010218026 [0,3,0,0,0,0|0,0,0]=3 18381 B13R1.49 CNC(=O)c1ccc(c(c1)CO)F 1626a_100102657272_100011803322 [0,3,0,0,0,0|0,0,0]=3 18382 B13R1.49 CNC(=O)c1ccc(c(c1)CO)F 240690a_100102657272_100011803322 [0,3,0,0,0,0|0,0,0]=3 18383 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 2230a_100000737617_200000210301 [0,3,0,0,0,0|0,0,0]=3 18384 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 34a_100000737617_200000210301 [0,3,0,0,0,0|0,0,0]=3 18385 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 7a_100000737617_200000210301 [0,3,0,0,0,0|0,0,0]=3 18386 B13R1.49 CNC(=O)c1ccc(c(c1)NC)Cl 34a_100000740709_200000210301 [0,3,0,0,0,0|0,0,0]=3 18387 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 27a_100102657272_200012359898 [0,3,0,0,0,0|0,0,0]=3 18388 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 34a_100011295210_200000210301 [0,3,0,0,0,0|0,0,0]=3 18389 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_100000737617_200025704644 [0,3,0,0,0,0|0,0,0]=3 18390 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 34a_100000737617_200025704644 [0,3,0,0,0,0|0,0,0]=3 18391 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 7a_100000737617_200025704644 [0,3,0,0,0,0|0,0,0]=3 18392 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])Cl 34a_100000740709_200025704644 [0,3,0,0,0,0|0,0,0]=3 18393 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])F 34a_100011295210_200025704644 [0,3,0,0,0,0|0,0,0]=3 18394 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 11a_106832991635_100011934951 [0,3,0,0,0,0|0,0,0]=3 18395 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 1626a_100102657272_100011934951 [0,3,0,0,0,0|0,0,0]=3 18396 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 240690a_100102657272_100011934951 [0,3,0,0,0,0|0,0,0]=3 18397 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 527a_100102657272_100011934951 [0,3,0,0,0,0|0,0,0]=3 18398 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 11a_106832991635_100000212341 [0,3,0,0,0,0|0,0,0]=3 18399 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 1626a_100102657272_100000212341 [0,3,0,0,0,0|0,0,0]=3 18400 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 240690a_100102657272_100000212341 [0,3,0,0,0,0|0,0,0]=3 18401 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 527a_100102657272_100000212341 [0,3,0,0,0,0|0,0,0]=3 18402 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 11a_106832991635_100000181799 [0,3,0,0,0,0|0,0,0]=3 18403 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 1626a_100102657272_100000181799 [0,3,0,0,0,0|0,0,0]=3 18404 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 240690a_100102657272_100000181799 [0,3,0,0,0,0|0,0,0]=3 18405 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 527a_100102657272_100000181799 [0,3,0,0,0,0|0,0,0]=3 18406 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 11a_106832991635_100000757635 [0,3,0,0,0,0|0,0,0]=3 18407 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 1626a_100102657272_100000757635 [0,3,0,0,0,0|0,0,0]=3 18408 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 240690a_100102657272_100000757635 [0,3,0,0,0,0|0,0,0]=3 18409 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 527a_100102657272_100000757635 [0,3,0,0,0,0|0,0,0]=3 18410 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 11a_106832991635_100012356290 [0,3,0,0,0,0|0,0,0]=3 18411 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 1626a_100102657272_100012356290 [0,3,0,0,0,0|0,0,0]=3 18412 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 240690a_100102657272_100012356290 [0,3,0,0,0,0|0,0,0]=3 18413 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 527a_100102657272_100012356290 [0,3,0,0,0,0|0,0,0]=3 18414 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [0,3,0,0,0,0|0,0,0]=3 18415 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200000210301_200012359898 [0,3,0,0,0,0|0,0,0]=3 18416 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200012359898_200000210301 [0,3,0,0,0,0|0,0,0]=3 18417 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200012359898_200025704644 [0,3,0,0,0,0|0,0,0]=3 18418 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_200012359898 [0,3,0,0,0,0|0,0,0]=3 18419 B13R1.49 COC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010150795 [0,3,0,0,0,0|1,0,0]=4 18420 B13R1.49 COC(=O)c1ccc(c(c1)C=O)O 271570a_203496583355_100012274322 [0,3,0,0,0,0|1,0,0]=4 18421 B13R1.49 COC(=O)c1ccc(c(c1)CO)O 271570a_203496583355_100010201863 [0,3,0,0,0,0|1,0,0]=4 18422 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [0,3,0,0,0,0|1,0,0]=4 18423 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [0,3,0,0,0,0|1,0,0]=4 18424 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [0,3,0,0,0,0|1,0,0]=4 18425 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [0,3,0,0,0,0|1,0,0]=4 18426 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [0,3,0,0,0,0|1,0,0]=4 18427 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [0,3,0,0,0,0|1,0,0]=4 18428 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [0,3,0,0,0,0|1,0,0]=4 18429 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [0,3,0,0,0,0|1,0,0]=4 18430 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [0,3,0,0,0,0|1,0,0]=4 18431 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [0,3,0,0,0,0|1,0,0]=4 18432 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [0,3,0,0,0,0|1,0,0]=4 18433 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [0,3,0,0,0,0|1,0,0]=4 18434 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [0,3,0,0,0,0|1,0,0]=4 18435 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [0,3,0,0,0,0|1,0,0]=4 18436 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [0,3,0,0,0,0|1,0,0]=4 18437 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [0,3,0,0,0,0|1,0,0]=4 18438 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [0,3,0,0,0,0|1,0,0]=4 18439 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [0,3,0,0,0,0|1,0,0]=4 18440 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [0,3,0,0,0,0|1,0,0]=4 18441 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [0,3,0,0,0,0|1,0,0]=4 18442 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [0,3,0,0,0,0|1,0,0]=4 18443 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [0,3,0,0,0,0|1,0,0]=4 18444 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [0,3,0,0,0,0|1,0,0]=4 18445 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [0,3,0,0,0,0|1,0,0]=4 18446 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [0,3,0,0,0,0|1,0,0]=4 18447 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_100012349818_200000210301 [0,3,0,0,0,0|1,0,0]=4 18448 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_200000210301_100012349818 [0,3,0,0,0,0|1,0,0]=4 18449 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_100000723194_200000210301 [0,3,0,0,0,0|1,0,0]=4 18450 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100000723194 [0,3,0,0,0,0|1,0,0]=4 18451 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_100011294800_200000210301 [0,3,0,0,0,0|1,0,0]=4 18452 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_200000210301_100011294800 [0,3,0,0,0,0|1,0,0]=4 18453 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_100000722584_200000210301 [0,3,0,0,0,0|1,0,0]=4 18454 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100000722584 [0,3,0,0,0,0|1,0,0]=4 18455 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_100000187552_200000210301 [0,3,0,0,0,0|1,0,0]=4 18456 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_200000210301_100000187552 [0,3,0,0,0,0|1,0,0]=4 18457 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [0,3,0,0,0,0|1,0,0]=4 18458 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [0,3,0,0,0,0|1,0,0]=4 18459 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100012349818_200025704644 [0,3,0,0,0,0|1,0,0]=4 18460 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012349818 [0,3,0,0,0,0|1,0,0]=4 18461 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_100000723194_200025704644 [0,3,0,0,0,0|1,0,0]=4 18462 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100000723194 [0,3,0,0,0,0|1,0,0]=4 18463 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_100011294800_200025704644 [0,3,0,0,0,0|1,0,0]=4 18464 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011294800 [0,3,0,0,0,0|1,0,0]=4 18465 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000722584_200025704644 [0,3,0,0,0,0|1,0,0]=4 18466 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000722584 [0,3,0,0,0,0|1,0,0]=4 18467 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_100000187552_200025704644 [0,3,0,0,0,0|1,0,0]=4 18468 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100000187552 [0,3,0,0,0,0|1,0,0]=4 18469 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [0,3,0,0,0,0|1,0,0]=4 18470 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [0,3,0,0,0,0|1,0,0]=4 18471 B13R1.49 COc1cc(ccc1N)C(=O)NN 34a_200000073589_200000210301 [0,3,0,0,0,0|1,0,0]=4 18472 B13R1.49 CSc1cc(ccc1C)C(=O)NN 62a_100000188075_200000210301 [0,3,0,0,0,0|1,0,0]=4 18473 B13R1.49 CSc1cc(ccc1C)C(=O)NN 62a_200000210301_100000188075 [0,3,0,0,0,0|1,0,0]=4 18474 B13R1.49 CSc1cc(ccc1Cl)C(=O)NN 62a_100000046573_200000210301 [0,3,0,0,0,0|1,0,0]=4 18475 B13R1.49 CSc1cc(ccc1Cl)C(=O)NN 62a_200000210301_100000046573 [0,3,0,0,0,0|1,0,0]=4 18476 B13R1.49 Cc1ccc(cc1S[13CH3])C(=O)NN 62a_100000188075_200025704644 [0,3,0,0,0,0|1,0,0]=4 18477 B13R1.49 Cc1ccc(cc1S[13CH3])C(=O)NN 62a_200025704644_100000188075 [0,3,0,0,0,0|1,0,0]=4 18478 B13R1.49 [13CH3]Oc1cc(ccc1N)C(=O)NN 34a_200000073589_200025704644 [0,3,0,0,0,0|1,0,0]=4 18479 B13R1.49 [13CH3]Sc1cc(ccc1Cl)C(=O)NN 62a_100000046573_200025704644 [0,3,0,0,0,0|1,0,0]=4 18480 B13R1.49 [13CH3]Sc1cc(ccc1Cl)C(=O)NN 62a_200025704644_100000046573 [0,3,0,0,0,0|1,0,0]=4 18481 B13R1.1807 CCC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_100000210202 [0,3,0,0,0,0|1,0,0]=4 18482 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_100000210202 [0,3,0,0,0,0|1,0,0]=4 18483 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210202 [0,3,0,0,0,0|1,0,0]=4 18484 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_100000210202 [0,3,0,0,0,0|1,0,0]=4 18485 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_100000210202 [0,3,0,0,0,0|1,0,0]=4 18486 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_100000210202 [0,3,0,0,0,0|1,0,0]=4 18487 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_100000210202 [0,3,0,0,0,0|1,0,0]=4 18488 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210202 [0,3,0,0,0,0|1,0,0]=4 18489 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_100000210202 [0,3,0,0,0,0|1,0,0]=4 18490 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210202 [0,3,0,0,0,0|1,0,0]=4 18491 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210202 [0,3,0,0,0,0|1,0,0]=4 18492 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_100000210202 [0,3,0,0,0,0|1,0,0]=4 18493 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_100000210202 [0,3,0,0,0,0|1,0,0]=4 18494 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_100000210202 [0,3,0,0,0,0|1,0,0]=4 18495 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210202 [0,3,0,0,0,0|1,0,0]=4 18496 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210202 [0,3,0,0,0,0|1,0,0]=4 18497 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210202 [0,3,0,0,0,0|1,0,0]=4 18498 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_100000210202 [0,3,0,0,0,0|1,0,0]=4 18499 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210202 [0,3,0,0,0,0|1,0,0]=4 18500 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210202 [0,3,0,0,0,0|1,0,0]=4 18501 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_100000210202 [0,3,0,0,0,0|1,0,0]=4 18502 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_100000210202 [0,3,0,0,0,0|1,0,0]=4 18503 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_100000210202 [0,3,0,0,0,0|1,0,0]=4 18504 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210202 [0,3,0,0,0,0|1,0,0]=4 18505 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_100000210202 [0,3,0,0,0,0|1,0,0]=4 18506 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210202 [0,3,0,0,0,0|1,0,0]=4 18507 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_100000210202 [0,3,0,0,0,0|1,0,0]=4 18508 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_100000210202 [0,3,0,0,0,0|1,0,0]=4 18509 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_100000210202 [0,3,0,0,0,0|1,0,0]=4 18510 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_100000210202 [0,3,0,0,0,0|1,0,0]=4 18511 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210202 [0,3,0,0,0,0|1,0,0]=4 18512 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210202 [0,3,0,0,0,0|1,0,0]=4 18513 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210202 [0,3,0,0,0,0|1,0,0]=4 18514 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210202 [0,3,0,0,0,0|1,0,0]=4 18515 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210202 [0,3,0,0,0,0|1,0,0]=4 18516 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_100000210202 [0,3,0,0,0,0|1,0,0]=4 18517 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_100000210202 [0,3,0,0,0,0|1,0,0]=4 18518 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_100000210202 [0,3,0,0,0,0|1,0,0]=4 18519 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_100000210202 [0,3,0,0,0,0|1,0,0]=4 18520 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_100000210202 [0,3,0,0,0,0|1,0,0]=4 18521 B13R1.1807 CCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210202 [0,3,0,0,0,0|1,0,0]=4 18522 B13R1.1807 CCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210202 [0,3,0,0,0,0|1,0,0]=4 18523 B13R1.1807 CCC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_100000210202 [0,3,0,0,0,0|1,0,0]=4 18524 B13R1.1807 CCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210202 [0,3,0,0,0,0|1,0,0]=4 18525 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000210202 [0,3,0,0,0,0|1,0,0]=4 18526 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210202 [0,3,0,0,0,0|1,0,0]=4 18527 B13R1.1807 CCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210202 [0,3,0,0,0,0|1,0,0]=4 18528 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210202 [0,3,0,0,0,0|1,0,0]=4 18529 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210202 [0,3,0,0,0,0|1,0,0]=4 18530 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000210202 [0,3,0,0,0,0|1,0,0]=4 18531 B13R1.1807 CCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210202 [0,3,0,0,0,0|1,0,0]=4 18532 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 11a_106832991635_200012355688 [0,3,0,0,0,0|0,0,0]=3 18533 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 1626a_100102657272_200012355688 [0,3,0,0,0,0|0,0,0]=3 18534 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 240690a_100102657272_200012355688 [0,3,0,0,0,0|0,0,0]=3 18535 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 527a_100102657272_200012355688 [0,3,0,0,0,0|0,0,0]=3 18536 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 11a_106832991635_100010204433 [0,3,0,0,0,0|0,0,0]=3 18537 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 1626a_100102657272_100010204433 [0,3,0,0,0,0|0,0,0]=3 18538 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 240690a_100102657272_100010204433 [0,3,0,0,0,0|0,0,0]=3 18539 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 527a_100102657272_100010204433 [0,3,0,0,0,0|0,0,0]=3 18540 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 11a_106832991635_100012921620 [0,3,0,0,0,0|0,0,0]=3 18541 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 1626a_100102657272_100012921620 [0,3,0,0,0,0|0,0,0]=3 18542 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100102657272_100012921620 [0,3,0,0,0,0|0,0,0]=3 18543 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 527a_100102657272_100012921620 [0,3,0,0,0,0|0,0,0]=3 18544 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 11a_106832991635_100000685074 [0,3,0,0,0,0|0,0,0]=3 18545 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 1626a_100102657272_100000685074 [0,3,0,0,0,0|0,0,0]=3 18546 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 240690a_100102657272_100000685074 [0,3,0,0,0,0|0,0,0]=3 18547 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 527a_100102657272_100000685074 [0,3,0,0,0,0|0,0,0]=3 18548 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 11a_106832991635_100000695896 [0,3,0,0,0,0|0,0,0]=3 18549 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 1626a_100102657272_100000695896 [0,3,0,0,0,0|0,0,0]=3 18550 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 240690a_100102657272_100000695896 [0,3,0,0,0,0|0,0,0]=3 18551 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 527a_100102657272_100000695896 [0,3,0,0,0,0|0,0,0]=3 18552 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 11a_106832991635_100012344525 [0,3,0,0,0,0|0,0,0]=3 18553 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 1626a_100102657272_100012344525 [0,3,0,0,0,0|0,0,0]=3 18554 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 240690a_100102657272_100012344525 [0,3,0,0,0,0|0,0,0]=3 18555 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 527a_100102657272_100012344525 [0,3,0,0,0,0|0,0,0]=3 18556 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 11a_106832991635_100012920494 [0,3,0,0,0,0|0,0,0]=3 18557 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 1626a_100102657272_100012920494 [0,3,0,0,0,0|0,0,0]=3 18558 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 240690a_100102657272_100012920494 [0,3,0,0,0,0|0,0,0]=3 18559 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 527a_100102657272_100012920494 [0,3,0,0,0,0|0,0,0]=3 18560 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 11a_106832991635_100011216168 [0,3,0,0,0,0|0,0,0]=3 18561 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 1626a_100102657272_100011216168 [0,3,0,0,0,0|0,0,0]=3 18562 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 240690a_100102657272_100011216168 [0,3,0,0,0,0|0,0,0]=3 18563 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 527a_100102657272_100011216168 [0,3,0,0,0,0|0,0,0]=3 18564 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 11a_106832991635_100000723791 [0,3,0,0,0,0|0,0,0]=3 18565 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 1626a_100102657272_100000723791 [0,3,0,0,0,0|0,0,0]=3 18566 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 240690a_100102657272_100000723791 [0,3,0,0,0,0|0,0,0]=3 18567 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 527a_100102657272_100000723791 [0,3,0,0,0,0|0,0,0]=3 18568 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 11a_106832991635_100010439669 [0,3,0,0,0,0|0,0,0]=3 18569 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100102657272_100010439669 [0,3,0,0,0,0|0,0,0]=3 18570 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100102657272_100010439669 [0,3,0,0,0,0|0,0,0]=3 18571 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100102657272_100010439669 [0,3,0,0,0,0|0,0,0]=3 18572 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 11a_106832991635_200010768543 [0,3,0,0,0,0|0,0,0]=3 18573 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 1626a_100102657272_200010768543 [0,3,0,0,0,0|0,0,0]=3 18574 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 240690a_100102657272_200010768543 [0,3,0,0,0,0|0,0,0]=3 18575 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 527a_100102657272_200010768543 [0,3,0,0,0,0|0,0,0]=3 18576 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 11a_106832991635_100000724332 [0,3,0,0,0,0|0,0,0]=3 18577 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 1626a_100102657272_100000724332 [0,3,0,0,0,0|0,0,0]=3 18578 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 240690a_100102657272_100000724332 [0,3,0,0,0,0|0,0,0]=3 18579 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 527a_100102657272_100000724332 [0,3,0,0,0,0|0,0,0]=3 18580 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 11a_106832991635_100000062099 [0,3,0,0,0,0|0,0,0]=3 18581 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 1626a_100102657272_100000062099 [0,3,0,0,0,0|0,0,0]=3 18582 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 240690a_100102657272_100000062099 [0,3,0,0,0,0|0,0,0]=3 18583 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 527a_100102657272_100000062099 [0,3,0,0,0,0|0,0,0]=3 18584 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 11a_106832991635_100013328184 [0,3,0,0,0,0|0,0,0]=3 18585 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 1626a_100102657272_100013328184 [0,3,0,0,0,0|0,0,0]=3 18586 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 240690a_100102657272_100013328184 [0,3,0,0,0,0|0,0,0]=3 18587 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 527a_100102657272_100013328184 [0,3,0,0,0,0|0,0,0]=3 18588 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_106832991635_100000246132 [0,3,0,0,0,0|0,0,0]=3 18589 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 1626a_100102657272_100000246132 [0,3,0,0,0,0|0,0,0]=3 18590 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100102657272_100000246132 [0,3,0,0,0,0|0,0,0]=3 18591 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100102657272_100000246132 [0,3,0,0,0,0|0,0,0]=3 18592 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 11a_106832991635_100000724438 [0,3,0,0,0,0|0,0,0]=3 18593 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 1626a_100102657272_100000724438 [0,3,0,0,0,0|0,0,0]=3 18594 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100102657272_100000724438 [0,3,0,0,0,0|0,0,0]=3 18595 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 527a_100102657272_100000724438 [0,3,0,0,0,0|0,0,0]=3 18596 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 11a_106832991635_100013033594 [0,3,0,0,0,0|0,0,0]=3 18597 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 1626a_100102657272_100013033594 [0,3,0,0,0,0|0,0,0]=3 18598 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100102657272_100013033594 [0,3,0,0,0,0|0,0,0]=3 18599 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100102657272_100013033594 [0,3,0,0,0,0|0,0,0]=3 18600 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 11a_106832991635_100009857485 [0,3,0,0,0,0|0,0,0]=3 18601 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 1626a_100102657272_100009857485 [0,3,0,0,0,0|0,0,0]=3 18602 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 240690a_100102657272_100009857485 [0,3,0,0,0,0|0,0,0]=3 18603 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 527a_100102657272_100009857485 [0,3,0,0,0,0|0,0,0]=3 18604 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_106832991635_100011934218 [0,3,0,0,0,0|0,0,0]=3 18605 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100102657272_100011934218 [0,3,0,0,0,0|0,0,0]=3 18606 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100102657272_100011934218 [0,3,0,0,0,0|0,0,0]=3 18607 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100102657272_100011934218 [0,3,0,0,0,0|0,0,0]=3 18608 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 11a_106832991635_100000212284 [0,3,0,0,0,0|0,0,0]=3 18609 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100102657272_100000212284 [0,3,0,0,0,0|0,0,0]=3 18610 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100102657272_100000212284 [0,3,0,0,0,0|0,0,0]=3 18611 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100102657272_100000212284 [0,3,0,0,0,0|0,0,0]=3 18612 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 11a_106832991635_100000687843 [0,3,0,0,0,0|0,0,0]=3 18613 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 1626a_100102657272_100000687843 [0,3,0,0,0,0|0,0,0]=3 18614 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 240690a_100102657272_100000687843 [0,3,0,0,0,0|0,0,0]=3 18615 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 527a_100102657272_100000687843 [0,3,0,0,0,0|0,0,0]=3 18616 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 11a_106832991635_100025704182 [0,3,0,0,0,0|0,0,0]=3 18617 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 1626a_100102657272_100025704182 [0,3,0,0,0,0|0,0,0]=3 18618 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 240690a_100102657272_100025704182 [0,3,0,0,0,0|0,0,0]=3 18619 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 527a_100102657272_100025704182 [0,3,0,0,0,0|0,0,0]=3 18620 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 11a_106832991635_100012920486 [0,3,0,0,0,0|0,0,0]=3 18621 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 1626a_100102657272_100012920486 [0,3,0,0,0,0|0,0,0]=3 18622 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 240690a_100102657272_100012920486 [0,3,0,0,0,0|0,0,0]=3 18623 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 527a_100102657272_100012920486 [0,3,0,0,0,0|0,0,0]=3 18624 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 11a_106832991635_200011217225 [0,3,0,0,0,0|0,0,0]=3 18625 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 1626a_100102657272_200011217225 [0,3,0,0,0,0|0,0,0]=3 18626 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 240690a_100102657272_200011217225 [0,3,0,0,0,0|0,0,0]=3 18627 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 527a_100102657272_200011217225 [0,3,0,0,0,0|0,0,0]=3 18628 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 11a_106832991635_100012354683 [0,3,0,0,0,0|0,0,0]=3 18629 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 1626a_100102657272_100012354683 [0,3,0,0,0,0|0,0,0]=3 18630 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 240690a_100102657272_100012354683 [0,3,0,0,0,0|0,0,0]=3 18631 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 527a_100102657272_100012354683 [0,3,0,0,0,0|0,0,0]=3 18632 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 11a_106832991635_100012347732 [0,3,0,0,0,0|0,0,0]=3 18633 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 1626a_100102657272_100012347732 [0,3,0,0,0,0|0,0,0]=3 18634 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100102657272_100012347732 [0,3,0,0,0,0|0,0,0]=3 18635 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 527a_100102657272_100012347732 [0,3,0,0,0,0|0,0,0]=3 18636 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 11a_106832991635_100012024349 [0,3,0,0,0,0|0,0,0]=3 18637 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 1626a_100102657272_100012024349 [0,3,0,0,0,0|0,0,0]=3 18638 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 240690a_100102657272_100012024349 [0,3,0,0,0,0|0,0,0]=3 18639 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 527a_100102657272_100012024349 [0,3,0,0,0,0|0,0,0]=3 18640 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 11a_106832991635_100012920545 [0,3,0,0,0,0|0,0,0]=3 18641 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 1626a_100102657272_100012920545 [0,3,0,0,0,0|0,0,0]=3 18642 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 240690a_100102657272_100012920545 [0,3,0,0,0,0|0,0,0]=3 18643 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 527a_100102657272_100012920545 [0,3,0,0,0,0|0,0,0]=3 18644 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 11a_106832991635_100012180961 [0,3,0,0,0,0|0,0,0]=3 18645 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 1626a_100102657272_100012180961 [0,3,0,0,0,0|0,0,0]=3 18646 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 240690a_100102657272_100012180961 [0,3,0,0,0,0|0,0,0]=3 18647 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 527a_100102657272_100012180961 [0,3,0,0,0,0|0,0,0]=3 18648 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 11a_106832991635_100000686409 [0,3,0,0,0,0|0,0,0]=3 18649 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 1626a_100102657272_100000686409 [0,3,0,0,0,0|0,0,0]=3 18650 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 240690a_100102657272_100000686409 [0,3,0,0,0,0|0,0,0]=3 18651 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 527a_100102657272_100000686409 [0,3,0,0,0,0|0,0,0]=3 18652 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)O 240690a_100102657272_100009839767 [0,3,0,0,0,0|0,0,0]=3 18653 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 11a_106832991635_100011217226 [0,3,0,0,0,0|0,0,0]=3 18654 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100102657272_100011217226 [0,3,0,0,0,0|0,0,0]=3 18655 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100102657272_100011217226 [0,3,0,0,0,0|0,0,0]=3 18656 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 527a_100102657272_100011217226 [0,3,0,0,0,0|0,0,0]=3 18657 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 11a_106832991635_100011217469 [0,3,0,0,0,0|0,0,0]=3 18658 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100102657272_100011217469 [0,3,0,0,0,0|0,0,0]=3 18659 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100102657272_100011217469 [0,3,0,0,0,0|0,0,0]=3 18660 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100102657272_100011217469 [0,3,0,0,0,0|0,0,0]=3 18661 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 11a_106832991635_100000690020 [0,3,0,0,0,0|0,0,0]=3 18662 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 1626a_100102657272_100000690020 [0,3,0,0,0,0|0,0,0]=3 18663 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 240690a_100102657272_100000690020 [0,3,0,0,0,0|0,0,0]=3 18664 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 527a_100102657272_100000690020 [0,3,0,0,0,0|0,0,0]=3 18665 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 11a_106832991635_100012920488 [0,3,0,0,0,0|0,0,0]=3 18666 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 1626a_100102657272_100012920488 [0,3,0,0,0,0|0,0,0]=3 18667 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 240690a_100102657272_100012920488 [0,3,0,0,0,0|0,0,0]=3 18668 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 527a_100102657272_100012920488 [0,3,0,0,0,0|0,0,0]=3 18669 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 11a_106832991635_100000718434 [0,3,0,0,0,0|0,0,0]=3 18670 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 1626a_100102657272_100000718434 [0,3,0,0,0,0|0,0,0]=3 18671 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 240690a_100102657272_100000718434 [0,3,0,0,0,0|0,0,0]=3 18672 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 527a_100102657272_100000718434 [0,3,0,0,0,0|0,0,0]=3 18673 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 11a_106832991635_100000767126 [0,3,0,0,0,0|0,0,0]=3 18674 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 1626a_100102657272_100000767126 [0,3,0,0,0,0|0,0,0]=3 18675 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 240690a_100102657272_100000767126 [0,3,0,0,0,0|0,0,0]=3 18676 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 527a_100102657272_100000767126 [0,3,0,0,0,0|0,0,0]=3 18677 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 11a_106832991635_100011997751 [0,3,0,0,0,0|0,0,0]=3 18678 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 1626a_100102657272_100011997751 [0,3,0,0,0,0|0,0,0]=3 18679 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 240690a_100102657272_100011997751 [0,3,0,0,0,0|0,0,0]=3 18680 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 527a_100102657272_100011997751 [0,3,0,0,0,0|0,0,0]=3 18681 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 11a_106832991635_100000687535 [0,3,0,0,0,0|0,0,0]=3 18682 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 1626a_100102657272_100000687535 [0,3,0,0,0,0|0,0,0]=3 18683 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 240690a_100102657272_100000687535 [0,3,0,0,0,0|0,0,0]=3 18684 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 527a_100102657272_100000687535 [0,3,0,0,0,0|0,0,0]=3 18685 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 11a_106832991635_100000691139 [0,3,0,0,0,0|0,0,0]=3 18686 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 1626a_100102657272_100000691139 [0,3,0,0,0,0|0,0,0]=3 18687 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 240690a_100102657272_100000691139 [0,3,0,0,0,0|0,0,0]=3 18688 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 527a_100102657272_100000691139 [0,3,0,0,0,0|0,0,0]=3 18689 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 240690a_100102657272_200009924051 [0,3,0,0,0,0|0,0,0]=3 18690 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 527a_100102657272_200009924051 [0,3,0,0,0,0|0,0,0]=3 18691 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_200107972064 [0,3,0,0,0,0|0,0,0]=3 18692 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 11a_106832991635_100010184404 [0,3,0,0,0,0|0,0,0]=3 18693 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 1626a_100102657272_100010184404 [0,3,0,0,0,0|0,0,0]=3 18694 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 240690a_100102657272_100010184404 [0,3,0,0,0,0|0,0,0]=3 18695 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 527a_100102657272_100010184404 [0,3,0,0,0,0|0,0,0]=3 18696 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 11a_106832991635_100000688017 [0,3,0,0,0,0|0,0,0]=3 18697 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 1626a_100102657272_100000688017 [0,3,0,0,0,0|0,0,0]=3 18698 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 240690a_100102657272_100000688017 [0,3,0,0,0,0|0,0,0]=3 18699 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 527a_100102657272_100000688017 [0,3,0,0,0,0|0,0,0]=3 18700 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 240690a_100102657272_100010827371 [0,3,0,0,0,0|0,0,0]=3 18701 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 527a_100102657272_100010827371 [0,3,0,0,0,0|0,0,0]=3 18702 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 240690a_100102657272_100010233826 [0,3,0,0,0,0|0,0,0]=3 18703 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 527a_100102657272_100010233826 [0,3,0,0,0,0|0,0,0]=3 18704 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 240690a_100102657272_100009831561 [0,3,0,0,0,0|0,0,0]=3 18705 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 527a_100102657272_100009831561 [0,3,0,0,0,0|0,0,0]=3 18706 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100102657272_200009814723 [0,3,0,0,0,0|0,0,0]=3 18707 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 527a_100102657272_200009814723 [0,3,0,0,0,0|0,0,0]=3 18708 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 240690a_100102657272_100010188153 [0,3,0,0,0,0|0,0,0]=3 18709 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 527a_100102657272_100010188153 [0,3,0,0,0,0|0,0,0]=3 18710 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 240690a_100102657272_100009910333 [0,3,0,0,0,0|0,0,0]=3 18711 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 527a_100102657272_100009910333 [0,3,0,0,0,0|0,0,0]=3 18712 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 240690a_100102657272_100012182723 [0,3,0,0,0,0|0,0,0]=3 18713 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 527a_100102657272_100012182723 [0,3,0,0,0,0|0,0,0]=3 18714 B13R1.1807 CNC(=O)c1cc(c(cc1O)O)Br 527a_100102657272_100009813906 [0,3,0,0,0,0|0,0,0]=3 18715 B13R1.1807 COC(=O)c1cc(c(cc1C)C)O 271570a_203496583355_200012360129 [0,3,0,0,0,0|1,0,0]=4 18716 B13R1.1807 COC(=O)c1cc(c(cc1C)F)O 271570a_203496583355_100013328185 [0,3,0,0,0,0|1,0,0]=4 18717 B13R1.1807 COC(=O)c1cc(c(cc1C)N)O 271570a_203496583355_100010236254 [0,3,0,0,0,0|1,0,0]=4 18718 B13R1.1807 COC(=O)c1cc(c(cc1C)O)F 271570a_203496583355_100010291504 [0,3,0,0,0,0|1,0,0]=4 18719 B13R1.1807 COC(=O)c1cc(c(cc1Cl)C)O 271570a_203496583355_100014124666 [0,3,0,0,0,0|1,0,0]=4 18720 B13R1.1807 COC(=O)c1cc(c(cc1Cl)N)O 271570a_203496583355_100010204190 [0,3,0,0,0,0|1,0,0]=4 18721 B13R1.1807 COC(=O)c1cc(c(cc1F)C)O 271570a_203496583355_100012920548 [0,3,0,0,0,0|1,0,0]=4 18722 B13R1.1807 COC(=O)c1cc(c(cc1F)Cl)O 271570a_203496583355_100012920370 [0,3,0,0,0,0|1,0,0]=4 18723 B13R1.1807 COC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100000718433 [0,3,0,0,0,0|1,0,0]=4 18724 B13R1.1807 COC(=O)c1cc(c(cc1F)N)O 271570a_203496583355_100010764354 [0,3,0,0,0,0|1,0,0]=4 18725 B13R1.1807 COC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010769226 [0,3,0,0,0,0|1,0,0]=4 18726 B13R1.1807 COC(=O)c1cc(c(cc1F)O)N 271570a_203496583355_100000760059 [0,3,0,0,0,0|1,0,0]=4 18727 B13R1.1807 COC(=O)c1cc(c(cc1N)C)O 271570a_203496583355_100010892302 [0,3,0,0,0,0|1,0,0]=4 18728 B13R1.1807 COC(=O)c1cc(c(cc1N)Cl)O 271570a_203496583355_100010253894 [0,3,0,0,0,0|1,0,0]=4 18729 B13R1.1807 COC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100000699149 [0,3,0,0,0,0|1,0,0]=4 18730 B13R1.1807 COC(=O)c1cc(c(cc1N)O)F 271570a_203496583355_100000724440 [0,3,0,0,0,0|1,0,0]=4 18731 B13R1.1807 COC(=O)c1cc(c(cc1O)Br)F 271570a_203496583355_100014686389 [0,3,0,0,0,0|1,0,0]=4 18732 B13R1.1807 COC(=O)c1cc(c(cc1O)C)F 271570a_203496583355_100015763395 [0,3,0,0,0,0|1,0,0]=4 18733 B13R1.1807 COC(=O)c1cc(c(cc1O)C)N 271570a_203496583355_100000730709 [0,3,0,0,0,0|1,0,0]=4 18734 B13R1.1807 COC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_100010233952 [0,3,0,0,0,0|1,0,0]=4 18735 B13R1.1807 COC(=O)c1cc(c(cc1O)Cl)Br 271570a_203496583355_200012920379 [0,3,0,0,0,0|1,0,0]=4 18736 B13R1.1807 COC(=O)c1cc(c(cc1O)F)C 271570a_203496583355_100015451887 [0,3,0,0,0,0|1,0,0]=4 18737 B13R1.1807 COC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100010195689 [0,3,0,0,0,0|1,0,0]=4 18738 B13R1.1807 COC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100010371811 [0,3,0,0,0,0|1,0,0]=4 18739 B13R1.1807 COC(=O)c1cc(c(cc1O)N)F 271570a_203496583355_100010764352 [0,3,0,0,0,0|1,0,0]=4 18740 B13R1.1807 COC(=O)c1cc(c(cc1O)N)O 271570a_203496583355_100010075205 [0,3,0,0,0,0|1,0,0]=4 18741 B13R1.1807 COC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_100010760826 [0,3,0,0,0,0|1,0,0]=4 18742 B13R1.1807 NNC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100135386025 [0,3,0,0,0,0|1,0,0]=4 18743 B13R1.1808 CCC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_100000210202 [0,3,0,0,0,0|1,0,0]=4 18744 B13R1.1808 CCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210202 [0,3,0,0,0,0|1,0,0]=4 18745 B13R1.1808 CCC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_100000210202 [0,3,0,0,0,0|1,0,0]=4 18746 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210202 [0,3,0,0,0,0|1,0,0]=4 18747 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210202 [0,3,0,0,0,0|1,0,0]=4 18748 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_100000210202 [0,3,0,0,0,0|1,0,0]=4 18749 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100000210202 [0,3,0,0,0,0|1,0,0]=4 18750 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_100000210202 [0,3,0,0,0,0|1,0,0]=4 18751 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210202 [0,3,0,0,0,0|1,0,0]=4 18752 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_100000210202 [0,3,0,0,0,0|1,0,0]=4 18753 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [0,3,0,0,0,0|1,0,0]=4 18754 B13R1.1808 CCC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_100000210202 [0,3,0,0,0,0|1,0,0]=4 18755 B13R1.1808 CCC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_100000210202 [0,3,0,0,0,0|1,0,0]=4 18756 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_100000210202 [0,3,0,0,0,0|1,0,0]=4 18757 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210202 [0,3,0,0,0,0|1,0,0]=4 18758 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210202 [0,3,0,0,0,0|1,0,0]=4 18759 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_100000210202 [0,3,0,0,0,0|1,0,0]=4 18760 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100000210202 [0,3,0,0,0,0|1,0,0]=4 18761 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_100000210202 [0,3,0,0,0,0|1,0,0]=4 18762 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_100000210202 [0,3,0,0,0,0|1,0,0]=4 18763 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_100000210202 [0,3,0,0,0,0|1,0,0]=4 18764 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_100000210202 [0,3,0,0,0,0|1,0,0]=4 18765 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210202 [0,3,0,0,0,0|1,0,0]=4 18766 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_100000210202 [0,3,0,0,0,0|1,0,0]=4 18767 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_100000210202 [0,3,0,0,0,0|1,0,0]=4 18768 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_100000210202 [0,3,0,0,0,0|1,0,0]=4 18769 B13R1.1808 CCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210202 [0,3,0,0,0,0|1,0,0]=4 18770 B13R1.1808 CCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210202 [0,3,0,0,0,0|1,0,0]=4 18771 B13R1.1808 CCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210202 [0,3,0,0,0,0|1,0,0]=4 18772 B13R1.1808 CCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000210202 [0,3,0,0,0,0|1,0,0]=4 18773 B13R1.1808 CCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000210202 [0,3,0,0,0,0|1,0,0]=4 18774 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [0,3,0,0,0,0|1,0,0]=4 18775 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 11a_106832991635_100012356454 [0,3,0,0,0,0|0,0,0]=3 18776 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 1626a_100102657272_100012356454 [0,3,0,0,0,0|0,0,0]=3 18777 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 240690a_100102657272_100012356454 [0,3,0,0,0,0|0,0,0]=3 18778 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 527a_100102657272_100012356454 [0,3,0,0,0,0|0,0,0]=3 18779 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 240690a_100102657272_100016068111 [0,3,0,0,0,0|0,0,0]=3 18780 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 527a_100102657272_100016068111 [0,3,0,0,0,0|0,0,0]=3 18781 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 11a_106832991635_100000061971 [0,3,0,0,0,0|0,0,0]=3 18782 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 1626a_100102657272_100000061971 [0,3,0,0,0,0|0,0,0]=3 18783 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 240690a_100102657272_100000061971 [0,3,0,0,0,0|0,0,0]=3 18784 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 527a_100102657272_100000061971 [0,3,0,0,0,0|0,0,0]=3 18785 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_106832991635_100010208263 [0,3,0,0,0,0|0,0,0]=3 18786 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100102657272_100010208263 [0,3,0,0,0,0|0,0,0]=3 18787 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100102657272_100010208263 [0,3,0,0,0,0|0,0,0]=3 18788 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100102657272_100010208263 [0,3,0,0,0,0|0,0,0]=3 18789 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 11a_106832991635_100010074829 [0,3,0,0,0,0|0,0,0]=3 18790 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100102657272_100010074829 [0,3,0,0,0,0|0,0,0]=3 18791 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100102657272_100010074829 [0,3,0,0,0,0|0,0,0]=3 18792 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100102657272_100010074829 [0,3,0,0,0,0|0,0,0]=3 18793 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 11a_106832991635_100000061447 [0,3,0,0,0,0|0,0,0]=3 18794 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 1626a_100102657272_100000061447 [0,3,0,0,0,0|0,0,0]=3 18795 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 240690a_100102657272_100000061447 [0,3,0,0,0,0|0,0,0]=3 18796 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 527a_100102657272_100000061447 [0,3,0,0,0,0|0,0,0]=3 18797 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 11a_106832991635_200012347731 [0,3,0,0,0,0|0,0,0]=3 18798 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 1626a_100102657272_200012347731 [0,3,0,0,0,0|0,0,0]=3 18799 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 240690a_100102657272_200012347731 [0,3,0,0,0,0|0,0,0]=3 18800 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 527a_100102657272_200012347731 [0,3,0,0,0,0|0,0,0]=3 18801 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 11a_106832991635_100010209669 [0,3,0,0,0,0|0,0,0]=3 18802 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 1626a_100102657272_100010209669 [0,3,0,0,0,0|0,0,0]=3 18803 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 240690a_100102657272_100010209669 [0,3,0,0,0,0|0,0,0]=3 18804 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 527a_100102657272_100010209669 [0,3,0,0,0,0|0,0,0]=3 18805 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 11a_106832991635_200010192171 [0,3,0,0,0,0|0,0,0]=3 18806 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100102657272_200010192171 [0,3,0,0,0,0|0,0,0]=3 18807 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100102657272_200010192171 [0,3,0,0,0,0|0,0,0]=3 18808 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100102657272_200010192171 [0,3,0,0,0,0|0,0,0]=3 18809 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 11a_106832991635_100009888510 [0,3,0,0,0,0|0,0,0]=3 18810 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 1626a_100102657272_100009888510 [0,3,0,0,0,0|0,0,0]=3 18811 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 240690a_100102657272_100009888510 [0,3,0,0,0,0|0,0,0]=3 18812 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 527a_100102657272_100009888510 [0,3,0,0,0,0|0,0,0]=3 18813 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)O)O 240690a_100102657272_100009910189 [0,3,0,0,0,0|0,0,0]=3 18814 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 11a_106832991635_200016032200 [0,3,0,0,0,0|0,0,0]=3 18815 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 1626a_100102657272_200016032200 [0,3,0,0,0,0|0,0,0]=3 18816 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 240690a_100102657272_200016032200 [0,3,0,0,0,0|0,0,0]=3 18817 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 527a_100102657272_200016032200 [0,3,0,0,0,0|0,0,0]=3 18818 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 11a_106832991635_100010204296 [0,3,0,0,0,0|0,0,0]=3 18819 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 1626a_100102657272_100010204296 [0,3,0,0,0,0|0,0,0]=3 18820 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 240690a_100102657272_100010204296 [0,3,0,0,0,0|0,0,0]=3 18821 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 527a_100102657272_100010204296 [0,3,0,0,0,0|0,0,0]=3 18822 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 11a_106832991635_100000722919 [0,3,0,0,0,0|0,0,0]=3 18823 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 1626a_100102657272_100000722919 [0,3,0,0,0,0|0,0,0]=3 18824 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 240690a_100102657272_100000722919 [0,3,0,0,0,0|0,0,0]=3 18825 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 527a_100102657272_100000722919 [0,3,0,0,0,0|0,0,0]=3 18826 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 11a_106832991635_100010768504 [0,3,0,0,0,0|0,0,0]=3 18827 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 1626a_100102657272_100010768504 [0,3,0,0,0,0|0,0,0]=3 18828 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 240690a_100102657272_100010768504 [0,3,0,0,0,0|0,0,0]=3 18829 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 527a_100102657272_100010768504 [0,3,0,0,0,0|0,0,0]=3 18830 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 11a_106832991635_100012183103 [0,3,0,0,0,0|0,0,0]=3 18831 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 1626a_100102657272_100012183103 [0,3,0,0,0,0|0,0,0]=3 18832 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 240690a_100102657272_100012183103 [0,3,0,0,0,0|0,0,0]=3 18833 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 527a_100102657272_100012183103 [0,3,0,0,0,0|0,0,0]=3 18834 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 11a_106832991635_100000067293 [0,3,0,0,0,0|0,0,0]=3 18835 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 1626a_100102657272_100000067293 [0,3,0,0,0,0|0,0,0]=3 18836 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 240690a_100102657272_100000067293 [0,3,0,0,0,0|0,0,0]=3 18837 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 527a_100102657272_100000067293 [0,3,0,0,0,0|0,0,0]=3 18838 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 11a_106832991635_100000719840 [0,3,0,0,0,0|0,0,0]=3 18839 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 1626a_100102657272_100000719840 [0,3,0,0,0,0|0,0,0]=3 18840 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 240690a_100102657272_100000719840 [0,3,0,0,0,0|0,0,0]=3 18841 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 527a_100102657272_100000719840 [0,3,0,0,0,0|0,0,0]=3 18842 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 11a_106832991635_100000722910 [0,3,0,0,0,0|0,0,0]=3 18843 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 1626a_100102657272_100000722910 [0,3,0,0,0,0|0,0,0]=3 18844 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 240690a_100102657272_100000722910 [0,3,0,0,0,0|0,0,0]=3 18845 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 527a_100102657272_100000722910 [0,3,0,0,0,0|0,0,0]=3 18846 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 11a_106832991635_100000034381 [0,3,0,0,0,0|0,0,0]=3 18847 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 1626a_100102657272_100000034381 [0,3,0,0,0,0|0,0,0]=3 18848 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 240690a_100102657272_100000034381 [0,3,0,0,0,0|0,0,0]=3 18849 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 527a_100102657272_100000034381 [0,3,0,0,0,0|0,0,0]=3 18850 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 11a_106832991635_100009816880 [0,3,0,0,0,0|0,0,0]=3 18851 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 1626a_100102657272_100009816880 [0,3,0,0,0,0|0,0,0]=3 18852 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 240690a_100102657272_100009816880 [0,3,0,0,0,0|0,0,0]=3 18853 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 527a_100102657272_100009816880 [0,3,0,0,0,0|0,0,0]=3 18854 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 11a_106832991635_100011219789 [0,3,0,0,0,0|0,0,0]=3 18855 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 1626a_100102657272_100011219789 [0,3,0,0,0,0|0,0,0]=3 18856 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 240690a_100102657272_100011219789 [0,3,0,0,0,0|0,0,0]=3 18857 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 527a_100102657272_100011219789 [0,3,0,0,0,0|0,0,0]=3 18858 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 11a_106832991635_100000085317 [0,3,0,0,0,0|0,0,0]=3 18859 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 1626a_100102657272_100000085317 [0,3,0,0,0,0|0,0,0]=3 18860 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 240690a_100102657272_100000085317 [0,3,0,0,0,0|0,0,0]=3 18861 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 527a_100102657272_100000085317 [0,3,0,0,0,0|0,0,0]=3 18862 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 11a_106832991635_100000766628 [0,3,0,0,0,0|0,0,0]=3 18863 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 1626a_100102657272_100000766628 [0,3,0,0,0,0|0,0,0]=3 18864 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 240690a_100102657272_100000766628 [0,3,0,0,0,0|0,0,0]=3 18865 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 527a_100102657272_100000766628 [0,3,0,0,0,0|0,0,0]=3 18866 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 11a_106832991635_100010177778 [0,3,0,0,0,0|0,0,0]=3 18867 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 1626a_100102657272_100010177778 [0,3,0,0,0,0|0,0,0]=3 18868 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 240690a_100102657272_100010177778 [0,3,0,0,0,0|0,0,0]=3 18869 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 527a_100102657272_100010177778 [0,3,0,0,0,0|0,0,0]=3 18870 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)O 240690a_100102657272_100000036740 [0,3,0,0,0,0|0,0,0]=3 18871 B13R1.1808 CNC(=O)c1ccc(c(c1F)O)F 240690a_100102657272_100000084588 [0,3,0,0,0,0|0,0,0]=3 18872 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 11a_106832991635_100010188221 [0,3,0,0,0,0|0,0,0]=3 18873 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 1626a_100102657272_100010188221 [0,3,0,0,0,0|0,0,0]=3 18874 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 240690a_100102657272_100010188221 [0,3,0,0,0,0|0,0,0]=3 18875 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 527a_100102657272_100010188221 [0,3,0,0,0,0|0,0,0]=3 18876 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 240690a_100102657272_100000742916 [0,3,0,0,0,0|0,0,0]=3 18877 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 527a_100102657272_100000742916 [0,3,0,0,0,0|0,0,0]=3 18878 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)Br 240690a_100102657272_100010761495 [0,3,0,0,0,0|0,0,0]=3 18879 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)Br 527a_100102657272_100010761495 [0,3,0,0,0,0|0,0,0]=3 18880 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)F 240690a_100102657272_100011799213 [0,3,0,0,0,0|0,0,0]=3 18881 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [0,3,0,0,0,0|1,0,0]=4 18882 B13R1.1808 COC(=O)c1ccc(c(c1C)F)O 271570a_203496583355_100010291505 [0,3,0,0,0,0|1,0,0]=4 18883 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [0,3,0,0,0,0|1,0,0]=4 18884 B13R1.1808 COC(=O)c1ccc(c(c1C)O)N 271570a_203496583355_100010764323 [0,3,0,0,0,0|1,0,0]=4 18885 B13R1.1808 COC(=O)c1ccc(c(c1C)O)O 271570a_203496583355_100010889012 [0,3,0,0,0,0|1,0,0]=4 18886 B13R1.1808 COC(=O)c1ccc(c(c1Cl)O)N 271570a_203496583355_200016031531 [0,3,0,0,0,0|1,0,0]=4 18887 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [0,3,0,0,0,0|1,0,0]=4 18888 B13R1.1808 COC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010982024 [0,3,0,0,0,0|1,0,0]=4 18889 B13R1.1808 COC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100000697099 [0,3,0,0,0,0|1,0,0]=4 18890 B13R1.1808 COC(=O)c1ccc(c(c1F)O)O 271570a_203496583355_100011096176 [0,3,0,0,0,0|1,0,0]=4 18891 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [0,3,0,0,0,0|1,0,0]=4 18892 B13R1.1808 COC(=O)c1ccc(c(c1N)F)O 271570a_203496583355_100022009169 [0,3,0,0,0,0|1,0,0]=4 18893 B13R1.1808 COC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_100010710315 [0,3,0,0,0,0|1,0,0]=4 18894 B13R1.1808 COC(=O)c1ccc(c(c1O)F)O 271570a_203496583355_100011092008 [0,3,0,0,0,0|1,0,0]=4 18895 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_100000210202 [0,3,0,0,0,0|1,0,0]=4 18896 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_100000210202 [0,3,0,0,0,0|1,0,0]=4 18897 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100000210202 [0,3,0,0,0,0|1,0,0]=4 18898 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210202 [0,3,0,0,0,0|1,0,0]=4 18899 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_100000210202 [0,3,0,0,0,0|1,0,0]=4 18900 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210202 [0,3,0,0,0,0|1,0,0]=4 18901 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210202 [0,3,0,0,0,0|1,0,0]=4 18902 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_100000210202 [0,3,0,0,0,0|1,0,0]=4 18903 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_100000210202 [0,3,0,0,0,0|1,0,0]=4 18904 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_100000210202 [0,3,0,0,0,0|1,0,0]=4 18905 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_100000210202 [0,3,0,0,0,0|1,0,0]=4 18906 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_100000210202 [0,3,0,0,0,0|1,0,0]=4 18907 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210202 [0,3,0,0,0,0|1,0,0]=4 18908 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100000210202 [0,3,0,0,0,0|1,0,0]=4 18909 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_100000210202 [0,3,0,0,0,0|1,0,0]=4 18910 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100000210202 [0,3,0,0,0,0|1,0,0]=4 18911 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100000210202 [0,3,0,0,0,0|1,0,0]=4 18912 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_100000210202 [0,3,0,0,0,0|1,0,0]=4 18913 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_100000210202 [0,3,0,0,0,0|1,0,0]=4 18914 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210202 [0,3,0,0,0,0|1,0,0]=4 18915 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210202 [0,3,0,0,0,0|1,0,0]=4 18916 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_100000210202 [0,3,0,0,0,0|1,0,0]=4 18917 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_100000210202 [0,3,0,0,0,0|1,0,0]=4 18918 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100000210202 [0,3,0,0,0,0|1,0,0]=4 18919 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_100000210202 [0,3,0,0,0,0|1,0,0]=4 18920 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_100000210202 [0,3,0,0,0,0|1,0,0]=4 18921 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210202 [0,3,0,0,0,0|1,0,0]=4 18922 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210202 [0,3,0,0,0,0|1,0,0]=4 18923 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_100000210202 [0,3,0,0,0,0|1,0,0]=4 18924 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_100000210202 [0,3,0,0,0,0|1,0,0]=4 18925 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210202 [0,3,0,0,0,0|1,0,0]=4 18926 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210202 [0,3,0,0,0,0|1,0,0]=4 18927 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210202 [0,3,0,0,0,0|1,0,0]=4 18928 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210202 [0,3,0,0,0,0|1,0,0]=4 18929 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 11a_106832991635_100000187602 [0,3,0,0,0,0|0,0,0]=3 18930 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 1626a_100102657272_100000187602 [0,3,0,0,0,0|0,0,0]=3 18931 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 240690a_100102657272_100000187602 [0,3,0,0,0,0|0,0,0]=3 18932 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 527a_100102657272_100000187602 [0,3,0,0,0,0|0,0,0]=3 18933 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 11a_106832991635_200012347618 [0,3,0,0,0,0|0,0,0]=3 18934 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 1626a_100102657272_200012347618 [0,3,0,0,0,0|0,0,0]=3 18935 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 240690a_100102657272_200012347618 [0,3,0,0,0,0|0,0,0]=3 18936 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 527a_100102657272_200012347618 [0,3,0,0,0,0|0,0,0]=3 18937 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 11a_106832991635_200012920480 [0,3,0,0,0,0|0,0,0]=3 18938 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100102657272_200012920480 [0,3,0,0,0,0|0,0,0]=3 18939 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100102657272_200012920480 [0,3,0,0,0,0|0,0,0]=3 18940 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100102657272_200012920480 [0,3,0,0,0,0|0,0,0]=3 18941 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 11a_106832991635_100010291025 [0,3,0,0,0,0|0,0,0]=3 18942 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100102657272_100010291025 [0,3,0,0,0,0|0,0,0]=3 18943 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100102657272_100010291025 [0,3,0,0,0,0|0,0,0]=3 18944 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100102657272_100010291025 [0,3,0,0,0,0|0,0,0]=3 18945 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 11a_106832991635_100010259547 [0,3,0,0,0,0|0,0,0]=3 18946 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 1626a_100102657272_100010259547 [0,3,0,0,0,0|0,0,0]=3 18947 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 240690a_100102657272_100010259547 [0,3,0,0,0,0|0,0,0]=3 18948 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 527a_100102657272_100010259547 [0,3,0,0,0,0|0,0,0]=3 18949 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100102657272_100000692688 [0,3,0,0,0,0|0,0,0]=3 18950 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100102657272_100000692688 [0,3,0,0,0,0|0,0,0]=3 18951 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100102657272_200009992764 [0,3,0,0,0,0|0,0,0]=3 18952 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 11a_106832991635_100000700660 [0,3,0,0,0,0|0,0,0]=3 18953 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 1626a_100102657272_100000700660 [0,3,0,0,0,0|0,0,0]=3 18954 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 240690a_100102657272_100000700660 [0,3,0,0,0,0|0,0,0]=3 18955 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 527a_100102657272_100000700660 [0,3,0,0,0,0|0,0,0]=3 18956 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 11a_106832991635_100000075298 [0,3,0,0,0,0|0,0,0]=3 18957 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 1626a_100102657272_100000075298 [0,3,0,0,0,0|0,0,0]=3 18958 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 240690a_100102657272_100000075298 [0,3,0,0,0,0|0,0,0]=3 18959 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 527a_100102657272_100000075298 [0,3,0,0,0,0|0,0,0]=3 18960 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 11a_106832991635_100000102532 [0,3,0,0,0,0|0,0,0]=3 18961 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100102657272_100000102532 [0,3,0,0,0,0|0,0,0]=3 18962 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100102657272_100000102532 [0,3,0,0,0,0|0,0,0]=3 18963 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100102657272_100000102532 [0,3,0,0,0,0|0,0,0]=3 18964 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 11a_106832991635_100000741972 [0,3,0,0,0,0|0,0,0]=3 18965 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 1626a_100102657272_100000741972 [0,3,0,0,0,0|0,0,0]=3 18966 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 240690a_100102657272_100000741972 [0,3,0,0,0,0|0,0,0]=3 18967 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 527a_100102657272_100000741972 [0,3,0,0,0,0|0,0,0]=3 18968 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 11a_106832991635_100010769667 [0,3,0,0,0,0|0,0,0]=3 18969 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 1626a_100102657272_100010769667 [0,3,0,0,0,0|0,0,0]=3 18970 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 240690a_100102657272_100010769667 [0,3,0,0,0,0|0,0,0]=3 18971 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 527a_100102657272_100010769667 [0,3,0,0,0,0|0,0,0]=3 18972 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)O)C 240690a_100102657272_100011219978 [0,3,0,0,0,0|0,0,0]=3 18973 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)O)C 527a_100102657272_100011219978 [0,3,0,0,0,0|0,0,0]=3 18974 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 11a_106832991635_100012354307 [0,3,0,0,0,0|0,0,0]=3 18975 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 1626a_100102657272_100012354307 [0,3,0,0,0,0|0,0,0]=3 18976 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 240690a_100102657272_100012354307 [0,3,0,0,0,0|0,0,0]=3 18977 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 11a_106832991635_100012356007 [0,3,0,0,0,0|0,0,0]=3 18978 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 1626a_100102657272_100012356007 [0,3,0,0,0,0|0,0,0]=3 18979 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 240690a_100102657272_100012356007 [0,3,0,0,0,0|0,0,0]=3 18980 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 527a_100102657272_100012356007 [0,3,0,0,0,0|0,0,0]=3 18981 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 11a_106832991635_100012339221 [0,3,0,0,0,0|0,0,0]=3 18982 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100102657272_100012339221 [0,3,0,0,0,0|0,0,0]=3 18983 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100102657272_100012339221 [0,3,0,0,0,0|0,0,0]=3 18984 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100102657272_100012339221 [0,3,0,0,0,0|0,0,0]=3 18985 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 11a_106832991635_200010244527 [0,3,0,0,0,0|0,0,0]=3 18986 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100102657272_200010244527 [0,3,0,0,0,0|0,0,0]=3 18987 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100102657272_200010244527 [0,3,0,0,0,0|0,0,0]=3 18988 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100102657272_200010244527 [0,3,0,0,0,0|0,0,0]=3 18989 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 11a_106832991635_100011934374 [0,3,0,0,0,0|0,0,0]=3 18990 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 1626a_100102657272_100011934374 [0,3,0,0,0,0|0,0,0]=3 18991 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 240690a_100102657272_100011934374 [0,3,0,0,0,0|0,0,0]=3 18992 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 11a_106832991635_100000068011 [0,3,0,0,0,0|0,0,0]=3 18993 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 1626a_100102657272_100000068011 [0,3,0,0,0,0|0,0,0]=3 18994 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 240690a_100102657272_100000068011 [0,3,0,0,0,0|0,0,0]=3 18995 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 527a_100102657272_100000068011 [0,3,0,0,0,0|0,0,0]=3 18996 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100102657272_100000184433 [0,3,0,0,0,0|0,0,0]=3 18997 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100102657272_100000184433 [0,3,0,0,0,0|0,0,0]=3 18998 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100102657272_200000078382 [0,3,0,0,0,0|0,0,0]=3 18999 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 11a_106832991635_100010078405 [0,3,0,0,0,0|0,0,0]=3 19000 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 1626a_100102657272_100010078405 [0,3,0,0,0,0|0,0,0]=3 19001 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 240690a_100102657272_100010078405 [0,3,0,0,0,0|0,0,0]=3 19002 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 527a_100102657272_100010078405 [0,3,0,0,0,0|0,0,0]=3 19003 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 11a_106832991635_100000055762 [0,3,0,0,0,0|0,0,0]=3 19004 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 1626a_100102657272_100000055762 [0,3,0,0,0,0|0,0,0]=3 19005 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 240690a_100102657272_100000055762 [0,3,0,0,0,0|0,0,0]=3 19006 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 527a_100102657272_100000055762 [0,3,0,0,0,0|0,0,0]=3 19007 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 11a_106832991635_100000104779 [0,3,0,0,0,0|0,0,0]=3 19008 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100102657272_100000104779 [0,3,0,0,0,0|0,0,0]=3 19009 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100102657272_100000104779 [0,3,0,0,0,0|0,0,0]=3 19010 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100102657272_100000104779 [0,3,0,0,0,0|0,0,0]=3 19011 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 11a_106832991635_100000061453 [0,3,0,0,0,0|0,0,0]=3 19012 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 1626a_100102657272_100000061453 [0,3,0,0,0,0|0,0,0]=3 19013 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 240690a_100102657272_100000061453 [0,3,0,0,0,0|0,0,0]=3 19014 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 527a_100102657272_100000061453 [0,3,0,0,0,0|0,0,0]=3 19015 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 11a_106832991635_100000751656 [0,3,0,0,0,0|0,0,0]=3 19016 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 1626a_100102657272_100000751656 [0,3,0,0,0,0|0,0,0]=3 19017 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 240690a_100102657272_100000751656 [0,3,0,0,0,0|0,0,0]=3 19018 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 527a_100102657272_100000751656 [0,3,0,0,0,0|0,0,0]=3 19019 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)O 240690a_100102657272_200000081825 [0,3,0,0,0,0|0,0,0]=3 19020 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)O)F 240690a_100102657272_100000766045 [0,3,0,0,0,0|0,0,0]=3 19021 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)O)F 527a_100102657272_100000766045 [0,3,0,0,0,0|0,0,0]=3 19022 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 11a_106832991635_100012344050 [0,3,0,0,0,0|0,0,0]=3 19023 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 1626a_100102657272_100012344050 [0,3,0,0,0,0|0,0,0]=3 19024 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 240690a_100102657272_100012344050 [0,3,0,0,0,0|0,0,0]=3 19025 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 527a_100102657272_100012344050 [0,3,0,0,0,0|0,0,0]=3 19026 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 11a_106832991635_100000033816 [0,3,0,0,0,0|0,0,0]=3 19027 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 1626a_100102657272_100000033816 [0,3,0,0,0,0|0,0,0]=3 19028 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 527a_100102657272_100000033816 [0,3,0,0,0,0|0,0,0]=3 19029 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 1626a_100102657272_100000034356 [0,3,0,0,0,0|0,0,0]=3 19030 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 240690a_100102657272_100000034356 [0,3,0,0,0,0|0,0,0]=3 19031 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 527a_100102657272_100000034356 [0,3,0,0,0,0|0,0,0]=3 19032 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100102657272_100009812877 [0,3,0,0,0,0|0,0,0]=3 19033 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100102657272_100000031928 [0,3,0,0,0,0|0,0,0]=3 19034 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 527a_100102657272_100000031928 [0,3,0,0,0,0|0,0,0]=3 19035 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100102657272_100000074654 [0,3,0,0,0,0|0,0,0]=3 19036 B13R1.2678 COC(=O)c1cc(c(c(c1)Br)O)Cl 271570a_203496583355_100012361296 [0,3,0,0,0,0|1,0,0]=4 19037 B13R1.2678 COC(=O)c1cc(c(c(c1)C)O)C 271570a_203496583355_100010209423 [0,3,0,0,0,0|1,0,0]=4 19038 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)C)O 271570a_203496583355_100012360618 [0,3,0,0,0,0|1,0,0]=4 19039 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)O)O 271570a_203496583355_100135280131 [0,3,0,0,0,0|1,0,0]=4 19040 B13R1.2678 COC(=O)c1cc(c(c(c1)F)C)O 271570a_203496583355_100012920391 [0,3,0,0,0,0|1,0,0]=4 19041 B13R1.2678 COC(=O)c1cc(c(c(c1)F)F)O 271570a_203496583355_100010189562 [0,3,0,0,0,0|1,0,0]=4 19042 B13R1.2678 COC(=O)c1cc(c(c(c1)F)N)O 271570a_203496583355_100010170820 [0,3,0,0,0,0|1,0,0]=4 19043 B13R1.2678 COC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_200010155432 [0,3,0,0,0,0|1,0,0]=4 19044 B13R1.2678 COC(=O)c1cc(c(c(c1)O)C)N 271570a_203496583355_100012353609 [0,3,0,0,0,0|1,0,0]=4 19045 B13R1.2678 COC(=O)c1cc(c(c(c1)O)F)N 271570a_203496583355_200010713629 [0,3,0,0,0,0|1,0,0]=4 19046 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)C 271570a_203496583355_100010177015 [0,3,0,0,0,0|1,0,0]=4 19047 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)N 271570a_203496583355_100010128412 [0,3,0,0,0,0|1,0,0]=4 19048 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)N 271570a_203496583355_100010372079 [0,3,0,0,0,0|1,0,0]=4 19049 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_100010192586 [0,3,0,0,0,0|1,0,0]=4 19050 B13R1.2065 C=Cc1cc(ccc1C(=O)CC)C 271570a_100011290941_200012349623 [0,3,0,0,0,0|1,0,0]=4 19051 B13R1.2065 C=Cc1cc(ccc1C(=O)NC)F 271570a_100011290941_200000206206 [0,3,0,0,0,0|0,0,0]=3 19052 B13R1.2065 C=Cc1cc(ccc1C(=O)NN)C 271570a_100011290941_200012340525 [0,3,0,0,0,0|1,0,0]=4 19053 B13R1.2065 C=Cc1cc(ccc1C(=O)NN)F 271570a_100011290941_100000203923 [0,3,0,0,0,0|1,0,0]=4 19054 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)Br 271570a_100011290941_100000701758 [0,3,0,0,0,0|1,0,0]=4 19055 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)C 271570a_100011290941_100012340597 [0,3,0,0,0,0|1,0,0]=4 19056 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)Cl 271570a_100011290941_100000047510 [0,3,0,0,0,0|1,0,0]=4 19057 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)F 271570a_100011290941_100000204356 [0,3,0,0,0,0|1,0,0]=4 19058 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)N 271570a_100011290941_100009998378 [0,3,0,0,0,0|1,0,0]=4 19059 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)O 271570a_100011290941_100010150825 [0,3,0,0,0,0|1,0,0]=4 19060 B13R1.2065 CCC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210202 [0,3,0,0,0,0|1,0,0]=4 19061 B13R1.2065 CCC(=O)c1ccc(cc1C#N)C 1458a_200012184421_100000210202 [0,3,0,0,0,0|1,0,0]=4 19062 B13R1.2065 CCC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210202 [0,3,0,0,0,0|1,0,0]=4 19063 B13R1.2065 CCC(=O)c1ccc(cc1CC)Br 1458a_200012349896_100000210202 [0,3,0,0,0,0|1,0,0]=4 19064 B13R1.2065 CCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210202 [0,3,0,0,0,0|1,0,0]=4 19065 B13R1.2065 CCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210202 [0,3,0,0,0,0|1,0,0]=4 19066 B13R1.2065 CCC(=O)c1ccc(cc1NC)C 27a_100102657272_200012349623 [0,3,0,0,0,0|1,0,0]=4 19067 B13R1.2065 CCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000210202 [0,3,0,0,0,0|1,0,0]=4 19068 B13R1.2065 CCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000210202 [0,3,0,0,0,0|1,0,0]=4 19069 B13R1.2065 CCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210202 [0,3,0,0,0,0|1,0,0]=4 19070 B13R1.2065 CCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000210202 [0,3,0,0,0,0|1,0,0]=4 19071 B13R1.2065 CCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000210202 [0,3,0,0,0,0|1,0,0]=4 19072 B13R1.2065 CCC(=O)c1ccc(cc1SC)C 62a_200000210301_200012349623 [0,3,0,0,0,0|1,0,0]=4 19073 B13R1.2065 CCC(=O)c1ccc(cc1SC)C 62a_200012349623_200000210301 [0,3,0,0,0,0|1,0,0]=4 19074 B13R1.2065 CCC(=O)c1ccc(cc1S[13CH3])C 62a_200012349623_200025704644 [0,3,0,0,0,0|1,0,0]=4 19075 B13R1.2065 CCC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_200012349623 [0,3,0,0,0,0|1,0,0]=4 19076 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 11a_106832991635_200012349896 [0,3,0,0,0,0|0,0,0]=3 19077 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 1626a_100102657272_200012349896 [0,3,0,0,0,0|0,0,0]=3 19078 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 240690a_100102657272_200012349896 [0,3,0,0,0,0|0,0,0]=3 19079 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 527a_100102657272_200012349896 [0,3,0,0,0,0|0,0,0]=3 19080 B13R1.2065 CNC(=O)c1ccc(cc1C#N)Br 11a_106832991635_100012349539 [0,3,0,0,0,0|0,0,0]=3 19081 B13R1.2065 CNC(=O)c1ccc(cc1C#N)Br 240690a_100102657272_100012349539 [0,3,0,0,0,0|0,0,0]=3 19082 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 1626a_100102657272_200012184421 [0,3,0,0,0,0|0,0,0]=3 19083 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 240690a_100102657272_200012184421 [0,3,0,0,0,0|0,0,0]=3 19084 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 527a_100102657272_200012184421 [0,3,0,0,0,0|0,0,0]=3 19085 B13R1.2065 CNC(=O)c1ccc(cc1C#N)F 11a_106832991635_100012002388 [0,3,0,0,0,0|0,0,0]=3 19086 B13R1.2065 CNC(=O)c1ccc(cc1C#N)F 1626a_100102657272_100012002388 [0,3,0,0,0,0|0,0,0]=3 19087 B13R1.2065 CNC(=O)c1ccc(cc1CO)F 1626a_100102657272_100013035055 [0,3,0,0,0,0|0,0,0]=3 19088 B13R1.2065 CNC(=O)c1ccc(cc1CO)F 240690a_100102657272_100013035055 [0,3,0,0,0,0|0,0,0]=3 19089 B13R1.2065 CNC(=O)c1ccc(cc1NC)Cl 34a_100000742614_200000210301 [0,3,0,0,0,0|0,0,0]=3 19090 B13R1.2065 CNC(=O)c1ccc(cc1NC)F 27a_100102657272_200000206206 [0,3,0,0,0,0|0,0,0]=3 19091 B13R1.2065 CNC(=O)c1ccc(cc1N[13CH3])Cl 34a_100000742614_200025704644 [0,3,0,0,0,0|0,0,0]=3 19092 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 11a_106832991635_100000748230 [0,3,0,0,0,0|0,0,0]=3 19093 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 1626a_100102657272_100000748230 [0,3,0,0,0,0|0,0,0]=3 19094 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 240690a_100102657272_100000748230 [0,3,0,0,0,0|0,0,0]=3 19095 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 527a_100102657272_100000748230 [0,3,0,0,0,0|0,0,0]=3 19096 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 11a_106832991635_100000217210 [0,3,0,0,0,0|0,0,0]=3 19097 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 1626a_100102657272_100000217210 [0,3,0,0,0,0|0,0,0]=3 19098 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 240690a_100102657272_100000217210 [0,3,0,0,0,0|0,0,0]=3 19099 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 527a_100102657272_100000217210 [0,3,0,0,0,0|0,0,0]=3 19100 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 11a_106832991635_100000217211 [0,3,0,0,0,0|0,0,0]=3 19101 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 1626a_100102657272_100000217211 [0,3,0,0,0,0|0,0,0]=3 19102 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 240690a_100102657272_100000217211 [0,3,0,0,0,0|0,0,0]=3 19103 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 527a_100102657272_100000217211 [0,3,0,0,0,0|0,0,0]=3 19104 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 11a_106832991635_100000239970 [0,3,0,0,0,0|0,0,0]=3 19105 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 1626a_100102657272_100000239970 [0,3,0,0,0,0|0,0,0]=3 19106 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 240690a_100102657272_100000239970 [0,3,0,0,0,0|0,0,0]=3 19107 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 527a_100102657272_100000239970 [0,3,0,0,0,0|0,0,0]=3 19108 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 11a_106832991635_100012353712 [0,3,0,0,0,0|0,0,0]=3 19109 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 1626a_100102657272_100012353712 [0,3,0,0,0,0|0,0,0]=3 19110 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 240690a_100102657272_100012353712 [0,3,0,0,0,0|0,0,0]=3 19111 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 527a_100102657272_100012353712 [0,3,0,0,0,0|0,0,0]=3 19112 B13R1.2065 CNC(=O)c1ccc(cc1OC)N 34a_100000223174_200000210301 [0,3,0,0,0,0|0,0,0]=3 19113 B13R1.2065 CNC(=O)c1ccc(cc1OC)N 7a_100000223174_200000210301 [0,3,0,0,0,0|0,0,0]=3 19114 B13R1.2065 CNC(=O)c1ccc(cc1O[13CH3])N 34a_100000223174_200025704644 [0,3,0,0,0,0|0,0,0]=3 19115 B13R1.2065 CNC(=O)c1ccc(cc1O[13CH3])N 7a_100000223174_200025704644 [0,3,0,0,0,0|0,0,0]=3 19116 B13R1.2065 CNC(=O)c1ccc(cc1SC)F 62a_200000206206_200000210301 [0,3,0,0,0,0|0,0,0]=3 19117 B13R1.2065 CNC(=O)c1ccc(cc1SC)F 62a_200000210301_200000206206 [0,3,0,0,0,0|0,0,0]=3 19118 B13R1.2065 CNC(=O)c1ccc(cc1S[13CH3])F 62a_200000206206_200025704644 [0,3,0,0,0,0|0,0,0]=3 19119 B13R1.2065 CNC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_200000206206 [0,3,0,0,0,0|0,0,0]=3 19120 B13R1.2065 CNc1cc(ccc1C(=O)NN)F 27a_100102657272_100000203923 [0,3,0,0,0,0|1,0,0]=4 19121 B13R1.2065 CNc1cc(ccc1C(=O)OC)O 271570a_203496583355_200160487225 [0,3,0,0,0,0|1,0,0]=4 19122 B13R1.2065 COC(=O)c1ccc(cc1C#N)O 271570a_203496583355_100010150794 [0,3,0,0,0,0|1,0,0]=4 19123 B13R1.2065 COC(=O)c1ccc(cc1C=O)O 271570a_203496583355_100010732994 [0,3,0,0,0,0|1,0,0]=4 19124 B13R1.2065 COC(=O)c1ccc(cc1OC)Br 34a_100000699699_200000210301 [0,3,0,0,0,0|1,0,0]=4 19125 B13R1.2065 COC(=O)c1ccc(cc1OC)Br 7a_100000699699_200000210301 [0,3,0,0,0,0|1,0,0]=4 19126 B13R1.2065 COC(=O)c1ccc(cc1OC)C 34a_100000148187_200000210301 [0,3,0,0,0,0|1,0,0]=4 19127 B13R1.2065 COC(=O)c1ccc(cc1OC)C 7a_100000148187_200000210301 [0,3,0,0,0,0|1,0,0]=4 19128 B13R1.2065 COC(=O)c1ccc(cc1OC)Cl 34a_100000151441_200000210301 [0,3,0,0,0,0|1,0,0]=4 19129 B13R1.2065 COC(=O)c1ccc(cc1OC)Cl 7a_100000151441_200000210301 [0,3,0,0,0,0|1,0,0]=4 19130 B13R1.2065 COC(=O)c1ccc(cc1OC)F 34a_100011216117_200000210301 [0,3,0,0,0,0|1,0,0]=4 19131 B13R1.2065 COC(=O)c1ccc(cc1OC)F 7a_100011216117_200000210301 [0,3,0,0,0,0|1,0,0]=4 19132 B13R1.2065 COC(=O)c1ccc(cc1OC)I 7a_100000062286_200000210301 [0,3,0,0,0,0|1,0,0]=4 19133 B13R1.2065 COC(=O)c1ccc(cc1OC)N 34a_100000718744_200000210301 [0,3,0,0,0,0|1,0,0]=4 19134 B13R1.2065 COC(=O)c1ccc(cc1OC)N 7a_100000718744_200000210301 [0,3,0,0,0,0|1,0,0]=4 19135 B13R1.2065 COC(=O)c1ccc(cc1OC)O 271570a_203496583355_100000708095 [0,3,0,0,0,0|1,0,0]=4 19136 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Br 34a_100000699699_200025704644 [0,3,0,0,0,0|1,0,0]=4 19137 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Br 7a_100000699699_200025704644 [0,3,0,0,0,0|1,0,0]=4 19138 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 34a_100000148187_200025704644 [0,3,0,0,0,0|1,0,0]=4 19139 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 7a_100000148187_200025704644 [0,3,0,0,0,0|1,0,0]=4 19140 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Cl 34a_100000151441_200025704644 [0,3,0,0,0,0|1,0,0]=4 19141 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Cl 7a_100000151441_200025704644 [0,3,0,0,0,0|1,0,0]=4 19142 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])F 34a_100011216117_200025704644 [0,3,0,0,0,0|1,0,0]=4 19143 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])F 7a_100011216117_200025704644 [0,3,0,0,0,0|1,0,0]=4 19144 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])I 7a_100000062286_200025704644 [0,3,0,0,0,0|1,0,0]=4 19145 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])N 34a_100000718744_200025704644 [0,3,0,0,0,0|1,0,0]=4 19146 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])N 7a_100000718744_200025704644 [0,3,0,0,0,0|1,0,0]=4 19147 B13R1.2065 COC(=O)c1ccc(cc1SC)Br 62a_100000701758_200000210301 [0,3,0,0,0,0|1,0,0]=4 19148 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_100012340597_200000210301 [0,3,0,0,0,0|1,0,0]=4 19149 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_200000210301_100012340597 [0,3,0,0,0,0|1,0,0]=4 19150 B13R1.2065 COC(=O)c1ccc(cc1SC)Cl 62a_100000047510_200000210301 [0,3,0,0,0,0|1,0,0]=4 19151 B13R1.2065 COC(=O)c1ccc(cc1SC)Cl 62a_200000210301_100000047510 [0,3,0,0,0,0|1,0,0]=4 19152 B13R1.2065 COC(=O)c1ccc(cc1SC)F 62a_100000204356_200000210301 [0,3,0,0,0,0|1,0,0]=4 19153 B13R1.2065 COC(=O)c1ccc(cc1SC)F 62a_200000210301_100000204356 [0,3,0,0,0,0|1,0,0]=4 19154 B13R1.2065 COC(=O)c1ccc(cc1SC)N 62a_100009998378_200000210301 [0,3,0,0,0,0|1,0,0]=4 19155 B13R1.2065 COC(=O)c1ccc(cc1SC)N 62a_200000210301_100010150747 [0,3,0,0,0,0|1,0,0]=4 19156 B13R1.2065 COC(=O)c1ccc(cc1SC)O 62a_100010150825_200000210301 [0,3,0,0,0,0|1,0,0]=4 19157 B13R1.2065 COC(=O)c1ccc(cc1SC)O 62a_200000210301_100010150825 [0,3,0,0,0,0|1,0,0]=4 19158 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Br 62a_100000701758_200025704644 [0,3,0,0,0,0|1,0,0]=4 19159 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_100012340597_200025704644 [0,3,0,0,0,0|1,0,0]=4 19160 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_100012340597 [0,3,0,0,0,0|1,0,0]=4 19161 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Cl 62a_100000047510_200025704644 [0,3,0,0,0,0|1,0,0]=4 19162 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Cl 62a_200025704644_100000047510 [0,3,0,0,0,0|1,0,0]=4 19163 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])F 62a_100000204356_200025704644 [0,3,0,0,0,0|1,0,0]=4 19164 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_100000204356 [0,3,0,0,0,0|1,0,0]=4 19165 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])N 62a_100009998378_200025704644 [0,3,0,0,0,0|1,0,0]=4 19166 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])N 62a_200025704644_100010150747 [0,3,0,0,0,0|1,0,0]=4 19167 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])O 62a_100010150825_200025704644 [0,3,0,0,0,0|1,0,0]=4 19168 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])O 62a_200025704644_100010150825 [0,3,0,0,0,0|1,0,0]=4 19169 B13R1.2065 COc1cc(ccc1C(=O)NN)C 34a_100000193368_200000210301 [0,3,0,0,0,0|1,0,0]=4 19170 B13R1.2065 COc1cc(ccc1C(=O)NN)Cl 34a_100000193371_200000210301 [0,3,0,0,0,0|1,0,0]=4 19171 B13R1.2065 COc1cc(ccc1C(=O)NN)N 34a_200000020778_200000210301 [0,3,0,0,0,0|1,0,0]=4 19172 B13R1.2065 COc1cc(ccc1C(=O)NO)C 34a_200000199133_200000210301 [0,3,0,0,0,0|1,0,0]=4 19173 B13R1.2065 COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_200000210301 [0,3,0,0,0,0|1,0,0]=4 19174 B13R1.2065 CSc1cc(ccc1C(=O)NN)C 62a_200000210301_200012340525 [0,3,0,0,0,0|1,0,0]=4 19175 B13R1.2065 CSc1cc(ccc1C(=O)NN)C 62a_200012340525_200000210301 [0,3,0,0,0,0|1,0,0]=4 19176 B13R1.2065 CSc1cc(ccc1C(=O)NN)F 62a_100000203923_200000210301 [0,3,0,0,0,0|1,0,0]=4 19177 B13R1.2065 CSc1cc(ccc1C(=O)NN)F 62a_200000210301_100000203923 [0,3,0,0,0,0|1,0,0]=4 19178 B13R1.2065 Cc1ccc(c(c1)O[13CH3])C(=O)NN 34a_100000193368_200025704644 [0,3,0,0,0,0|1,0,0]=4 19179 B13R1.2065 Cc1ccc(c(c1)O[13CH3])C(=O)NO 34a_200000199133_200025704644 [0,3,0,0,0,0|1,0,0]=4 19180 B13R1.2065 Cc1ccc(c(c1)S[13CH3])C(=O)NN 62a_200012340525_200025704644 [0,3,0,0,0,0|1,0,0]=4 19181 B13R1.2065 Cc1ccc(c(c1)S[13CH3])C(=O)NN 62a_200025704644_200012340525 [0,3,0,0,0,0|1,0,0]=4 19182 B13R1.2065 [13CH3]Oc1cc(ccc1C(=O)NN)Cl 34a_100000193371_200025704644 [0,3,0,0,0,0|1,0,0]=4 19183 B13R1.2065 [13CH3]Oc1cc(ccc1C(=O)NN)N 34a_200000020778_200025704644 [0,3,0,0,0,0|1,0,0]=4 19184 B13R1.2065 [13CH3]Oc1cc(ccc1C(=O)NO)Cl 34a_100000199135_200025704644 [0,3,0,0,0,0|1,0,0]=4 19185 B13R1.2065 [13CH3]Sc1cc(ccc1C(=O)NN)F 62a_100000203923_200025704644 [0,3,0,0,0,0|1,0,0]=4 19186 B13R1.2065 [13CH3]Sc1cc(ccc1C(=O)NN)F 62a_200025704644_100000203923 [0,3,0,0,0,0|1,0,0]=4 19187 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100000210202 [0,3,0,0,0,0|1,0,0]=4 19188 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_100000210202 [0,3,0,0,0,0|1,0,0]=4 19189 B13R1.4656 CCC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_100000210202 [0,3,0,0,0,0|1,0,0]=4 19190 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210202 [0,3,0,0,0,0|1,0,0]=4 19191 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_100000210202 [0,3,0,0,0,0|1,0,0]=4 19192 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_100000210202 [0,3,0,0,0,0|1,0,0]=4 19193 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_100000210202 [0,3,0,0,0,0|1,0,0]=4 19194 B13R1.4656 CCC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_100000210202 [0,3,0,0,0,0|1,0,0]=4 19195 B13R1.4656 CCC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_100000210202 [0,3,0,0,0,0|1,0,0]=4 19196 B13R1.4656 CCC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_100000210202 [0,3,0,0,0,0|1,0,0]=4 19197 B13R1.4656 CCC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_100000210202 [0,3,0,0,0,0|1,0,0]=4 19198 B13R1.4656 CCC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_100000210202 [0,3,0,0,0,0|1,0,0]=4 19199 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_100000210202 [0,3,0,0,0,0|1,0,0]=4 19200 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100000210202 [0,3,0,0,0,0|1,0,0]=4 19201 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100000210202 [0,3,0,0,0,0|1,0,0]=4 19202 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_100000210202 [0,3,0,0,0,0|1,0,0]=4 19203 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100000210202 [0,3,0,0,0,0|1,0,0]=4 19204 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100000210202 [0,3,0,0,0,0|1,0,0]=4 19205 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_100000210202 [0,3,0,0,0,0|1,0,0]=4 19206 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_100000210202 [0,3,0,0,0,0|1,0,0]=4 19207 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100000210202 [0,3,0,0,0,0|1,0,0]=4 19208 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100000210202 [0,3,0,0,0,0|1,0,0]=4 19209 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_100000210202 [0,3,0,0,0,0|1,0,0]=4 19210 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_100000210202 [0,3,0,0,0,0|1,0,0]=4 19211 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000210202 [0,3,0,0,0,0|1,0,0]=4 19212 B13R1.4656 CCC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_100000210202 [0,3,0,0,0,0|1,0,0]=4 19213 B13R1.4656 CCC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_100000210202 [0,3,0,0,0,0|1,0,0]=4 19214 B13R1.4656 CCC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_100000210202 [0,3,0,0,0,0|1,0,0]=4 19215 B13R1.4656 CCC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_100000210202 [0,3,0,0,0,0|1,0,0]=4 19216 B13R1.4656 CCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000210202 [0,3,0,0,0,0|1,0,0]=4 19217 B13R1.4656 CCC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_100000210202 [0,3,0,0,0,0|1,0,0]=4 19218 B13R1.4656 CCC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_100000210202 [0,3,0,0,0,0|1,0,0]=4 19219 B13R1.4656 CCC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_100000210202 [0,3,0,0,0,0|1,0,0]=4 19220 B13R1.4656 CCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000210202 [0,3,0,0,0,0|1,0,0]=4 19221 B13R1.4656 CCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000210202 [0,3,0,0,0,0|1,0,0]=4 19222 B13R1.4656 CCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000210202 [0,3,0,0,0,0|1,0,0]=4 19223 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 11a_106832991635_100011217931 [0,3,0,0,0,0|0,0,0]=3 19224 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 240690a_100102657272_100011217931 [0,3,0,0,0,0|0,0,0]=3 19225 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 527a_100102657272_100011217931 [0,3,0,0,0,0|0,0,0]=3 19226 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 11a_106832991635_100009813784 [0,3,0,0,0,0|0,0,0]=3 19227 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 1626a_100102657272_100009813784 [0,3,0,0,0,0|0,0,0]=3 19228 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 240690a_100102657272_100009813784 [0,3,0,0,0,0|0,0,0]=3 19229 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 527a_100102657272_100009813784 [0,3,0,0,0,0|0,0,0]=3 19230 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 11a_106832991635_100010768510 [0,3,0,0,0,0|0,0,0]=3 19231 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 1626a_100102657272_100010768510 [0,3,0,0,0,0|0,0,0]=3 19232 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 240690a_100102657272_100010768510 [0,3,0,0,0,0|0,0,0]=3 19233 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 527a_100102657272_100010768510 [0,3,0,0,0,0|0,0,0]=3 19234 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 11a_106832991635_100010244364 [0,3,0,0,0,0|0,0,0]=3 19235 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100102657272_100010244364 [0,3,0,0,0,0|0,0,0]=3 19236 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100102657272_100010244364 [0,3,0,0,0,0|0,0,0]=3 19237 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 527a_100102657272_100010244364 [0,3,0,0,0,0|0,0,0]=3 19238 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 11a_106832991635_200015320377 [0,3,0,0,0,0|0,0,0]=3 19239 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 1626a_100102657272_200015320377 [0,3,0,0,0,0|0,0,0]=3 19240 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 240690a_100102657272_200015320377 [0,3,0,0,0,0|0,0,0]=3 19241 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 527a_100102657272_200015320377 [0,3,0,0,0,0|0,0,0]=3 19242 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 11a_106832991635_100010204434 [0,3,0,0,0,0|0,0,0]=3 19243 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 1626a_100102657272_100010204434 [0,3,0,0,0,0|0,0,0]=3 19244 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 240690a_100102657272_100010204434 [0,3,0,0,0,0|0,0,0]=3 19245 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 527a_100102657272_100010204434 [0,3,0,0,0,0|0,0,0]=3 19246 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 11a_106832991635_100013316034 [0,3,0,0,0,0|0,0,0]=3 19247 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 1626a_100102657272_100013316034 [0,3,0,0,0,0|0,0,0]=3 19248 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 240690a_100102657272_100013316034 [0,3,0,0,0,0|0,0,0]=3 19249 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 527a_100102657272_100013316034 [0,3,0,0,0,0|0,0,0]=3 19250 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 11a_106832991635_100000739581 [0,3,0,0,0,0|0,0,0]=3 19251 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 1626a_100102657272_100000739581 [0,3,0,0,0,0|0,0,0]=3 19252 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 240690a_100102657272_100000739581 [0,3,0,0,0,0|0,0,0]=3 19253 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 11a_106832991635_100000211658 [0,3,0,0,0,0|0,0,0]=3 19254 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 1626a_100102657272_100000211658 [0,3,0,0,0,0|0,0,0]=3 19255 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 240690a_100102657272_100000211658 [0,3,0,0,0,0|0,0,0]=3 19256 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 11a_106832991635_100000088873 [0,3,0,0,0,0|0,0,0]=3 19257 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 1626a_100102657272_100000088873 [0,3,0,0,0,0|0,0,0]=3 19258 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 240690a_100102657272_100000088873 [0,3,0,0,0,0|0,0,0]=3 19259 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 11a_106832991635_100012017201 [0,3,0,0,0,0|0,0,0]=3 19260 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 1626a_100102657272_100012017201 [0,3,0,0,0,0|0,0,0]=3 19261 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 240690a_100102657272_100012017201 [0,3,0,0,0,0|0,0,0]=3 19262 B13R1.4656 CNC(=O)c1c(cc(cc1C)O)C 240690a_100102657272_100000066486 [0,3,0,0,0,0|0,0,0]=3 19263 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 11a_106832991635_100000698028 [0,3,0,0,0,0|0,0,0]=3 19264 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 1626a_100102657272_100000698028 [0,3,0,0,0,0|0,0,0]=3 19265 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 240690a_100102657272_100000698028 [0,3,0,0,0,0|0,0,0]=3 19266 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 11a_106832991635_100012360385 [0,3,0,0,0,0|0,0,0]=3 19267 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 1626a_100102657272_100012360385 [0,3,0,0,0,0|0,0,0]=3 19268 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 240690a_100102657272_100012360385 [0,3,0,0,0,0|0,0,0]=3 19269 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 11a_106832991635_100010078411 [0,3,0,0,0,0|0,0,0]=3 19270 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 1626a_100102657272_100010078411 [0,3,0,0,0,0|0,0,0]=3 19271 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 240690a_100102657272_100010078411 [0,3,0,0,0,0|0,0,0]=3 19272 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 527a_100102657272_100010078411 [0,3,0,0,0,0|0,0,0]=3 19273 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 11a_106832991635_100009989429 [0,3,0,0,0,0|0,0,0]=3 19274 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 1626a_100102657272_100009989429 [0,3,0,0,0,0|0,0,0]=3 19275 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 240690a_100102657272_100009989429 [0,3,0,0,0,0|0,0,0]=3 19276 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 527a_100102657272_100009989429 [0,3,0,0,0,0|0,0,0]=3 19277 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_106832991635_100011215713 [0,3,0,0,0,0|0,0,0]=3 19278 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100102657272_100011215713 [0,3,0,0,0,0|0,0,0]=3 19279 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100102657272_100011215713 [0,3,0,0,0,0|0,0,0]=3 19280 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 11a_106832991635_100010068318 [0,3,0,0,0,0|0,0,0]=3 19281 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100102657272_100010068318 [0,3,0,0,0,0|0,0,0]=3 19282 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100102657272_100010068318 [0,3,0,0,0,0|0,0,0]=3 19283 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100102657272_100010068318 [0,3,0,0,0,0|0,0,0]=3 19284 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 11a_106832991635_100000703918 [0,3,0,0,0,0|0,0,0]=3 19285 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 1626a_100102657272_100000703918 [0,3,0,0,0,0|0,0,0]=3 19286 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 240690a_100102657272_100000703918 [0,3,0,0,0,0|0,0,0]=3 19287 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 11a_106832991635_100000119028 [0,3,0,0,0,0|0,0,0]=3 19288 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 1626a_100102657272_100000119028 [0,3,0,0,0,0|0,0,0]=3 19289 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 240690a_100102657272_100000119028 [0,3,0,0,0,0|0,0,0]=3 19290 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 527a_100102657272_100000119028 [0,3,0,0,0,0|0,0,0]=3 19291 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 11a_106832991635_100010740244 [0,3,0,0,0,0|0,0,0]=3 19292 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 1626a_100102657272_100010740244 [0,3,0,0,0,0|0,0,0]=3 19293 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 240690a_100102657272_100010740244 [0,3,0,0,0,0|0,0,0]=3 19294 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 527a_100102657272_100010740244 [0,3,0,0,0,0|0,0,0]=3 19295 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)O)Cl 240690a_100102657272_100010423397 [0,3,0,0,0,0|0,0,0]=3 19296 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 11a_106832991635_100000708665 [0,3,0,0,0,0|0,0,0]=3 19297 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 1626a_100102657272_100000708665 [0,3,0,0,0,0|0,0,0]=3 19298 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 240690a_100102657272_100000708665 [0,3,0,0,0,0|0,0,0]=3 19299 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 527a_100102657272_100000708665 [0,3,0,0,0,0|0,0,0]=3 19300 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 11a_106832991635_100000766946 [0,3,0,0,0,0|0,0,0]=3 19301 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 1626a_100102657272_100000766946 [0,3,0,0,0,0|0,0,0]=3 19302 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 240690a_100102657272_100000766946 [0,3,0,0,0,0|0,0,0]=3 19303 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 527a_100102657272_100000766946 [0,3,0,0,0,0|0,0,0]=3 19304 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)O 527a_100102657272_200015963038 [0,3,0,0,0,0|0,0,0]=3 19305 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 11a_106832991635_100009878570 [0,3,0,0,0,0|0,0,0]=3 19306 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 1626a_100102657272_100009878570 [0,3,0,0,0,0|0,0,0]=3 19307 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 240690a_100102657272_100009878570 [0,3,0,0,0,0|0,0,0]=3 19308 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 527a_100102657272_100009878570 [0,3,0,0,0,0|0,0,0]=3 19309 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 11a_106832991635_100010768517 [0,3,0,0,0,0|0,0,0]=3 19310 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 1626a_100102657272_100010768517 [0,3,0,0,0,0|0,0,0]=3 19311 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 240690a_100102657272_100010768517 [0,3,0,0,0,0|0,0,0]=3 19312 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 527a_100102657272_100010768517 [0,3,0,0,0,0|0,0,0]=3 19313 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 11a_106832991635_100000062413 [0,3,0,0,0,0|0,0,0]=3 19314 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 1626a_100102657272_100000062413 [0,3,0,0,0,0|0,0,0]=3 19315 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 240690a_100102657272_100000062413 [0,3,0,0,0,0|0,0,0]=3 19316 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 527a_100102657272_100000062413 [0,3,0,0,0,0|0,0,0]=3 19317 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 11a_106832991635_100000751013 [0,3,0,0,0,0|0,0,0]=3 19318 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 1626a_100102657272_100000751013 [0,3,0,0,0,0|0,0,0]=3 19319 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 240690a_100102657272_100000751013 [0,3,0,0,0,0|0,0,0]=3 19320 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 527a_100102657272_100000751013 [0,3,0,0,0,0|0,0,0]=3 19321 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)O 240690a_100102657272_100000746385 [0,3,0,0,0,0|0,0,0]=3 19322 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)O 527a_100102657272_100000746385 [0,3,0,0,0,0|0,0,0]=3 19323 B13R1.4656 CNC(=O)c1c(cc(cc1F)O)F 240690a_100102657272_100000038755 [0,3,0,0,0,0|0,0,0]=3 19324 B13R1.4656 CNC(=O)c1c(cc(cc1F)O)F 527a_100102657272_100000038755 [0,3,0,0,0,0|0,0,0]=3 19325 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 11a_106832991635_200010371430 [0,3,0,0,0,0|0,0,0]=3 19326 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 1626a_100102657272_200010371430 [0,3,0,0,0,0|0,0,0]=3 19327 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 240690a_100102657272_200010371430 [0,3,0,0,0,0|0,0,0]=3 19328 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 527a_100102657272_200010371430 [0,3,0,0,0,0|0,0,0]=3 19329 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 11a_106832991635_200010371433 [0,3,0,0,0,0|0,0,0]=3 19330 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 1626a_100102657272_200010371433 [0,3,0,0,0,0|0,0,0]=3 19331 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 240690a_100102657272_200010371433 [0,3,0,0,0,0|0,0,0]=3 19332 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 527a_100102657272_200010371433 [0,3,0,0,0,0|0,0,0]=3 19333 B13R1.4656 CNC(=O)c1c(cc(cc1O)C)O 527a_100102657272_100000036929 [0,3,0,0,0,0|0,0,0]=3 19334 B13R1.4656 CNC(=O)c1c(cc(cc1O)O)O 527a_100102657272_100000040092 [0,3,0,0,0,0|0,0,0]=3 19335 B13R1.4656 COC(=O)c1c(cc(cc1C)O)C 271570a_203496583355_100009831683 [0,3,0,0,0,0|1,0,0]=4 19336 B13R1.4656 COC(=O)c1c(cc(cc1F)C)O 271570a_203496583355_100015667323 [0,3,0,0,0,0|1,0,0]=4 19337 B13R1.4656 COC(=O)c1c(cc(cc1F)F)O 271570a_203496583355_100010009842 [0,3,0,0,0,0|1,0,0]=4 19338 B13R1.4656 COC(=O)c1c(cc(cc1F)O)C 271570a_203496583355_100010761470 [0,3,0,0,0,0|1,0,0]=4 19339 B13R1.4656 COC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100012350779 [0,3,0,0,0,0|1,0,0]=4 19340 B13R1.4656 COC(=O)c1c(cc(cc1F)O)N 271570a_203496583355_100015466354 [0,3,0,0,0,0|1,0,0]=4 19341 B13R1.4656 COC(=O)c1c(cc(cc1F)O)O 271570a_203496583355_100010889199 [0,3,0,0,0,0|1,0,0]=4 19342 B13R1.82 C=Cc1cccc(c1Br)C(=O)OC 271570a_100011290941_100010240208 [0,3,0,0,0,0|1,0,0]=4 19343 B13R1.82 C=Cc1cccc(c1C)C(=O)NN 271570a_100011290941_200012298103 [0,3,0,0,0,0|1,0,0]=4 19344 B13R1.82 C=Cc1cccc(c1C)C(=O)OC 271570a_100011290941_100012298220 [0,3,0,0,0,0|1,0,0]=4 19345 B13R1.82 C=Cc1cccc(c1F)C(=O)OC 271570a_100011290941_100012355674 [0,3,0,0,0,0|1,0,0]=4 19346 B13R1.82 C=Cc1cccc(c1N)C(=O)OC 271570a_100011290941_100011356556 [0,3,0,0,0,0|1,0,0]=4 19347 B13R1.82 C=Cc1cccc(c1O)C(=O)OC 271570a_100011290941_100009816214 [0,3,0,0,0,0|1,0,0]=4 19348 B13R1.82 CCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210202 [0,3,0,0,0,0|1,0,0]=4 19349 B13R1.82 CCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210202 [0,3,0,0,0,0|1,0,0]=4 19350 B13R1.82 CCC(=O)c1cccc(c1Cl)C#N 1458a_100009860865_100000210202 [0,3,0,0,0,0|1,0,0]=4 19351 B13R1.82 CCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210202 [0,3,0,0,0,0|1,0,0]=4 19352 B13R1.82 CCC(=O)c1cccc(c1F)C#N 1458a_100011999812_100000210202 [0,3,0,0,0,0|1,0,0]=4 19353 B13R1.82 CCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210202 [0,3,0,0,0,0|1,0,0]=4 19354 B13R1.82 CCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210202 [0,3,0,0,0,0|1,0,0]=4 19355 B13R1.82 CCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000210202 [0,3,0,0,0,0|1,0,0]=4 19356 B13R1.82 CCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210202 [0,3,0,0,0,0|1,0,0]=4 19357 B13R1.82 CCc1cccc(c1O)C(=O)OC 271570a_203496583355_200009992460 [0,3,0,0,0,0|1,0,0]=4 19358 B13R1.82 CNC(=O)c1cccc(c1Br)OC 11a_106832991635_100010245468 [0,3,0,0,0,0|0,0,0]=3 19359 B13R1.82 CNC(=O)c1cccc(c1Br)OC 1626a_100102657272_100010245468 [0,3,0,0,0,0|0,0,0]=3 19360 B13R1.82 CNC(=O)c1cccc(c1Br)OC 240690a_100102657272_100010245468 [0,3,0,0,0,0|0,0,0]=3 19361 B13R1.82 CNC(=O)c1cccc(c1Br)OC 527a_100102657272_100010245468 [0,3,0,0,0,0|0,0,0]=3 19362 B13R1.82 CNC(=O)c1cccc(c1C)NC 34a_100000739055_200000210301 [0,3,0,0,0,0|0,0,0]=3 19363 B13R1.82 CNC(=O)c1cccc(c1C)N[13CH3] 34a_100000739055_200025704644 [0,3,0,0,0,0|0,0,0]=3 19364 B13R1.82 CNC(=O)c1cccc(c1C)OC 11a_106832991635_100011217801 [0,3,0,0,0,0|0,0,0]=3 19365 B13R1.82 CNC(=O)c1cccc(c1C)OC 1626a_100102657272_100011217801 [0,3,0,0,0,0|0,0,0]=3 19366 B13R1.82 CNC(=O)c1cccc(c1C)OC 240690a_100102657272_100011217801 [0,3,0,0,0,0|0,0,0]=3 19367 B13R1.82 CNC(=O)c1cccc(c1C)OC 527a_100102657272_100011217801 [0,3,0,0,0,0|0,0,0]=3 19368 B13R1.82 CNC(=O)c1cccc(c1Cl)C#N 11a_106832991635_100009860865 [0,3,0,0,0,0|0,0,0]=3 19369 B13R1.82 CNC(=O)c1cccc(c1Cl)C#N 1626a_100102657272_100009860865 [0,3,0,0,0,0|0,0,0]=3 19370 B13R1.82 CNC(=O)c1cccc(c1Cl)C#N 527a_100102657272_100009860865 [0,3,0,0,0,0|0,0,0]=3 19371 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 11a_106832991635_100000068443 [0,3,0,0,0,0|0,0,0]=3 19372 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 1626a_100102657272_100000068443 [0,3,0,0,0,0|0,0,0]=3 19373 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 240690a_100102657272_100000068443 [0,3,0,0,0,0|0,0,0]=3 19374 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 527a_100102657272_100000068443 [0,3,0,0,0,0|0,0,0]=3 19375 B13R1.82 CNC(=O)c1cccc(c1F)C#N 11a_106832991635_100011999812 [0,3,0,0,0,0|0,0,0]=3 19376 B13R1.82 CNC(=O)c1cccc(c1F)C#N 1626a_100102657272_100011999812 [0,3,0,0,0,0|0,0,0]=3 19377 B13R1.82 CNC(=O)c1cccc(c1F)C#N 240690a_100102657272_100011999812 [0,3,0,0,0,0|0,0,0]=3 19378 B13R1.82 CNC(=O)c1cccc(c1F)C#N 527a_100102657272_100011999812 [0,3,0,0,0,0|0,0,0]=3 19379 B13R1.82 CNC(=O)c1cccc(c1F)OC 11a_106832991635_100000766180 [0,3,0,0,0,0|0,0,0]=3 19380 B13R1.82 CNC(=O)c1cccc(c1F)OC 1626a_100102657272_100000766180 [0,3,0,0,0,0|0,0,0]=3 19381 B13R1.82 CNC(=O)c1cccc(c1F)OC 240690a_100102657272_100000766180 [0,3,0,0,0,0|0,0,0]=3 19382 B13R1.82 CNC(=O)c1cccc(c1F)OC 527a_100102657272_100000766180 [0,3,0,0,0,0|0,0,0]=3 19383 B13R1.82 CNC(=O)c1cccc(c1I)OC 11a_106832991635_100010075502 [0,3,0,0,0,0|0,0,0]=3 19384 B13R1.82 CNC(=O)c1cccc(c1I)OC 1626a_100102657272_100010075502 [0,3,0,0,0,0|0,0,0]=3 19385 B13R1.82 CNC(=O)c1cccc(c1I)OC 240690a_100102657272_100010075502 [0,3,0,0,0,0|0,0,0]=3 19386 B13R1.82 CNC(=O)c1cccc(c1I)OC 527a_100102657272_100010075502 [0,3,0,0,0,0|0,0,0]=3 19387 B13R1.82 CNC(=O)c1cccc(c1O)C#N 527a_100102657272_100009886288 [0,3,0,0,0,0|0,0,0]=3 19388 B13R1.82 CNC(=O)c1cccc(c1O)OC 240690a_100102657272_100000212136 [0,3,0,0,0,0|0,0,0]=3 19389 B13R1.82 CNC(=O)c1cccc(c1O)OC 527a_100102657272_100000212136 [0,3,0,0,0,0|0,0,0]=3 19390 B13R1.82 COC(=O)c1cccc(c1Br)OC 34a_200010230364_200000210301 [0,3,0,0,0,0|1,0,0]=4 19391 B13R1.82 COC(=O)c1cccc(c1Br)OC 7a_200010230364_200000210301 [0,3,0,0,0,0|1,0,0]=4 19392 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 34a_200010230364_200025704644 [0,3,0,0,0,0|1,0,0]=4 19393 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 7a_200010230364_200025704644 [0,3,0,0,0,0|1,0,0]=4 19394 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_100010240208_200000210301 [0,3,0,0,0,0|1,0,0]=4 19395 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_200000210301_100010240208 [0,3,0,0,0,0|1,0,0]=4 19396 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_100010240208_200025704644 [0,3,0,0,0,0|1,0,0]=4 19397 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_200025704644_100010240208 [0,3,0,0,0,0|1,0,0]=4 19398 B13R1.82 COC(=O)c1cccc(c1C)OC 34a_100011999632_200000210301 [0,3,0,0,0,0|1,0,0]=4 19399 B13R1.82 COC(=O)c1cccc(c1C)OC 7a_100011999632_200000210301 [0,3,0,0,0,0|1,0,0]=4 19400 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 34a_100011999632_200025704644 [0,3,0,0,0,0|1,0,0]=4 19401 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 7a_100011999632_200025704644 [0,3,0,0,0,0|1,0,0]=4 19402 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_100012298220_200000210301 [0,3,0,0,0,0|1,0,0]=4 19403 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_200000210301_100012298220 [0,3,0,0,0,0|1,0,0]=4 19404 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_100012298220_200025704644 [0,3,0,0,0,0|1,0,0]=4 19405 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298220 [0,3,0,0,0,0|1,0,0]=4 19406 B13R1.82 COC(=O)c1cccc(c1Cl)OC 34a_100009866855_200000210301 [0,3,0,0,0,0|1,0,0]=4 19407 B13R1.82 COC(=O)c1cccc(c1Cl)OC 7a_100009866855_200000210301 [0,3,0,0,0,0|1,0,0]=4 19408 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 34a_100009866855_200025704644 [0,3,0,0,0,0|1,0,0]=4 19409 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 7a_100009866855_200025704644 [0,3,0,0,0,0|1,0,0]=4 19410 B13R1.82 COC(=O)c1cccc(c1F)OC 34a_100009854753_200000210301 [0,3,0,0,0,0|1,0,0]=4 19411 B13R1.82 COC(=O)c1cccc(c1F)OC 7a_100009854753_200000210301 [0,3,0,0,0,0|1,0,0]=4 19412 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 34a_100009854753_200025704644 [0,3,0,0,0,0|1,0,0]=4 19413 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 7a_100009854753_200025704644 [0,3,0,0,0,0|1,0,0]=4 19414 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_100012355674_200000210301 [0,3,0,0,0,0|1,0,0]=4 19415 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_200000210301_100012355674 [0,3,0,0,0,0|1,0,0]=4 19416 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_100012355674_200025704644 [0,3,0,0,0,0|1,0,0]=4 19417 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355674 [0,3,0,0,0,0|1,0,0]=4 19418 B13R1.82 COC(=O)c1cccc(c1N)OC 34a_100015205654_200000210301 [0,3,0,0,0,0|1,0,0]=4 19419 B13R1.82 COC(=O)c1cccc(c1N)OC 7a_100015205654_200000210301 [0,3,0,0,0,0|1,0,0]=4 19420 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 34a_100015205654_200025704644 [0,3,0,0,0,0|1,0,0]=4 19421 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 7a_100015205654_200025704644 [0,3,0,0,0,0|1,0,0]=4 19422 B13R1.82 COC(=O)c1cccc(c1N)SC 62a_100011356556_200000210301 [0,3,0,0,0,0|1,0,0]=4 19423 B13R1.82 COC(=O)c1cccc(c1N)S[13CH3] 62a_100011356556_200025704644 [0,3,0,0,0,0|1,0,0]=4 19424 B13R1.82 COC(=O)c1cccc(c1O)OC 271570a_203496583355_100010189551 [0,3,0,0,0,0|1,0,0]=4 19425 B13R1.82 COC(=O)c1cccc(c1O)SC 62a_100009816214_200000210301 [0,3,0,0,0,0|1,0,0]=4 19426 B13R1.82 COC(=O)c1cccc(c1O)S[13CH3] 62a_100009816214_200025704644 [0,3,0,0,0,0|1,0,0]=4 19427 B13R1.82 CSc1cccc(c1C)C(=O)NN 62a_200000210301_200012298103 [0,3,0,0,0,0|1,0,0]=4 19428 B13R1.82 CSc1cccc(c1C)C(=O)NN 62a_200012298103_200000210301 [0,3,0,0,0,0|1,0,0]=4 19429 B13R1.82 Cc1c(cccc1C(=O)NN)S[13CH3] 62a_200012298103_200025704644 [0,3,0,0,0,0|1,0,0]=4 19430 B13R1.82 Cc1c(cccc1C(=O)NN)S[13CH3] 62a_200025704644_200012298103 [0,3,0,0,0,0|1,0,0]=4 19431 B13R1.107 C=Cc1c(cccc1C(=O)OC)Br 271570a_100011290941_100010150843 [0,3,0,0,0,0|1,0,0]=4 19432 B13R1.107 C=Cc1c(cccc1C(=O)OC)C 271570a_100011290941_100012002529 [0,3,0,0,0,0|1,0,0]=4 19433 B13R1.107 C=Cc1c(cccc1C(=O)OC)F 271570a_100011290941_100012357630 [0,3,0,0,0,0|1,0,0]=4 19434 B13R1.107 C=Cc1c(cccc1C(=O)OC)N 271570a_100011290941_100000719424 [0,3,0,0,0,0|1,0,0]=4 19435 B13R1.107 C=Cc1c(cccc1C(=O)OC)O 271570a_100011290941_200010230364 [0,3,0,0,0,0|1,0,0]=4 19436 B13R1.107 CCC(=O)c1cccc(c1C#N)F 1458a_100000702252_100000210202 [0,3,0,0,0,0|1,0,0]=4 19437 B13R1.107 CCC(=O)c1cccc(c1CC)Br 1458a_100010125490_100000210202 [0,3,0,0,0,0|1,0,0]=4 19438 B13R1.107 CCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000210202 [0,3,0,0,0,0|1,0,0]=4 19439 B13R1.107 CCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000210202 [0,3,0,0,0,0|1,0,0]=4 19440 B13R1.107 CCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000210202 [0,3,0,0,0,0|1,0,0]=4 19441 B13R1.107 CCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000210202 [0,3,0,0,0,0|1,0,0]=4 19442 B13R1.107 CCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000210202 [0,3,0,0,0,0|1,0,0]=4 19443 B13R1.107 CCc1c(cccc1C(=O)NC)Br 11a_106832991635_100010125490 [0,3,0,0,0,0|0,0,0]=3 19444 B13R1.107 CCc1c(cccc1C(=O)NC)Br 1626a_100102657272_100010125490 [0,3,0,0,0,0|0,0,0]=3 19445 B13R1.107 CCc1c(cccc1C(=O)NC)Br 240690a_100102657272_100010125490 [0,3,0,0,0,0|0,0,0]=3 19446 B13R1.107 CCc1c(cccc1C(=O)NC)Br 527a_100102657272_100010125490 [0,3,0,0,0,0|0,0,0]=3 19447 B13R1.107 CNC(=O)c1cccc(c1C#N)F 240690a_100102657272_100000702252 [0,3,0,0,0,0|0,0,0]=3 19448 B13R1.107 CNC(=O)c1cccc(c1C#N)F 527a_100102657272_100000702252 [0,3,0,0,0,0|0,0,0]=3 19449 B13R1.107 CNC(=O)c1cccc(c1NC)C 34a_100000223168_200000210301 [0,3,0,0,0,0|0,0,0]=3 19450 B13R1.107 CNC(=O)c1cccc(c1NC)Cl 34a_200012181065_200000210301 [0,3,0,0,0,0|0,0,0]=3 19451 B13R1.107 CNC(=O)c1cccc(c1N[13CH3])C 34a_100000223168_200025704644 [0,3,0,0,0,0|0,0,0]=3 19452 B13R1.107 CNC(=O)c1cccc(c1N[13CH3])Cl 34a_200012181065_200025704644 [0,3,0,0,0,0|0,0,0]=3 19453 B13R1.107 CNC(=O)c1cccc(c1OC)Br 11a_106832991635_100000689802 [0,3,0,0,0,0|0,0,0]=3 19454 B13R1.107 CNC(=O)c1cccc(c1OC)Br 1626a_100102657272_100000689802 [0,3,0,0,0,0|0,0,0]=3 19455 B13R1.107 CNC(=O)c1cccc(c1OC)Br 240690a_100102657272_100000689802 [0,3,0,0,0,0|0,0,0]=3 19456 B13R1.107 CNC(=O)c1cccc(c1OC)Br 527a_100102657272_100000689802 [0,3,0,0,0,0|0,0,0]=3 19457 B13R1.107 CNC(=O)c1cccc(c1OC)C 11a_106832991635_100000187929 [0,3,0,0,0,0|0,0,0]=3 19458 B13R1.107 CNC(=O)c1cccc(c1OC)C 1626a_100102657272_100000187929 [0,3,0,0,0,0|0,0,0]=3 19459 B13R1.107 CNC(=O)c1cccc(c1OC)C 240690a_100102657272_100000187929 [0,3,0,0,0,0|0,0,0]=3 19460 B13R1.107 CNC(=O)c1cccc(c1OC)C 527a_100102657272_100000187929 [0,3,0,0,0,0|0,0,0]=3 19461 B13R1.107 CNC(=O)c1cccc(c1OC)Cl 11a_106832991635_100011934004 [0,3,0,0,0,0|0,0,0]=3 19462 B13R1.107 CNC(=O)c1cccc(c1OC)Cl 1626a_100102657272_100011934004 [0,3,0,0,0,0|0,0,0]=3 19463 B13R1.107 CNC(=O)c1cccc(c1OC)Cl 240690a_100102657272_100011934004 [0,3,0,0,0,0|0,0,0]=3 19464 B13R1.107 CNC(=O)c1cccc(c1OC)Cl 527a_100102657272_100011934004 [0,3,0,0,0,0|0,0,0]=3 19465 B13R1.107 CNC(=O)c1cccc(c1OC)F 11a_106832991635_100011218433 [0,3,0,0,0,0|0,0,0]=3 19466 B13R1.107 CNC(=O)c1cccc(c1OC)F 1626a_100102657272_100011218433 [0,3,0,0,0,0|0,0,0]=3 19467 B13R1.107 CNC(=O)c1cccc(c1OC)F 240690a_100102657272_100011218433 [0,3,0,0,0,0|0,0,0]=3 19468 B13R1.107 CNC(=O)c1cccc(c1OC)F 527a_100102657272_100011218433 [0,3,0,0,0,0|0,0,0]=3 19469 B13R1.107 COC(=O)c1cccc(c1C#N)O 271570a_203496583355_100000766541 [0,3,0,0,0,0|1,0,0]=4 19470 B13R1.107 COC(=O)c1cccc(c1OC)Br 34a_100009816214_200000210301 [0,3,0,0,0,0|1,0,0]=4 19471 B13R1.107 COC(=O)c1cccc(c1OC)C 34a_100000149854_200000210301 [0,3,0,0,0,0|1,0,0]=4 19472 B13R1.107 COC(=O)c1cccc(c1OC)C 7a_100000149854_200000210301 [0,3,0,0,0,0|1,0,0]=4 19473 B13R1.107 COC(=O)c1cccc(c1OC)Cl 34a_100000074923_200000210301 [0,3,0,0,0,0|1,0,0]=4 19474 B13R1.107 COC(=O)c1cccc(c1OC)Cl 7a_100000074923_200000210301 [0,3,0,0,0,0|1,0,0]=4 19475 B13R1.107 COC(=O)c1cccc(c1OC)F 34a_100000082593_200000210301 [0,3,0,0,0,0|1,0,0]=4 19476 B13R1.107 COC(=O)c1cccc(c1OC)F 7a_100000082593_200000210301 [0,3,0,0,0,0|1,0,0]=4 19477 B13R1.107 COC(=O)c1cccc(c1OC)N 34a_100000750886_200000210301 [0,3,0,0,0,0|1,0,0]=4 19478 B13R1.107 COC(=O)c1cccc(c1OC)O 271570a_203496583355_100010233336 [0,3,0,0,0,0|1,0,0]=4 19479 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Br 34a_100009816214_200025704644 [0,3,0,0,0,0|1,0,0]=4 19480 B13R1.107 COC(=O)c1cccc(c1O[13CH3])C 34a_100000149854_200025704644 [0,3,0,0,0,0|1,0,0]=4 19481 B13R1.107 COC(=O)c1cccc(c1O[13CH3])C 7a_100000149854_200025704644 [0,3,0,0,0,0|1,0,0]=4 19482 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Cl 34a_100000074923_200025704644 [0,3,0,0,0,0|1,0,0]=4 19483 B13R1.107 COC(=O)c1cccc(c1O[13CH3])Cl 7a_100000074923_200025704644 [0,3,0,0,0,0|1,0,0]=4 19484 B13R1.107 COC(=O)c1cccc(c1O[13CH3])F 34a_100000082593_200025704644 [0,3,0,0,0,0|1,0,0]=4 19485 B13R1.107 COC(=O)c1cccc(c1O[13CH3])F 7a_100000082593_200025704644 [0,3,0,0,0,0|1,0,0]=4 19486 B13R1.107 COC(=O)c1cccc(c1O[13CH3])N 34a_100000750886_200025704644 [0,3,0,0,0,0|1,0,0]=4 19487 B13R1.107 COC(=O)c1cccc(c1SC)Br 62a_100010150843_200000210301 [0,3,0,0,0,0|1,0,0]=4 19488 B13R1.107 COC(=O)c1cccc(c1SC)Br 62a_200000210301_100010150843 [0,3,0,0,0,0|1,0,0]=4 19489 B13R1.107 COC(=O)c1cccc(c1SC)C 62a_100012002529_200000210301 [0,3,0,0,0,0|1,0,0]=4 19490 B13R1.107 COC(=O)c1cccc(c1SC)C 62a_200000210301_100012002529 [0,3,0,0,0,0|1,0,0]=4 19491 B13R1.107 COC(=O)c1cccc(c1SC)F 62a_100012357630_200000210301 [0,3,0,0,0,0|1,0,0]=4 19492 B13R1.107 COC(=O)c1cccc(c1SC)F 62a_200000210301_100012357630 [0,3,0,0,0,0|1,0,0]=4 19493 B13R1.107 COC(=O)c1cccc(c1SC)N 62a_100000719424_200000210301 [0,3,0,0,0,0|1,0,0]=4 19494 B13R1.107 COC(=O)c1cccc(c1SC)O 62a_200000210301_200010230364 [0,3,0,0,0,0|1,0,0]=4 19495 B13R1.107 COC(=O)c1cccc(c1SC)O 62a_200010230364_200000210301 [0,3,0,0,0,0|1,0,0]=4 19496 B13R1.107 COC(=O)c1cccc(c1S[13CH3])Br 62a_100010150843_200025704644 [0,3,0,0,0,0|1,0,0]=4 19497 B13R1.107 COC(=O)c1cccc(c1S[13CH3])Br 62a_200025704644_100010150843 [0,3,0,0,0,0|1,0,0]=4 19498 B13R1.107 COC(=O)c1cccc(c1S[13CH3])C 62a_100012002529_200025704644 [0,3,0,0,0,0|1,0,0]=4 19499 B13R1.107 COC(=O)c1cccc(c1S[13CH3])C 62a_200025704644_100012002529 [0,3,0,0,0,0|1,0,0]=4 19500 B13R1.107 COC(=O)c1cccc(c1S[13CH3])F 62a_100012357630_200025704644 [0,3,0,0,0,0|1,0,0]=4 19501 B13R1.107 COC(=O)c1cccc(c1S[13CH3])F 62a_200025704644_100012357630 [0,3,0,0,0,0|1,0,0]=4 19502 B13R1.107 COC(=O)c1cccc(c1S[13CH3])N 62a_100000719424_200025704644 [0,3,0,0,0,0|1,0,0]=4 19503 B13R1.107 COC(=O)c1cccc(c1S[13CH3])O 62a_200010230364_200025704644 [0,3,0,0,0,0|1,0,0]=4 19504 B13R1.107 COC(=O)c1cccc(c1S[13CH3])O 62a_200025704644_200010230364 [0,3,0,0,0,0|1,0,0]=4 19505 B13R1.107 COc1c(cccc1C(=O)NN)C 34a_100000193353_200000210301 [0,3,0,0,0,0|1,0,0]=4 19506 B13R1.107 CSc1c(cccc1C(=O)NN)C 62a_200000210301_200012340524 [0,3,0,0,0,0|1,0,0]=4 19507 B13R1.107 CSc1c(cccc1C(=O)NN)C 62a_200012340524_200000210301 [0,3,0,0,0,0|1,0,0]=4 19508 B13R1.107 Cc1cccc(c1O[13CH3])C(=O)NN 34a_100000193353_200025704644 [0,3,0,0,0,0|1,0,0]=4 19509 B13R1.107 Cc1cccc(c1S[13CH3])C(=O)NN 62a_200012340524_200025704644 [0,3,0,0,0,0|1,0,0]=4 19510 B13R1.107 Cc1cccc(c1S[13CH3])C(=O)NN 62a_200025704644_200012340524 [0,3,0,0,0,0|1,0,0]=4 19511 B13R1.1822 CCC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_100000210202 [0,3,0,0,0,0|1,0,0]=4 19512 B13R1.1822 CCC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_100000210202 [0,3,0,0,0,0|1,0,0]=4 19513 B13R1.1822 CCC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_100000210202 [0,3,0,0,0,0|1,0,0]=4 19514 B13R1.1822 CCC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_100000210202 [0,3,0,0,0,0|1,0,0]=4 19515 B13R1.1822 CCC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_100000210202 [0,3,0,0,0,0|1,0,0]=4 19516 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_100000210202 [0,3,0,0,0,0|1,0,0]=4 19517 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_100000210202 [0,3,0,0,0,0|1,0,0]=4 19518 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_100000210202 [0,3,0,0,0,0|1,0,0]=4 19519 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_100000210202 [0,3,0,0,0,0|1,0,0]=4 19520 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_100000210202 [0,3,0,0,0,0|1,0,0]=4 19521 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_100000210202 [0,3,0,0,0,0|1,0,0]=4 19522 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_100000210202 [0,3,0,0,0,0|1,0,0]=4 19523 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_100000210202 [0,3,0,0,0,0|1,0,0]=4 19524 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_100000210202 [0,3,0,0,0,0|1,0,0]=4 19525 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_100000210202 [0,3,0,0,0,0|1,0,0]=4 19526 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_100000210202 [0,3,0,0,0,0|1,0,0]=4 19527 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_100000210202 [0,3,0,0,0,0|1,0,0]=4 19528 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_100000210202 [0,3,0,0,0,0|1,0,0]=4 19529 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_100000210202 [0,3,0,0,0,0|1,0,0]=4 19530 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_100000210202 [0,3,0,0,0,0|1,0,0]=4 19531 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_100000210202 [0,3,0,0,0,0|1,0,0]=4 19532 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_100000210202 [0,3,0,0,0,0|1,0,0]=4 19533 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_100000210202 [0,3,0,0,0,0|1,0,0]=4 19534 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_100000210202 [0,3,0,0,0,0|1,0,0]=4 19535 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_100000210202 [0,3,0,0,0,0|1,0,0]=4 19536 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_100000210202 [0,3,0,0,0,0|1,0,0]=4 19537 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000210202 [0,3,0,0,0,0|1,0,0]=4 19538 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_100000210202 [0,3,0,0,0,0|1,0,0]=4 19539 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_100000210202 [0,3,0,0,0,0|1,0,0]=4 19540 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_100000210202 [0,3,0,0,0,0|1,0,0]=4 19541 B13R1.1822 CCC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_100000210202 [0,3,0,0,0,0|1,0,0]=4 19542 B13R1.1822 CCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000210202 [0,3,0,0,0,0|1,0,0]=4 19543 B13R1.1822 CCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000210202 [0,3,0,0,0,0|1,0,0]=4 19544 B13R1.1822 CCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000210202 [0,3,0,0,0,0|1,0,0]=4 19545 B13R1.1822 CCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000210202 [0,3,0,0,0,0|1,0,0]=4 19546 B13R1.1822 CCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000210202 [0,3,0,0,0,0|1,0,0]=4 19547 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 11a_106832991635_100000720849 [0,3,0,0,0,0|0,0,0]=3 19548 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 1626a_100102657272_100000720849 [0,3,0,0,0,0|0,0,0]=3 19549 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 240690a_100102657272_100000720849 [0,3,0,0,0,0|0,0,0]=3 19550 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 527a_100102657272_100000720849 [0,3,0,0,0,0|0,0,0]=3 19551 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 11a_106832991635_100010245744 [0,3,0,0,0,0|0,0,0]=3 19552 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 1626a_100102657272_100010245744 [0,3,0,0,0,0|0,0,0]=3 19553 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 240690a_100102657272_100010245744 [0,3,0,0,0,0|0,0,0]=3 19554 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 527a_100102657272_100010245744 [0,3,0,0,0,0|0,0,0]=3 19555 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 11a_106832991635_100012355652 [0,3,0,0,0,0|0,0,0]=3 19556 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 1626a_100102657272_100012355652 [0,3,0,0,0,0|0,0,0]=3 19557 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 240690a_100102657272_100012355652 [0,3,0,0,0,0|0,0,0]=3 19558 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 527a_100102657272_100012355652 [0,3,0,0,0,0|0,0,0]=3 19559 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 11a_106832991635_100010768519 [0,3,0,0,0,0|0,0,0]=3 19560 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 1626a_100102657272_100010768519 [0,3,0,0,0,0|0,0,0]=3 19561 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 240690a_100102657272_100010768519 [0,3,0,0,0,0|0,0,0]=3 19562 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 527a_100102657272_100010768519 [0,3,0,0,0,0|0,0,0]=3 19563 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 11a_106832991635_100010768524 [0,3,0,0,0,0|0,0,0]=3 19564 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 1626a_100102657272_100010768524 [0,3,0,0,0,0|0,0,0]=3 19565 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 240690a_100102657272_100010768524 [0,3,0,0,0,0|0,0,0]=3 19566 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 527a_100102657272_100010768524 [0,3,0,0,0,0|0,0,0]=3 19567 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 11a_106832991635_100012350121 [0,3,0,0,0,0|0,0,0]=3 19568 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 1626a_100102657272_100012350121 [0,3,0,0,0,0|0,0,0]=3 19569 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 240690a_100102657272_100012350121 [0,3,0,0,0,0|0,0,0]=3 19570 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 527a_100102657272_100012350121 [0,3,0,0,0,0|0,0,0]=3 19571 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 11a_106832991635_100010245877 [0,3,0,0,0,0|0,0,0]=3 19572 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 1626a_100102657272_100010245877 [0,3,0,0,0,0|0,0,0]=3 19573 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 240690a_100102657272_100010245877 [0,3,0,0,0,0|0,0,0]=3 19574 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 527a_100102657272_100010245877 [0,3,0,0,0,0|0,0,0]=3 19575 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 11a_106832991635_200010769262 [0,3,0,0,0,0|0,0,0]=3 19576 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 1626a_100102657272_200010769262 [0,3,0,0,0,0|0,0,0]=3 19577 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 240690a_100102657272_200010769262 [0,3,0,0,0,0|0,0,0]=3 19578 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 527a_100102657272_200010769262 [0,3,0,0,0,0|0,0,0]=3 19579 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 11a_106832991635_100000036856 [0,3,0,0,0,0|0,0,0]=3 19580 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 1626a_100102657272_100000036856 [0,3,0,0,0,0|0,0,0]=3 19581 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 240690a_100102657272_100000036856 [0,3,0,0,0,0|0,0,0]=3 19582 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 527a_100102657272_100000036856 [0,3,0,0,0,0|0,0,0]=3 19583 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 11a_106832991635_100000182695 [0,3,0,0,0,0|0,0,0]=3 19584 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 1626a_100102657272_100000182695 [0,3,0,0,0,0|0,0,0]=3 19585 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 240690a_100102657272_100000182695 [0,3,0,0,0,0|0,0,0]=3 19586 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 527a_100102657272_100000182695 [0,3,0,0,0,0|0,0,0]=3 19587 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 11a_106832991635_100000061834 [0,3,0,0,0,0|0,0,0]=3 19588 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 1626a_100102657272_100000061834 [0,3,0,0,0,0|0,0,0]=3 19589 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 240690a_100102657272_100000061834 [0,3,0,0,0,0|0,0,0]=3 19590 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 527a_100102657272_100000061834 [0,3,0,0,0,0|0,0,0]=3 19591 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 11a_106832991635_100000068355 [0,3,0,0,0,0|0,0,0]=3 19592 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 1626a_100102657272_100000068355 [0,3,0,0,0,0|0,0,0]=3 19593 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 240690a_100102657272_100000068355 [0,3,0,0,0,0|0,0,0]=3 19594 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 11a_106832991635_100000043044 [0,3,0,0,0,0|0,0,0]=3 19595 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 1626a_100102657272_100000043044 [0,3,0,0,0,0|0,0,0]=3 19596 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 240690a_100102657272_100000043044 [0,3,0,0,0,0|0,0,0]=3 19597 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 527a_100102657272_100000043044 [0,3,0,0,0,0|0,0,0]=3 19598 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 11a_106832991635_100010233042 [0,3,0,0,0,0|0,0,0]=3 19599 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 240690a_100102657272_100010233042 [0,3,0,0,0,0|0,0,0]=3 19600 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 527a_100102657272_100010233042 [0,3,0,0,0,0|0,0,0]=3 19601 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 11a_106832991635_100010235752 [0,3,0,0,0,0|0,0,0]=3 19602 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 1626a_100102657272_100010235752 [0,3,0,0,0,0|0,0,0]=3 19603 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 240690a_100102657272_100010235752 [0,3,0,0,0,0|0,0,0]=3 19604 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 527a_100102657272_100010235752 [0,3,0,0,0,0|0,0,0]=3 19605 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 11a_106832991635_100000721511 [0,3,0,0,0,0|0,0,0]=3 19606 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 1626a_100102657272_100000721511 [0,3,0,0,0,0|0,0,0]=3 19607 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 240690a_100102657272_100000721511 [0,3,0,0,0,0|0,0,0]=3 19608 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 527a_100102657272_100000721511 [0,3,0,0,0,0|0,0,0]=3 19609 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 11a_106832991635_100010271678 [0,3,0,0,0,0|0,0,0]=3 19610 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 1626a_100102657272_100010271678 [0,3,0,0,0,0|0,0,0]=3 19611 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 240690a_100102657272_100010271678 [0,3,0,0,0,0|0,0,0]=3 19612 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 527a_100102657272_100010271678 [0,3,0,0,0,0|0,0,0]=3 19613 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 11a_106832991635_100000039063 [0,3,0,0,0,0|0,0,0]=3 19614 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 1626a_100102657272_100000039063 [0,3,0,0,0,0|0,0,0]=3 19615 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 240690a_100102657272_100000039063 [0,3,0,0,0,0|0,0,0]=3 19616 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 527a_100102657272_100000039063 [0,3,0,0,0,0|0,0,0]=3 19617 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 11a_106832991635_100000692215 [0,3,0,0,0,0|0,0,0]=3 19618 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 1626a_100102657272_100000692215 [0,3,0,0,0,0|0,0,0]=3 19619 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 240690a_100102657272_100000692215 [0,3,0,0,0,0|0,0,0]=3 19620 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 527a_100102657272_100000692215 [0,3,0,0,0,0|0,0,0]=3 19621 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 11a_106832991635_100010769261 [0,3,0,0,0,0|0,0,0]=3 19622 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 1626a_100102657272_100010769261 [0,3,0,0,0,0|0,0,0]=3 19623 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 240690a_100102657272_100010769261 [0,3,0,0,0,0|0,0,0]=3 19624 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 527a_100102657272_100010769261 [0,3,0,0,0,0|0,0,0]=3 19625 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 11a_106832991635_100000061686 [0,3,0,0,0,0|0,0,0]=3 19626 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 1626a_100102657272_100000061686 [0,3,0,0,0,0|0,0,0]=3 19627 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 240690a_100102657272_100000061686 [0,3,0,0,0,0|0,0,0]=3 19628 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 527a_100102657272_100000061686 [0,3,0,0,0,0|0,0,0]=3 19629 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 11a_106832991635_100011219569 [0,3,0,0,0,0|0,0,0]=3 19630 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 1626a_100102657272_100011219569 [0,3,0,0,0,0|0,0,0]=3 19631 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 240690a_100102657272_100011219569 [0,3,0,0,0,0|0,0,0]=3 19632 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 527a_100102657272_100011219569 [0,3,0,0,0,0|0,0,0]=3 19633 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 11a_106832991635_100010177765 [0,3,0,0,0,0|0,0,0]=3 19634 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 1626a_100102657272_100010177765 [0,3,0,0,0,0|0,0,0]=3 19635 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 240690a_100102657272_100010177765 [0,3,0,0,0,0|0,0,0]=3 19636 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 527a_100102657272_100010177765 [0,3,0,0,0,0|0,0,0]=3 19637 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 11a_106832991635_100011998153 [0,3,0,0,0,0|0,0,0]=3 19638 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 1626a_100102657272_100011998153 [0,3,0,0,0,0|0,0,0]=3 19639 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 240690a_100102657272_100011998153 [0,3,0,0,0,0|0,0,0]=3 19640 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 527a_100102657272_100011998153 [0,3,0,0,0,0|0,0,0]=3 19641 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 11a_106832991635_100000031524 [0,3,0,0,0,0|0,0,0]=3 19642 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 1626a_100102657272_100000031524 [0,3,0,0,0,0|0,0,0]=3 19643 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 240690a_100102657272_100000031524 [0,3,0,0,0,0|0,0,0]=3 19644 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 527a_100102657272_100000031524 [0,3,0,0,0,0|0,0,0]=3 19645 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 11a_106832991635_100010177766 [0,3,0,0,0,0|0,0,0]=3 19646 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 1626a_100102657272_100010177766 [0,3,0,0,0,0|0,0,0]=3 19647 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 240690a_100102657272_100010177766 [0,3,0,0,0,0|0,0,0]=3 19648 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 527a_100102657272_100010177766 [0,3,0,0,0,0|0,0,0]=3 19649 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)O 240690a_100102657272_100000062415 [0,3,0,0,0,0|0,0,0]=3 19650 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)O 527a_100102657272_100000062415 [0,3,0,0,0,0|0,0,0]=3 19651 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 11a_106832991635_100010782274 [0,3,0,0,0,0|0,0,0]=3 19652 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 1626a_100102657272_100010782274 [0,3,0,0,0,0|0,0,0]=3 19653 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 240690a_100102657272_100010782274 [0,3,0,0,0,0|0,0,0]=3 19654 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 527a_100102657272_100010782274 [0,3,0,0,0,0|0,0,0]=3 19655 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 11a_106832991635_100021583479 [0,3,0,0,0,0|0,0,0]=3 19656 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 1626a_100102657272_100021583479 [0,3,0,0,0,0|0,0,0]=3 19657 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 240690a_100102657272_100021583479 [0,3,0,0,0,0|0,0,0]=3 19658 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 527a_100102657272_100021583479 [0,3,0,0,0,0|0,0,0]=3 19659 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 11a_106832991635_100012359589 [0,3,0,0,0,0|0,0,0]=3 19660 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 1626a_100102657272_100012359589 [0,3,0,0,0,0|0,0,0]=3 19661 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 240690a_100102657272_100012359589 [0,3,0,0,0,0|0,0,0]=3 19662 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 527a_100102657272_100012359589 [0,3,0,0,0,0|0,0,0]=3 19663 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 240690a_100102657272_100000068660 [0,3,0,0,0,0|0,0,0]=3 19664 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 527a_100102657272_100000068660 [0,3,0,0,0,0|0,0,0]=3 19665 B13R1.1822 CNC(=O)c1c(ccc(c1O)Br)O 240690a_100102657272_100010008628 [0,3,0,0,0,0|0,0,0]=3 19666 B13R1.1822 CNC(=O)c1c(ccc(c1O)Br)O 527a_100102657272_100010008628 [0,3,0,0,0,0|0,0,0]=3 19667 B13R1.1822 CNC(=O)c1c(ccc(c1O)C)C 240690a_100102657272_100011255215 [0,3,0,0,0,0|0,0,0]=3 19668 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100102657272_100011255222 [0,3,0,0,0,0|0,0,0]=3 19669 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100102657272_100011255222 [0,3,0,0,0,0|0,0,0]=3 19670 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)O 240690a_100102657272_100000080727 [0,3,0,0,0,0|0,0,0]=3 19671 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)O 527a_100102657272_100000080727 [0,3,0,0,0,0|0,0,0]=3 19672 B13R1.1822 CNC(=O)c1c(ccc(c1O)F)F 240690a_100102657272_100011830443 [0,3,0,0,0,0|0,0,0]=3 19673 B13R1.1822 CNC(=O)c1c(ccc(c1O)F)F 527a_100102657272_100011830443 [0,3,0,0,0,0|0,0,0]=3 19674 B13R1.1822 COC(=O)c1c(ccc(c1C)F)O 271570a_203496583355_100015681208 [0,3,0,0,0,0|1,0,0]=4 19675 B13R1.1822 COC(=O)c1c(ccc(c1C)N)O 271570a_203496583355_100000718917 [0,3,0,0,0,0|1,0,0]=4 19676 B13R1.1822 COC(=O)c1c(ccc(c1C)O)C 271570a_203496583355_100016100700 [0,3,0,0,0,0|1,0,0]=4 19677 B13R1.1822 COC(=O)c1c(ccc(c1C)O)N 271570a_203496583355_100010203172 [0,3,0,0,0,0|1,0,0]=4 19678 B13R1.1822 COC(=O)c1c(ccc(c1C)O)O 271570a_203496583355_100010074912 [0,3,0,0,0,0|1,0,0]=4 19679 B13R1.1822 COC(=O)c1c(ccc(c1F)Br)O 271570a_203496583355_100015883209 [0,3,0,0,0,0|1,0,0]=4 19680 B13R1.1822 COC(=O)c1c(ccc(c1F)C)O 271570a_203496583355_100010782293 [0,3,0,0,0,0|1,0,0]=4 19681 B13R1.1822 COC(=O)c1c(ccc(c1F)O)F 271570a_203496583355_100000721510 [0,3,0,0,0,0|1,0,0]=4 19682 B13R1.1822 COC(=O)c1c(ccc(c1O)F)F 271570a_203496583355_100011071027 [0,3,0,0,0,0|1,0,0]=4 19683 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210206 [0,3,0,0,0,0|1,0,0]=4 19684 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210206 [0,3,0,0,0,0|1,0,0]=4 19685 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)F 1458a_100011217547_100000210206 [0,3,0,0,0,0|1,0,0]=4 19686 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)I 1458a_100010232522_100000210206 [0,3,0,0,0,0|1,0,0]=4 19687 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)O 1458a_100010230362_100000210206 [0,3,0,0,0,0|1,0,0]=4 19688 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210206 [0,3,0,0,0,0|1,0,0]=4 19689 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210206 [0,3,0,0,0,0|1,0,0]=4 19690 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210206 [0,3,0,0,0,0|1,0,0]=4 19691 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210206 [0,3,0,0,0,0|1,0,0]=4 19692 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210206 [0,3,0,0,0,0|1,0,0]=4 19693 B13R1.3768 CC(C)C(=O)c1cccc(c1F)Br 1458a_100000756403_100000210206 [0,3,0,0,0,0|1,0,0]=4 19694 B13R1.3768 CC(C)C(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210206 [0,3,0,0,0,0|1,0,0]=4 19695 B13R1.3768 CC(C)C(=O)c1cccc(c1F)F 1458a_100000748134_100000210206 [0,3,0,0,0,0|1,0,0]=4 19696 B13R1.3768 CC(C)C(=O)c1cccc(c1F)I 1458a_100010185205_100000210206 [0,3,0,0,0,0|1,0,0]=4 19697 B13R1.3768 CC(C)C(=O)c1cccc(c1F)O 1458a_100000037433_100000210206 [0,3,0,0,0,0|1,0,0]=4 19698 B13R1.3768 CC(C)C(=O)c1cccc(c1I)Br 1458a_100000688019_100000210206 [0,3,0,0,0,0|1,0,0]=4 19699 B13R1.3768 CC(C)C(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210206 [0,3,0,0,0,0|1,0,0]=4 19700 B13R1.3768 CC(C)C(=O)c1cccc(c1I)F 1458a_100000690930_100000210206 [0,3,0,0,0,0|1,0,0]=4 19701 B13R1.3768 CC(C)C(=O)c1cccc(c1I)O 1458a_100010084636_100000210206 [0,3,0,0,0,0|1,0,0]=4 19702 B13R1.3768 CC(C)C(=O)c1cccc(c1O)Br 1458a_100000752940_100000210206 [0,3,0,0,0,0|1,0,0]=4 19703 B13R1.3768 CC(C)C(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210206 [0,3,0,0,0,0|1,0,0]=4 19704 B13R1.3768 CC(C)C(=O)c1cccc(c1O)F 1458a_100011217230_100000210206 [0,3,0,0,0,0|1,0,0]=4 19705 B13R1.3768 CC(C)C(=O)c1cccc(c1O)O 1458a_100000690420_100000210206 [0,3,0,0,0,0|1,0,0]=4 19706 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Br 11a_100102631434_100012360534 [0,3,0,0,0,0|0,0,0]=3 19707 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Br 1626a_100102631434_100012360534 [0,3,0,0,0,0|0,0,0]=3 19708 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Br 240690a_100102631434_100012360534 [0,3,0,0,0,0|0,0,0]=3 19709 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Br 527a_100102631434_100012360534 [0,3,0,0,0,0|0,0,0]=3 19710 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Cl 11a_100102631434_100012339722 [0,3,0,0,0,0|0,0,0]=3 19711 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Cl 1626a_100102631434_100012339722 [0,3,0,0,0,0|0,0,0]=3 19712 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Cl 240690a_100102631434_100012339722 [0,3,0,0,0,0|0,0,0]=3 19713 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)Cl 527a_100102631434_100012339722 [0,3,0,0,0,0|0,0,0]=3 19714 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)F 11a_100102631434_100011217547 [0,3,0,0,0,0|0,0,0]=3 19715 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)F 1626a_100102631434_100011217547 [0,3,0,0,0,0|0,0,0]=3 19716 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)F 240690a_100102631434_100011217547 [0,3,0,0,0,0|0,0,0]=3 19717 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)F 527a_100102631434_100011217547 [0,3,0,0,0,0|0,0,0]=3 19718 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)I 11a_100102631434_100010232522 [0,3,0,0,0,0|0,0,0]=3 19719 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)I 1626a_100102631434_100010232522 [0,3,0,0,0,0|0,0,0]=3 19720 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)I 240690a_100102631434_100010232522 [0,3,0,0,0,0|0,0,0]=3 19721 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)I 527a_100102631434_100010232522 [0,3,0,0,0,0|0,0,0]=3 19722 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)O 240690a_100102631434_100010230362 [0,3,0,0,0,0|0,0,0]=3 19723 B13R1.3768 CN(C)C(=O)c1cccc(c1Br)O 527a_100102631434_100010230362 [0,3,0,0,0,0|0,0,0]=3 19724 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Br 11a_100102631434_100000760540 [0,3,0,0,0,0|0,0,0]=3 19725 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Br 1626a_100102631434_100000760540 [0,3,0,0,0,0|0,0,0]=3 19726 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Br 240690a_100102631434_100000760540 [0,3,0,0,0,0|0,0,0]=3 19727 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Br 527a_100102631434_100000760540 [0,3,0,0,0,0|0,0,0]=3 19728 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Cl 11a_100102631434_100000183631 [0,3,0,0,0,0|0,0,0]=3 19729 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Cl 1626a_100102631434_100000183631 [0,3,0,0,0,0|0,0,0]=3 19730 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Cl 240690a_100102631434_100000183631 [0,3,0,0,0,0|0,0,0]=3 19731 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)Cl 527a_100102631434_100000183631 [0,3,0,0,0,0|0,0,0]=3 19732 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)F 11a_100102631434_100000759904 [0,3,0,0,0,0|0,0,0]=3 19733 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)F 1626a_100102631434_100000759904 [0,3,0,0,0,0|0,0,0]=3 19734 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)F 240690a_100102631434_100000759904 [0,3,0,0,0,0|0,0,0]=3 19735 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)F 527a_100102631434_100000759904 [0,3,0,0,0,0|0,0,0]=3 19736 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)I 11a_100102631434_100010176783 [0,3,0,0,0,0|0,0,0]=3 19737 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)I 1626a_100102631434_100010176783 [0,3,0,0,0,0|0,0,0]=3 19738 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)I 240690a_100102631434_100010176783 [0,3,0,0,0,0|0,0,0]=3 19739 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)I 527a_100102631434_100010176783 [0,3,0,0,0,0|0,0,0]=3 19740 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)O 240690a_100102631434_100000092362 [0,3,0,0,0,0|0,0,0]=3 19741 B13R1.3768 CN(C)C(=O)c1cccc(c1Cl)O 527a_100102631434_100000092362 [0,3,0,0,0,0|0,0,0]=3 19742 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Br 11a_100102631434_100000756403 [0,3,0,0,0,0|0,0,0]=3 19743 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Br 1626a_100102631434_100000756403 [0,3,0,0,0,0|0,0,0]=3 19744 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Br 240690a_100102631434_100000756403 [0,3,0,0,0,0|0,0,0]=3 19745 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Br 527a_100102631434_100000756403 [0,3,0,0,0,0|0,0,0]=3 19746 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Cl 11a_100102631434_100000688816 [0,3,0,0,0,0|0,0,0]=3 19747 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Cl 1626a_100102631434_100000688816 [0,3,0,0,0,0|0,0,0]=3 19748 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Cl 240690a_100102631434_100000688816 [0,3,0,0,0,0|0,0,0]=3 19749 B13R1.3768 CN(C)C(=O)c1cccc(c1F)Cl 527a_100102631434_100000688816 [0,3,0,0,0,0|0,0,0]=3 19750 B13R1.3768 CN(C)C(=O)c1cccc(c1F)F 11a_100102631434_100000748134 [0,3,0,0,0,0|0,0,0]=3 19751 B13R1.3768 CN(C)C(=O)c1cccc(c1F)F 1626a_100102631434_100000748134 [0,3,0,0,0,0|0,0,0]=3 19752 B13R1.3768 CN(C)C(=O)c1cccc(c1F)F 240690a_100102631434_100000748134 [0,3,0,0,0,0|0,0,0]=3 19753 B13R1.3768 CN(C)C(=O)c1cccc(c1F)F 527a_100102631434_100000748134 [0,3,0,0,0,0|0,0,0]=3 19754 B13R1.3768 CN(C)C(=O)c1cccc(c1F)I 11a_100102631434_100010185205 [0,3,0,0,0,0|0,0,0]=3 19755 B13R1.3768 CN(C)C(=O)c1cccc(c1F)I 1626a_100102631434_100010185205 [0,3,0,0,0,0|0,0,0]=3 19756 B13R1.3768 CN(C)C(=O)c1cccc(c1F)I 240690a_100102631434_100010185205 [0,3,0,0,0,0|0,0,0]=3 19757 B13R1.3768 CN(C)C(=O)c1cccc(c1F)I 527a_100102631434_100010185205 [0,3,0,0,0,0|0,0,0]=3 19758 B13R1.3768 CN(C)C(=O)c1cccc(c1F)O 240690a_100102631434_100000037433 [0,3,0,0,0,0|0,0,0]=3 19759 B13R1.3768 CN(C)C(=O)c1cccc(c1F)O 271570a_203496583355_100014069087 [0,3,0,0,0,0|0,0,0]=3 19760 B13R1.3768 CN(C)C(=O)c1cccc(c1F)O 527a_100102631434_100000037433 [0,3,0,0,0,0|0,0,0]=3 19761 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Br 11a_100102631434_100000688019 [0,3,0,0,0,0|0,0,0]=3 19762 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Br 1626a_100102631434_100000688019 [0,3,0,0,0,0|0,0,0]=3 19763 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Br 240690a_100102631434_100000688019 [0,3,0,0,0,0|0,0,0]=3 19764 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Br 527a_100102631434_100000688019 [0,3,0,0,0,0|0,0,0]=3 19765 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Cl 11a_100102631434_100010176784 [0,3,0,0,0,0|0,0,0]=3 19766 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Cl 1626a_100102631434_100010176784 [0,3,0,0,0,0|0,0,0]=3 19767 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Cl 240690a_100102631434_100010176784 [0,3,0,0,0,0|0,0,0]=3 19768 B13R1.3768 CN(C)C(=O)c1cccc(c1I)Cl 527a_100102631434_100010176784 [0,3,0,0,0,0|0,0,0]=3 19769 B13R1.3768 CN(C)C(=O)c1cccc(c1I)F 11a_100102631434_100000690930 [0,3,0,0,0,0|0,0,0]=3 19770 B13R1.3768 CN(C)C(=O)c1cccc(c1I)F 1626a_100102631434_100000690930 [0,3,0,0,0,0|0,0,0]=3 19771 B13R1.3768 CN(C)C(=O)c1cccc(c1I)F 240690a_100102631434_100000690930 [0,3,0,0,0,0|0,0,0]=3 19772 B13R1.3768 CN(C)C(=O)c1cccc(c1I)F 527a_100102631434_100000690930 [0,3,0,0,0,0|0,0,0]=3 19773 B13R1.3768 CN(C)C(=O)c1cccc(c1I)O 527a_100102631434_100010084636 [0,3,0,0,0,0|0,0,0]=3 19774 B13R1.3768 CN(C)C(=O)c1cccc(c1O)Br 240690a_100102631434_100000752940 [0,3,0,0,0,0|0,0,0]=3 19775 B13R1.3768 CN(C)C(=O)c1cccc(c1O)Br 527a_100102631434_100000752940 [0,3,0,0,0,0|0,0,0]=3 19776 B13R1.3768 CN(C)C(=O)c1cccc(c1O)Cl 240690a_100102631434_100000742801 [0,3,0,0,0,0|0,0,0]=3 19777 B13R1.3768 CN(C)C(=O)c1cccc(c1O)Cl 527a_100102631434_100000742801 [0,3,0,0,0,0|0,0,0]=3 19778 B13R1.3768 CN(C)C(=O)c1cccc(c1O)F 240690a_100102631434_100011217230 [0,3,0,0,0,0|0,0,0]=3 19779 B13R1.3768 CN(C)C(=O)c1cccc(c1O)F 527a_100102631434_100011217230 [0,3,0,0,0,0|0,0,0]=3 19780 B13R1.3768 CN(C)C(=O)c1cccc(c1O)O 527a_100102631434_100000690420 [0,3,0,0,0,0|0,0,0]=3 19781 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)Br 1458a_100000760464_100000210206 [0,3,0,0,0,0|1,0,0]=4 19782 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)Cl 1458a_100000690184_100000210206 [0,3,0,0,0,0|1,0,0]=4 19783 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)F 1458a_100011218272_100000210206 [0,3,0,0,0,0|1,0,0]=4 19784 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)I 1458a_100000751865_100000210206 [0,3,0,0,0,0|1,0,0]=4 19785 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)O 1458a_100000766327_100000210206 [0,3,0,0,0,0|1,0,0]=4 19786 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Br 11a_100102631434_100000760464 [0,3,0,0,0,0|0,0,0]=3 19787 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Br 1626a_100102631434_100000760464 [0,3,0,0,0,0|0,0,0]=3 19788 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Br 240690a_100102631434_100000760464 [0,3,0,0,0,0|0,0,0]=3 19789 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Br 527a_100102631434_100000760464 [0,3,0,0,0,0|0,0,0]=3 19790 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Cl 11a_100102631434_100000690184 [0,3,0,0,0,0|0,0,0]=3 19791 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Cl 1626a_100102631434_100000690184 [0,3,0,0,0,0|0,0,0]=3 19792 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Cl 240690a_100102631434_100000690184 [0,3,0,0,0,0|0,0,0]=3 19793 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)Cl 527a_100102631434_100000690184 [0,3,0,0,0,0|0,0,0]=3 19794 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)F 11a_100102631434_100011218272 [0,3,0,0,0,0|0,0,0]=3 19795 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)F 1626a_100102631434_100011218272 [0,3,0,0,0,0|0,0,0]=3 19796 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)F 240690a_100102631434_100011218272 [0,3,0,0,0,0|0,0,0]=3 19797 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)F 527a_100102631434_100011218272 [0,3,0,0,0,0|0,0,0]=3 19798 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)I 11a_100102631434_100000751865 [0,3,0,0,0,0|0,0,0]=3 19799 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)I 1626a_100102631434_100000751865 [0,3,0,0,0,0|0,0,0]=3 19800 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)I 240690a_100102631434_100000751865 [0,3,0,0,0,0|0,0,0]=3 19801 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)I 527a_100102631434_100000751865 [0,3,0,0,0,0|0,0,0]=3 19802 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)O 240690a_100102631434_100000766327 [0,3,0,0,0,0|0,0,0]=3 19803 B13R1.3768 Cc1c(cccc1C(=O)N(C)C)O 527a_100102631434_100000766327 [0,3,0,0,0,0|0,0,0]=3 19804 B13R1.3768 Cc1cccc(c1Br)C(=O)C(C)C 1458a_100000692419_100000210206 [0,3,0,0,0,0|1,0,0]=4 19805 B13R1.3768 Cc1cccc(c1Br)C(=O)N(C)C 11a_100102631434_100000692419 [0,3,0,0,0,0|0,0,0]=3 19806 B13R1.3768 Cc1cccc(c1Br)C(=O)N(C)C 1626a_100102631434_100000692419 [0,3,0,0,0,0|0,0,0]=3 19807 B13R1.3768 Cc1cccc(c1Br)C(=O)N(C)C 240690a_100102631434_100000692419 [0,3,0,0,0,0|0,0,0]=3 19808 B13R1.3768 Cc1cccc(c1Br)C(=O)N(C)C 527a_100102631434_100000692419 [0,3,0,0,0,0|0,0,0]=3 19809 B13R1.3768 Cc1cccc(c1C)C(=O)C(C)C 1458a_100000183679_100000210206 [0,3,0,0,0,0|1,0,0]=4 19810 B13R1.3768 Cc1cccc(c1C)C(=O)N(C)C 11a_100102631434_100000183679 [0,3,0,0,0,0|0,0,0]=3 19811 B13R1.3768 Cc1cccc(c1C)C(=O)N(C)C 1626a_100102631434_100000183679 [0,3,0,0,0,0|0,0,0]=3 19812 B13R1.3768 Cc1cccc(c1C)C(=O)N(C)C 240690a_100102631434_100000183679 [0,3,0,0,0,0|0,0,0]=3 19813 B13R1.3768 Cc1cccc(c1C)C(=O)N(C)C 527a_100102631434_100000183679 [0,3,0,0,0,0|0,0,0]=3 19814 B13R1.3768 Cc1cccc(c1Cl)C(=O)C(C)C 1458a_100000693142_100000210206 [0,3,0,0,0,0|1,0,0]=4 19815 B13R1.3768 Cc1cccc(c1Cl)C(=O)N(C)C 11a_100102631434_100000693142 [0,3,0,0,0,0|0,0,0]=3 19816 B13R1.3768 Cc1cccc(c1Cl)C(=O)N(C)C 1626a_100102631434_100000693142 [0,3,0,0,0,0|0,0,0]=3 19817 B13R1.3768 Cc1cccc(c1Cl)C(=O)N(C)C 240690a_100102631434_100000693142 [0,3,0,0,0,0|0,0,0]=3 19818 B13R1.3768 Cc1cccc(c1Cl)C(=O)N(C)C 527a_100102631434_100000693142 [0,3,0,0,0,0|0,0,0]=3 19819 B13R1.3768 Cc1cccc(c1F)C(=O)C(C)C 1458a_100000766181_100000210206 [0,3,0,0,0,0|1,0,0]=4 19820 B13R1.3768 Cc1cccc(c1F)C(=O)N(C)C 11a_100102631434_100000766181 [0,3,0,0,0,0|0,0,0]=3 19821 B13R1.3768 Cc1cccc(c1F)C(=O)N(C)C 1626a_100102631434_100000766181 [0,3,0,0,0,0|0,0,0]=3 19822 B13R1.3768 Cc1cccc(c1F)C(=O)N(C)C 240690a_100102631434_100000766181 [0,3,0,0,0,0|0,0,0]=3 19823 B13R1.3768 Cc1cccc(c1F)C(=O)N(C)C 527a_100102631434_100000766181 [0,3,0,0,0,0|0,0,0]=3 19824 B13R1.3768 Cc1cccc(c1I)C(=O)C(C)C 1458a_100000739377_100000210206 [0,3,0,0,0,0|1,0,0]=4 19825 B13R1.3768 Cc1cccc(c1I)C(=O)N(C)C 11a_100102631434_100000739377 [0,3,0,0,0,0|0,0,0]=3 19826 B13R1.3768 Cc1cccc(c1I)C(=O)N(C)C 1626a_100102631434_100000739377 [0,3,0,0,0,0|0,0,0]=3 19827 B13R1.3768 Cc1cccc(c1I)C(=O)N(C)C 240690a_100102631434_100000739377 [0,3,0,0,0,0|0,0,0]=3 19828 B13R1.3768 Cc1cccc(c1I)C(=O)N(C)C 527a_100102631434_100000739377 [0,3,0,0,0,0|0,0,0]=3 19829 B13R1.3768 Cc1cccc(c1O)C(=O)C(C)C 1458a_100000183896_100000210206 [0,3,0,0,0,0|1,0,0]=4 19830 B13R1.3768 Cc1cccc(c1O)C(=O)N(C)C 240690a_100102631434_100000183896 [0,3,0,0,0,0|0,0,0]=3 19831 B13R1.3768 Cc1cccc(c1O)C(=O)N(C)C 527a_100102631434_100000183896 [0,3,0,0,0,0|0,0,0]=3 19832 B13R1.4789 CCC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_100000210202 [0,3,0,0,0,0|1,0,0]=4 19833 B13R1.4789 CCC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_100000210202 [0,3,0,0,0,0|1,0,0]=4 19834 B13R1.4789 CCC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_100000210202 [0,3,0,0,0,0|1,0,0]=4 19835 B13R1.4789 CCC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_100000210202 [0,3,0,0,0,0|1,0,0]=4 19836 B13R1.4789 CCC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_100000210202 [0,3,0,0,0,0|1,0,0]=4 19837 B13R1.4789 CCC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_100000210202 [0,3,0,0,0,0|1,0,0]=4 19838 B13R1.4789 CCC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_100000210202 [0,3,0,0,0,0|1,0,0]=4 19839 B13R1.4789 CCC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_100000210202 [0,3,0,0,0,0|1,0,0]=4 19840 B13R1.4789 CCC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_100000210202 [0,3,0,0,0,0|1,0,0]=4 19841 B13R1.4789 CCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210202 [0,3,0,0,0,0|1,0,0]=4 19842 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_100000210202 [0,3,0,0,0,0|1,0,0]=4 19843 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_100000210202 [0,3,0,0,0,0|1,0,0]=4 19844 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_100000210202 [0,3,0,0,0,0|1,0,0]=4 19845 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_100000210202 [0,3,0,0,0,0|1,0,0]=4 19846 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_100000210202 [0,3,0,0,0,0|1,0,0]=4 19847 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_100000210202 [0,3,0,0,0,0|1,0,0]=4 19848 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_100000210202 [0,3,0,0,0,0|1,0,0]=4 19849 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_100000210202 [0,3,0,0,0,0|1,0,0]=4 19850 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_100000210202 [0,3,0,0,0,0|1,0,0]=4 19851 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_100000210202 [0,3,0,0,0,0|1,0,0]=4 19852 B13R1.4789 CCC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_100000210202 [0,3,0,0,0,0|1,0,0]=4 19853 B13R1.4789 CCC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_100000210202 [0,3,0,0,0,0|1,0,0]=4 19854 B13R1.4789 CCC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000210202 [0,3,0,0,0,0|1,0,0]=4 19855 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_100000210202 [0,3,0,0,0,0|1,0,0]=4 19856 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_100000210202 [0,3,0,0,0,0|1,0,0]=4 19857 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_100000210202 [0,3,0,0,0,0|1,0,0]=4 19858 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_100000210202 [0,3,0,0,0,0|1,0,0]=4 19859 B13R1.4789 CCC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_100000210202 [0,3,0,0,0,0|1,0,0]=4 19860 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210202 [0,3,0,0,0,0|1,0,0]=4 19861 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210202 [0,3,0,0,0,0|1,0,0]=4 19862 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000210202 [0,3,0,0,0,0|1,0,0]=4 19863 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000210202 [0,3,0,0,0,0|1,0,0]=4 19864 B13R1.4789 CCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210202 [0,3,0,0,0,0|1,0,0]=4 19865 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210202 [0,3,0,0,0,0|1,0,0]=4 19866 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000210202 [0,3,0,0,0,0|1,0,0]=4 19867 B13R1.4789 CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210202 [0,3,0,0,0,0|1,0,0]=4 19868 B13R1.4789 CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210202 [0,3,0,0,0,0|1,0,0]=4 19869 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 11a_106832991635_200012920551 [0,3,0,0,0,0|0,0,0]=3 19870 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 1626a_100102657272_200012920551 [0,3,0,0,0,0|0,0,0]=3 19871 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 240690a_100102657272_200012920551 [0,3,0,0,0,0|0,0,0]=3 19872 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 527a_100102657272_200012920551 [0,3,0,0,0,0|0,0,0]=3 19873 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 11a_106832991635_200000701928 [0,3,0,0,0,0|0,0,0]=3 19874 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 1626a_100102657272_200000701928 [0,3,0,0,0,0|0,0,0]=3 19875 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 240690a_100102657272_200000701928 [0,3,0,0,0,0|0,0,0]=3 19876 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 527a_100102657272_200000701928 [0,3,0,0,0,0|0,0,0]=3 19877 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 11a_106832991635_100010209673 [0,3,0,0,0,0|0,0,0]=3 19878 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 1626a_100102657272_100010209673 [0,3,0,0,0,0|0,0,0]=3 19879 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 240690a_100102657272_100010209673 [0,3,0,0,0,0|0,0,0]=3 19880 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 527a_100102657272_100010209673 [0,3,0,0,0,0|0,0,0]=3 19881 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 11a_106832991635_100012356187 [0,3,0,0,0,0|0,0,0]=3 19882 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 240690a_100102657272_100012356187 [0,3,0,0,0,0|0,0,0]=3 19883 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 527a_100102657272_100012356187 [0,3,0,0,0,0|0,0,0]=3 19884 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 11a_106832991635_100012347597 [0,3,0,0,0,0|0,0,0]=3 19885 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 1626a_100102657272_100012347597 [0,3,0,0,0,0|0,0,0]=3 19886 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 240690a_100102657272_100012347597 [0,3,0,0,0,0|0,0,0]=3 19887 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 527a_100102657272_100012347597 [0,3,0,0,0,0|0,0,0]=3 19888 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 11a_106832991635_100012920495 [0,3,0,0,0,0|0,0,0]=3 19889 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 1626a_100102657272_100012920495 [0,3,0,0,0,0|0,0,0]=3 19890 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 240690a_100102657272_100012920495 [0,3,0,0,0,0|0,0,0]=3 19891 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 527a_100102657272_100012920495 [0,3,0,0,0,0|0,0,0]=3 19892 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 11a_106832991635_100012921640 [0,3,0,0,0,0|0,0,0]=3 19893 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 1626a_100102657272_100012921640 [0,3,0,0,0,0|0,0,0]=3 19894 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 240690a_100102657272_100012921640 [0,3,0,0,0,0|0,0,0]=3 19895 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 527a_100102657272_100012921640 [0,3,0,0,0,0|0,0,0]=3 19896 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 11a_106832991635_100012177191 [0,3,0,0,0,0|0,0,0]=3 19897 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 1626a_100102657272_100012177191 [0,3,0,0,0,0|0,0,0]=3 19898 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 240690a_100102657272_100012177191 [0,3,0,0,0,0|0,0,0]=3 19899 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 527a_100102657272_100012177191 [0,3,0,0,0,0|0,0,0]=3 19900 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 11a_106832991635_100010768523 [0,3,0,0,0,0|0,0,0]=3 19901 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 1626a_100102657272_100010768523 [0,3,0,0,0,0|0,0,0]=3 19902 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 240690a_100102657272_100010768523 [0,3,0,0,0,0|0,0,0]=3 19903 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 527a_100102657272_100010768523 [0,3,0,0,0,0|0,0,0]=3 19904 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 240690a_100102657272_100011101721 [0,3,0,0,0,0|0,0,0]=3 19905 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 527a_100102657272_100011101721 [0,3,0,0,0,0|0,0,0]=3 19906 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 11a_106832991635_200012920481 [0,3,0,0,0,0|0,0,0]=3 19907 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 1626a_100102657272_200012920481 [0,3,0,0,0,0|0,0,0]=3 19908 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 240690a_100102657272_200012920481 [0,3,0,0,0,0|0,0,0]=3 19909 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 527a_100102657272_200012920481 [0,3,0,0,0,0|0,0,0]=3 19910 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 11a_106832991635_100011105905 [0,3,0,0,0,0|0,0,0]=3 19911 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 1626a_100102657272_100011105905 [0,3,0,0,0,0|0,0,0]=3 19912 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 240690a_100102657272_100011105905 [0,3,0,0,0,0|0,0,0]=3 19913 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 527a_100102657272_100011105905 [0,3,0,0,0,0|0,0,0]=3 19914 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 11a_106832991635_200010768536 [0,3,0,0,0,0|0,0,0]=3 19915 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 1626a_100102657272_200010768536 [0,3,0,0,0,0|0,0,0]=3 19916 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 240690a_100102657272_200010768536 [0,3,0,0,0,0|0,0,0]=3 19917 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 527a_100102657272_200010768536 [0,3,0,0,0,0|0,0,0]=3 19918 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 11a_106832991635_100011215521 [0,3,0,0,0,0|0,0,0]=3 19919 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 1626a_100102657272_100011215521 [0,3,0,0,0,0|0,0,0]=3 19920 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 240690a_100102657272_100011215521 [0,3,0,0,0,0|0,0,0]=3 19921 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 527a_100102657272_100011215521 [0,3,0,0,0,0|0,0,0]=3 19922 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 11a_106832991635_200010244589 [0,3,0,0,0,0|0,0,0]=3 19923 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 1626a_100102657272_200010244589 [0,3,0,0,0,0|0,0,0]=3 19924 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 240690a_100102657272_200010244589 [0,3,0,0,0,0|0,0,0]=3 19925 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 527a_100102657272_200010244589 [0,3,0,0,0,0|0,0,0]=3 19926 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 11a_106832991635_200012352169 [0,3,0,0,0,0|0,0,0]=3 19927 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 1626a_100102657272_200012352169 [0,3,0,0,0,0|0,0,0]=3 19928 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 240690a_100102657272_200012352169 [0,3,0,0,0,0|0,0,0]=3 19929 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 527a_100102657272_200012352169 [0,3,0,0,0,0|0,0,0]=3 19930 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 11a_106832991635_100009888511 [0,3,0,0,0,0|0,0,0]=3 19931 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 1626a_100102657272_100009888511 [0,3,0,0,0,0|0,0,0]=3 19932 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 240690a_100102657272_100009888511 [0,3,0,0,0,0|0,0,0]=3 19933 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 527a_100102657272_100009888511 [0,3,0,0,0,0|0,0,0]=3 19934 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 11a_106832991635_100009996753 [0,3,0,0,0,0|0,0,0]=3 19935 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 1626a_100102657272_100009996753 [0,3,0,0,0,0|0,0,0]=3 19936 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 240690a_100102657272_100009996753 [0,3,0,0,0,0|0,0,0]=3 19937 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 527a_100102657272_100009996753 [0,3,0,0,0,0|0,0,0]=3 19938 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 11a_106832991635_100000720295 [0,3,0,0,0,0|0,0,0]=3 19939 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 1626a_100102657272_100000720295 [0,3,0,0,0,0|0,0,0]=3 19940 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 240690a_100102657272_100000720295 [0,3,0,0,0,0|0,0,0]=3 19941 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 527a_100102657272_100000720295 [0,3,0,0,0,0|0,0,0]=3 19942 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 11a_106832991635_100012920464 [0,3,0,0,0,0|0,0,0]=3 19943 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 1626a_100102657272_100012920464 [0,3,0,0,0,0|0,0,0]=3 19944 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 240690a_100102657272_100012920464 [0,3,0,0,0,0|0,0,0]=3 19945 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 527a_100102657272_100012920464 [0,3,0,0,0,0|0,0,0]=3 19946 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 11a_106832991635_100012928937 [0,3,0,0,0,0|0,0,0]=3 19947 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 1626a_100102657272_100012928937 [0,3,0,0,0,0|0,0,0]=3 19948 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 240690a_100102657272_100012928937 [0,3,0,0,0,0|0,0,0]=3 19949 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 11a_106832991635_100012920557 [0,3,0,0,0,0|0,0,0]=3 19950 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 1626a_100102657272_100012920557 [0,3,0,0,0,0|0,0,0]=3 19951 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 240690a_100102657272_100012920557 [0,3,0,0,0,0|0,0,0]=3 19952 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 11a_106832991635_100012920558 [0,3,0,0,0,0|0,0,0]=3 19953 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 1626a_100102657272_100012920558 [0,3,0,0,0,0|0,0,0]=3 19954 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 240690a_100102657272_100012920558 [0,3,0,0,0,0|0,0,0]=3 19955 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 11a_106832991635_100012349847 [0,3,0,0,0,0|0,0,0]=3 19956 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 1626a_100102657272_100012349847 [0,3,0,0,0,0|0,0,0]=3 19957 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 240690a_100102657272_100012349847 [0,3,0,0,0,0|0,0,0]=3 19958 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 527a_100102657272_100012349847 [0,3,0,0,0,0|0,0,0]=3 19959 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 11a_106832991635_100000094381 [0,3,0,0,0,0|0,0,0]=3 19960 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 1626a_100102657272_100000094381 [0,3,0,0,0,0|0,0,0]=3 19961 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 240690a_100102657272_100000094381 [0,3,0,0,0,0|0,0,0]=3 19962 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 527a_100102657272_100000094381 [0,3,0,0,0,0|0,0,0]=3 19963 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 11a_106832991635_100011217470 [0,3,0,0,0,0|0,0,0]=3 19964 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 1626a_100102657272_100011217470 [0,3,0,0,0,0|0,0,0]=3 19965 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 240690a_100102657272_100011217470 [0,3,0,0,0,0|0,0,0]=3 19966 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 527a_100102657272_100011217470 [0,3,0,0,0,0|0,0,0]=3 19967 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 11a_106832991635_100012344719 [0,3,0,0,0,0|0,0,0]=3 19968 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 1626a_100102657272_100012344719 [0,3,0,0,0,0|0,0,0]=3 19969 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 240690a_100102657272_100012344719 [0,3,0,0,0,0|0,0,0]=3 19970 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 527a_100102657272_100012344719 [0,3,0,0,0,0|0,0,0]=3 19971 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 11a_106832991635_100000211575 [0,3,0,0,0,0|0,0,0]=3 19972 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 1626a_100102657272_100000211575 [0,3,0,0,0,0|0,0,0]=3 19973 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 240690a_100102657272_100000211575 [0,3,0,0,0,0|0,0,0]=3 19974 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 527a_100102657272_100000211575 [0,3,0,0,0,0|0,0,0]=3 19975 B13R1.4789 CNC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100010284104 [0,3,0,0,0,0|0,0,0]=3 19976 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 240690a_100102657272_100000212120 [0,3,0,0,0,0|0,0,0]=3 19977 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 527a_100102657272_100000212120 [0,3,0,0,0,0|0,0,0]=3 19978 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100102657272_100000765379 [0,3,0,0,0,0|0,0,0]=3 19979 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 527a_100102657272_100000765379 [0,3,0,0,0,0|0,0,0]=3 19980 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Br 240690a_100102657272_100011825902 [0,3,0,0,0,0|0,0,0]=3 19981 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 240690a_100102657272_100011255218 [0,3,0,0,0,0|0,0,0]=3 19982 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 527a_100102657272_100011255218 [0,3,0,0,0,0|0,0,0]=3 19983 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100102657272_100000215963 [0,3,0,0,0,0|0,0,0]=3 19984 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100102657272_100000215963 [0,3,0,0,0,0|0,0,0]=3 19985 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 240690a_100102657272_100011255233 [0,3,0,0,0,0|0,0,0]=3 19986 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 527a_100102657272_100011255233 [0,3,0,0,0,0|0,0,0]=3 19987 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 240690a_100102657272_100011255242 [0,3,0,0,0,0|0,0,0]=3 19988 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 527a_100102657272_100011255242 [0,3,0,0,0,0|0,0,0]=3 19989 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 1626a_100102657272_100000748652 [0,3,0,0,0,0|0,0,0]=3 19990 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 240690a_100102657272_100000748652 [0,3,0,0,0,0|0,0,0]=3 19991 B13R1.4789 COC(=O)c1cc(cc(c1C)Br)O 271570a_203496583355_100012569200 [0,3,0,0,0,0|1,0,0]=4 19992 B13R1.4789 COC(=O)c1cc(cc(c1C)F)O 271570a_203496583355_100015527428 [0,3,0,0,0,0|1,0,0]=4 19993 B13R1.4789 COC(=O)c1cc(cc(c1C)N)O 271570a_203496583355_100012257200 [0,3,0,0,0,0|1,0,0]=4 19994 B13R1.4789 COC(=O)c1cc(cc(c1C)O)F 271570a_203496583355_100012347598 [0,3,0,0,0,0|1,0,0]=4 19995 B13R1.4789 COC(=O)c1cc(cc(c1C)O)O 271570a_203496583355_200011012443 [0,3,0,0,0,0|1,0,0]=4 19996 B13R1.4789 COC(=O)c1cc(cc(c1F)C)O 271570a_203496583355_200012928940 [0,3,0,0,0,0|1,0,0]=4 19997 B13R1.4789 COC(=O)c1cc(cc(c1F)F)O 271570a_203496583355_100012362532 [0,3,0,0,0,0|1,0,0]=4 19998 B13R1.4789 COC(=O)c1cc(cc(c1F)N)O 271570a_203496583355_100011794250 [0,3,0,0,0,0|1,0,0]=4 19999 B13R1.4789 COC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100011356660 [0,3,0,0,0,0|1,0,0]=4 20000 B13R1.4789 COC(=O)c1cc(cc(c1N)N)O 271570a_203496583355_100010127340 [0,3,0,0,0,0|1,0,0]=4 20001 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Br 271570a_203496583355_100010726126 [0,3,0,0,0,0|1,0,0]=4 20002 B13R1.4789 COC(=O)c1cc(cc(c1N)O)C 271570a_203496583355_100000216481 [0,3,0,0,0,0|1,0,0]=4 20003 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Cl 271570a_203496583355_100000043629 [0,3,0,0,0,0|1,0,0]=4 20004 B13R1.4789 COC(=O)c1cc(cc(c1O)C)F 271570a_203496583355_100016049047 [0,3,0,0,0,0|1,0,0]=4 20005 B13R1.4789 COC(=O)c1cc(cc(c1O)F)F 271570a_203496583355_100010155431 [0,3,0,0,0,0|1,0,0]=4 20006 B13R1.4789 COC(=O)c1cc(cc(c1O)N)F 271570a_203496583355_100011794234 [0,3,0,0,0,0|1,0,0]=4 20007 B13R1.4789 COC(=O)c1cc(cc(c1O)O)Br 271570a_203496583355_100009996593 [0,3,0,0,0,0|1,0,0]=4 20008 B13R1.642 C#Cc1cccc(c1)C(=O)C(C)C 1458a_100011997762_100000210206 [0,3,0,0,0,0|1,0,0]=4 20009 B13R1.642 C#Cc1cccc(c1)C(=O)N(C)C 11a_100102631434_100011997762 [0,3,0,0,0,0|0,0,0]=3 20010 B13R1.642 C#Cc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100011997762 [0,3,0,0,0,0|0,0,0]=3 20011 B13R1.642 C#Cc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100011997762 [0,3,0,0,0,0|0,0,0]=3 20012 B13R1.642 C#Cc1cccc(c1)C(=O)N(C)C 527a_100102631434_100011997762 [0,3,0,0,0,0|0,0,0]=3 20013 B13R1.642 C=Cc1cc(ccn1)C(=O)N(C)C 271570a_100011290941_100000229821 [0,3,0,0,0,0|1,0,0]=4 20014 B13R1.642 C=Cc1cccc(c1)C(=O)C(C)C 1458a_100011215009_100000210206 [0,3,0,0,0,0|1,0,0]=4 20015 B13R1.642 C=Cc1cccc(c1)C(=O)C(C)C 271570a_100011290941_100011350656 [0,3,0,0,0,0|1,0,0]=4 20016 B13R1.642 C=Cc1cccc(c1)C(=O)N(C)C 11a_100102631434_100011215009 [0,3,0,0,0,0|0,0,0]=3 20017 B13R1.642 C=Cc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100011215009 [0,3,0,0,0,0|0,0,0]=3 20018 B13R1.642 C=Cc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100011215009 [0,3,0,0,0,0|0,0,0]=3 20019 B13R1.642 C=Cc1cccc(c1)C(=O)N(C)C 271570a_100011290941_100000159571 [0,3,0,0,0,0|0,0,0]=3 20020 B13R1.642 C=Cc1cccc(c1)C(=O)N(C)C 527a_100102631434_100011215009 [0,3,0,0,0,0|0,0,0]=3 20021 B13R1.642 C=Cc1ccnc(c1)C(=O)N(C)C 271570a_100011290941_200000198538 [0,3,0,0,0,0|1,0,0]=4 20022 B13R1.642 C=Cc1cncc(c1)C(=O)N(C)C 271570a_100011290941_200000159598 [0,3,0,0,0,0|1,0,0]=4 20023 B13R1.642 CC(C)C(=O)c1cccc(c1)C#N 1458a_100000183950_100000210206 [0,3,0,0,0,0|1,0,0]=4 20024 B13R1.642 CC(C)C(=O)c1cccc(c1)CO 1458a_100000746274_100000210206 [0,3,0,0,0,0|1,0,0]=4 20025 B13R1.642 CC(C)C(=O)c1cccc(c1)S[13CH3] 62a_100011350656_200025704644 [0,3,0,0,0,0|1,0,0]=4 20026 B13R1.642 CC(C)C(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100011350656 [0,3,0,0,0,0|1,0,0]=4 20027 B13R1.642 CCc1cccc(c1)C(=O)C(C)C 1458a_100011933908_100000210206 [0,3,0,0,0,0|1,0,0]=4 20028 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 11a_100102631434_100011933908 [0,3,0,0,0,0|0,0,0]=3 20029 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100011933908 [0,3,0,0,0,0|0,0,0]=3 20030 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100011933908 [0,3,0,0,0,0|0,0,0]=3 20031 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 527a_100102631434_100011933908 [0,3,0,0,0,0|0,0,0]=3 20032 B13R1.642 CN(C)C(=O)c1cc(ccn1)S[13CH3] 62a_200000198538_200025704644 [0,3,0,0,0,0|1,0,0]=4 20033 B13R1.642 CN(C)C(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_200000198538 [0,3,0,0,0,0|1,0,0]=4 20034 B13R1.642 CN(C)C(=O)c1cccc(c1)C#N 11a_100102631434_100000183950 [0,3,0,0,0,0|0,0,0]=3 20035 B13R1.642 CN(C)C(=O)c1cccc(c1)C#N 1626a_100102631434_100000183950 [0,3,0,0,0,0|0,0,0]=3 20036 B13R1.642 CN(C)C(=O)c1cccc(c1)C#N 240690a_100102631434_100000183950 [0,3,0,0,0,0|0,0,0]=3 20037 B13R1.642 CN(C)C(=O)c1cccc(c1)C#N 527a_100102631434_100000183950 [0,3,0,0,0,0|0,0,0]=3 20038 B13R1.642 CN(C)C(=O)c1cccc(c1)CO 240690a_100102631434_100000746274 [0,3,0,0,0,0|0,0,0]=3 20039 B13R1.642 CN(C)C(=O)c1cccc(c1)N[13CH3] 34a_100000246196_200025704644 [0,3,0,0,0,0|0,0,0]=3 20040 B13R1.642 CN(C)C(=O)c1cccc(c1)N[13CH3] 7a_100000246196_200025704644 [0,3,0,0,0,0|0,0,0]=3 20041 B13R1.642 CN(C)C(=O)c1cccc(c1)O[13CH3] 34a_100000159535_200025704644 [0,3,0,0,0,0|0,0,0]=3 20042 B13R1.642 CN(C)C(=O)c1cccc(c1)O[13CH3] 7a_100000159535_200025704644 [0,3,0,0,0,0|0,0,0]=3 20043 B13R1.642 CN(C)C(=O)c1cccc(c1)S[13CH3] 62a_100000159571_200025704644 [0,3,0,0,0,0|0,0,0]=3 20044 B13R1.642 CN(C)C(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000159571 [0,3,0,0,0,0|0,0,0]=3 20045 B13R1.642 CN(C)C(=O)c1ccnc(c1)S[13CH3] 62a_100000229821_200025704644 [0,3,0,0,0,0|1,0,0]=4 20046 B13R1.642 CN(C)C(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000229821 [0,3,0,0,0,0|1,0,0]=4 20047 B13R1.642 CN(C)C(=O)c1cncc(c1)S[13CH3] 62a_200000159598_200025704644 [0,3,0,0,0,0|1,0,0]=4 20048 B13R1.642 CN(C)C(=O)c1cncc(c1)S[13CH3] 62a_200025704644_200000159598 [0,3,0,0,0,0|1,0,0]=4 20049 B13R1.642 CNc1cccc(c1)C(=O)C(C)C 27a_100102657272_100011350656 [0,3,0,0,0,0|1,0,0]=4 20050 B13R1.642 CNc1cccc(c1)C(=O)N(C)C 34a_100000246196_200000210301 [0,3,0,0,0,0|0,0,0]=3 20051 B13R1.642 CNc1cccc(c1)C(=O)N(C)C 7a_100000246196_200000210301 [0,3,0,0,0,0|0,0,0]=3 20052 B13R1.642 CNc1ccnc(c1)C(=O)N(C)C 27a_100102657272_200000198538 [0,3,0,0,0,0|1,0,0]=4 20053 B13R1.642 COc1cccc(c1)C(=O)C(C)C 1458a_100000188888_100000210206 [0,3,0,0,0,0|1,0,0]=4 20054 B13R1.642 COc1cccc(c1)C(=O)N(C)C 11a_100102631434_100000188888 [0,3,0,0,0,0|0,0,0]=3 20055 B13R1.642 COc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100000188888 [0,3,0,0,0,0|0,0,0]=3 20056 B13R1.642 COc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100000188888 [0,3,0,0,0,0|0,0,0]=3 20057 B13R1.642 COc1cccc(c1)C(=O)N(C)C 34a_100000159535_200000210301 [0,3,0,0,0,0|0,0,0]=3 20058 B13R1.642 COc1cccc(c1)C(=O)N(C)C 527a_100102631434_100000188888 [0,3,0,0,0,0|0,0,0]=3 20059 B13R1.642 COc1cccc(c1)C(=O)N(C)C 7a_100000159535_200000210301 [0,3,0,0,0,0|0,0,0]=3 20060 B13R1.642 CSc1cc(ccn1)C(=O)N(C)C 62a_100000229821_200000210301 [0,3,0,0,0,0|1,0,0]=4 20061 B13R1.642 CSc1cc(ccn1)C(=O)N(C)C 62a_200000210301_100000229821 [0,3,0,0,0,0|1,0,0]=4 20062 B13R1.642 CSc1cccc(c1)C(=O)C(C)C 1458a_100011217804_100000210206 [0,3,0,0,0,0|1,0,0]=4 20063 B13R1.642 CSc1cccc(c1)C(=O)C(C)C 62a_100011350656_200000210301 [0,3,0,0,0,0|1,0,0]=4 20064 B13R1.642 CSc1cccc(c1)C(=O)C(C)C 62a_200000210301_100011350656 [0,3,0,0,0,0|1,0,0]=4 20065 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 11a_100102631434_100011217804 [0,3,0,0,0,0|0,0,0]=3 20066 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100011217804 [0,3,0,0,0,0|0,0,0]=3 20067 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100011217804 [0,3,0,0,0,0|0,0,0]=3 20068 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 527a_100102631434_100011217804 [0,3,0,0,0,0|0,0,0]=3 20069 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 62a_100000159571_200000210301 [0,3,0,0,0,0|0,0,0]=3 20070 B13R1.642 CSc1cccc(c1)C(=O)N(C)C 62a_200000210301_100000159571 [0,3,0,0,0,0|0,0,0]=3 20071 B13R1.642 CSc1ccnc(c1)C(=O)N(C)C 62a_200000198538_200000210301 [0,3,0,0,0,0|1,0,0]=4 20072 B13R1.642 CSc1ccnc(c1)C(=O)N(C)C 62a_200000210301_200000198538 [0,3,0,0,0,0|1,0,0]=4 20073 B13R1.642 CSc1cncc(c1)C(=O)N(C)C 62a_200000159598_200000210301 [0,3,0,0,0,0|1,0,0]=4 20074 B13R1.642 CSc1cncc(c1)C(=O)N(C)C 62a_200000210301_200000159598 [0,3,0,0,0,0|1,0,0]=4 20075 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210206 [0,3,0,0,0,0|1,0,0]=4 20076 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210206 [0,3,0,0,0,0|1,0,0]=4 20077 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210206 [0,3,0,0,0,0|1,0,0]=4 20078 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210206 [0,3,0,0,0,0|1,0,0]=4 20079 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210206 [0,3,0,0,0,0|1,0,0]=4 20080 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210206 [0,3,0,0,0,0|1,0,0]=4 20081 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210206 [0,3,0,0,0,0|1,0,0]=4 20082 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210206 [0,3,0,0,0,0|1,0,0]=4 20083 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210206 [0,3,0,0,0,0|1,0,0]=4 20084 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210206 [0,3,0,0,0,0|1,0,0]=4 20085 B13R1.897 CC(C)C(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210206 [0,3,0,0,0,0|1,0,0]=4 20086 B13R1.897 CC(C)C(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210206 [0,3,0,0,0,0|1,0,0]=4 20087 B13R1.897 CC(C)C(=O)c1cc(ccc1F)F 1458a_100000198512_100000210206 [0,3,0,0,0,0|1,0,0]=4 20088 B13R1.897 CC(C)C(=O)c1cc(ccc1F)I 1458a_100000688014_100000210206 [0,3,0,0,0,0|1,0,0]=4 20089 B13R1.897 CC(C)C(=O)c1cc(ccc1F)O 1458a_100000037260_100000210206 [0,3,0,0,0,0|1,0,0]=4 20090 B13R1.897 CC(C)C(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210206 [0,3,0,0,0,0|1,0,0]=4 20091 B13R1.897 CC(C)C(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210206 [0,3,0,0,0,0|1,0,0]=4 20092 B13R1.897 CC(C)C(=O)c1cc(ccc1I)F 1458a_100000748905_100000210206 [0,3,0,0,0,0|1,0,0]=4 20093 B13R1.897 CC(C)C(=O)c1cc(ccc1I)I 1458a_100000750460_100000210206 [0,3,0,0,0,0|1,0,0]=4 20094 B13R1.897 CC(C)C(=O)c1cc(ccc1I)O 1458a_200009995701_100000210206 [0,3,0,0,0,0|1,0,0]=4 20095 B13R1.897 CC(C)C(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210206 [0,3,0,0,0,0|1,0,0]=4 20096 B13R1.897 CC(C)C(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210206 [0,3,0,0,0,0|1,0,0]=4 20097 B13R1.897 CC(C)C(=O)c1cc(ccc1O)F 1458a_100000742286_100000210206 [0,3,0,0,0,0|1,0,0]=4 20098 B13R1.897 CC(C)C(=O)c1cc(ccc1O)I 1458a_100000212111_100000210206 [0,3,0,0,0,0|1,0,0]=4 20099 B13R1.897 CC(C)C(=O)c1cc(ccc1O)O 1458a_100000758025_100000210206 [0,3,0,0,0,0|1,0,0]=4 20100 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Br 11a_100102631434_100000690610 [0,3,0,0,0,0|0,0,0]=3 20101 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Br 1626a_100102631434_100000690610 [0,3,0,0,0,0|0,0,0]=3 20102 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Br 240690a_100102631434_100000690610 [0,3,0,0,0,0|0,0,0]=3 20103 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Br 527a_100102631434_100000690610 [0,3,0,0,0,0|0,0,0]=3 20104 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Cl 11a_100102631434_100000736951 [0,3,0,0,0,0|0,0,0]=3 20105 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Cl 1626a_100102631434_100000736951 [0,3,0,0,0,0|0,0,0]=3 20106 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Cl 240690a_100102631434_100000736951 [0,3,0,0,0,0|0,0,0]=3 20107 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)Cl 527a_100102631434_100000736951 [0,3,0,0,0,0|0,0,0]=3 20108 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)F 11a_100102631434_100000212315 [0,3,0,0,0,0|0,0,0]=3 20109 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)F 1626a_100102631434_100000212315 [0,3,0,0,0,0|0,0,0]=3 20110 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)F 240690a_100102631434_100000212315 [0,3,0,0,0,0|0,0,0]=3 20111 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)F 527a_100102631434_100000212315 [0,3,0,0,0,0|0,0,0]=3 20112 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)I 11a_100102631434_100000698340 [0,3,0,0,0,0|0,0,0]=3 20113 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)I 1626a_100102631434_100000698340 [0,3,0,0,0,0|0,0,0]=3 20114 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)I 240690a_100102631434_100000698340 [0,3,0,0,0,0|0,0,0]=3 20115 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)I 527a_100102631434_100000698340 [0,3,0,0,0,0|0,0,0]=3 20116 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)O 240690a_100102631434_100012352043 [0,3,0,0,0,0|0,0,0]=3 20117 B13R1.897 CN(C)C(=O)c1cc(ccc1Br)O 527a_100102631434_100012352043 [0,3,0,0,0,0|0,0,0]=3 20118 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Br 11a_100102631434_100000211212 [0,3,0,0,0,0|0,0,0]=3 20119 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Br 1626a_100102631434_100000211212 [0,3,0,0,0,0|0,0,0]=3 20120 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Br 240690a_100102631434_100000211212 [0,3,0,0,0,0|0,0,0]=3 20121 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Br 527a_100102631434_100000211212 [0,3,0,0,0,0|0,0,0]=3 20122 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Cl 11a_100102631434_100000210642 [0,3,0,0,0,0|0,0,0]=3 20123 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Cl 1626a_100102631434_100000210642 [0,3,0,0,0,0|0,0,0]=3 20124 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Cl 240690a_100102631434_100000210642 [0,3,0,0,0,0|0,0,0]=3 20125 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)Cl 527a_100102631434_100000210642 [0,3,0,0,0,0|0,0,0]=3 20126 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)F 11a_100102631434_100011219680 [0,3,0,0,0,0|0,0,0]=3 20127 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)F 1626a_100102631434_100011219680 [0,3,0,0,0,0|0,0,0]=3 20128 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)F 240690a_100102631434_100011219680 [0,3,0,0,0,0|0,0,0]=3 20129 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)F 527a_100102631434_100011219680 [0,3,0,0,0,0|0,0,0]=3 20130 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)I 11a_100102631434_100000688013 [0,3,0,0,0,0|0,0,0]=3 20131 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)I 1626a_100102631434_100000688013 [0,3,0,0,0,0|0,0,0]=3 20132 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)I 240690a_100102631434_100000688013 [0,3,0,0,0,0|0,0,0]=3 20133 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)I 527a_100102631434_100000688013 [0,3,0,0,0,0|0,0,0]=3 20134 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)O 240690a_100102631434_100000719527 [0,3,0,0,0,0|0,0,0]=3 20135 B13R1.897 CN(C)C(=O)c1cc(ccc1Cl)O 527a_100102631434_100000719527 [0,3,0,0,0,0|0,0,0]=3 20136 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Br 11a_100102631434_100000212322 [0,3,0,0,0,0|0,0,0]=3 20137 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Br 1626a_100102631434_100000212322 [0,3,0,0,0,0|0,0,0]=3 20138 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Br 240690a_100102631434_100000212322 [0,3,0,0,0,0|0,0,0]=3 20139 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Br 527a_100102631434_100000212322 [0,3,0,0,0,0|0,0,0]=3 20140 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Cl 11a_100102631434_100000214954 [0,3,0,0,0,0|0,0,0]=3 20141 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Cl 1626a_100102631434_100000214954 [0,3,0,0,0,0|0,0,0]=3 20142 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Cl 240690a_100102631434_100000214954 [0,3,0,0,0,0|0,0,0]=3 20143 B13R1.897 CN(C)C(=O)c1cc(ccc1F)Cl 527a_100102631434_100000214954 [0,3,0,0,0,0|0,0,0]=3 20144 B13R1.897 CN(C)C(=O)c1cc(ccc1F)F 11a_100102631434_100000198512 [0,3,0,0,0,0|0,0,0]=3 20145 B13R1.897 CN(C)C(=O)c1cc(ccc1F)F 1626a_100102631434_100000198512 [0,3,0,0,0,0|0,0,0]=3 20146 B13R1.897 CN(C)C(=O)c1cc(ccc1F)F 240690a_100102631434_100000198512 [0,3,0,0,0,0|0,0,0]=3 20147 B13R1.897 CN(C)C(=O)c1cc(ccc1F)F 527a_100102631434_100000198512 [0,3,0,0,0,0|0,0,0]=3 20148 B13R1.897 CN(C)C(=O)c1cc(ccc1F)I 11a_100102631434_100000688014 [0,3,0,0,0,0|0,0,0]=3 20149 B13R1.897 CN(C)C(=O)c1cc(ccc1F)I 1626a_100102631434_100000688014 [0,3,0,0,0,0|0,0,0]=3 20150 B13R1.897 CN(C)C(=O)c1cc(ccc1F)I 240690a_100102631434_100000688014 [0,3,0,0,0,0|0,0,0]=3 20151 B13R1.897 CN(C)C(=O)c1cc(ccc1F)I 527a_100102631434_100000688014 [0,3,0,0,0,0|0,0,0]=3 20152 B13R1.897 CN(C)C(=O)c1cc(ccc1F)O 240690a_100102631434_100000037260 [0,3,0,0,0,0|0,0,0]=3 20153 B13R1.897 CN(C)C(=O)c1cc(ccc1F)O 271570a_203496583355_200000159508 [0,3,0,0,0,0|0,0,0]=3 20154 B13R1.897 CN(C)C(=O)c1cc(ccc1F)O 527a_100102631434_100000037260 [0,3,0,0,0,0|0,0,0]=3 20155 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Br 11a_100102631434_100000183945 [0,3,0,0,0,0|0,0,0]=3 20156 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Br 1626a_100102631434_100000183945 [0,3,0,0,0,0|0,0,0]=3 20157 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Br 240690a_100102631434_100000183945 [0,3,0,0,0,0|0,0,0]=3 20158 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Cl 11a_100102631434_100000739379 [0,3,0,0,0,0|0,0,0]=3 20159 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Cl 1626a_100102631434_100000739379 [0,3,0,0,0,0|0,0,0]=3 20160 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Cl 240690a_100102631434_100000739379 [0,3,0,0,0,0|0,0,0]=3 20161 B13R1.897 CN(C)C(=O)c1cc(ccc1I)Cl 527a_100102631434_100000739379 [0,3,0,0,0,0|0,0,0]=3 20162 B13R1.897 CN(C)C(=O)c1cc(ccc1I)F 11a_100102631434_100000748905 [0,3,0,0,0,0|0,0,0]=3 20163 B13R1.897 CN(C)C(=O)c1cc(ccc1I)F 1626a_100102631434_100000748905 [0,3,0,0,0,0|0,0,0]=3 20164 B13R1.897 CN(C)C(=O)c1cc(ccc1I)F 240690a_100102631434_100000748905 [0,3,0,0,0,0|0,0,0]=3 20165 B13R1.897 CN(C)C(=O)c1cc(ccc1I)F 527a_100102631434_100000748905 [0,3,0,0,0,0|0,0,0]=3 20166 B13R1.897 CN(C)C(=O)c1cc(ccc1I)I 11a_100102631434_100000750460 [0,3,0,0,0,0|0,0,0]=3 20167 B13R1.897 CN(C)C(=O)c1cc(ccc1I)I 1626a_100102631434_100000750460 [0,3,0,0,0,0|0,0,0]=3 20168 B13R1.897 CN(C)C(=O)c1cc(ccc1I)I 240690a_100102631434_100000750460 [0,3,0,0,0,0|0,0,0]=3 20169 B13R1.897 CN(C)C(=O)c1cc(ccc1I)I 527a_100102631434_100000750460 [0,3,0,0,0,0|0,0,0]=3 20170 B13R1.897 CN(C)C(=O)c1cc(ccc1I)O 1626a_100102631434_200009995701 [0,3,0,0,0,0|0,0,0]=3 20171 B13R1.897 CN(C)C(=O)c1cc(ccc1I)O 240690a_100102631434_200009995701 [0,3,0,0,0,0|0,0,0]=3 20172 B13R1.897 CN(C)C(=O)c1cc(ccc1I)O 527a_100102631434_200009995701 [0,3,0,0,0,0|0,0,0]=3 20173 B13R1.897 CN(C)C(=O)c1cc(ccc1N)O 271570a_203496583355_100012355269 [0,3,0,0,0,0|0,0,0]=3 20174 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Br 1626a_100102631434_100000212140 [0,3,0,0,0,0|0,0,0]=3 20175 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Br 240690a_100102631434_100000212140 [0,3,0,0,0,0|0,0,0]=3 20176 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Br 527a_100102631434_100000212140 [0,3,0,0,0,0|0,0,0]=3 20177 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Cl 11a_100102631434_100000212143 [0,3,0,0,0,0|0,0,0]=3 20178 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Cl 1626a_100102631434_100000212143 [0,3,0,0,0,0|0,0,0]=3 20179 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Cl 240690a_100102631434_100000212143 [0,3,0,0,0,0|0,0,0]=3 20180 B13R1.897 CN(C)C(=O)c1cc(ccc1O)Cl 527a_100102631434_100000212143 [0,3,0,0,0,0|0,0,0]=3 20181 B13R1.897 CN(C)C(=O)c1cc(ccc1O)F 240690a_100102631434_100000742286 [0,3,0,0,0,0|0,0,0]=3 20182 B13R1.897 CN(C)C(=O)c1cc(ccc1O)F 271570a_203496583355_200000206186 [0,3,0,0,0,0|0,0,0]=3 20183 B13R1.897 CN(C)C(=O)c1cc(ccc1O)F 527a_100102631434_100000742286 [0,3,0,0,0,0|0,0,0]=3 20184 B13R1.897 CN(C)C(=O)c1cc(ccc1O)I 240690a_100102631434_100000212111 [0,3,0,0,0,0|0,0,0]=3 20185 B13R1.897 CN(C)C(=O)c1cc(ccc1O)I 527a_100102631434_100000212111 [0,3,0,0,0,0|0,0,0]=3 20186 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)Br 1458a_100000689033_100000210206 [0,3,0,0,0,0|1,0,0]=4 20187 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)C 1458a_100000195421_100000210206 [0,3,0,0,0,0|1,0,0]=4 20188 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)Cl 1458a_100011290873_100000210206 [0,3,0,0,0,0|1,0,0]=4 20189 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)F 1458a_100000749327_100000210206 [0,3,0,0,0,0|1,0,0]=4 20190 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)I 1458a_100000057929_100000210206 [0,3,0,0,0,0|1,0,0]=4 20191 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)O 1458a_100000229998_100000210206 [0,3,0,0,0,0|1,0,0]=4 20192 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Br 11a_100102631434_100000689033 [0,3,0,0,0,0|0,0,0]=3 20193 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Br 1626a_100102631434_100000689033 [0,3,0,0,0,0|0,0,0]=3 20194 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Br 240690a_100102631434_100000689033 [0,3,0,0,0,0|0,0,0]=3 20195 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Br 527a_100102631434_100000689033 [0,3,0,0,0,0|0,0,0]=3 20196 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)C 11a_100102631434_100000195421 [0,3,0,0,0,0|0,0,0]=3 20197 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)C 1626a_100102631434_100000195421 [0,3,0,0,0,0|0,0,0]=3 20198 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)C 240690a_100102631434_100000195421 [0,3,0,0,0,0|0,0,0]=3 20199 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)C 527a_100102631434_100000195421 [0,3,0,0,0,0|0,0,0]=3 20200 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Cl 11a_100102631434_100011290873 [0,3,0,0,0,0|0,0,0]=3 20201 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Cl 1626a_100102631434_100011290873 [0,3,0,0,0,0|0,0,0]=3 20202 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Cl 240690a_100102631434_100011290873 [0,3,0,0,0,0|0,0,0]=3 20203 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)Cl 527a_100102631434_100011290873 [0,3,0,0,0,0|0,0,0]=3 20204 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)F 11a_100102631434_100000749327 [0,3,0,0,0,0|0,0,0]=3 20205 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)F 1626a_100102631434_100000749327 [0,3,0,0,0,0|0,0,0]=3 20206 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)F 240690a_100102631434_100000749327 [0,3,0,0,0,0|0,0,0]=3 20207 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)F 527a_100102631434_100000749327 [0,3,0,0,0,0|0,0,0]=3 20208 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)I 11a_100102631434_100000057929 [0,3,0,0,0,0|0,0,0]=3 20209 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)I 1626a_100102631434_100000057929 [0,3,0,0,0,0|0,0,0]=3 20210 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)I 240690a_100102631434_100000057929 [0,3,0,0,0,0|0,0,0]=3 20211 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)I 527a_100102631434_100000057929 [0,3,0,0,0,0|0,0,0]=3 20212 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)O 240690a_100102631434_100000229998 [0,3,0,0,0,0|0,0,0]=3 20213 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)O 527a_100102631434_100000229998 [0,3,0,0,0,0|0,0,0]=3 20214 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)Br 1458a_100000759961_100000210206 [0,3,0,0,0,0|1,0,0]=4 20215 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)Cl 1458a_100000692595_100000210206 [0,3,0,0,0,0|1,0,0]=4 20216 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)F 1458a_100000240043_100000210206 [0,3,0,0,0,0|1,0,0]=4 20217 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)I 1458a_100000688012_100000210206 [0,3,0,0,0,0|1,0,0]=4 20218 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)O 1458a_100000687834_100000210206 [0,3,0,0,0,0|1,0,0]=4 20219 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Br 11a_100102631434_100000759961 [0,3,0,0,0,0|0,0,0]=3 20220 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Br 1626a_100102631434_100000759961 [0,3,0,0,0,0|0,0,0]=3 20221 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Br 240690a_100102631434_100000759961 [0,3,0,0,0,0|0,0,0]=3 20222 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Br 527a_100102631434_100000759961 [0,3,0,0,0,0|0,0,0]=3 20223 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Cl 11a_100102631434_100000692595 [0,3,0,0,0,0|0,0,0]=3 20224 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Cl 1626a_100102631434_100000692595 [0,3,0,0,0,0|0,0,0]=3 20225 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Cl 240690a_100102631434_100000692595 [0,3,0,0,0,0|0,0,0]=3 20226 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)Cl 527a_100102631434_100000692595 [0,3,0,0,0,0|0,0,0]=3 20227 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)F 11a_100102631434_100000240043 [0,3,0,0,0,0|0,0,0]=3 20228 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)F 1626a_100102631434_100000240043 [0,3,0,0,0,0|0,0,0]=3 20229 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)F 240690a_100102631434_100000240043 [0,3,0,0,0,0|0,0,0]=3 20230 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)F 527a_100102631434_100000240043 [0,3,0,0,0,0|0,0,0]=3 20231 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)I 11a_100102631434_100000688012 [0,3,0,0,0,0|0,0,0]=3 20232 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)I 1626a_100102631434_100000688012 [0,3,0,0,0,0|0,0,0]=3 20233 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)I 240690a_100102631434_100000688012 [0,3,0,0,0,0|0,0,0]=3 20234 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)I 527a_100102631434_100000688012 [0,3,0,0,0,0|0,0,0]=3 20235 B13R1.897 Cc1ccc(cc1C(=O)N(C)C)O 240690a_100102631434_100000687834 [0,3,0,0,0,0|0,0,0]=3 20236 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210206 [0,3,0,0,0,0|1,0,0]=4 20237 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210206 [0,3,0,0,0,0|1,0,0]=4 20238 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210206 [0,3,0,0,0,0|1,0,0]=4 20239 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210206 [0,3,0,0,0,0|1,0,0]=4 20240 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210206 [0,3,0,0,0,0|1,0,0]=4 20241 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210206 [0,3,0,0,0,0|1,0,0]=4 20242 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210206 [0,3,0,0,0,0|1,0,0]=4 20243 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210206 [0,3,0,0,0,0|1,0,0]=4 20244 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210206 [0,3,0,0,0,0|1,0,0]=4 20245 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012353570 [0,3,0,0,0,0|1,0,0]=4 20246 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210206 [0,3,0,0,0,0|1,0,0]=4 20247 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210206 [0,3,0,0,0,0|1,0,0]=4 20248 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210206 [0,3,0,0,0,0|1,0,0]=4 20249 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210206 [0,3,0,0,0,0|1,0,0]=4 20250 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Br 11a_100102631434_100000687083 [0,3,0,0,0,0|0,0,0]=3 20251 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Br 1626a_100102631434_100000687083 [0,3,0,0,0,0|0,0,0]=3 20252 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Br 240690a_100102631434_100000687083 [0,3,0,0,0,0|0,0,0]=3 20253 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Br 527a_100102631434_100000687083 [0,3,0,0,0,0|0,0,0]=3 20254 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Cl 11a_100102631434_100000687899 [0,3,0,0,0,0|0,0,0]=3 20255 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Cl 1626a_100102631434_100000687899 [0,3,0,0,0,0|0,0,0]=3 20256 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Cl 240690a_100102631434_100000687899 [0,3,0,0,0,0|0,0,0]=3 20257 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)Cl 527a_100102631434_100000687899 [0,3,0,0,0,0|0,0,0]=3 20258 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)F 11a_100102631434_100000739618 [0,3,0,0,0,0|0,0,0]=3 20259 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)F 1626a_100102631434_100000739618 [0,3,0,0,0,0|0,0,0]=3 20260 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)F 240690a_100102631434_100000739618 [0,3,0,0,0,0|0,0,0]=3 20261 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)F 527a_100102631434_100000739618 [0,3,0,0,0,0|0,0,0]=3 20262 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)O 240690a_100102631434_100011934545 [0,3,0,0,0,0|0,0,0]=3 20263 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Br)O 527a_100102631434_100011934545 [0,3,0,0,0,0|0,0,0]=3 20264 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)Cl 11a_100102631434_100000210701 [0,3,0,0,0,0|0,0,0]=3 20265 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)Cl 1626a_100102631434_100000210701 [0,3,0,0,0,0|0,0,0]=3 20266 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)Cl 240690a_100102631434_100000210701 [0,3,0,0,0,0|0,0,0]=3 20267 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)Cl 527a_100102631434_100000210701 [0,3,0,0,0,0|0,0,0]=3 20268 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)F 11a_100102631434_100000685768 [0,3,0,0,0,0|0,0,0]=3 20269 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)F 1626a_100102631434_100000685768 [0,3,0,0,0,0|0,0,0]=3 20270 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)F 240690a_100102631434_100000685768 [0,3,0,0,0,0|0,0,0]=3 20271 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)F 527a_100102631434_100000685768 [0,3,0,0,0,0|0,0,0]=3 20272 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)O 240690a_100102631434_100011997059 [0,3,0,0,0,0|0,0,0]=3 20273 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)Cl)O 527a_100102631434_100011997059 [0,3,0,0,0,0|0,0,0]=3 20274 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)F 11a_100102631434_100000211655 [0,3,0,0,0,0|0,0,0]=3 20275 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)F 1626a_100102631434_100000211655 [0,3,0,0,0,0|0,0,0]=3 20276 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)F 240690a_100102631434_100000211655 [0,3,0,0,0,0|0,0,0]=3 20277 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)F 527a_100102631434_100000211655 [0,3,0,0,0,0|0,0,0]=3 20278 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)O 11a_100102631434_100012017291 [0,3,0,0,0,0|0,0,0]=3 20279 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)O 240690a_100102631434_100012017291 [0,3,0,0,0,0|0,0,0]=3 20280 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)F)O 527a_100102631434_100012017291 [0,3,0,0,0,0|0,0,0]=3 20281 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Br 11a_100102631434_100000689235 [0,3,0,0,0,0|0,0,0]=3 20282 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Br 1626a_100102631434_100000689235 [0,3,0,0,0,0|0,0,0]=3 20283 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Br 240690a_100102631434_100000689235 [0,3,0,0,0,0|0,0,0]=3 20284 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Br 527a_100102631434_100000689235 [0,3,0,0,0,0|0,0,0]=3 20285 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Cl 11a_100102631434_100012047205 [0,3,0,0,0,0|0,0,0]=3 20286 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Cl 1626a_100102631434_100012047205 [0,3,0,0,0,0|0,0,0]=3 20287 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Cl 240690a_100102631434_100012047205 [0,3,0,0,0,0|0,0,0]=3 20288 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)Cl 527a_100102631434_100012047205 [0,3,0,0,0,0|0,0,0]=3 20289 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)F 11a_100102631434_100012047268 [0,3,0,0,0,0|0,0,0]=3 20290 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)F 1626a_100102631434_100012047268 [0,3,0,0,0,0|0,0,0]=3 20291 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)F 240690a_100102631434_100012047268 [0,3,0,0,0,0|0,0,0]=3 20292 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)F 527a_100102631434_100012047268 [0,3,0,0,0,0|0,0,0]=3 20293 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)I 11a_100102631434_100011204819 [0,3,0,0,0,0|0,0,0]=3 20294 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)I 1626a_100102631434_100011204819 [0,3,0,0,0,0|0,0,0]=3 20295 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)I 240690a_100102631434_100011204819 [0,3,0,0,0,0|0,0,0]=3 20296 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)I)I 527a_100102631434_100011204819 [0,3,0,0,0,0|0,0,0]=3 20297 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)O)O 240690a_100102631434_100000690292 [0,3,0,0,0,0|0,0,0]=3 20298 B13R1.3423 CN(C)C(=O)c1cc(cc(c1)O)O 527a_100102631434_100000690292 [0,3,0,0,0,0|0,0,0]=3 20299 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)Br 1458a_100000760426_100000210206 [0,3,0,0,0,0|1,0,0]=4 20300 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)C 1458a_100000210874_100000210206 [0,3,0,0,0,0|1,0,0]=4 20301 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)Cl 1458a_100000684526_100000210206 [0,3,0,0,0,0|1,0,0]=4 20302 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)F 1458a_100000763163_100000210206 [0,3,0,0,0,0|1,0,0]=4 20303 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)I 1458a_100000729426_100000210206 [0,3,0,0,0,0|1,0,0]=4 20304 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)O 1458a_100000094094_100000210206 [0,3,0,0,0,0|1,0,0]=4 20305 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Br 11a_100102631434_100000760426 [0,3,0,0,0,0|0,0,0]=3 20306 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Br 1626a_100102631434_100000760426 [0,3,0,0,0,0|0,0,0]=3 20307 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Br 240690a_100102631434_100000760426 [0,3,0,0,0,0|0,0,0]=3 20308 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Br 527a_100102631434_100000760426 [0,3,0,0,0,0|0,0,0]=3 20309 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)C 11a_100102631434_100000210874 [0,3,0,0,0,0|0,0,0]=3 20310 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)C 1626a_100102631434_100000210874 [0,3,0,0,0,0|0,0,0]=3 20311 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)C 240690a_100102631434_100000210874 [0,3,0,0,0,0|0,0,0]=3 20312 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)C 527a_100102631434_100000210874 [0,3,0,0,0,0|0,0,0]=3 20313 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Cl 11a_100102631434_100000684526 [0,3,0,0,0,0|0,0,0]=3 20314 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Cl 1626a_100102631434_100000684526 [0,3,0,0,0,0|0,0,0]=3 20315 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Cl 240690a_100102631434_100000684526 [0,3,0,0,0,0|0,0,0]=3 20316 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)Cl 527a_100102631434_100000684526 [0,3,0,0,0,0|0,0,0]=3 20317 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)F 11a_100102631434_100000763163 [0,3,0,0,0,0|0,0,0]=3 20318 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)F 1626a_100102631434_100000763163 [0,3,0,0,0,0|0,0,0]=3 20319 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)F 240690a_100102631434_100000763163 [0,3,0,0,0,0|0,0,0]=3 20320 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)F 527a_100102631434_100000763163 [0,3,0,0,0,0|0,0,0]=3 20321 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)I 11a_100102631434_100000729426 [0,3,0,0,0,0|0,0,0]=3 20322 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)I 1626a_100102631434_100000729426 [0,3,0,0,0,0|0,0,0]=3 20323 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)I 240690a_100102631434_100000729426 [0,3,0,0,0,0|0,0,0]=3 20324 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)I 527a_100102631434_100000729426 [0,3,0,0,0,0|0,0,0]=3 20325 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)O 240690a_100102631434_100000094094 [0,3,0,0,0,0|0,0,0]=3 20326 B13R1.3423 Cc1cc(cc(c1)C(=O)N(C)C)O 527a_100102631434_100000094094 [0,3,0,0,0,0|0,0,0]=3 20327 B13R1.3492 CC(C)(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011667116 [0,3,0,0,0,0|1,0,0]=4 20328 B13R1.2209 C=Cc1ccc(cc1C(=O)NC)Cl 271570a_100011290941_200011279454 [0,3,0,0,0,0|0,0,0]=3 20329 B13R1.2209 C=Cc1ccc(cc1C(=O)NC)F 271570a_100011290941_200000206232 [0,3,0,0,0,0|0,0,0]=3 20330 B13R1.2209 C=Cc1ccc(cc1C(=O)NN)F 271570a_100011290941_100000205862 [0,3,0,0,0,0|1,0,0]=4 20331 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)Br 271570a_100011290941_100000148213 [0,3,0,0,0,0|1,0,0]=4 20332 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)C 271570a_100011290941_100012339458 [0,3,0,0,0,0|1,0,0]=4 20333 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)Cl 271570a_100011290941_100011294804 [0,3,0,0,0,0|1,0,0]=4 20334 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)F 271570a_100011290941_100000205820 [0,3,0,0,0,0|1,0,0]=4 20335 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)N 271570a_100011290941_100000696289 [0,3,0,0,0,0|1,0,0]=4 20336 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)O 271570a_100011290941_100010230369 [0,3,0,0,0,0|1,0,0]=4 20337 B13R1.2209 CCC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210202 [0,3,0,0,0,0|1,0,0]=4 20338 B13R1.2209 CCC(=O)c1cc(ccc1CC)Br 1458a_100012343961_100000210202 [0,3,0,0,0,0|1,0,0]=4 20339 B13R1.2209 CCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000210202 [0,3,0,0,0,0|1,0,0]=4 20340 B13R1.2209 CCC(=O)c1cc(ccc1OC)Br 7a_100000183607_200000210301 [0,3,0,0,0,0|1,0,0]=4 20341 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210202 [0,3,0,0,0,0|1,0,0]=4 20342 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 7a_100000183590_200000210301 [0,3,0,0,0,0|1,0,0]=4 20343 B13R1.2209 CCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000210202 [0,3,0,0,0,0|1,0,0]=4 20344 B13R1.2209 CCC(=O)c1cc(ccc1OC)Cl 7a_100000181482_200000210301 [0,3,0,0,0,0|1,0,0]=4 20345 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000210202 [0,3,0,0,0,0|1,0,0]=4 20346 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 34a_100000183209_200000210301 [0,3,0,0,0,0|1,0,0]=4 20347 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 7a_100000183209_200000210301 [0,3,0,0,0,0|1,0,0]=4 20348 B13R1.2209 CCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000210202 [0,3,0,0,0,0|1,0,0]=4 20349 B13R1.2209 CCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210202 [0,3,0,0,0,0|1,0,0]=4 20350 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])Br 7a_100000183607_200025704644 [0,3,0,0,0,0|1,0,0]=4 20351 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])C 7a_100000183590_200025704644 [0,3,0,0,0,0|1,0,0]=4 20352 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000181482_200025704644 [0,3,0,0,0,0|1,0,0]=4 20353 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])F 34a_100000183209_200025704644 [0,3,0,0,0,0|1,0,0]=4 20354 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])F 7a_100000183209_200025704644 [0,3,0,0,0,0|1,0,0]=4 20355 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 11a_106832991635_100012343961 [0,3,0,0,0,0|0,0,0]=3 20356 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 1626a_100102657272_100012343961 [0,3,0,0,0,0|0,0,0]=3 20357 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 240690a_100102657272_100012343961 [0,3,0,0,0,0|0,0,0]=3 20358 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 527a_100102657272_100012343961 [0,3,0,0,0,0|0,0,0]=3 20359 B13R1.2209 CCc1ccc(cc1C(=O)OC)O 271570a_203496583355_100012360140 [0,3,0,0,0,0|1,0,0]=4 20360 B13R1.2209 CNC(=O)c1cc(ccc1C#N)F 11a_106832991635_100011217471 [0,3,0,0,0,0|0,0,0]=3 20361 B13R1.2209 CNC(=O)c1cc(ccc1C#N)F 1626a_100102657272_100011217471 [0,3,0,0,0,0|0,0,0]=3 20362 B13R1.2209 CNC(=O)c1cc(ccc1NC)Br 34a_100000690504_200000210301 [0,3,0,0,0,0|0,0,0]=3 20363 B13R1.2209 CNC(=O)c1cc(ccc1NC)Cl 27a_100102657272_200011279454 [0,3,0,0,0,0|0,0,0]=3 20364 B13R1.2209 CNC(=O)c1cc(ccc1NC)Cl 34a_100000739363_200000210301 [0,3,0,0,0,0|0,0,0]=3 20365 B13R1.2209 CNC(=O)c1cc(ccc1NC)F 27a_100102657272_200000206232 [0,3,0,0,0,0|0,0,0]=3 20366 B13R1.2209 CNC(=O)c1cc(ccc1N[13CH3])Br 34a_100000690504_200025704644 [0,3,0,0,0,0|0,0,0]=3 20367 B13R1.2209 CNC(=O)c1cc(ccc1N[13CH3])Cl 34a_100000739363_200025704644 [0,3,0,0,0,0|0,0,0]=3 20368 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 11a_106832991635_100000188853 [0,3,0,0,0,0|0,0,0]=3 20369 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 1626a_100102657272_100000188853 [0,3,0,0,0,0|0,0,0]=3 20370 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 240690a_100102657272_100000188853 [0,3,0,0,0,0|0,0,0]=3 20371 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 527a_100102657272_100000188853 [0,3,0,0,0,0|0,0,0]=3 20372 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 11a_106832991635_100000204667 [0,3,0,0,0,0|0,0,0]=3 20373 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 1626a_100102657272_100000204667 [0,3,0,0,0,0|0,0,0]=3 20374 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 240690a_100102657272_100000204667 [0,3,0,0,0,0|0,0,0]=3 20375 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 527a_100102657272_100000204667 [0,3,0,0,0,0|0,0,0]=3 20376 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 11a_106832991635_100000211409 [0,3,0,0,0,0|0,0,0]=3 20377 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 1626a_100102657272_100000211409 [0,3,0,0,0,0|0,0,0]=3 20378 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 240690a_100102657272_100000211409 [0,3,0,0,0,0|0,0,0]=3 20379 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 527a_100102657272_100000211409 [0,3,0,0,0,0|0,0,0]=3 20380 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 11a_106832991635_100000735445 [0,3,0,0,0,0|0,0,0]=3 20381 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 1626a_100102657272_100000735445 [0,3,0,0,0,0|0,0,0]=3 20382 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 240690a_100102657272_100000735445 [0,3,0,0,0,0|0,0,0]=3 20383 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 527a_100102657272_100000735445 [0,3,0,0,0,0|0,0,0]=3 20384 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 11a_106832991635_100000230898 [0,3,0,0,0,0|0,0,0]=3 20385 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 1626a_100102657272_100000230898 [0,3,0,0,0,0|0,0,0]=3 20386 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 240690a_100102657272_100000230898 [0,3,0,0,0,0|0,0,0]=3 20387 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 527a_100102657272_100000230898 [0,3,0,0,0,0|0,0,0]=3 20388 B13R1.2209 CNC(=O)c1cc(ccc1OC)O 240690a_100102657272_200000100057 [0,3,0,0,0,0|0,0,0]=3 20389 B13R1.2209 CNC(=O)c1cc(ccc1OC)O 527a_100102657272_200000100057 [0,3,0,0,0,0|0,0,0]=3 20390 B13R1.2209 CNC(=O)c1cc(ccc1SC)Cl 62a_200000210301_200011279454 [0,3,0,0,0,0|0,0,0]=3 20391 B13R1.2209 CNC(=O)c1cc(ccc1SC)Cl 62a_200011279454_200000210301 [0,3,0,0,0,0|0,0,0]=3 20392 B13R1.2209 CNC(=O)c1cc(ccc1SC)F 62a_200000206232_200000210301 [0,3,0,0,0,0|0,0,0]=3 20393 B13R1.2209 CNC(=O)c1cc(ccc1SC)F 62a_200000210301_200000206232 [0,3,0,0,0,0|0,0,0]=3 20394 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])Cl 62a_200011279454_200025704644 [0,3,0,0,0,0|0,0,0]=3 20395 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])Cl 62a_200025704644_200011279454 [0,3,0,0,0,0|0,0,0]=3 20396 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])F 62a_200000206232_200025704644 [0,3,0,0,0,0|0,0,0]=3 20397 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_200000206232 [0,3,0,0,0,0|0,0,0]=3 20398 B13R1.2209 CNc1ccc(cc1C(=O)OC)O 271570a_203496583355_200000216482 [0,3,0,0,0,0|1,0,0]=4 20399 B13R1.2209 COC(=O)c1cc(ccc1C#N)O 271570a_203496583355_100010201442 [0,3,0,0,0,0|1,0,0]=4 20400 B13R1.2209 COC(=O)c1cc(ccc1C=O)O 271570a_203496583355_100012355575 [0,3,0,0,0,0|1,0,0]=4 20401 B13R1.2209 COC(=O)c1cc(ccc1CN)O 271570a_203496583355_100016992124 [0,3,0,0,0,0|1,0,0]=4 20402 B13R1.2209 COC(=O)c1cc(ccc1OC)Br 34a_100000149267_200000210301 [0,3,0,0,0,0|1,0,0]=4 20403 B13R1.2209 COC(=O)c1cc(ccc1OC)Br 7a_100000149267_200000210301 [0,3,0,0,0,0|1,0,0]=4 20404 B13R1.2209 COC(=O)c1cc(ccc1OC)C 34a_100000216618_200000210301 [0,3,0,0,0,0|1,0,0]=4 20405 B13R1.2209 COC(=O)c1cc(ccc1OC)C 7a_100000216618_200000210301 [0,3,0,0,0,0|1,0,0]=4 20406 B13R1.2209 COC(=O)c1cc(ccc1OC)Cl 34a_100000149278_200000210301 [0,3,0,0,0,0|1,0,0]=4 20407 B13R1.2209 COC(=O)c1cc(ccc1OC)Cl 7a_100000149278_200000210301 [0,3,0,0,0,0|1,0,0]=4 20408 B13R1.2209 COC(=O)c1cc(ccc1OC)F 34a_100011219540_200000210301 [0,3,0,0,0,0|1,0,0]=4 20409 B13R1.2209 COC(=O)c1cc(ccc1OC)F 7a_100011219540_200000210301 [0,3,0,0,0,0|1,0,0]=4 20410 B13R1.2209 COC(=O)c1cc(ccc1OC)I 34a_100000149868_200000210301 [0,3,0,0,0,0|1,0,0]=4 20411 B13R1.2209 COC(=O)c1cc(ccc1OC)I 7a_100000149868_200000210301 [0,3,0,0,0,0|1,0,0]=4 20412 B13R1.2209 COC(=O)c1cc(ccc1OC)N 34a_100011246163_200000210301 [0,3,0,0,0,0|1,0,0]=4 20413 B13R1.2209 COC(=O)c1cc(ccc1OC)N 7a_100011246163_200000210301 [0,3,0,0,0,0|1,0,0]=4 20414 B13R1.2209 COC(=O)c1cc(ccc1OC)O 271570a_203496583355_100012047238 [0,3,0,0,0,0|1,0,0]=4 20415 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Br 34a_100000149267_200025704644 [0,3,0,0,0,0|1,0,0]=4 20416 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Br 7a_100000149267_200025704644 [0,3,0,0,0,0|1,0,0]=4 20417 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])C 34a_100000216618_200025704644 [0,3,0,0,0,0|1,0,0]=4 20418 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])C 7a_100000216618_200025704644 [0,3,0,0,0,0|1,0,0]=4 20419 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Cl 34a_100000149278_200025704644 [0,3,0,0,0,0|1,0,0]=4 20420 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000149278_200025704644 [0,3,0,0,0,0|1,0,0]=4 20421 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])F 34a_100011219540_200025704644 [0,3,0,0,0,0|1,0,0]=4 20422 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])F 7a_100011219540_200025704644 [0,3,0,0,0,0|1,0,0]=4 20423 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])I 34a_100000149868_200025704644 [0,3,0,0,0,0|1,0,0]=4 20424 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])I 7a_100000149868_200025704644 [0,3,0,0,0,0|1,0,0]=4 20425 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])N 34a_100011246163_200025704644 [0,3,0,0,0,0|1,0,0]=4 20426 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])N 7a_100011246163_200025704644 [0,3,0,0,0,0|1,0,0]=4 20427 B13R1.2209 COC(=O)c1cc(ccc1SC)Br 62a_100000148213_200000210301 [0,3,0,0,0,0|1,0,0]=4 20428 B13R1.2209 COC(=O)c1cc(ccc1SC)Br 62a_200000210301_100000148213 [0,3,0,0,0,0|1,0,0]=4 20429 B13R1.2209 COC(=O)c1cc(ccc1SC)C 62a_100012339458_200000210301 [0,3,0,0,0,0|1,0,0]=4 20430 B13R1.2209 COC(=O)c1cc(ccc1SC)C 62a_200000210301_100012339458 [0,3,0,0,0,0|1,0,0]=4 20431 B13R1.2209 COC(=O)c1cc(ccc1SC)Cl 62a_100011294804_200000210301 [0,3,0,0,0,0|1,0,0]=4 20432 B13R1.2209 COC(=O)c1cc(ccc1SC)Cl 62a_200000210301_100011294804 [0,3,0,0,0,0|1,0,0]=4 20433 B13R1.2209 COC(=O)c1cc(ccc1SC)F 62a_100000205820_200000210301 [0,3,0,0,0,0|1,0,0]=4 20434 B13R1.2209 COC(=O)c1cc(ccc1SC)F 62a_200000210301_100000205820 [0,3,0,0,0,0|1,0,0]=4 20435 B13R1.2209 COC(=O)c1cc(ccc1SC)N 62a_100000696289_200000210301 [0,3,0,0,0,0|1,0,0]=4 20436 B13R1.2209 COC(=O)c1cc(ccc1SC)N 62a_200000210301_100011794239 [0,3,0,0,0,0|1,0,0]=4 20437 B13R1.2209 COC(=O)c1cc(ccc1SC)O 271570a_203496583355_200010204078 [0,3,0,0,0,0|1,0,0]=4 20438 B13R1.2209 COC(=O)c1cc(ccc1SC)O 62a_100010230369_200000210301 [0,3,0,0,0,0|1,0,0]=4 20439 B13R1.2209 COC(=O)c1cc(ccc1SC)O 62a_200000210301_100010230369 [0,3,0,0,0,0|1,0,0]=4 20440 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Br 62a_100000148213_200025704644 [0,3,0,0,0,0|1,0,0]=4 20441 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Br 62a_200025704644_100000148213 [0,3,0,0,0,0|1,0,0]=4 20442 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])C 62a_100012339458_200025704644 [0,3,0,0,0,0|1,0,0]=4 20443 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])C 62a_200025704644_100012339458 [0,3,0,0,0,0|1,0,0]=4 20444 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Cl 62a_100011294804_200025704644 [0,3,0,0,0,0|1,0,0]=4 20445 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Cl 62a_200025704644_100011294804 [0,3,0,0,0,0|1,0,0]=4 20446 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])F 62a_100000205820_200025704644 [0,3,0,0,0,0|1,0,0]=4 20447 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_100000205820 [0,3,0,0,0,0|1,0,0]=4 20448 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])N 62a_100000696289_200025704644 [0,3,0,0,0,0|1,0,0]=4 20449 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])N 62a_200025704644_100011794239 [0,3,0,0,0,0|1,0,0]=4 20450 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])O 62a_100010230369_200025704644 [0,3,0,0,0,0|1,0,0]=4 20451 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])O 62a_200025704644_100010230369 [0,3,0,0,0,0|1,0,0]=4 20452 B13R1.2209 COc1ccc(cc1C(=O)NN)Br 34a_100000193350_200000210301 [0,3,0,0,0,0|1,0,0]=4 20453 B13R1.2209 COc1ccc(cc1C(=O)NN)C 34a_200000193374_200000210301 [0,3,0,0,0,0|1,0,0]=4 20454 B13R1.2209 COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_200000210301 [0,3,0,0,0,0|1,0,0]=4 20455 B13R1.2209 CSc1ccc(cc1C(=O)NN)F 62a_100000205862_200000210301 [0,3,0,0,0,0|1,0,0]=4 20456 B13R1.2209 CSc1ccc(cc1C(=O)NN)F 62a_200000210301_100000205862 [0,3,0,0,0,0|1,0,0]=4 20457 B13R1.2209 Cc1ccc(c(c1)C(=O)NN)O[13CH3] 34a_200000193374_200025704644 [0,3,0,0,0,0|1,0,0]=4 20458 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)NN)Br 34a_100000193350_200025704644 [0,3,0,0,0,0|1,0,0]=4 20459 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)NO)Cl 34a_100000199126_200025704644 [0,3,0,0,0,0|1,0,0]=4 20460 B13R1.2209 [13CH3]Sc1ccc(cc1C(=O)NN)F 62a_100000205862_200025704644 [0,3,0,0,0,0|1,0,0]=4 20461 B13R1.2209 [13CH3]Sc1ccc(cc1C(=O)NN)F 62a_200025704644_100000205862 [0,3,0,0,0,0|1,0,0]=4 20462 B13R1.2431 C=Cc1ccc(c(c1)C(=O)CC)O 271570a_100011290941_100000183607 [0,3,0,0,0,0|1,0,0]=4 20463 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NC)F 271570a_100011290941_100000155058 [0,3,0,0,0,0|0,0,0]=3 20464 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NC)N 271570a_100011290941_100000690504 [0,3,0,0,0,0|0,0,0]=3 20465 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NN)Br 271570a_100011290941_200011356971 [0,3,0,0,0,0|1,0,0]=4 20466 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NN)Cl 271570a_100011290941_200000049959 [0,3,0,0,0,0|1,0,0]=4 20467 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NN)O 271570a_100011290941_100000193350 [0,3,0,0,0,0|1,0,0]=4 20468 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)Br 271570a_100011290941_100012340073 [0,3,0,0,0,0|1,0,0]=4 20469 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)C 271570a_100011290941_100012360116 [0,3,0,0,0,0|1,0,0]=4 20470 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)Cl 271570a_100011290941_100012353682 [0,3,0,0,0,0|1,0,0]=4 20471 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)F 271570a_100011290941_100000154357 [0,3,0,0,0,0|1,0,0]=4 20472 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)N 271570a_100011290941_100000212070 [0,3,0,0,0,0|1,0,0]=4 20473 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)O 271570a_100011290941_100000149868 [0,3,0,0,0,0|1,0,0]=4 20474 B13R1.2431 CCC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_100000210202 [0,3,0,0,0,0|1,0,0]=4 20475 B13R1.2431 CCC(=O)c1cc(ccc1Br)CO 1458a_100010259715_100000210202 [0,3,0,0,0,0|1,0,0]=4 20476 B13R1.2431 CCC(=O)c1cc(ccc1Br)OC 1458a_100000211723_100000210202 [0,3,0,0,0,0|1,0,0]=4 20477 B13R1.2431 CCC(=O)c1cc(ccc1C)C#N 1458a_200012187059_100000210202 [0,3,0,0,0,0|1,0,0]=4 20478 B13R1.2431 CCC(=O)c1cc(ccc1C)OC 1458a_100011399813_100000210202 [0,3,0,0,0,0|1,0,0]=4 20479 B13R1.2431 CCC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_100000210202 [0,3,0,0,0,0|1,0,0]=4 20480 B13R1.2431 CCC(=O)c1cc(ccc1Cl)OC 1458a_100000763818_100000210202 [0,3,0,0,0,0|1,0,0]=4 20481 B13R1.2431 CCC(=O)c1cc(ccc1Cl)SC 1458a_100000212015_100000210202 [0,3,0,0,0,0|1,0,0]=4 20482 B13R1.2431 CCC(=O)c1cc(ccc1F)C#N 1458a_100011218479_100000210202 [0,3,0,0,0,0|1,0,0]=4 20483 B13R1.2431 CCC(=O)c1cc(ccc1F)OC 1458a_100011217016_100000210202 [0,3,0,0,0,0|1,0,0]=4 20484 B13R1.2431 CCC(=O)c1cc(ccc1F)SC 1458a_200012183283_100000210202 [0,3,0,0,0,0|1,0,0]=4 20485 B13R1.2431 CCC(=O)c1cc(ccc1I)C#N 1458a_200010191847_100000210202 [0,3,0,0,0,0|1,0,0]=4 20486 B13R1.2431 CCC(=O)c1cc(ccc1I)OC 1458a_100012339533_100000210202 [0,3,0,0,0,0|1,0,0]=4 20487 B13R1.2431 CCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000210202 [0,3,0,0,0,0|1,0,0]=4 20488 B13R1.2431 CCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000210202 [0,3,0,0,0,0|1,0,0]=4 20489 B13R1.2431 CCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000210202 [0,3,0,0,0,0|1,0,0]=4 20490 B13R1.2431 CCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000210202 [0,3,0,0,0,0|1,0,0]=4 20491 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200000748397 [0,3,0,0,0,0|0,0,0]=3 20492 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200000748397 [0,3,0,0,0,0|0,0,0]=3 20493 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 11a_106832991635_100012361338 [0,3,0,0,0,0|0,0,0]=3 20494 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 1626a_100102657272_100012361338 [0,3,0,0,0,0|0,0,0]=3 20495 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 240690a_100102657272_100012361338 [0,3,0,0,0,0|0,0,0]=3 20496 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 527a_100102657272_100012361338 [0,3,0,0,0,0|0,0,0]=3 20497 B13R1.2431 CNC(=O)c1cc(ccc1Br)CO 240690a_100102657272_100010259715 [0,3,0,0,0,0|0,0,0]=3 20498 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 11a_106832991635_100000211723 [0,3,0,0,0,0|0,0,0]=3 20499 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 1626a_100102657272_100000211723 [0,3,0,0,0,0|0,0,0]=3 20500 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 240690a_100102657272_100000211723 [0,3,0,0,0,0|0,0,0]=3 20501 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 527a_100102657272_100000211723 [0,3,0,0,0,0|0,0,0]=3 20502 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 11a_106832991635_200012187059 [0,3,0,0,0,0|0,0,0]=3 20503 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 1626a_100102657272_200012187059 [0,3,0,0,0,0|0,0,0]=3 20504 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 240690a_100102657272_200012187059 [0,3,0,0,0,0|0,0,0]=3 20505 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 527a_100102657272_200012187059 [0,3,0,0,0,0|0,0,0]=3 20506 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 11a_106832991635_100011399813 [0,3,0,0,0,0|0,0,0]=3 20507 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 1626a_100102657272_100011399813 [0,3,0,0,0,0|0,0,0]=3 20508 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 240690a_100102657272_100011399813 [0,3,0,0,0,0|0,0,0]=3 20509 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 527a_100102657272_100011399813 [0,3,0,0,0,0|0,0,0]=3 20510 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 11a_106832991635_100000729836 [0,3,0,0,0,0|0,0,0]=3 20511 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 1626a_100102657272_100000729836 [0,3,0,0,0,0|0,0,0]=3 20512 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 240690a_100102657272_100000729836 [0,3,0,0,0,0|0,0,0]=3 20513 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 527a_100102657272_100000729836 [0,3,0,0,0,0|0,0,0]=3 20514 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 2230a_100000742274_200000210301 [0,3,0,0,0,0|0,0,0]=3 20515 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 34a_100000742274_200000210301 [0,3,0,0,0,0|0,0,0]=3 20516 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 2230a_100000742274_200025704644 [0,3,0,0,0,0|0,0,0]=3 20517 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 34a_100000742274_200025704644 [0,3,0,0,0,0|0,0,0]=3 20518 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 11a_106832991635_100000763818 [0,3,0,0,0,0|0,0,0]=3 20519 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 1626a_100102657272_100000763818 [0,3,0,0,0,0|0,0,0]=3 20520 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 240690a_100102657272_100000763818 [0,3,0,0,0,0|0,0,0]=3 20521 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 527a_100102657272_100000763818 [0,3,0,0,0,0|0,0,0]=3 20522 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 11a_106832991635_100000212015 [0,3,0,0,0,0|0,0,0]=3 20523 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 1626a_100102657272_100000212015 [0,3,0,0,0,0|0,0,0]=3 20524 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 240690a_100102657272_100000212015 [0,3,0,0,0,0|0,0,0]=3 20525 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 527a_100102657272_100000212015 [0,3,0,0,0,0|0,0,0]=3 20526 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 11a_106832991635_100011218479 [0,3,0,0,0,0|0,0,0]=3 20527 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 1626a_100102657272_100011218479 [0,3,0,0,0,0|0,0,0]=3 20528 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 240690a_100102657272_100011218479 [0,3,0,0,0,0|0,0,0]=3 20529 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 2230a_100000747870_200000210301 [0,3,0,0,0,0|0,0,0]=3 20530 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 34a_100000747870_200000210301 [0,3,0,0,0,0|0,0,0]=3 20531 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 7a_100000747870_200000210301 [0,3,0,0,0,0|0,0,0]=3 20532 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 2230a_100000747870_200025704644 [0,3,0,0,0,0|0,0,0]=3 20533 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 34a_100000747870_200025704644 [0,3,0,0,0,0|0,0,0]=3 20534 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 7a_100000747870_200025704644 [0,3,0,0,0,0|0,0,0]=3 20535 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 11a_106832991635_100011217016 [0,3,0,0,0,0|0,0,0]=3 20536 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 1626a_100102657272_100011217016 [0,3,0,0,0,0|0,0,0]=3 20537 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 240690a_100102657272_100011217016 [0,3,0,0,0,0|0,0,0]=3 20538 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 527a_100102657272_100011217016 [0,3,0,0,0,0|0,0,0]=3 20539 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 11a_106832991635_200012183283 [0,3,0,0,0,0|0,0,0]=3 20540 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 1626a_100102657272_200012183283 [0,3,0,0,0,0|0,0,0]=3 20541 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 240690a_100102657272_200012183283 [0,3,0,0,0,0|0,0,0]=3 20542 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 527a_100102657272_200012183283 [0,3,0,0,0,0|0,0,0]=3 20543 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 62a_100000155058_200000210301 [0,3,0,0,0,0|0,0,0]=3 20544 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 62a_200000210301_100000155058 [0,3,0,0,0,0|0,0,0]=3 20545 B13R1.2431 CNC(=O)c1cc(ccc1F)S[13CH3] 62a_100000155058_200025704644 [0,3,0,0,0,0|0,0,0]=3 20546 B13R1.2431 CNC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000155058 [0,3,0,0,0,0|0,0,0]=3 20547 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 11a_106832991635_200010191847 [0,3,0,0,0,0|0,0,0]=3 20548 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 1626a_100102657272_200010191847 [0,3,0,0,0,0|0,0,0]=3 20549 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 240690a_100102657272_200010191847 [0,3,0,0,0,0|0,0,0]=3 20550 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 11a_106832991635_100012339533 [0,3,0,0,0,0|0,0,0]=3 20551 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 1626a_100102657272_100012339533 [0,3,0,0,0,0|0,0,0]=3 20552 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 240690a_100102657272_100012339533 [0,3,0,0,0,0|0,0,0]=3 20553 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 527a_100102657272_100012339533 [0,3,0,0,0,0|0,0,0]=3 20554 B13R1.2431 CNC(=O)c1cc(ccc1N)SC 62a_100000690504_200000210301 [0,3,0,0,0,0|0,0,0]=3 20555 B13R1.2431 CNC(=O)c1cc(ccc1N)S[13CH3] 62a_100000690504_200025704644 [0,3,0,0,0,0|0,0,0]=3 20556 B13R1.2431 CNC(=O)c1cc(ccc1O)C#N 240690a_100102657272_100000719980 [0,3,0,0,0,0|0,0,0]=3 20557 B13R1.2431 CNC(=O)c1cc(ccc1O)CO 240690a_100102657272_200000045694 [0,3,0,0,0,0|0,0,0]=3 20558 B13R1.2431 CNC(=O)c1cc(ccc1O)OC 240690a_100102657272_100000211986 [0,3,0,0,0,0|0,0,0]=3 20559 B13R1.2431 CNC(=O)c1cc(ccc1O)OC 527a_100102657272_100000211986 [0,3,0,0,0,0|0,0,0]=3 20560 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 34a_100010230369_200000210301 [0,3,0,0,0,0|1,0,0]=4 20561 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 7a_100010230369_200000210301 [0,3,0,0,0,0|1,0,0]=4 20562 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 34a_100010230369_200025704644 [0,3,0,0,0,0|1,0,0]=4 20563 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 7a_100010230369_200025704644 [0,3,0,0,0,0|1,0,0]=4 20564 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_100012340073_200000210301 [0,3,0,0,0,0|1,0,0]=4 20565 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_200000210301_100012340073 [0,3,0,0,0,0|1,0,0]=4 20566 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_100012340073_200025704644 [0,3,0,0,0,0|1,0,0]=4 20567 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_100012340073 [0,3,0,0,0,0|1,0,0]=4 20568 B13R1.2431 COC(=O)c1cc(ccc1C)OC 34a_100012002527_200000210301 [0,3,0,0,0,0|1,0,0]=4 20569 B13R1.2431 COC(=O)c1cc(ccc1C)OC 7a_100012002527_200000210301 [0,3,0,0,0,0|1,0,0]=4 20570 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 34a_100012002527_200025704644 [0,3,0,0,0,0|1,0,0]=4 20571 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 7a_100012002527_200025704644 [0,3,0,0,0,0|1,0,0]=4 20572 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_100012360116_200000210301 [0,3,0,0,0,0|1,0,0]=4 20573 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_200000210301_100012360116 [0,3,0,0,0,0|1,0,0]=4 20574 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_100012360116_200025704644 [0,3,0,0,0,0|1,0,0]=4 20575 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_200025704644_100012360116 [0,3,0,0,0,0|1,0,0]=4 20576 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 34a_100012001761_200000210301 [0,3,0,0,0,0|1,0,0]=4 20577 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 7a_100012001761_200000210301 [0,3,0,0,0,0|1,0,0]=4 20578 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100012001761_200025704644 [0,3,0,0,0,0|1,0,0]=4 20579 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100012001761_200025704644 [0,3,0,0,0,0|1,0,0]=4 20580 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_100012353682_200000210301 [0,3,0,0,0,0|1,0,0]=4 20581 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_200000210301_100012353682 [0,3,0,0,0,0|1,0,0]=4 20582 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100012353682_200025704644 [0,3,0,0,0,0|1,0,0]=4 20583 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_200025704644_100012353682 [0,3,0,0,0,0|1,0,0]=4 20584 B13R1.2431 COC(=O)c1cc(ccc1F)OC 34a_100009856154_200000210301 [0,3,0,0,0,0|1,0,0]=4 20585 B13R1.2431 COC(=O)c1cc(ccc1F)OC 7a_100009856154_200000210301 [0,3,0,0,0,0|1,0,0]=4 20586 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 34a_100009856154_200025704644 [0,3,0,0,0,0|1,0,0]=4 20587 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 7a_100009856154_200025704644 [0,3,0,0,0,0|1,0,0]=4 20588 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_100000216675_200000210301 [0,3,0,0,0,0|1,0,0]=4 20589 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_200000210301_100000216675 [0,3,0,0,0,0|1,0,0]=4 20590 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_100000216675_200025704644 [0,3,0,0,0,0|1,0,0]=4 20591 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000216675 [0,3,0,0,0,0|1,0,0]=4 20592 B13R1.2431 COC(=O)c1cc(ccc1I)OC 34a_200009888904_200000210301 [0,3,0,0,0,0|1,0,0]=4 20593 B13R1.2431 COC(=O)c1cc(ccc1I)OC 7a_200009888904_200000210301 [0,3,0,0,0,0|1,0,0]=4 20594 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 34a_200009888904_200025704644 [0,3,0,0,0,0|1,0,0]=4 20595 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 7a_200009888904_200025704644 [0,3,0,0,0,0|1,0,0]=4 20596 B13R1.2431 COC(=O)c1cc(ccc1N)OC 34a_100000694981_200000210301 [0,3,0,0,0,0|1,0,0]=4 20597 B13R1.2431 COC(=O)c1cc(ccc1N)OC 7a_100000694981_200000210301 [0,3,0,0,0,0|1,0,0]=4 20598 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 34a_100000694981_200025704644 [0,3,0,0,0,0|1,0,0]=4 20599 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 7a_100000694981_200025704644 [0,3,0,0,0,0|1,0,0]=4 20600 B13R1.2431 COC(=O)c1cc(ccc1N)SC 62a_100000212070_200000210301 [0,3,0,0,0,0|1,0,0]=4 20601 B13R1.2431 COC(=O)c1cc(ccc1N)S[13CH3] 62a_100000212070_200025704644 [0,3,0,0,0,0|1,0,0]=4 20602 B13R1.2431 COC(=O)c1cc(ccc1O)C#N 271570a_203496583355_100009817095 [0,3,0,0,0,0|1,0,0]=4 20603 B13R1.2431 COC(=O)c1cc(ccc1O)C=O 271570a_203496583355_100013328361 [0,3,0,0,0,0|1,0,0]=4 20604 B13R1.2431 COC(=O)c1cc(ccc1O)CN 271570a_203496583355_100016988414 [0,3,0,0,0,0|1,0,0]=4 20605 B13R1.2431 COC(=O)c1cc(ccc1O)OC 271570a_203496583355_100000151459 [0,3,0,0,0,0|1,0,0]=4 20606 B13R1.2431 COC(=O)c1cc(ccc1O)SC 62a_200000210301_100000149868 [0,3,0,0,0,0|1,0,0]=4 20607 B13R1.2431 COC(=O)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000149868 [0,3,0,0,0,0|1,0,0]=4 20608 B13R1.2431 COc1ccc(c(c1)C(=O)NN)O 271570a_203496583355_100000189949 [0,3,0,0,0,0|1,0,0]=4 20609 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Br 62a_200000210301_200011356971 [0,3,0,0,0,0|1,0,0]=4 20610 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Br 62a_200011356971_200000210301 [0,3,0,0,0,0|1,0,0]=4 20611 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Cl 62a_200000049959_200000210301 [0,3,0,0,0,0|1,0,0]=4 20612 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Cl 62a_200000210301_200000049959 [0,3,0,0,0,0|1,0,0]=4 20613 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)O 62a_200000210301_100000193350 [0,3,0,0,0,0|1,0,0]=4 20614 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Br 62a_200011356971_200025704644 [0,3,0,0,0,0|1,0,0]=4 20615 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Br 62a_200025704644_200011356971 [0,3,0,0,0,0|1,0,0]=4 20616 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Cl 62a_200000049959_200025704644 [0,3,0,0,0,0|1,0,0]=4 20617 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Cl 62a_200025704644_200000049959 [0,3,0,0,0,0|1,0,0]=4 20618 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)O 62a_200025704644_100000193350 [0,3,0,0,0,0|1,0,0]=4 20619 B13R1.314 C=Cc1cc(cc(c1)C(=O)NC)F 271570a_100011290941_200011295653 [0,3,0,0,0,0|0,0,0]=3 20620 B13R1.314 C=Cc1cc(cc(c1)C(=O)NN)F 271570a_100011290941_100011279999 [0,3,0,0,0,0|1,0,0]=4 20621 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)Br 271570a_100011290941_100012339729 [0,3,0,0,0,0|1,0,0]=4 20622 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)C 271570a_100011290941_100012359405 [0,3,0,0,0,0|1,0,0]=4 20623 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)Cl 271570a_100011290941_100000695173 [0,3,0,0,0,0|1,0,0]=4 20624 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)F 271570a_100011290941_100000698578 [0,3,0,0,0,0|1,0,0]=4 20625 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)N 271570a_100011290941_100138415615 [0,3,0,0,0,0|1,0,0]=4 20626 B13R1.314 C=Cc1cc(cc(c1)C(=O)OC)O 271570a_100011290941_100000696291 [0,3,0,0,0,0|1,0,0]=4 20627 B13R1.314 CCC(=O)c1cc(cc(c1)C#N)Br 1458a_100011935128_100000210202 [0,3,0,0,0,0|1,0,0]=4 20628 B13R1.314 CCC(=O)c1cc(cc(c1)C#N)C 1458a_100012001805_100000210202 [0,3,0,0,0,0|1,0,0]=4 20629 B13R1.314 CCC(=O)c1cc(cc(c1)C#N)Cl 1458a_100011997934_100000210202 [0,3,0,0,0,0|1,0,0]=4 20630 B13R1.314 CCC(=O)c1cc(cc(c1)C#N)F 1458a_100011356446_100000210202 [0,3,0,0,0,0|1,0,0]=4 20631 B13R1.314 CCC(=O)c1cc(cc(c1)CO)Cl 1458a_100009925505_100000210202 [0,3,0,0,0,0|1,0,0]=4 20632 B13R1.314 CCC(=O)c1cc(cc(c1)CO)F 1458a_100012278920_100000210202 [0,3,0,0,0,0|1,0,0]=4 20633 B13R1.314 CCC(=O)c1cc(cc(c1)OC)Br 1458a_100011934030_100000210202 [0,3,0,0,0,0|1,0,0]=4 20634 B13R1.314 CCC(=O)c1cc(cc(c1)OC)C 1458a_100000117910_100000210202 [0,3,0,0,0,0|1,0,0]=4 20635 B13R1.314 CCC(=O)c1cc(cc(c1)OC)Cl 1458a_100000066651_100000210202 [0,3,0,0,0,0|1,0,0]=4 20636 B13R1.314 CCC(=O)c1cc(cc(c1)OC)F 1458a_100011934639_100000210202 [0,3,0,0,0,0|1,0,0]=4 20637 B13R1.314 CCC(=O)c1cc(cc(c1)OC)I 1458a_200010292657_100000210202 [0,3,0,0,0,0|1,0,0]=4 20638 B13R1.314 CCC(=O)c1cc(cc(c1)OC)O 1458a_100000083963_100000210202 [0,3,0,0,0,0|1,0,0]=4 20639 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Br 11a_106832991635_100011935128 [0,3,0,0,0,0|0,0,0]=3 20640 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Br 1626a_100102657272_100011935128 [0,3,0,0,0,0|0,0,0]=3 20641 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Br 240690a_100102657272_100011935128 [0,3,0,0,0,0|0,0,0]=3 20642 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Br 527a_100102657272_100011935128 [0,3,0,0,0,0|0,0,0]=3 20643 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)C 11a_106832991635_100012001805 [0,3,0,0,0,0|0,0,0]=3 20644 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)C 1626a_100102657272_100012001805 [0,3,0,0,0,0|0,0,0]=3 20645 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)C 240690a_100102657272_100012001805 [0,3,0,0,0,0|0,0,0]=3 20646 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)C 527a_100102657272_100012001805 [0,3,0,0,0,0|0,0,0]=3 20647 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Cl 11a_106832991635_100011997934 [0,3,0,0,0,0|0,0,0]=3 20648 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Cl 1626a_100102657272_100011997934 [0,3,0,0,0,0|0,0,0]=3 20649 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Cl 240690a_100102657272_100011997934 [0,3,0,0,0,0|0,0,0]=3 20650 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)Cl 527a_100102657272_100011997934 [0,3,0,0,0,0|0,0,0]=3 20651 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)F 11a_106832991635_100011356446 [0,3,0,0,0,0|0,0,0]=3 20652 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)F 1626a_100102657272_100011356446 [0,3,0,0,0,0|0,0,0]=3 20653 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)F 240690a_100102657272_100011356446 [0,3,0,0,0,0|0,0,0]=3 20654 B13R1.314 CNC(=O)c1cc(cc(c1)C#N)F 527a_100102657272_100011356446 [0,3,0,0,0,0|0,0,0]=3 20655 B13R1.314 CNC(=O)c1cc(cc(c1)CO)Cl 240690a_100102657272_100009925505 [0,3,0,0,0,0|0,0,0]=3 20656 B13R1.314 CNC(=O)c1cc(cc(c1)CO)F 240690a_100102657272_100012278920 [0,3,0,0,0,0|0,0,0]=3 20657 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Br 11a_106832991635_100011934030 [0,3,0,0,0,0|0,0,0]=3 20658 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Br 1626a_100102657272_100011934030 [0,3,0,0,0,0|0,0,0]=3 20659 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Br 240690a_100102657272_100011934030 [0,3,0,0,0,0|0,0,0]=3 20660 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Br 527a_100102657272_100011934030 [0,3,0,0,0,0|0,0,0]=3 20661 B13R1.314 CNC(=O)c1cc(cc(c1)OC)C 11a_106832991635_100000117910 [0,3,0,0,0,0|0,0,0]=3 20662 B13R1.314 CNC(=O)c1cc(cc(c1)OC)C 1626a_100102657272_100000117910 [0,3,0,0,0,0|0,0,0]=3 20663 B13R1.314 CNC(=O)c1cc(cc(c1)OC)C 240690a_100102657272_100000117910 [0,3,0,0,0,0|0,0,0]=3 20664 B13R1.314 CNC(=O)c1cc(cc(c1)OC)C 527a_100102657272_100000117910 [0,3,0,0,0,0|0,0,0]=3 20665 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Cl 11a_106832991635_100000066651 [0,3,0,0,0,0|0,0,0]=3 20666 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Cl 1626a_100102657272_100000066651 [0,3,0,0,0,0|0,0,0]=3 20667 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Cl 240690a_100102657272_100000066651 [0,3,0,0,0,0|0,0,0]=3 20668 B13R1.314 CNC(=O)c1cc(cc(c1)OC)Cl 527a_100102657272_100000066651 [0,3,0,0,0,0|0,0,0]=3 20669 B13R1.314 CNC(=O)c1cc(cc(c1)OC)F 11a_106832991635_100011934639 [0,3,0,0,0,0|0,0,0]=3 20670 B13R1.314 CNC(=O)c1cc(cc(c1)OC)F 1626a_100102657272_100011934639 [0,3,0,0,0,0|0,0,0]=3 20671 B13R1.314 CNC(=O)c1cc(cc(c1)OC)F 240690a_100102657272_100011934639 [0,3,0,0,0,0|0,0,0]=3 20672 B13R1.314 CNC(=O)c1cc(cc(c1)OC)F 527a_100102657272_100011934639 [0,3,0,0,0,0|0,0,0]=3 20673 B13R1.314 CNC(=O)c1cc(cc(c1)OC)I 11a_106832991635_200010292657 [0,3,0,0,0,0|0,0,0]=3 20674 B13R1.314 CNC(=O)c1cc(cc(c1)OC)I 1626a_100102657272_200010292657 [0,3,0,0,0,0|0,0,0]=3 20675 B13R1.314 CNC(=O)c1cc(cc(c1)OC)I 240690a_100102657272_200010292657 [0,3,0,0,0,0|0,0,0]=3 20676 B13R1.314 CNC(=O)c1cc(cc(c1)OC)I 527a_100102657272_200010292657 [0,3,0,0,0,0|0,0,0]=3 20677 B13R1.314 CNC(=O)c1cc(cc(c1)OC)O 240690a_100102657272_100000083963 [0,3,0,0,0,0|0,0,0]=3 20678 B13R1.314 CNC(=O)c1cc(cc(c1)OC)O 527a_100102657272_100000083963 [0,3,0,0,0,0|0,0,0]=3 20679 B13R1.314 CNC(=O)c1cc(cc(c1)SC)F 62a_200000210301_200011295653 [0,3,0,0,0,0|0,0,0]=3 20680 B13R1.314 CNC(=O)c1cc(cc(c1)SC)F 62a_200011295653_200000210301 [0,3,0,0,0,0|0,0,0]=3 20681 B13R1.314 CNC(=O)c1cc(cc(c1)S[13CH3])F 62a_200011295653_200025704644 [0,3,0,0,0,0|0,0,0]=3 20682 B13R1.314 CNC(=O)c1cc(cc(c1)S[13CH3])F 62a_200025704644_200011295653 [0,3,0,0,0,0|0,0,0]=3 20683 B13R1.314 COC(=O)c1cc(cc(c1)C#N)O 271570a_203496583355_200010072370 [0,3,0,0,0,0|1,0,0]=4 20684 B13R1.314 COC(=O)c1cc(cc(c1)C=O)O 271570a_203496583355_100010371122 [0,3,0,0,0,0|1,0,0]=4 20685 B13R1.314 COC(=O)c1cc(cc(c1)CN)O 271570a_203496583355_100134615983 [0,3,0,0,0,0|1,0,0]=4 20686 B13R1.314 COC(=O)c1cc(cc(c1)CO)O 271570a_203496583355_100010232996 [0,3,0,0,0,0|1,0,0]=4 20687 B13R1.314 COC(=O)c1cc(cc(c1)OC)Br 34a_100000696291_200000210301 [0,3,0,0,0,0|1,0,0]=4 20688 B13R1.314 COC(=O)c1cc(cc(c1)OC)Br 7a_100000696291_200000210301 [0,3,0,0,0,0|1,0,0]=4 20689 B13R1.314 COC(=O)c1cc(cc(c1)OC)Cl 34a_100009870047_200000210301 [0,3,0,0,0,0|1,0,0]=4 20690 B13R1.314 COC(=O)c1cc(cc(c1)OC)Cl 7a_100009870047_200000210301 [0,3,0,0,0,0|1,0,0]=4 20691 B13R1.314 COC(=O)c1cc(cc(c1)OC)F 34a_100000118610_200000210301 [0,3,0,0,0,0|1,0,0]=4 20692 B13R1.314 COC(=O)c1cc(cc(c1)OC)F 7a_100000118610_200000210301 [0,3,0,0,0,0|1,0,0]=4 20693 B13R1.314 COC(=O)c1cc(cc(c1)OC)N 34a_100000069914_200000210301 [0,3,0,0,0,0|1,0,0]=4 20694 B13R1.314 COC(=O)c1cc(cc(c1)OC)N 7a_100000069914_200000210301 [0,3,0,0,0,0|1,0,0]=4 20695 B13R1.314 COC(=O)c1cc(cc(c1)OC)O 271570a_203496583355_200010233337 [0,3,0,0,0,0|1,0,0]=4 20696 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Br 34a_100000696291_200025704644 [0,3,0,0,0,0|1,0,0]=4 20697 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Br 7a_100000696291_200025704644 [0,3,0,0,0,0|1,0,0]=4 20698 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Cl 34a_100009870047_200025704644 [0,3,0,0,0,0|1,0,0]=4 20699 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Cl 7a_100009870047_200025704644 [0,3,0,0,0,0|1,0,0]=4 20700 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])F 34a_100000118610_200025704644 [0,3,0,0,0,0|1,0,0]=4 20701 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])F 7a_100000118610_200025704644 [0,3,0,0,0,0|1,0,0]=4 20702 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])N 34a_100000069914_200025704644 [0,3,0,0,0,0|1,0,0]=4 20703 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])N 7a_100000069914_200025704644 [0,3,0,0,0,0|1,0,0]=4 20704 B13R1.314 COC(=O)c1cc(cc(c1)SC)Br 62a_100012339729_200000210301 [0,3,0,0,0,0|1,0,0]=4 20705 B13R1.314 COC(=O)c1cc(cc(c1)SC)Br 62a_200000210301_100012339729 [0,3,0,0,0,0|1,0,0]=4 20706 B13R1.314 COC(=O)c1cc(cc(c1)SC)C 62a_100012359405_200000210301 [0,3,0,0,0,0|1,0,0]=4 20707 B13R1.314 COC(=O)c1cc(cc(c1)SC)C 62a_200000210301_100012359405 [0,3,0,0,0,0|1,0,0]=4 20708 B13R1.314 COC(=O)c1cc(cc(c1)SC)Cl 62a_100000695173_200000210301 [0,3,0,0,0,0|1,0,0]=4 20709 B13R1.314 COC(=O)c1cc(cc(c1)SC)Cl 62a_200000210301_100000695173 [0,3,0,0,0,0|1,0,0]=4 20710 B13R1.314 COC(=O)c1cc(cc(c1)SC)F 62a_100000698578_200000210301 [0,3,0,0,0,0|1,0,0]=4 20711 B13R1.314 COC(=O)c1cc(cc(c1)SC)F 62a_200000210301_100000698578 [0,3,0,0,0,0|1,0,0]=4 20712 B13R1.314 COC(=O)c1cc(cc(c1)SC)N 62a_100138415615_200000210301 [0,3,0,0,0,0|1,0,0]=4 20713 B13R1.314 COC(=O)c1cc(cc(c1)SC)N 62a_200000210301_100138415615 [0,3,0,0,0,0|1,0,0]=4 20714 B13R1.314 COC(=O)c1cc(cc(c1)SC)O 62a_100000696291_200000210301 [0,3,0,0,0,0|1,0,0]=4 20715 B13R1.314 COC(=O)c1cc(cc(c1)SC)O 62a_200000210301_100000696291 [0,3,0,0,0,0|1,0,0]=4 20716 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Br 62a_100012339729_200025704644 [0,3,0,0,0,0|1,0,0]=4 20717 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Br 62a_200025704644_100012339729 [0,3,0,0,0,0|1,0,0]=4 20718 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])C 62a_100012359405_200025704644 [0,3,0,0,0,0|1,0,0]=4 20719 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])C 62a_200025704644_100012359405 [0,3,0,0,0,0|1,0,0]=4 20720 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Cl 62a_100000695173_200025704644 [0,3,0,0,0,0|1,0,0]=4 20721 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100000695173 [0,3,0,0,0,0|1,0,0]=4 20722 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])F 62a_100000698578_200025704644 [0,3,0,0,0,0|1,0,0]=4 20723 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])F 62a_200025704644_100000698578 [0,3,0,0,0,0|1,0,0]=4 20724 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])N 62a_100138415615_200025704644 [0,3,0,0,0,0|1,0,0]=4 20725 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])N 62a_200025704644_100138415615 [0,3,0,0,0,0|1,0,0]=4 20726 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])O 62a_100000696291_200025704644 [0,3,0,0,0,0|1,0,0]=4 20727 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])O 62a_200025704644_100000696291 [0,3,0,0,0,0|1,0,0]=4 20728 B13R1.314 CSc1cc(cc(c1)C(=O)NN)F 62a_100011279999_200000210301 [0,3,0,0,0,0|1,0,0]=4 20729 B13R1.314 CSc1cc(cc(c1)C(=O)NN)F 62a_200000210301_100011279999 [0,3,0,0,0,0|1,0,0]=4 20730 B13R1.314 [13CH3]Sc1cc(cc(c1)C(=O)NN)F 62a_100011279999_200025704644 [0,3,0,0,0,0|1,0,0]=4 20731 B13R1.314 [13CH3]Sc1cc(cc(c1)C(=O)NN)F 62a_200025704644_100011279999 [0,3,0,0,0,0|1,0,0]=4 20732 B13R1.374 C=C=Cc1cc(ccn1)C(=O)NC 271570a_100015277604_100011196506 [0,3,0,0,0,0|1,0,0]=4 20733 B13R1.374 C=C=Cc1cccc(c1)C(=O)CC 271570a_100015277604_100000211677 [0,3,0,0,0,0|1,0,0]=4 20734 B13R1.374 C=C=Cc1cccc(c1)C(=O)NC 271570a_100015277604_100000155082 [0,3,0,0,0,0|0,0,0]=3 20735 B13R1.374 C=C=Cc1cccc(c1)C(=O)NN 271570a_100015277604_100000189783 [0,3,0,0,0,0|1,0,0]=4 20736 B13R1.374 C=C=Cc1cccc(c1)C(=O)OC 271570a_100015277604_100000148679 [0,3,0,0,0,0|1,0,0]=4 20737 B13R1.374 C=C=Cc1cccc(n1)C(=O)NC 271570a_100015277604_100000755456 [0,3,0,0,0,0|1,0,0]=4 20738 B13R1.374 C=C=Cc1ccnc(c1)C(=O)NC 271570a_100015277604_100000204654 [0,3,0,0,0,0|1,0,0]=4 20739 B13R1.374 C=C=Cc1cncc(c1)C(=O)NC 271570a_100015277604_200000155086 [0,3,0,0,0,0|1,0,0]=4 20740 B13R1.374 CC=Cc1cc(ccn1)C(=O)NC 271570a_100016259895_100011196506 [0,3,0,0,0,0|1,0,0]=4 20741 B13R1.374 CC=Cc1cccc(c1)C(=O)CC 271570a_100016259895_100000211677 [0,3,0,0,0,0|1,0,0]=4 20742 B13R1.374 CC=Cc1cccc(c1)C(=O)NC 271570a_100016259895_100000155082 [0,3,0,0,0,0|0,0,0]=3 20743 B13R1.374 CC=Cc1cccc(c1)C(=O)NN 271570a_100016259895_100000189783 [0,3,0,0,0,0|1,0,0]=4 20744 B13R1.374 CC=Cc1cccc(c1)C(=O)OC 271570a_100016259895_100000148679 [0,3,0,0,0,0|1,0,0]=4 20745 B13R1.374 CC=Cc1cccc(n1)C(=O)NC 271570a_100016259895_100000755456 [0,3,0,0,0,0|1,0,0]=4 20746 B13R1.374 CC=Cc1ccnc(c1)C(=O)NC 271570a_100016259895_100000204654 [0,3,0,0,0,0|1,0,0]=4 20747 B13R1.374 CC=Cc1cncc(c1)C(=O)NC 271570a_100016259895_200000155086 [0,3,0,0,0,0|1,0,0]=4 20748 B13R1.374 CCC(=O)c1cccc(c1)CC#N 1458a_100000027370_100000210202 [0,3,0,0,0,0|1,0,0]=4 20749 B13R1.374 CCC(=O)c1cccc(c1)CCO 1458a_100009869812_100000210202 [0,3,0,0,0,0|1,0,0]=4 20750 B13R1.374 CCC(=O)c1cccc(c1)CNC 26a_100102657272_100011996911 [0,3,0,0,0,0|1,0,0]=4 20751 B13R1.374 CCC(=O)c1cccc(c1)COC 1458a_100000199024_100000210202 [0,3,0,0,0,0|1,0,0]=4 20752 B13R1.374 CCC(=O)c1cccc(c1)OCF 34a_100011996911_100015361967 [0,3,0,0,0,0|1,0,0]=4 20753 B13R1.374 CCC(=O)c1cccc(c1)OCF 7a_100011996911_100015361967 [0,3,0,0,0,0|1,0,0]=4 20754 B13R1.374 CCC(=O)c1cccc(c1)SCF 62a_100000211677_100015361967 [0,3,0,0,0,0|1,0,0]=4 20755 B13R1.374 CCC(=O)c1cccc(c1)SCF 62a_100015361967_100000211677 [0,3,0,0,0,0|1,0,0]=4 20756 B13R1.374 CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000210202 [0,3,0,0,0,0|0,0,0]=3 20757 B13R1.374 CCNc1cccc(n1)C(=O)NC 27a_100015525214_100000755456 [0,3,0,0,0,0|1,0,0]=4 20758 B13R1.374 CCNc1ccnc(c1)C(=O)NC 27a_100015525214_100000204654 [0,3,0,0,0,0|1,0,0]=4 20759 B13R1.374 CCNc1cncc(c1)C(=O)NC 27a_100015525214_200000155086 [0,3,0,0,0,0|1,0,0]=4 20760 B13R1.374 CCOc1cccc(c1)C(=O)CC 1458a_100000216331_100000210202 [0,3,0,0,0,0|1,0,0]=4 20761 B13R1.374 CCOc1cccc(c1)C(=O)CC 34a_100011996911_100000210202 [0,3,0,0,0,0|1,0,0]=4 20762 B13R1.374 CCOc1cccc(c1)C(=O)CC 7a_100011996911_100000210202 [0,3,0,0,0,0|1,0,0]=4 20763 B13R1.374 CCOc1cccc(c1)C(=O)NC 11a_106832991635_100000216331 [0,3,0,0,0,0|0,0,0]=3 20764 B13R1.374 CCOc1cccc(c1)C(=O)NC 1626a_100102657272_100000216331 [0,3,0,0,0,0|0,0,0]=3 20765 B13R1.374 CCOc1cccc(c1)C(=O)NC 240690a_100102657272_100000216331 [0,3,0,0,0,0|0,0,0]=3 20766 B13R1.374 CCOc1cccc(c1)C(=O)NC 34a_100000159807_100000210202 [0,3,0,0,0,0|0,0,0]=3 20767 B13R1.374 CCOc1cccc(c1)C(=O)NC 527a_100102657272_100000216331 [0,3,0,0,0,0|0,0,0]=3 20768 B13R1.374 CCOc1cccc(c1)C(=O)NC 7a_100000159807_100000210202 [0,3,0,0,0,0|0,0,0]=3 20769 B13R1.374 CCOc1cccc(c1)C(=O)NN 34a_100000184184_100000210202 [0,3,0,0,0,0|1,0,0]=4 20770 B13R1.374 CCOc1cccc(c1)C(=O)OC 34a_100000150331_100000210202 [0,3,0,0,0,0|1,0,0]=4 20771 B13R1.374 CCOc1cccc(c1)C(=O)OC 7a_100000150331_100000210202 [0,3,0,0,0,0|1,0,0]=4 20772 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100000210202_100011196506 [0,3,0,0,0,0|1,0,0]=4 20773 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100011196506_100000210202 [0,3,0,0,0,0|1,0,0]=4 20774 B13R1.374 CCSc1cccc(c1)C(=O)CC 62a_100000210202_100000211677 [0,3,0,0,0,0|1,0,0]=4 20775 B13R1.374 CCSc1cccc(c1)C(=O)CC 62a_100000211677_100000210202 [0,3,0,0,0,0|1,0,0]=4 20776 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000155082_100000210202 [0,3,0,0,0,0|0,0,0]=3 20777 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000210202_100000155082 [0,3,0,0,0,0|0,0,0]=3 20778 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000189783_100000210202 [0,3,0,0,0,0|1,0,0]=4 20779 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000210202_100000189783 [0,3,0,0,0,0|1,0,0]=4 20780 B13R1.374 CCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210202 [0,3,0,0,0,0|1,0,0]=4 20781 B13R1.374 CCSc1cccc(c1)C(=O)OC 62a_100000210202_100000148848 [0,3,0,0,0,0|1,0,0]=4 20782 B13R1.374 CCSc1cccc(n1)C(=O)NC 62a_100000210202_100000755456 [0,3,0,0,0,0|1,0,0]=4 20783 B13R1.374 CCSc1cccc(n1)C(=O)NC 62a_100000755456_100000210202 [0,3,0,0,0,0|1,0,0]=4 20784 B13R1.374 CCSc1ccnc(c1)C(=O)NC 62a_100000204654_100000210202 [0,3,0,0,0,0|1,0,0]=4 20785 B13R1.374 CCSc1ccnc(c1)C(=O)NC 62a_100000210202_100000204654 [0,3,0,0,0,0|1,0,0]=4 20786 B13R1.374 CCSc1cncc(c1)C(=O)NC 62a_100000210202_200000155086 [0,3,0,0,0,0|1,0,0]=4 20787 B13R1.374 CCSc1cncc(c1)C(=O)NC 62a_200000155086_100000210202 [0,3,0,0,0,0|1,0,0]=4 20788 B13R1.374 CNC(=O)c1cc(ccn1)SCF 62a_100000204654_100015361967 [0,3,0,0,0,0|1,0,0]=4 20789 B13R1.374 CNC(=O)c1cc(ccn1)SCF 62a_100015361967_100000204654 [0,3,0,0,0,0|1,0,0]=4 20790 B13R1.374 CNC(=O)c1cccc(c1)CC#N 11a_106832991635_100000027370 [0,3,0,0,0,0|0,0,0]=3 20791 B13R1.374 CNC(=O)c1cccc(c1)CC#N 1626a_100102657272_100000027370 [0,3,0,0,0,0|0,0,0]=3 20792 B13R1.374 CNC(=O)c1cccc(c1)CC#N 527a_100102657272_100000027370 [0,3,0,0,0,0|0,0,0]=3 20793 B13R1.374 CNC(=O)c1cccc(c1)CCO 1626a_100102657272_100009869812 [0,3,0,0,0,0|0,0,0]=3 20794 B13R1.374 CNC(=O)c1cccc(c1)CCO 240690a_100102657272_100009869812 [0,3,0,0,0,0|0,0,0]=3 20795 B13R1.374 CNC(=O)c1cccc(c1)COC 11a_106832991635_100000199024 [0,3,0,0,0,0|0,0,0]=3 20796 B13R1.374 CNC(=O)c1cccc(c1)COC 1626a_100102657272_100000199024 [0,3,0,0,0,0|0,0,0]=3 20797 B13R1.374 CNC(=O)c1cccc(c1)COC 240690a_100102657272_100000199024 [0,3,0,0,0,0|0,0,0]=3 20798 B13R1.374 CNC(=O)c1cccc(c1)COC 34a_100138415774_100000755619 [0,3,0,0,0,0|0,0,0]=3 20799 B13R1.374 CNC(=O)c1cccc(c1)COC 527a_100102657272_100000199024 [0,3,0,0,0,0|0,0,0]=3 20800 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_100000755619_200000210301 [0,3,0,0,0,0|0,0,0]=3 20801 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_200000210301_100000755619 [0,3,0,0,0,0|0,0,0]=3 20802 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_100000755619_200025704644 [0,3,0,0,0,0|0,0,0]=3 20803 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000755619 [0,3,0,0,0,0|0,0,0]=3 20804 B13R1.374 CNC(=O)c1cccc(c1)NCF 34a_100000185133_100015361967 [0,3,0,0,0,0|0,0,0]=3 20805 B13R1.374 CNC(=O)c1cccc(c1)OCF 34a_100000159807_100015361967 [0,3,0,0,0,0|0,0,0]=3 20806 B13R1.374 CNC(=O)c1cccc(c1)OCF 7a_100000159807_100015361967 [0,3,0,0,0,0|0,0,0]=3 20807 B13R1.374 CNC(=O)c1cccc(c1)SCF 62a_100000155082_100015361967 [0,3,0,0,0,0|0,0,0]=3 20808 B13R1.374 CNC(=O)c1cccc(c1)SCF 62a_100015361967_100000155082 [0,3,0,0,0,0|0,0,0]=3 20809 B13R1.374 CNC(=O)c1cccc(n1)SCF 62a_100000755456_100015361967 [0,3,0,0,0,0|1,0,0]=4 20810 B13R1.374 CNC(=O)c1cccc(n1)SCF 62a_100015361967_100000755456 [0,3,0,0,0,0|1,0,0]=4 20811 B13R1.374 CNC(=O)c1ccnc(c1)SCF 62a_100011196506_100015361967 [0,3,0,0,0,0|1,0,0]=4 20812 B13R1.374 CNC(=O)c1ccnc(c1)SCF 62a_100015361967_100011196506 [0,3,0,0,0,0|1,0,0]=4 20813 B13R1.374 CNC(=O)c1cncc(c1)SCF 62a_100015361967_200000155086 [0,3,0,0,0,0|1,0,0]=4 20814 B13R1.374 CNC(=O)c1cncc(c1)SCF 62a_200000155086_100015361967 [0,3,0,0,0,0|1,0,0]=4 20815 B13R1.374 CNCc1cccc(c1)C(=O)NC 2230a_106832991635_100000755619 [0,3,0,0,0,0|0,0,0]=3 20816 B13R1.374 CNCc1cccc(c1)C(=O)NC 34a_100102657272_100000755619 [0,3,0,0,0,0|0,0,0]=3 20817 B13R1.374 CNCc1cccc(c1)C(=O)NC 7a_106832991635_100000755619 [0,3,0,0,0,0|0,0,0]=3 20818 B13R1.374 CNCc1cccc(c1)C(=O)OC 2230a_106832991635_100000184886 [0,3,0,0,0,0|1,0,0]=4 20819 B13R1.374 CNCc1cccc(c1)C(=O)OC 26a_100102657272_100000150331 [0,3,0,0,0,0|1,0,0]=4 20820 B13R1.374 CNCc1cccc(c1)C(=O)OC 270004a_106832991635_100000687630 [0,3,0,0,0,0|1,0,0]=4 20821 B13R1.374 CNCc1cccc(c1)C(=O)OC 34a_100102657272_100000184886 [0,3,0,0,0,0|1,0,0]=4 20822 B13R1.374 CNCc1cccc(c1)C(=O)OC 7a_106832991635_100000184886 [0,3,0,0,0,0|1,0,0]=4 20823 B13R1.374 COC(=O)c1cccc(c1)CO[13CH3] 34a_100000750316_200025704644 [0,3,0,0,0,0|1,0,0]=4 20824 B13R1.374 COC(=O)c1cccc(c1)CO[13CH3] 7a_100000750316_200025704644 [0,3,0,0,0,0|1,0,0]=4 20825 B13R1.374 COC(=O)c1cccc(c1)CSC 62a_100000184886_200000210301 [0,3,0,0,0,0|1,0,0]=4 20826 B13R1.374 COC(=O)c1cccc(c1)CSC 62a_200000210301_100000184886 [0,3,0,0,0,0|1,0,0]=4 20827 B13R1.374 COC(=O)c1cccc(c1)CS[13CH3] 62a_100000184886_200025704644 [0,3,0,0,0,0|1,0,0]=4 20828 B13R1.374 COC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000184886 [0,3,0,0,0,0|1,0,0]=4 20829 B13R1.374 COC(=O)c1cccc(c1)OCF 34a_100000150331_100015361967 [0,3,0,0,0,0|1,0,0]=4 20830 B13R1.374 COC(=O)c1cccc(c1)OCF 7a_100000150331_100015361967 [0,3,0,0,0,0|1,0,0]=4 20831 B13R1.374 COC(=O)c1cccc(c1)SCF 62a_100000148848_100015361967 [0,3,0,0,0,0|1,0,0]=4 20832 B13R1.374 COC(=O)c1cccc(c1)SCF 62a_100015361967_100000148848 [0,3,0,0,0,0|1,0,0]=4 20833 B13R1.374 COCc1cccc(c1)C(=O)OC 34a_100000750316_200000210301 [0,3,0,0,0,0|1,0,0]=4 20834 B13R1.374 COCc1cccc(c1)C(=O)OC 34a_100138415774_100000184886 [0,3,0,0,0,0|1,0,0]=4 20835 B13R1.374 COCc1cccc(c1)C(=O)OC 7a_100000750316_200000210301 [0,3,0,0,0,0|1,0,0]=4 20836 B13R1.374 NNC(=O)c1cccc(c1)OCF 34a_100000184184_100015361967 [0,3,0,0,0,0|1,0,0]=4 20837 B13R1.374 NNC(=O)c1cccc(c1)SCF 62a_100000189783_100015361967 [0,3,0,0,0,0|1,0,0]=4 20838 B13R1.374 NNC(=O)c1cccc(c1)SCF 62a_100015361967_100000189783 [0,3,0,0,0,0|1,0,0]=4 20839 B13R1.543 C=C(C)c1cc(ccn1)C(=O)NC 271570a_100000694244_100011196506 [0,3,0,0,0,0|1,0,0]=4 20840 B13R1.543 C=C(C)c1cccc(c1)C(=O)CC 271570a_100000694244_100000211677 [0,3,0,0,0,0|1,0,0]=4 20841 B13R1.543 C=C(C)c1cccc(c1)C(=O)NC 271570a_100000694244_100000155082 [0,3,0,0,0,0|0,0,0]=3 20842 B13R1.543 C=C(C)c1cccc(c1)C(=O)NN 271570a_100000694244_100000189783 [0,3,0,0,0,0|1,0,0]=4 20843 B13R1.543 C=C(C)c1cccc(c1)C(=O)OC 271570a_100000694244_100000148679 [0,3,0,0,0,0|1,0,0]=4 20844 B13R1.543 C=C(C)c1cccc(n1)C(=O)NC 271570a_100000694244_100000755456 [0,3,0,0,0,0|1,0,0]=4 20845 B13R1.543 C=C(C)c1ccnc(c1)C(=O)NC 271570a_100000694244_100000204654 [0,3,0,0,0,0|1,0,0]=4 20846 B13R1.543 C=C(C)c1cncc(c1)C(=O)NC 271570a_100000694244_200000155086 [0,3,0,0,0,0|1,0,0]=4 20847 B13R1.543 CCC(=O)c1cccc(c1)C(=O)N 1458a_100000736676_100000210202 [0,3,0,0,0,0|1,0,0]=4 20848 B13R1.543 CCC(=O)c1cccc(c1)C(C)C 1458a_100011934808_100000210202 [0,3,0,0,0,0|1,0,0]=4 20849 B13R1.543 CCC(=O)c1cccc(c1)C(C)O 1458a_100000090953_100000210202 [0,3,0,0,0,0|1,0,0]=4 20850 B13R1.543 CCC(=O)c1cccc(c1)C(F)F 1458a_100000752119_100000210202 [0,3,0,0,0,0|1,0,0]=4 20851 B13R1.543 CCC(=O)c1cccc(c1)N(C)C 1458a_100000210872_100000210202 [0,3,0,0,0,0|1,0,0]=4 20852 B13R1.543 CCC(=O)c1cccc(c1)[N+](=O)[O-] 1458a_100000185806_100000210202 [0,3,0,0,0,0|1,0,0]=4 20853 B13R1.543 CNC(=O)c1cc(ccn1)C(F)F 11a_106832991635_100009881524 [0,3,0,0,0,0|1,0,0]=4 20854 B13R1.543 CNC(=O)c1cc(ccn1)C(F)F 1626a_100102657272_100009881524 [0,3,0,0,0,0|1,0,0]=4 20855 B13R1.543 CNC(=O)c1cc(ccn1)C(F)F 240690a_100102657272_100009881524 [0,3,0,0,0,0|1,0,0]=4 20856 B13R1.543 CNC(=O)c1cc(ccn1)C(F)F 527a_100102657272_100009881524 [0,3,0,0,0,0|1,0,0]=4 20857 B13R1.543 CNC(=O)c1cc(ccn1)N(C)C 27a_100102631434_100000204654 [0,3,0,0,0,0|1,0,0]=4 20858 B13R1.543 CNC(=O)c1cccc(c1)C(=O)N 11a_106832991635_100000736676 [0,3,0,0,0,0|0,0,0]=3 20859 B13R1.543 CNC(=O)c1cccc(c1)C(=O)N 1626a_100102657272_100000736676 [0,3,0,0,0,0|0,0,0]=3 20860 B13R1.543 CNC(=O)c1cccc(c1)C(=O)N 240690a_100102657272_100000736676 [0,3,0,0,0,0|0,0,0]=3 20861 B13R1.543 CNC(=O)c1cccc(c1)C(=O)N 527a_100102657272_100000736676 [0,3,0,0,0,0|0,0,0]=3 20862 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 11a_106832991635_100011934808 [0,3,0,0,0,0|0,0,0]=3 20863 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 1626a_100102657272_100011934808 [0,3,0,0,0,0|0,0,0]=3 20864 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 240690a_100102657272_100011934808 [0,3,0,0,0,0|0,0,0]=3 20865 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 527a_100102657272_100011934808 [0,3,0,0,0,0|0,0,0]=3 20866 B13R1.543 CNC(=O)c1cccc(c1)C(C)O 240690a_100102657272_100000090953 [0,3,0,0,0,0|0,0,0]=3 20867 B13R1.543 CNC(=O)c1cccc(c1)C(F)F 11a_106832991635_100000752119 [0,3,0,0,0,0|0,0,0]=3 20868 B13R1.543 CNC(=O)c1cccc(c1)C(F)F 1626a_100102657272_100000752119 [0,3,0,0,0,0|0,0,0]=3 20869 B13R1.543 CNC(=O)c1cccc(c1)C(F)F 240690a_100102657272_100000752119 [0,3,0,0,0,0|0,0,0]=3 20870 B13R1.543 CNC(=O)c1cccc(c1)C(F)F 527a_100102657272_100000752119 [0,3,0,0,0,0|0,0,0]=3 20871 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 11a_106832991635_100000210872 [0,3,0,0,0,0|0,0,0]=3 20872 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 1626a_100102657272_100000210872 [0,3,0,0,0,0|0,0,0]=3 20873 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 240690a_100102657272_100000210872 [0,3,0,0,0,0|0,0,0]=3 20874 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 527a_100102657272_100000210872 [0,3,0,0,0,0|0,0,0]=3 20875 B13R1.543 CNC(=O)c1cccc(c1)[N+](=O)[O-] 11a_106832991635_100000185806 [0,3,0,0,0,0|0,0,0]=3 20876 B13R1.543 CNC(=O)c1cccc(c1)[N+](=O)[O-] 1626a_100102657272_100000185806 [0,3,0,0,0,0|0,0,0]=3 20877 B13R1.543 CNC(=O)c1cccc(c1)[N+](=O)[O-] 240690a_100102657272_100000185806 [0,3,0,0,0,0|0,0,0]=3 20878 B13R1.543 CNC(=O)c1cccc(c1)[N+](=O)[O-] 527a_100102657272_100000185806 [0,3,0,0,0,0|0,0,0]=3 20879 B13R1.543 CNC(=O)c1cccc(n1)N(C)C 27a_100102631434_100000755456 [0,3,0,0,0,0|1,0,0]=4 20880 B13R1.543 CNC(=O)c1cncc(c1)N(C)C 27a_100102631434_200000155086 [0,3,0,0,0,0|1,0,0]=4 20881 B13R1.543 COC(=O)c1cccc(c1)C(=O)C 1458a_100000035267_200000210301 [0,3,0,0,0,0|1,0,0]=4 20882 B13R1.543 COC(=O)c1cccc(c1)C(=O)[13CH3] 1458a_100000035267_200025704644 [0,3,0,0,0,0|1,0,0]=4 20883 B13R1.89 C#Cc1ccccc1C(=O)C(C)C 1458a_100011243808_100000210206 [0,3,0,0,0,0|1,0,0]=4 20884 B13R1.89 C#Cc1ccccc1C(=O)N(C)C 527a_100102631434_100011243808 [0,3,0,0,0,0|0,0,0]=3 20885 B13R1.89 C=Cc1ccccc1C(=O)C(C)C 1458a_100011830265_100000210206 [0,3,0,0,0,0|1,0,0]=4 20886 B13R1.89 C=Cc1ccccc1C(=O)N(C)C 1626a_100102631434_100011830265 [0,3,0,0,0,0|0,0,0]=3 20887 B13R1.89 C=Cc1ccccc1C(=O)N(C)C 271570a_100011290941_100000159526 [0,3,0,0,0,0|0,0,0]=3 20888 B13R1.89 C=Cc1ncccc1C(=O)N(C)C 271570a_100011290941_100000159563 [0,3,0,0,0,0|1,0,0]=4 20889 B13R1.89 CC(C)C(=O)c1ccccc1C#N 1458a_100000742908_100000210206 [0,3,0,0,0,0|1,0,0]=4 20890 B13R1.89 CC(C)C(=O)c1ccccc1CO 1458a_100011301526_100000210206 [0,3,0,0,0,0|1,0,0]=4 20891 B13R1.89 CC(C)C(=O)c1ccccc1I=O 1458a_100000032414_100000210206 [0,3,0,0,0,0|1,0,0]=4 20892 B13R1.89 CCc1ccccc1C(=O)C(C)C 1458a_100000689120_100000210206 [0,3,0,0,0,0|1,0,0]=4 20893 B13R1.89 CCc1ccccc1C(=O)N(C)C 11a_100102631434_100000689120 [0,3,0,0,0,0|0,0,0]=3 20894 B13R1.89 CCc1ccccc1C(=O)N(C)C 1626a_100102631434_100000689120 [0,3,0,0,0,0|0,0,0]=3 20895 B13R1.89 CCc1ccccc1C(=O)N(C)C 240690a_100102631434_100000689120 [0,3,0,0,0,0|0,0,0]=3 20896 B13R1.89 CCc1ccccc1C(=O)N(C)C 527a_100102631434_100000689120 [0,3,0,0,0,0|0,0,0]=3 20897 B13R1.89 CN(C)C(=O)c1ccccc1C#N 11a_100102631434_100000742908 [0,3,0,0,0,0|0,0,0]=3 20898 B13R1.89 CN(C)C(=O)c1ccccc1C#N 1626a_100102631434_100000742908 [0,3,0,0,0,0|0,0,0]=3 20899 B13R1.89 CN(C)C(=O)c1ccccc1C#N 527a_100102631434_100000742908 [0,3,0,0,0,0|0,0,0]=3 20900 B13R1.89 CN(C)C(=O)c1ccccc1I=O 1626a_100102631434_100000032414 [0,3,0,0,0,0|0,0,0]=3 20901 B13R1.89 CN(C)C(=O)c1ccccc1I=O 240690a_100102631434_100000032414 [0,3,0,0,0,0|0,0,0]=3 20902 B13R1.89 CN(C)C(=O)c1ccccc1I=O 527a_100102631434_100000032414 [0,3,0,0,0,0|0,0,0]=3 20903 B13R1.89 CN(C)C(=O)c1ccccc1N[13CH3] 34a_100000188421_200025704644 [0,3,0,0,0,0|0,0,0]=3 20904 B13R1.89 CN(C)C(=O)c1ccccc1O[13CH3] 34a_100000192106_200025704644 [0,3,0,0,0,0|0,0,0]=3 20905 B13R1.89 CN(C)C(=O)c1ccccc1O[13CH3] 7a_100000192106_200025704644 [0,3,0,0,0,0|0,0,0]=3 20906 B13R1.89 CN(C)C(=O)c1ccccc1S[13CH3] 62a_100000159526_200025704644 [0,3,0,0,0,0|0,0,0]=3 20907 B13R1.89 CN(C)C(=O)c1ccccc1S[13CH3] 62a_200025704644_100000159526 [0,3,0,0,0,0|0,0,0]=3 20908 B13R1.89 CN(C)C(=O)c1cccnc1S[13CH3] 62a_100000159563_200025704644 [0,3,0,0,0,0|1,0,0]=4 20909 B13R1.89 CN(C)C(=O)c1cccnc1S[13CH3] 62a_200025704644_100000159563 [0,3,0,0,0,0|1,0,0]=4 20910 B13R1.89 CN(C)C(=O)c1ncccc1O[13CH3] 34a_200011376111_200025704644 [0,3,0,0,0,0|1,0,0]=4 20911 B13R1.89 CN(C)C(=O)c1ncccc1O[13CH3] 7a_200011376111_200025704644 [0,3,0,0,0,0|1,0,0]=4 20912 B13R1.89 CNc1ccccc1C(=O)N(C)C 34a_100000188421_200000210301 [0,3,0,0,0,0|0,0,0]=3 20913 B13R1.89 CNc1ncccc1C(=O)N(C)C 27a_100102657272_100000159563 [0,3,0,0,0,0|1,0,0]=4 20914 B13R1.89 COc1ccccc1C(=O)C(C)C 1458a_100000185835_100000210206 [0,3,0,0,0,0|1,0,0]=4 20915 B13R1.89 COc1ccccc1C(=O)N(C)C 11a_100102631434_100000185835 [0,3,0,0,0,0|0,0,0]=3 20916 B13R1.89 COc1ccccc1C(=O)N(C)C 1626a_100102631434_100000185835 [0,3,0,0,0,0|0,0,0]=3 20917 B13R1.89 COc1ccccc1C(=O)N(C)C 240690a_100102631434_100000185835 [0,3,0,0,0,0|0,0,0]=3 20918 B13R1.89 COc1ccccc1C(=O)N(C)C 34a_100000192106_200000210301 [0,3,0,0,0,0|0,0,0]=3 20919 B13R1.89 COc1ccccc1C(=O)N(C)C 527a_100102631434_100000185835 [0,3,0,0,0,0|0,0,0]=3 20920 B13R1.89 COc1ccccc1C(=O)N(C)C 7a_100000192106_200000210301 [0,3,0,0,0,0|0,0,0]=3 20921 B13R1.89 COc1cccnc1C(=O)N(C)C 34a_200011376111_200000210301 [0,3,0,0,0,0|1,0,0]=4 20922 B13R1.89 COc1cccnc1C(=O)N(C)C 7a_200011376111_200000210301 [0,3,0,0,0,0|1,0,0]=4 20923 B13R1.89 CSc1ccccc1C(=O)C(C)C 1458a_100000183967_100000210206 [0,3,0,0,0,0|1,0,0]=4 20924 B13R1.89 CSc1ccccc1C(=O)N(C)C 11a_100102631434_100000183967 [0,3,0,0,0,0|0,0,0]=3 20925 B13R1.89 CSc1ccccc1C(=O)N(C)C 1626a_100102631434_100000183967 [0,3,0,0,0,0|0,0,0]=3 20926 B13R1.89 CSc1ccccc1C(=O)N(C)C 240690a_100102631434_100000183967 [0,3,0,0,0,0|0,0,0]=3 20927 B13R1.89 CSc1ccccc1C(=O)N(C)C 527a_100102631434_100000183967 [0,3,0,0,0,0|0,0,0]=3 20928 B13R1.89 CSc1ccccc1C(=O)N(C)C 62a_100000159526_200000210301 [0,3,0,0,0,0|0,0,0]=3 20929 B13R1.89 CSc1ccccc1C(=O)N(C)C 62a_200000210301_100000159526 [0,3,0,0,0,0|0,0,0]=3 20930 B13R1.89 CSc1ncccc1C(=O)N(C)C 62a_100000159563_200000210301 [0,3,0,0,0,0|1,0,0]=4 20931 B13R1.89 CSc1ncccc1C(=O)N(C)C 62a_200000210301_100000159563 [0,3,0,0,0,0|1,0,0]=4 20932 B13R1.3789 CC(C)C(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210206 [0,3,0,0,0,0|1,0,0]=4 20933 B13R1.3789 CC(C)C(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210206 [0,3,0,0,0,0|1,0,0]=4 20934 B13R1.3789 CC(C)C(=O)c1c(cccc1Br)F 1458a_100000752694_100000210206 [0,3,0,0,0,0|1,0,0]=4 20935 B13R1.3789 CC(C)C(=O)c1c(cccc1Br)O 1458a_100011935254_100000210206 [0,3,0,0,0,0|1,0,0]=4 20936 B13R1.3789 CC(C)C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210206 [0,3,0,0,0,0|1,0,0]=4 20937 B13R1.3789 CC(C)C(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210206 [0,3,0,0,0,0|1,0,0]=4 20938 B13R1.3789 CC(C)C(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210206 [0,3,0,0,0,0|1,0,0]=4 20939 B13R1.3789 CC(C)C(=O)c1c(cccc1F)F 1458a_100000210804_100000210206 [0,3,0,0,0,0|1,0,0]=4 20940 B13R1.3789 CC(C)C(=O)c1c(cccc1F)O 1458a_100000763259_100000210206 [0,3,0,0,0,0|1,0,0]=4 20941 B13R1.3789 CC(C)C(=O)c1c(cccc1I)Br 1458a_100010232521_100000210206 [0,3,0,0,0,0|1,0,0]=4 20942 B13R1.3789 CC(C)C(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210206 [0,3,0,0,0,0|1,0,0]=4 20943 B13R1.3789 CC(C)C(=O)c1c(cccc1I)F 1458a_100000023732_100000210206 [0,3,0,0,0,0|1,0,0]=4 20944 B13R1.3789 CC(C)C(=O)c1c(cccc1O)O 1458a_100000755285_100000210206 [0,3,0,0,0,0|1,0,0]=4 20945 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Br 11a_100102631434_100000690891 [0,3,0,0,0,0|0,0,0]=3 20946 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Br 1626a_100102631434_100000690891 [0,3,0,0,0,0|0,0,0]=3 20947 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Br 240690a_100102631434_100000690891 [0,3,0,0,0,0|0,0,0]=3 20948 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Br 527a_100102631434_100000690891 [0,3,0,0,0,0|0,0,0]=3 20949 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Cl 11a_100102631434_100011253703 [0,3,0,0,0,0|0,0,0]=3 20950 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Cl 1626a_100102631434_100011253703 [0,3,0,0,0,0|0,0,0]=3 20951 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Cl 240690a_100102631434_100011253703 [0,3,0,0,0,0|0,0,0]=3 20952 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)Cl 527a_100102631434_100011253703 [0,3,0,0,0,0|0,0,0]=3 20953 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)F 11a_100102631434_100000752694 [0,3,0,0,0,0|0,0,0]=3 20954 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)F 1626a_100102631434_100000752694 [0,3,0,0,0,0|0,0,0]=3 20955 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)F 240690a_100102631434_100000752694 [0,3,0,0,0,0|0,0,0]=3 20956 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)F 527a_100102631434_100000752694 [0,3,0,0,0,0|0,0,0]=3 20957 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)O 240690a_100102631434_100011935254 [0,3,0,0,0,0|0,0,0]=3 20958 B13R1.3789 CN(C)C(=O)c1c(cccc1Br)O 527a_100102631434_100011935254 [0,3,0,0,0,0|0,0,0]=3 20959 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)Cl 11a_100102631434_100000210656 [0,3,0,0,0,0|0,0,0]=3 20960 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)Cl 1626a_100102631434_100000210656 [0,3,0,0,0,0|0,0,0]=3 20961 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)Cl 240690a_100102631434_100000210656 [0,3,0,0,0,0|0,0,0]=3 20962 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)F 11a_100102631434_100000210369 [0,3,0,0,0,0|0,0,0]=3 20963 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)F 1626a_100102631434_100000210369 [0,3,0,0,0,0|0,0,0]=3 20964 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)F 240690a_100102631434_100000210369 [0,3,0,0,0,0|0,0,0]=3 20965 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)F 527a_100102631434_100000210369 [0,3,0,0,0,0|0,0,0]=3 20966 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)O 240690a_100102631434_100000745519 [0,3,0,0,0,0|0,0,0]=3 20967 B13R1.3789 CN(C)C(=O)c1c(cccc1Cl)O 527a_100102631434_100000745519 [0,3,0,0,0,0|0,0,0]=3 20968 B13R1.3789 CN(C)C(=O)c1c(cccc1F)F 11a_100102631434_100000210804 [0,3,0,0,0,0|0,0,0]=3 20969 B13R1.3789 CN(C)C(=O)c1c(cccc1F)F 1626a_100102631434_100000210804 [0,3,0,0,0,0|0,0,0]=3 20970 B13R1.3789 CN(C)C(=O)c1c(cccc1F)F 240690a_100102631434_100000210804 [0,3,0,0,0,0|0,0,0]=3 20971 B13R1.3789 CN(C)C(=O)c1c(cccc1F)F 527a_100102631434_100000210804 [0,3,0,0,0,0|0,0,0]=3 20972 B13R1.3789 CN(C)C(=O)c1c(cccc1F)O 527a_100102631434_100000763259 [0,3,0,0,0,0|0,0,0]=3 20973 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Br 11a_100102631434_100010232521 [0,3,0,0,0,0|0,0,0]=3 20974 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Br 1626a_100102631434_100010232521 [0,3,0,0,0,0|0,0,0]=3 20975 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Br 240690a_100102631434_100010232521 [0,3,0,0,0,0|0,0,0]=3 20976 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Br 527a_100102631434_100010232521 [0,3,0,0,0,0|0,0,0]=3 20977 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Cl 11a_100102631434_100000702859 [0,3,0,0,0,0|0,0,0]=3 20978 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Cl 1626a_100102631434_100000702859 [0,3,0,0,0,0|0,0,0]=3 20979 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Cl 240690a_100102631434_100000702859 [0,3,0,0,0,0|0,0,0]=3 20980 B13R1.3789 CN(C)C(=O)c1c(cccc1I)Cl 527a_100102631434_100000702859 [0,3,0,0,0,0|0,0,0]=3 20981 B13R1.3789 CN(C)C(=O)c1c(cccc1I)F 11a_100102631434_100000023732 [0,3,0,0,0,0|0,0,0]=3 20982 B13R1.3789 CN(C)C(=O)c1c(cccc1I)F 1626a_100102631434_100000023732 [0,3,0,0,0,0|0,0,0]=3 20983 B13R1.3789 CN(C)C(=O)c1c(cccc1I)F 240690a_100102631434_100000023732 [0,3,0,0,0,0|0,0,0]=3 20984 B13R1.3789 CN(C)C(=O)c1c(cccc1O)O 527a_100102631434_100000755285 [0,3,0,0,0,0|0,0,0]=3 20985 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)Br 1458a_100000701904_100000210206 [0,3,0,0,0,0|1,0,0]=4 20986 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)C 1458a_100000758298_100000210206 [0,3,0,0,0,0|1,0,0]=4 20987 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)Cl 1458a_100000692601_100000210206 [0,3,0,0,0,0|1,0,0]=4 20988 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)F 1458a_100000762013_100000210206 [0,3,0,0,0,0|1,0,0]=4 20989 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)I 1458a_100000688020_100000210206 [0,3,0,0,0,0|1,0,0]=4 20990 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)O 1458a_100011934116_100000210206 [0,3,0,0,0,0|1,0,0]=4 20991 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Br 11a_100102631434_100000701904 [0,3,0,0,0,0|0,0,0]=3 20992 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Br 1626a_100102631434_100000701904 [0,3,0,0,0,0|0,0,0]=3 20993 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Br 240690a_100102631434_100000701904 [0,3,0,0,0,0|0,0,0]=3 20994 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Br 527a_100102631434_100000701904 [0,3,0,0,0,0|0,0,0]=3 20995 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)C 11a_100102631434_100000758298 [0,3,0,0,0,0|0,0,0]=3 20996 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)C 1626a_100102631434_100000758298 [0,3,0,0,0,0|0,0,0]=3 20997 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)C 240690a_100102631434_100000758298 [0,3,0,0,0,0|0,0,0]=3 20998 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Cl 11a_100102631434_100000692601 [0,3,0,0,0,0|0,0,0]=3 20999 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Cl 1626a_100102631434_100000692601 [0,3,0,0,0,0|0,0,0]=3 21000 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)Cl 240690a_100102631434_100000692601 [0,3,0,0,0,0|0,0,0]=3 21001 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)F 11a_100102631434_100000762013 [0,3,0,0,0,0|0,0,0]=3 21002 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)F 1626a_100102631434_100000762013 [0,3,0,0,0,0|0,0,0]=3 21003 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)F 240690a_100102631434_100000762013 [0,3,0,0,0,0|0,0,0]=3 21004 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)F 527a_100102631434_100000762013 [0,3,0,0,0,0|0,0,0]=3 21005 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)I 11a_100102631434_100000688020 [0,3,0,0,0,0|0,0,0]=3 21006 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)I 1626a_100102631434_100000688020 [0,3,0,0,0,0|0,0,0]=3 21007 B13R1.3789 Cc1cccc(c1C(=O)N(C)C)I 240690a_100102631434_100000688020 [0,3,0,0,0,0|0,0,0]=3 21008 B13R1.382 C=C=Cc1ccccc1C(=O)NC 271570a_100015277604_100000155073 [0,3,0,0,0,0|0,0,0]=3 21009 B13R1.382 C=C=Cc1ccccc1C(=O)NN 271570a_100015277604_100000190081 [0,3,0,0,0,0|1,0,0]=4 21010 B13R1.382 C=C=Cc1ccccc1C(=O)OC 271570a_100015277604_100000148710 [0,3,0,0,0,0|1,0,0]=4 21011 B13R1.382 C=C=Cc1ncccc1C(=O)NC 271570a_100015277604_100000159833 [0,3,0,0,0,0|1,0,0]=4 21012 B13R1.382 CC=Cc1ccccc1C(=O)NC 271570a_100016259895_100000155073 [0,3,0,0,0,0|0,0,0]=3 21013 B13R1.382 CC=Cc1ccccc1C(=O)NN 271570a_100016259895_100000190081 [0,3,0,0,0,0|1,0,0]=4 21014 B13R1.382 CC=Cc1ccccc1C(=O)OC 271570a_100016259895_100000148710 [0,3,0,0,0,0|1,0,0]=4 21015 B13R1.382 CC=Cc1ncccc1C(=O)NC 271570a_100016259895_100000159833 [0,3,0,0,0,0|1,0,0]=4 21016 B13R1.382 CCC(=O)c1ccccc1CC#N 1458a_100000010604_100000210202 [0,3,0,0,0,0|1,0,0]=4 21017 B13R1.382 CCC(=O)c1ccccc1COC 1458a_100000737999_100000210202 [0,3,0,0,0,0|1,0,0]=4 21018 B13R1.382 CCC(=O)c1ccccc1N=[N+]=[N-] 1458a_100009827904_100000210202 [0,3,0,0,0,0|1,0,0]=4 21019 B13R1.382 CCC(=O)c1ccccc1OCF 7a_100000184720_100015361967 [0,3,0,0,0,0|1,0,0]=4 21020 B13R1.382 CCNc1ccccc1C(=O)NC 27a_100015525214_100000155073 [0,3,0,0,0,0|0,0,0]=3 21021 B13R1.382 CCNc1ccccc1C(=O)NC 34a_100000185696_100000210202 [0,3,0,0,0,0|0,0,0]=3 21022 B13R1.382 CCNc1ncccc1C(=O)NC 27a_100015525214_100000159833 [0,3,0,0,0,0|1,0,0]=4 21023 B13R1.382 CCOc1ccccc1C(=O)CC 1458a_100000211144_100000210202 [0,3,0,0,0,0|1,0,0]=4 21024 B13R1.382 CCOc1ccccc1C(=O)CC 7a_100000184720_100000210202 [0,3,0,0,0,0|1,0,0]=4 21025 B13R1.382 CCOc1ccccc1C(=O)NC 11a_106832991635_100000211144 [0,3,0,0,0,0|0,0,0]=3 21026 B13R1.382 CCOc1ccccc1C(=O)NC 1626a_100102657272_100000211144 [0,3,0,0,0,0|0,0,0]=3 21027 B13R1.382 CCOc1ccccc1C(=O)NC 240690a_100102657272_100000211144 [0,3,0,0,0,0|0,0,0]=3 21028 B13R1.382 CCOc1ccccc1C(=O)NC 34a_100000185920_100000210202 [0,3,0,0,0,0|0,0,0]=3 21029 B13R1.382 CCOc1ccccc1C(=O)NC 527a_100102657272_100000211144 [0,3,0,0,0,0|0,0,0]=3 21030 B13R1.382 CCOc1ccccc1C(=O)NC 7a_100000185920_100000210202 [0,3,0,0,0,0|0,0,0]=3 21031 B13R1.382 CCOc1ccccc1C(=O)NN 34a_100000186518_100000210202 [0,3,0,0,0,0|1,0,0]=4 21032 B13R1.382 CCOc1ccccc1C(=O)NO 34a_100000188472_100000210202 [0,3,0,0,0,0|1,0,0]=4 21033 B13R1.382 CCOc1ccccc1C(=O)OC 7a_100000150335_100000210202 [0,3,0,0,0,0|1,0,0]=4 21034 B13R1.382 CCOc1cccnc1C(=O)NC 34a_100011376092_100000210202 [0,3,0,0,0,0|1,0,0]=4 21035 B13R1.382 CCOc1cccnc1C(=O)NC 7a_100011376092_100000210202 [0,3,0,0,0,0|1,0,0]=4 21036 B13R1.382 CCSc1ccccc1C(=O)CC 1458a_100000195471_100000210202 [0,3,0,0,0,0|1,0,0]=4 21037 B13R1.382 CCSc1ccccc1C(=O)NC 11a_106832991635_100000195471 [0,3,0,0,0,0|0,0,0]=3 21038 B13R1.382 CCSc1ccccc1C(=O)NC 1626a_100102657272_100000195471 [0,3,0,0,0,0|0,0,0]=3 21039 B13R1.382 CCSc1ccccc1C(=O)NC 240690a_100102657272_100000195471 [0,3,0,0,0,0|0,0,0]=3 21040 B13R1.382 CCSc1ccccc1C(=O)NC 527a_100102657272_100000195471 [0,3,0,0,0,0|0,0,0]=3 21041 B13R1.382 CCSc1ccccc1C(=O)NC 62a_100000155073_100000210202 [0,3,0,0,0,0|0,0,0]=3 21042 B13R1.382 CCSc1ccccc1C(=O)NC 62a_100000210202_100000155073 [0,3,0,0,0,0|0,0,0]=3 21043 B13R1.382 CCSc1ccccc1C(=O)NN 62a_100000190081_100000210202 [0,3,0,0,0,0|1,0,0]=4 21044 B13R1.382 CCSc1ccccc1C(=O)NN 62a_100000210202_100000190081 [0,3,0,0,0,0|1,0,0]=4 21045 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000148710_100000210202 [0,3,0,0,0,0|1,0,0]=4 21046 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000210202_100000148710 [0,3,0,0,0,0|1,0,0]=4 21047 B13R1.382 CCSc1ncccc1C(=O)NC 62a_100000159833_100000210202 [0,3,0,0,0,0|1,0,0]=4 21048 B13R1.382 CCSc1ncccc1C(=O)NC 62a_100000210202_100000159833 [0,3,0,0,0,0|1,0,0]=4 21049 B13R1.382 CNC(=O)c1ccccc1CC#N 11a_106832991635_100000010604 [0,3,0,0,0,0|0,0,0]=3 21050 B13R1.382 CNC(=O)c1ccccc1CC#N 1626a_100102657272_100000010604 [0,3,0,0,0,0|0,0,0]=3 21051 B13R1.382 CNC(=O)c1ccccc1COC 11a_106832991635_100000737999 [0,3,0,0,0,0|0,0,0]=3 21052 B13R1.382 CNC(=O)c1ccccc1COC 1626a_100102657272_100000737999 [0,3,0,0,0,0|0,0,0]=3 21053 B13R1.382 CNC(=O)c1ccccc1COC 240690a_100102657272_100000737999 [0,3,0,0,0,0|0,0,0]=3 21054 B13R1.382 CNC(=O)c1ccccc1COC 34a_100009855793_200000210301 [0,3,0,0,0,0|0,0,0]=3 21055 B13R1.382 CNC(=O)c1ccccc1COC 527a_100102657272_100000737999 [0,3,0,0,0,0|0,0,0]=3 21056 B13R1.382 CNC(=O)c1ccccc1COC 7a_100009855793_200000210301 [0,3,0,0,0,0|0,0,0]=3 21057 B13R1.382 CNC(=O)c1ccccc1CO[13CH3] 34a_100009855793_200025704644 [0,3,0,0,0,0|0,0,0]=3 21058 B13R1.382 CNC(=O)c1ccccc1CO[13CH3] 7a_100009855793_200025704644 [0,3,0,0,0,0|0,0,0]=3 21059 B13R1.382 CNC(=O)c1ccccc1N=[N+]=[N-] 240690a_100102657272_100009827904 [0,3,0,0,0,0|0,0,0]=3 21060 B13R1.382 CNC(=O)c1ccccc1NCF 34a_100000185696_100015361967 [0,3,0,0,0,0|0,0,0]=3 21061 B13R1.382 CNC(=O)c1ccccc1OCF 34a_100000185920_100015361967 [0,3,0,0,0,0|0,0,0]=3 21062 B13R1.382 CNC(=O)c1ccccc1OCF 7a_100000185920_100015361967 [0,3,0,0,0,0|0,0,0]=3 21063 B13R1.382 CNC(=O)c1ccccc1SCF 62a_100000155073_100015361967 [0,3,0,0,0,0|0,0,0]=3 21064 B13R1.382 CNC(=O)c1ccccc1SCF 62a_100015361967_100000155073 [0,3,0,0,0,0|0,0,0]=3 21065 B13R1.382 CNC(=O)c1cccnc1SCF 62a_100000159833_100015361967 [0,3,0,0,0,0|1,0,0]=4 21066 B13R1.382 CNC(=O)c1cccnc1SCF 62a_100015361967_100000159833 [0,3,0,0,0,0|1,0,0]=4 21067 B13R1.382 CNC(=O)c1ncccc1OCF 34a_100011376092_100015361967 [0,3,0,0,0,0|1,0,0]=4 21068 B13R1.382 CNC(=O)c1ncccc1OCF 7a_100011376092_100015361967 [0,3,0,0,0,0|1,0,0]=4 21069 B13R1.382 CNCc1ccccc1C(=O)OC 2230a_106832991635_100000744672 [0,3,0,0,0,0|1,0,0]=4 21070 B13R1.382 CNCc1ccccc1C(=O)OC 34a_100102657272_100000744672 [0,3,0,0,0,0|1,0,0]=4 21071 B13R1.382 CNCc1ccccc1C(=O)OC 7a_106832991635_100000744672 [0,3,0,0,0,0|1,0,0]=4 21072 B13R1.382 COC(=O)c1ccccc1CSC 62a_100000744672_200000210301 [0,3,0,0,0,0|1,0,0]=4 21073 B13R1.382 COC(=O)c1ccccc1CSC 62a_200000210301_100000744672 [0,3,0,0,0,0|1,0,0]=4 21074 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_100000744672_200025704644 [0,3,0,0,0,0|1,0,0]=4 21075 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_200025704644_100000744672 [0,3,0,0,0,0|1,0,0]=4 21076 B13R1.382 COC(=O)c1ccccc1OCF 7a_100000150335_100015361967 [0,3,0,0,0,0|1,0,0]=4 21077 B13R1.382 COC(=O)c1ccccc1SCF 62a_100000148710_100015361967 [0,3,0,0,0,0|1,0,0]=4 21078 B13R1.382 COC(=O)c1ccccc1SCF 62a_100015361967_100000148710 [0,3,0,0,0,0|1,0,0]=4 21079 B13R1.382 COCc1ccccc1C(=O)OC 34a_100138415774_100000744672 [0,3,0,0,0,0|1,0,0]=4 21080 B13R1.382 NNC(=O)c1ccccc1OCF 34a_100000186518_100015361967 [0,3,0,0,0,0|1,0,0]=4 21081 B13R1.382 NNC(=O)c1ccccc1SCF 62a_100000190081_100015361967 [0,3,0,0,0,0|1,0,0]=4 21082 B13R1.382 NNC(=O)c1ccccc1SCF 62a_100015361967_100000190081 [0,3,0,0,0,0|1,0,0]=4 21083 B13R1.382 O=C(NO)c1ccccc1OCF 34a_100000188472_100015361967 [0,3,0,0,0,0|1,0,0]=4 21084 B13R1.547 C=C(C)c1ccccc1C(=O)NC 271570a_100000694244_100000155073 [0,3,0,0,0,0|0,0,0]=3 21085 B13R1.547 C=C(C)c1ccccc1C(=O)NN 271570a_100000694244_100000190081 [0,3,0,0,0,0|1,0,0]=4 21086 B13R1.547 C=C(C)c1ccccc1C(=O)OC 271570a_100000694244_100000148710 [0,3,0,0,0,0|1,0,0]=4 21087 B13R1.547 C=C(C)c1ncccc1C(=O)NC 271570a_100000694244_100000159833 [0,3,0,0,0,0|1,0,0]=4 21088 B13R1.547 CCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210202 [0,3,0,0,0,0|1,0,0]=4 21089 B13R1.547 CCC(=O)c1ccccc1C(F)F 1458a_100009872251_100000210202 [0,3,0,0,0,0|1,0,0]=4 21090 B13R1.547 CCC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210202 [0,3,0,0,0,0|1,0,0]=4 21091 B13R1.547 CCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210202 [0,3,0,0,0,0|1,0,0]=4 21092 B13R1.547 CCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210202 [0,3,0,0,0,0|1,0,0]=4 21093 B13R1.547 CCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210202 [0,3,0,0,0,0|1,0,0]=4 21094 B13R1.547 CNC(=O)c1ccccc1C(C)C 11a_106832991635_100011941426 [0,3,0,0,0,0|0,0,0]=3 21095 B13R1.547 CNC(=O)c1ccccc1C(C)C 1626a_100102657272_100011941426 [0,3,0,0,0,0|0,0,0]=3 21096 B13R1.547 CNC(=O)c1ccccc1C(C)C 240690a_100102657272_100011941426 [0,3,0,0,0,0|0,0,0]=3 21097 B13R1.547 CNC(=O)c1ccccc1C(C)C 527a_100102657272_100011941426 [0,3,0,0,0,0|0,0,0]=3 21098 B13R1.547 CNC(=O)c1ccccc1C(F)F 11a_106832991635_100009872251 [0,3,0,0,0,0|0,0,0]=3 21099 B13R1.547 CNC(=O)c1ccccc1C(F)F 1626a_100102657272_100009872251 [0,3,0,0,0,0|0,0,0]=3 21100 B13R1.547 CNC(=O)c1ccccc1C(F)F 240690a_100102657272_100009872251 [0,3,0,0,0,0|0,0,0]=3 21101 B13R1.547 CNC(=O)c1ccccc1C(F)F 527a_100102657272_100009872251 [0,3,0,0,0,0|0,0,0]=3 21102 B13R1.547 CNC(=O)c1ccccc1I(=O)=O 1626a_100102657272_100000061294 [0,3,0,0,0,0|0,0,0]=3 21103 B13R1.547 CNC(=O)c1ccccc1I(=O)=O 240690a_100102657272_100000061294 [0,3,0,0,0,0|0,0,0]=3 21104 B13R1.547 CNC(=O)c1ccccc1N(C)C 11a_106832991635_100011218752 [0,3,0,0,0,0|0,0,0]=3 21105 B13R1.547 CNC(=O)c1ccccc1N(C)C 1626a_100102657272_100011218752 [0,3,0,0,0,0|0,0,0]=3 21106 B13R1.547 CNC(=O)c1ccccc1N(C)C 240690a_100102657272_100011218752 [0,3,0,0,0,0|0,0,0]=3 21107 B13R1.547 CNC(=O)c1ccccc1N(C)C 27a_100102631434_100000155073 [0,3,0,0,0,0|0,0,0]=3 21108 B13R1.547 CNC(=O)c1ccccc1N(C)C 527a_100102657272_100011218752 [0,3,0,0,0,0|0,0,0]=3 21109 B13R1.547 CNC(=O)c1ccccc1S(=O)C 1626a_100102657272_100000204632 [0,3,0,0,0,0|0,0,0]=3 21110 B13R1.547 CNC(=O)c1ccccc1S(=O)C 240690a_100102657272_100000204632 [0,3,0,0,0,0|0,0,0]=3 21111 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 11a_106832991635_100000188706 [0,3,0,0,0,0|0,0,0]=3 21112 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100102657272_100000188706 [0,3,0,0,0,0|0,0,0]=3 21113 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100102657272_100000188706 [0,3,0,0,0,0|0,0,0]=3 21114 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] 527a_100102657272_100000188706 [0,3,0,0,0,0|0,0,0]=3 21115 B13R1.547 CNC(=O)c1cccnc1N(C)C 27a_100102631434_100000159833 [0,3,0,0,0,0|1,0,0]=4 21116 B13R1.547 COC(=O)c1ccccc1C(=O)C 1458a_100011215673_200000210301 [0,3,0,0,0,0|1,0,0]=4 21117 B13R1.547 COC(=O)c1ccccc1C(=O)[13CH3] 1458a_100011215673_200025704644 [0,3,0,0,0,0|1,0,0]=4 21118 B13R1.547 COC(=O)c1ccccc1N(C)C 269982a_100000170468_200000210301 [0,3,0,0,0,0|1,0,0]=4 21119 B13R1.547 COC(=O)c1ccccc1N(C)C 34a_100000170468_200000210301 [0,3,0,0,0,0|1,0,0]=4 21120 B13R1.547 COC(=O)c1ccccc1N(C)[13CH3] 269982a_100000170468_200025704644 [0,3,0,0,0,0|1,0,0]=4 21121 B13R1.547 COC(=O)c1ccccc1N(C)[13CH3] 34a_100000170468_200025704644 [0,3,0,0,0,0|1,0,0]=4 21122 B13R1.2357 C=Cc1cccc(c1C(=O)NC)F 271570a_100011290941_100012642803 [0,3,0,0,0,0|0,0,0]=3 21123 B13R1.2357 C=Cc1cccc(c1C(=O)OC)Br 271570a_100011290941_100010247157 [0,3,0,0,0,0|1,0,0]=4 21124 B13R1.2357 C=Cc1cccc(c1C(=O)OC)C 271570a_100011290941_100010204206 [0,3,0,0,0,0|1,0,0]=4 21125 B13R1.2357 C=Cc1cccc(c1C(=O)OC)Cl 271570a_100011290941_100010150959 [0,3,0,0,0,0|1,0,0]=4 21126 B13R1.2357 C=Cc1cccc(c1C(=O)OC)F 271570a_100011290941_100000150693 [0,3,0,0,0,0|1,0,0]=4 21127 B13R1.2357 C=Cc1cccc(c1C(=O)OC)N 271570a_100011290941_100010253892 [0,3,0,0,0,0|1,0,0]=4 21128 B13R1.2357 CCC(=O)c1c(cccc1C#N)Br 1458a_200010145881_100000210202 [0,3,0,0,0,0|1,0,0]=4 21129 B13R1.2357 CCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000210202 [0,3,0,0,0,0|1,0,0]=4 21130 B13R1.2357 CCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000210202 [0,3,0,0,0,0|1,0,0]=4 21131 B13R1.2357 CCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000210202 [0,3,0,0,0,0|1,0,0]=4 21132 B13R1.2357 CCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000210202 [0,3,0,0,0,0|1,0,0]=4 21133 B13R1.2357 CCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000210202 [0,3,0,0,0,0|1,0,0]=4 21134 B13R1.2357 CCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000210202 [0,3,0,0,0,0|1,0,0]=4 21135 B13R1.2357 CNC(=O)c1c(cccc1C#N)Br 240690a_100102657272_200010145881 [0,3,0,0,0,0|0,0,0]=3 21136 B13R1.2357 CNC(=O)c1c(cccc1NC)F 27a_100102657272_100012642803 [0,3,0,0,0,0|0,0,0]=3 21137 B13R1.2357 CNC(=O)c1c(cccc1OC)Br 11a_106832991635_100011593405 [0,3,0,0,0,0|0,0,0]=3 21138 B13R1.2357 CNC(=O)c1c(cccc1OC)Br 1626a_100102657272_100011593405 [0,3,0,0,0,0|0,0,0]=3 21139 B13R1.2357 CNC(=O)c1c(cccc1OC)Br 240690a_100102657272_100011593405 [0,3,0,0,0,0|0,0,0]=3 21140 B13R1.2357 CNC(=O)c1c(cccc1OC)Br 527a_100102657272_100011593405 [0,3,0,0,0,0|0,0,0]=3 21141 B13R1.2357 CNC(=O)c1c(cccc1OC)C 11a_106832991635_100000066212 [0,3,0,0,0,0|0,0,0]=3 21142 B13R1.2357 CNC(=O)c1c(cccc1OC)C 1626a_100102657272_100000066212 [0,3,0,0,0,0|0,0,0]=3 21143 B13R1.2357 CNC(=O)c1c(cccc1OC)C 240690a_100102657272_100000066212 [0,3,0,0,0,0|0,0,0]=3 21144 B13R1.2357 CNC(=O)c1c(cccc1OC)Cl 11a_106832991635_100000743539 [0,3,0,0,0,0|0,0,0]=3 21145 B13R1.2357 CNC(=O)c1c(cccc1OC)Cl 1626a_100102657272_100000743539 [0,3,0,0,0,0|0,0,0]=3 21146 B13R1.2357 CNC(=O)c1c(cccc1OC)Cl 240690a_100102657272_100000743539 [0,3,0,0,0,0|0,0,0]=3 21147 B13R1.2357 CNC(=O)c1c(cccc1OC)Cl 527a_100102657272_100000743539 [0,3,0,0,0,0|0,0,0]=3 21148 B13R1.2357 CNC(=O)c1c(cccc1OC)F 11a_106832991635_100000759380 [0,3,0,0,0,0|0,0,0]=3 21149 B13R1.2357 CNC(=O)c1c(cccc1OC)F 1626a_100102657272_100000759380 [0,3,0,0,0,0|0,0,0]=3 21150 B13R1.2357 CNC(=O)c1c(cccc1OC)F 240690a_100102657272_100000759380 [0,3,0,0,0,0|0,0,0]=3 21151 B13R1.2357 CNC(=O)c1c(cccc1OC)F 527a_100102657272_100000759380 [0,3,0,0,0,0|0,0,0]=3 21152 B13R1.2357 CNC(=O)c1c(cccc1OC)I 11a_106832991635_100010179659 [0,3,0,0,0,0|0,0,0]=3 21153 B13R1.2357 CNC(=O)c1c(cccc1OC)I 1626a_100102657272_100010179659 [0,3,0,0,0,0|0,0,0]=3 21154 B13R1.2357 CNC(=O)c1c(cccc1OC)I 240690a_100102657272_100010179659 [0,3,0,0,0,0|0,0,0]=3 21155 B13R1.2357 CNC(=O)c1c(cccc1OC)I 527a_100102657272_100010179659 [0,3,0,0,0,0|0,0,0]=3 21156 B13R1.2357 CNC(=O)c1c(cccc1OC)O 240690a_100102657272_100000043310 [0,3,0,0,0,0|0,0,0]=3 21157 B13R1.2357 CNC(=O)c1c(cccc1SC)F 62a_100012642803_200000210301 [0,3,0,0,0,0|0,0,0]=3 21158 B13R1.2357 CNC(=O)c1c(cccc1SC)F 62a_200000210301_100012642803 [0,3,0,0,0,0|0,0,0]=3 21159 B13R1.2357 CNC(=O)c1c(cccc1S[13CH3])F 62a_100012642803_200025704644 [0,3,0,0,0,0|0,0,0]=3 21160 B13R1.2357 CNC(=O)c1c(cccc1S[13CH3])F 62a_200025704644_100012642803 [0,3,0,0,0,0|0,0,0]=3 21161 B13R1.2357 COC(=O)c1c(cccc1C#N)O 271570a_203496583355_100009843633 [0,3,0,0,0,0|1,0,0]=4 21162 B13R1.2357 COC(=O)c1c(cccc1OC)C 34a_100000084604_200000210301 [0,3,0,0,0,0|1,0,0]=4 21163 B13R1.2357 COC(=O)c1c(cccc1OC)C 7a_100000084604_200000210301 [0,3,0,0,0,0|1,0,0]=4 21164 B13R1.2357 COC(=O)c1c(cccc1OC)Cl 34a_200000055445_200000210301 [0,3,0,0,0,0|1,0,0]=4 21165 B13R1.2357 COC(=O)c1c(cccc1OC)Cl 7a_200000055445_200000210301 [0,3,0,0,0,0|1,0,0]=4 21166 B13R1.2357 COC(=O)c1c(cccc1OC)F 34a_100011216559_200000210301 [0,3,0,0,0,0|1,0,0]=4 21167 B13R1.2357 COC(=O)c1c(cccc1OC)F 7a_100011216559_200000210301 [0,3,0,0,0,0|1,0,0]=4 21168 B13R1.2357 COC(=O)c1c(cccc1OC)O 271570a_203496583355_100010189552 [0,3,0,0,0,0|1,0,0]=4 21169 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])C 34a_100000084604_200025704644 [0,3,0,0,0,0|1,0,0]=4 21170 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])C 7a_100000084604_200025704644 [0,3,0,0,0,0|1,0,0]=4 21171 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])Cl 34a_200000055445_200025704644 [0,3,0,0,0,0|1,0,0]=4 21172 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])Cl 7a_200000055445_200025704644 [0,3,0,0,0,0|1,0,0]=4 21173 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])F 34a_100011216559_200025704644 [0,3,0,0,0,0|1,0,0]=4 21174 B13R1.2357 COC(=O)c1c(cccc1O[13CH3])F 7a_100011216559_200025704644 [0,3,0,0,0,0|1,0,0]=4 21175 B13R1.2357 COC(=O)c1c(cccc1SC)Br 62a_100010247157_200000210301 [0,3,0,0,0,0|1,0,0]=4 21176 B13R1.2357 COC(=O)c1c(cccc1SC)Br 62a_200000210301_100010247157 [0,3,0,0,0,0|1,0,0]=4 21177 B13R1.2357 COC(=O)c1c(cccc1SC)C 62a_100010204206_200000210301 [0,3,0,0,0,0|1,0,0]=4 21178 B13R1.2357 COC(=O)c1c(cccc1SC)C 62a_200000210301_100010204206 [0,3,0,0,0,0|1,0,0]=4 21179 B13R1.2357 COC(=O)c1c(cccc1SC)Cl 62a_100010150959_200000210301 [0,3,0,0,0,0|1,0,0]=4 21180 B13R1.2357 COC(=O)c1c(cccc1SC)Cl 62a_200000210301_100010150959 [0,3,0,0,0,0|1,0,0]=4 21181 B13R1.2357 COC(=O)c1c(cccc1SC)F 62a_100000150693_200000210301 [0,3,0,0,0,0|1,0,0]=4 21182 B13R1.2357 COC(=O)c1c(cccc1SC)F 62a_200000210301_100000150693 [0,3,0,0,0,0|1,0,0]=4 21183 B13R1.2357 COC(=O)c1c(cccc1SC)N 62a_100010253892_200000210301 [0,3,0,0,0,0|1,0,0]=4 21184 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])Br 62a_100010247157_200025704644 [0,3,0,0,0,0|1,0,0]=4 21185 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])Br 62a_200025704644_100010247157 [0,3,0,0,0,0|1,0,0]=4 21186 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])C 62a_100010204206_200025704644 [0,3,0,0,0,0|1,0,0]=4 21187 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])C 62a_200025704644_100010204206 [0,3,0,0,0,0|1,0,0]=4 21188 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])Cl 62a_100010150959_200025704644 [0,3,0,0,0,0|1,0,0]=4 21189 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])Cl 62a_200025704644_100010150959 [0,3,0,0,0,0|1,0,0]=4 21190 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])F 62a_100000150693_200025704644 [0,3,0,0,0,0|1,0,0]=4 21191 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])F 62a_200025704644_100000150693 [0,3,0,0,0,0|1,0,0]=4 21192 B13R1.2357 COC(=O)c1c(cccc1S[13CH3])N 62a_100010253892_200025704644 [0,3,0,0,0,0|1,0,0]=4 21193 B9R1.3 Cn1cccc(c1=O)O 271570a_203496583355_100000687173 [1,0,1,1,0,0|1,0,0]=4 21194 B11R1.14 C=Cc1cc(=O)n(c(=O)[nH]1)C 271570a_100011290941_100000723047 [0,0,1,1,0,1|1,0,0]=4 21195 B11R1.277 C=Cc1cc(c(=O)[nH]c1C)N 271570a_100011290941_100010126670 [0,1,1,1,0,0|1,0,0]=4 21196 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [0,1,1,1,0,0|1,0,0]=4 21197 B11R1.265 C=Cc1cccc(c1NC)N 271570a_100011290941_100010510394 [0,1,1,1,0,0|1,0,0]=4 21198 B11R1.267 C=Cc1cccc(c1N)NC 271570a_100011290941_100000695761 [0,1,1,1,0,0|1,0,0]=4 21199 B11R1.25 CCC(=O)C=Cc1cccs1 1458a_100000182767_100000210202 [0,1,1,1,0,0|1,0,0]=4 21200 B11R1.25 CCC(=O)C=Cc1ccoc1 1458a_100000238621_100000210202 [0,1,1,1,0,0|1,0,0]=4 21201 B11R1.25 CCC(=O)C=Cc1ccsc1 1458a_100000698588_100000210202 [0,1,1,1,0,0|1,0,0]=4 21202 B11R1.25 CNC(=O)C=Cc1c[nH]cn1 240690a_100102657272_100102678534 [0,1,1,1,0,0|1,0,0]=4 21203 B11R1.25 CNC(=O)C=Cc1cccs1 11a_106832991635_100000182767 [0,1,1,1,0,0|0,0,0]=3 21204 B11R1.25 CNC(=O)C=Cc1cccs1 1626a_100102657272_100000182767 [0,1,1,1,0,0|0,0,0]=3 21205 B11R1.25 CNC(=O)C=Cc1cccs1 240690a_100102657272_100000182767 [0,1,1,1,0,0|0,0,0]=3 21206 B11R1.25 CNC(=O)C=Cc1ccoc1 11a_106832991635_100000238621 [0,1,1,1,0,0|0,0,0]=3 21207 B11R1.25 CNC(=O)C=Cc1ccoc1 1626a_100102657272_100000238621 [0,1,1,1,0,0|0,0,0]=3 21208 B11R1.25 CNC(=O)C=Cc1ccoc1 240690a_100102657272_100000238621 [0,1,1,1,0,0|0,0,0]=3 21209 B11R1.25 CNC(=O)C=Cc1ccsc1 11a_106832991635_100000698588 [0,1,1,1,0,0|0,0,0]=3 21210 B11R1.25 CNC(=O)C=Cc1ccsc1 1626a_100102657272_100000698588 [0,1,1,1,0,0|0,0,0]=3 21211 B11R1.25 CNC(=O)C=Cc1ccsc1 240690a_100102657272_100000698588 [0,1,1,1,0,0|0,0,0]=3 21212 B11R1.25 CNC(=O)C=Cc1ccsc1 527a_100102657272_100000698588 [0,1,1,1,0,0|0,0,0]=3 21213 B11R1.25 CNC(=O)C=Cc1cscn1 11a_106832991635_200000747928 [0,1,1,1,0,0|1,0,0]=4 21214 B11R1.25 CNC(=O)C=Cc1cscn1 1626a_100102657272_200000747928 [0,1,1,1,0,0|1,0,0]=4 21215 B11R1.25 CNC(=O)C=Cc1cscn1 240690a_100102657272_200000747928 [0,1,1,1,0,0|1,0,0]=4 21216 B11R1.25 CNC(=O)C=Cc1nccs1 11a_106832991635_100102558208 [0,1,1,1,0,0|1,0,0]=4 21217 B11R1.25 CNC(=O)C=Cc1nccs1 240690a_100102657272_100102558208 [0,1,1,1,0,0|1,0,0]=4 21218 B13R2.10 O=C1C=C(CC1)c2ccccc2 271570a_100010737933_100000210277 [0,0,0,1,0,2|1,0,0]=4 21219 B13R2.27 O=C1CCC1Nc2ccccc2 34a_100000106764_100009892977 [0,0,0,1,0,2|1,0,0]=4 21220 B13R2.27 O=C1CCC1Oc2ccccc2 34a_100000210340_100009892977 [0,0,0,1,0,2|1,0,0]=4 21221 B13R2.27 O=C1CCC1Oc2ccccc2 7a_100000210340_100009892977 [0,0,0,1,0,2|1,0,0]=4 21222 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100000719477_100009892977 [0,0,0,1,0,2|1,0,0]=4 21223 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100009892977_100000041952 [0,0,0,1,0,2|1,0,0]=4 21224 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,0,0,1,0,2|1,0,0]=4 21225 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,0,0,1,0,2|1,0,0]=4 21226 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [0,0,0,1,0,2|1,0,0]=4 21227 B13R2.57 CNc1cnc2ccccc2n1 27a_100102657272_100000756483 [0,0,0,1,0,2|1,0,0]=4 21228 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [0,0,0,1,0,2|1,0,0]=4 21229 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,0,0,1,0,2|1,0,0]=4 21230 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,0,0,1,0,2|1,0,0]=4 21231 B13R2.15272 CCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210202 [0,0,0,1,0,2|1,0,0]=4 21232 B13R2.15272 CNC(=O)C1Cc2c1cccc2 11a_106832991635_200000238571 [0,0,0,1,0,2|0,0,0]=3 21233 B13R2.15272 CNC(=O)C1Cc2c1cccc2 1626a_100102657272_200000238571 [0,0,0,1,0,2|0,0,0]=3 21234 B13R2.15272 CNC(=O)C1Cc2c1cccc2 240690a_100102657272_200000238571 [0,0,0,1,0,2|0,0,0]=3 21235 B13R2.15272 CNC(=O)C1Cc2c1cccc2 527a_100102657272_200000238571 [0,0,0,1,0,2|0,0,0]=3 21236 B13R2.1139 CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210202 [0,0,0,1,0,2|1,0,0]=4 21237 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 11a_106832991635_100000137882 [0,0,0,1,0,2|0,0,0]=3 21238 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 1626a_100102657272_100000137882 [0,0,0,1,0,2|0,0,0]=3 21239 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 240690a_100102657272_100000137882 [0,0,0,1,0,2|0,0,0]=3 21240 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 527a_100102657272_100000137882 [0,0,0,1,0,2|0,0,0]=3 21241 B13R2.26 CCNc1nc2ccccc2[nH]1 27a_100015525214_100009814255 [0,1,0,1,0,1|1,0,0]=4 21242 B13R2.26 CCNc1nc2ccccc2s1 27a_100015525214_100000751744 [0,1,0,1,0,1|0,1,0]=4 21243 B13R2.26 CNCc1cc2ccccc2[nH]1 270004a_106832991635_100000051030 [0,1,0,1,0,1|1,0,0]=4 21244 B13R2.26 CNCc1cc2ccccc2o1 207a_100102657272_100000229944 [0,1,0,1,0,1|0,0,1]=4 21245 B13R2.26 CNCc1cc2ccccc2o1 270004a_106832991635_100000229944 [0,1,0,1,0,1|0,0,1]=4 21246 B13R2.26 CNCc1cc2ccccc2s1 207a_100102657272_100000686906 [0,1,0,1,0,1|0,1,0]=4 21247 B13R2.26 CNCc1cc2ccccc2s1 2230a_100015187092_200000210301 [0,1,0,1,0,1|0,1,0]=4 21248 B13R2.26 CNCc1cc2ccccc2s1 270004a_106832991635_100000686906 [0,1,0,1,0,1|0,1,0]=4 21249 B13R2.26 CNCc1nc2ccccc2[nH]1 207a_100102657272_100000185668 [0,1,0,1,0,1|1,0,0]=4 21250 B13R2.26 CNCc1nc2ccccc2[nH]1 2230a_106832991635_100000737899 [0,1,0,1,0,1|1,0,0]=4 21251 B13R2.26 CNCc1nc2ccccc2[nH]1 270004a_106832991635_100000185668 [0,1,0,1,0,1|1,0,0]=4 21252 B13R2.26 CNCc1nc2ccccc2[nH]1 7a_106832991635_100000737899 [0,1,0,1,0,1|1,0,0]=4 21253 B13R2.26 CNCc1nc2ccccc2o1 2230a_106832991635_100000195508 [0,1,0,1,0,1|0,0,1]=4 21254 B13R2.26 CNCc1nc2ccccc2o1 34a_100102657272_200012361514 [0,1,0,1,0,1|0,0,1]=4 21255 B13R2.26 CNCc1nc2ccccc2o1 7a_106832991635_100000195508 [0,1,0,1,0,1|0,0,1]=4 21256 B13R2.26 CNCc1nc2ccccc2s1 2230a_106832991635_100000766747 [0,1,0,1,0,1|0,1,0]=4 21257 B13R2.26 CNCc1nc2ccccc2s1 270004a_106832991635_100011204187 [0,1,0,1,0,1|0,1,0]=4 21258 B13R2.26 CNCc1nc2ccccc2s1 34a_100102657272_100011217541 [0,1,0,1,0,1|0,1,0]=4 21259 B13R2.26 CNCc1nc2ccccc2s1 7a_106832991635_100011217541 [0,1,0,1,0,1|0,1,0]=4 21260 B13R2.26 [13CH3]NCc1cc2ccccc2s1 2230a_100015187092_200025704644 [0,1,0,1,0,1|0,1,0]=4 21261 B13R2.135 CSC1C(=O)Nc2c1cccc2 62a_200000210301_200009996675 [0,1,0,1,0,1|1,0,0]=4 21262 B13R2.135 [13CH3]SC1C(=O)Nc2c1cccc2 62a_200025704644_200009996675 [0,1,0,1,0,1|1,0,0]=4 21263 B13R2.444 O=C(Cc1ccccc1)C2CC2 1458a_100000210395_100015291786 [0,1,0,1,0,1|1,0,0]=4 21264 B13R2.444 O=C(Cc1ccccc1)C2CO2 1458a_100000701028_100015291786 [0,1,0,1,0,1|1,0,0]=4 21265 B13R2.444 O=C(Nc1ccccc1)C2CC2 11a_100000106764_100000210395 [0,1,0,1,0,1|1,0,0]=4 21266 B13R2.444 O=C(Nc1ccccc1)C2CC2 1626a_100000106764_100000210395 [0,1,0,1,0,1|1,0,0]=4 21267 B13R2.444 O=C(Nc1ccccc1)C2CC2 22a_100000106764_100000210395 [0,1,0,1,0,1|1,0,0]=4 21268 B13R2.444 O=C(Nc1ccccc1)C2CC2 527a_100000106764_100000210395 [0,1,0,1,0,1|1,0,0]=4 21269 B13R2.444 O=C(Nc1ccccc1)C2CO2 11a_100000106764_100000701028 [0,1,0,1,0,1|1,0,0]=4 21270 B13R2.444 O=C(Nc1ccccc1)C2CO2 1626a_100000106764_100000701028 [0,1,0,1,0,1|1,0,0]=4 21271 B13R2.444 O=C(Nc1ccccc1)C2CO2 22a_100000106764_100000701028 [0,1,0,1,0,1|1,0,0]=4 21272 B13R2.444 O=C(Nc1ccccc1)C2CO2 527a_100000106764_100000701028 [0,1,0,1,0,1|1,0,0]=4 21273 B13R2.45 C=Cc1nc2ccccc2n1C 271570a_100011290941_200000239431 [0,1,0,1,0,1|1,0,0]=4 21274 B13R2.45 CNc1nc2ccccc2n1C 27a_100102657272_200000239431 [0,1,0,1,0,1|1,0,0]=4 21275 B13R2.45 COc1cc2ccccc2n1C 34a_100000066695_200000210301 [0,1,0,1,0,1|0,0,1]=4 21276 B13R2.45 CSc1nc2ccccc2n1C 62a_200000210301_200000239431 [0,1,0,1,0,1|0,1,0]=4 21277 B13R2.45 CSc1nc2ccccc2n1C 62a_200000239431_200000210301 [0,1,0,1,0,1|0,1,0]=4 21278 B13R2.45 Cn1c(cc2c1cccc2)O[13CH3] 34a_100000066695_200025704644 [0,1,0,1,0,1|0,0,1]=4 21279 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200000239431_200025704644 [0,1,0,1,0,1|0,1,0]=4 21280 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200025704644_200000239431 [0,1,0,1,0,1|0,1,0]=4 21281 B13R2.435 CN(C)c1nc2ccccc2[nH]1 27a_100102631434_100009814255 [0,1,0,1,0,1|1,0,0]=4 21282 B13R2.435 CN(C)c1nc2ccccc2s1 27a_100102631434_100000751744 [0,1,0,1,0,1|0,1,0]=4 21283 B13R2.43 CNc1nc2cc(ccc2s1)F 27a_100102657272_200010206605 [0,1,0,1,0,1|0,1,0]=4 21284 B13R2.43 CNc1nc2cc(ccc2s1)N 27a_100102657272_100010329861 [0,1,0,1,0,1|0,1,0]=4 21285 B13R2.43 CNc1nc2ccc(cc2s1)C 27a_100102657272_100010186437 [0,1,0,1,0,1|0,1,0]=4 21286 B13R2.43 CNc1nc2ccc(cc2s1)F 27a_100102657272_100000751617 [0,1,0,1,0,1|0,1,0]=4 21287 B13R2.43 CNc1nc2ccc(cc2s1)N 27a_100102657272_100010253933 [0,1,0,1,0,1|0,1,0]=4 21288 B13R2.43 CNc1nc2ccc(cc2s1)O 271570a_203496583355_100012351673 [0,1,0,1,0,1|0,1,0]=4 21289 B13R2.43 CNc1nc2ccc(cc2s1)O 27a_100102657272_100010063415 [0,1,0,1,0,1|0,1,0]=4 21290 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,1,0,1,0,1|1,0,0]=4 21291 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [0,1,0,1,0,1|0,0,0]=3 21292 B13R2.3028 Cc1nc2ccc(cc2n1C)O 271570a_203496583355_200010218347 [0,1,0,1,0,1|1,0,0]=4 21293 B13R2.3028 Cn1c(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100010393459 [0,1,0,1,0,1|0,0,0]=3 21294 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,1,0,1,0,1|1,0,0]=4 21295 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,1,0,1,0,1|1,0,0]=4 21296 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,1,0,1,0,1|1,0,0]=4 21297 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,1,0,1,0,1|0,0,0]=3 21298 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,1,0,1,0,1|0,0,0]=3 21299 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,1,0,1,0,1|1,0,0]=4 21300 B13R2.54 CNc1nc2c(cccc2s1)C 27a_100102657272_100010008827 [0,1,0,1,0,1|0,1,0]=4 21301 B13R2.54 CNc1nc2c(cccc2s1)F 27a_100102657272_100010008856 [0,1,0,1,0,1|0,1,0]=4 21302 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,1,0,1,0,1|1,0,0]=4 21303 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,1,0,1,0,1|1,0,0]=4 21304 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [0,1,0,1,0,1|0,0,0]=3 21305 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,1,0,1|1,0,0]=4 21306 B13R2.4856 CN1C(=O)Cc2c1c(ccc2)O 271570a_203496583355_100010870571 [0,1,0,1,0,1|0,0,0]=3 21307 B13R2.4856 Cn1c(=O)[nH]c2c1c(ccc2)O 271570a_203496583355_100010994120 [0,1,0,1,0,1|0,0,0]=3 21308 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,1,0,1|1,0,0]=4 21309 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,1,0,1|1,0,0]=4 21310 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,1,0,1|1,0,0]=4 21311 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,1,0,1,0,1|1,0,0]=4 21312 B13R2.5190 CN1C(=O)Cc2c1ccc(c2)O 271570a_203496583355_100000183948 [0,1,0,1,0,1|0,0,0]=3 21313 B13R2.5190 Cc1nc2cc(ccc2n1C)O 271570a_203496583355_100000729442 [0,1,0,1,0,1|1,0,0]=4 21314 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,1,0,1,0,1|0,0,0]=3 21315 B13R2.5190 Cn1c(nc2c1ccc(c2)O)O 271570a_203496583355_100013992850 [0,1,0,1,0,1|0,0,1]=4 21316 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,1,0,1,0,1|1,0,0]=4 21317 B13R2.1 CNCc1coc2c1cccc2 207a_100102657272_100000688544 [0,2,0,1,0,0|0,0,1]=4 21318 B13R2.1 CNCc1coc2c1cccc2 270004a_106832991635_100000688544 [0,2,0,1,0,0|0,0,1]=4 21319 B13R2.1 CNCc1csc2c1cccc2 207a_100102657272_100000239721 [0,2,0,1,0,0|0,1,0]=4 21320 B13R2.1 CNCc1csc2c1cccc2 2230a_106832991635_200000742921 [0,2,0,1,0,0|0,1,0]=4 21321 B13R2.1 CNCc1csc2c1cccc2 270004a_106832991635_100000239721 [0,2,0,1,0,0|0,1,0]=4 21322 B13R2.1 CNCc1csc2c1cccc2 34a_100000744611_200000210301 [0,2,0,1,0,0|0,1,0]=4 21323 B13R2.1 CNCc1csc2c1cccc2 34a_100102657272_200000742921 [0,2,0,1,0,0|0,1,0]=4 21324 B13R2.1 CNCc1n[nH]c2c1cccc2 207a_100102657272_100000059708 [0,2,0,1,0,0|1,0,0]=4 21325 B13R2.1 CNCc1n[nH]c2c1cccc2 270004a_106832991635_100000059708 [0,2,0,1,0,0|1,0,0]=4 21326 B13R2.1 CNCc1noc2c1cccc2 34a_100102657272_100009813815 [0,2,0,1,0,0|0,0,1]=4 21327 B13R2.1 CNCc1noc2c1cccc2 7a_106832991635_100009813815 [0,2,0,1,0,0|0,0,1]=4 21328 B13R2.1 [13CH3]NCc1csc2c1cccc2 34a_100000744611_200025704644 [0,2,0,1,0,0|0,1,0]=4 21329 B13R2.3 C1=C(CCNC1)c2ccccc2 271570a_100000731432_100000210277 [0,2,0,1,0,0|1,0,0]=4 21330 B13R2.1613 CNc1cccc2c1cccc2 34a_100000185869_200000210301 [0,2,0,1,0,0|1,0,0]=4 21331 B13R2.1613 CNc1ccnc2c1cccc2 27a_100102657272_100011215880 [0,2,0,1,0,0|1,0,0]=4 21332 B13R2.1613 CNc1cnnc2c1cccc2 27a_100102657272_100000063506 [0,2,0,1,0,0|1,0,0]=4 21333 B13R2.1613 CNc1nccc2c1cccc2 27a_100102657272_100011934041 [0,2,0,1,0,0|1,0,0]=4 21334 B13R2.1613 CNc1ncnc2c1cccc2 27a_100102657272_100000217608 [0,2,0,1,0,0|1,0,0]=4 21335 B13R2.1613 [13CH3]Nc1cccc2c1cccc2 34a_100000185869_200025704644 [0,2,0,1,0,0|1,0,0]=4 21336 B13R2.2931 C=Cc1nn(c2c1cccc2)C 271570a_100011290941_100009817141 [0,2,0,1,0,0|1,0,0]=4 21337 B13R2.2931 CCn1nc(c2c1cccc2)O 271570a_203496583355_200010288290 [0,2,0,1,0,0|0,0,1]=4 21338 B13R2.2931 CNC1CC(=O)c2c1cccc2 2230a_106832991635_100010208147 [0,2,0,1,0,0|0,0,0]=3 21339 B13R2.2931 CNC1CC(=O)c2c1cccc2 7a_106832991635_100010208147 [0,2,0,1,0,0|0,0,0]=3 21340 B13R2.2931 CNC1OC(=O)c2c1cccc2 2230a_106832991635_100009813457 [0,2,0,1,0,0|0,0,0]=3 21341 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_100010208147_200000210301 [0,2,0,1,0,0|1,0,0]=4 21342 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_200000210301_100010208147 [0,2,0,1,0,0|1,0,0]=4 21343 B13R2.2931 CSC1OC(=O)c2c1cccc2 62a_200000210301_100009813457 [0,2,0,1,0,0|1,0,0]=4 21344 B13R2.2931 CSc1nn(c2c1cccc2)C 62a_100009817141_200000210301 [0,2,0,1,0,0|0,1,0]=4 21345 B13R2.2931 CSc1nn(c2c1cccc2)C 62a_200000210301_100009817141 [0,2,0,1,0,0|0,1,0]=4 21346 B13R2.2931 Cn1nc(c2c1cccc2)S[13CH3] 62a_100009817141_200025704644 [0,2,0,1,0,0|0,1,0]=4 21347 B13R2.2931 Cn1nc(c2c1cccc2)S[13CH3] 62a_200025704644_100009817141 [0,2,0,1,0,0|0,1,0]=4 21348 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_100010208147_200025704644 [0,2,0,1,0,0|1,0,0]=4 21349 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_200025704644_100010208147 [0,2,0,1,0,0|1,0,0]=4 21350 B13R2.2931 [13CH3]SC1OC(=O)c2c1cccc2 62a_200025704644_100009813457 [0,2,0,1,0,0|1,0,0]=4 21351 B13R2.72 CC(=O)C1=CCc2c1cccc2 1458a_100000037392_200000210301 [0,2,0,1,0,0|1,0,0]=4 21352 B13R2.72 [13CH3]C(=O)C1=CCc2c1cccc2 1458a_100000037392_200025704644 [0,2,0,1,0,0|1,0,0]=4 21353 B13R2.520 O=C(c1ccc(cc1)O)C2CC2 271570a_203496583355_100000764646 [0,2,0,1,0,0|1,0,0]=4 21354 B13R2.5187 Cc1ccc2c(c1)c(nn2C)O 271570a_203496583355_100000123007 [0,2,0,1,0,0|0,0,1]=4 21355 B13R2.5187 Cc1ccc2c(nn(c2c1)C)O 271570a_203496583355_100010073239 [0,2,0,1,0,0|0,0,1]=4 21356 B13R2.5187 Cc1nn(c2c1cc(cc2)O)C 271570a_203496583355_100010255089 [0,2,0,1,0,0|1,0,0]=4 21357 B13R2.5187 Cc1nn(c2c1ccc(c2)O)C 271570a_203496583355_100010255092 [0,2,0,1,0,0|1,0,0]=4 21358 B13R2.5187 Cn1[nH]c(=O)c2c1cc(cc2)O 271570a_203496583355_100011014602 [0,2,0,1,0,0|0,0,0]=3 21359 B13R2.5187 Cn1nc(c2c1cc(cc2)Br)O 271570a_203496583355_100010161269 [0,2,0,1,0,0|0,0,1]=4 21360 B13R2.5187 Cn1nc(c2c1cc(cc2)F)O 271570a_203496583355_100010161261 [0,2,0,1,0,0|0,0,1]=4 21361 B13R2.5187 Cn1nc(c2c1cc(cc2)N)O 271570a_203496583355_100010163569 [0,2,0,1,0,0|0,0,1]=4 21362 B13R2.5187 Cn1nc(c2c1cc(cc2)O)N 271570a_203496583355_100010244983 [0,2,0,1,0,0|1,0,0]=4 21363 B13R2.5187 Cn1nc(c2c1ccc(c2)Br)O 271570a_203496583355_100010161270 [0,2,0,1,0,0|0,0,1]=4 21364 B13R2.5187 Cn1nc(c2c1ccc(c2)F)O 271570a_203496583355_200000123018 [0,2,0,1,0,0|0,0,1]=4 21365 B13R2.5187 Cn1nc(c2c1ccc(c2)N)O 271570a_203496583355_100010234897 [0,2,0,1,0,0|0,0,1]=4 21366 B13R2.5187 Cn1nc(c2c1ccc(c2)O)N 271570a_203496583355_100010240166 [0,2,0,1,0,0|1,0,0]=4 21367 B13R2.5187 Cn1nc(c2c1ccc(c2)O)O 271570a_203496583355_100015481540 [0,2,0,1,0,0|0,0,1]=4 21368 B13R2.5187 O=C1NC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185758 [0,2,0,1,0,0|0,0,1]=4 21369 B13R2.342 O=C1CCCc2c1cccc2O 271570a_203496583355_100000691372 [0,2,0,1,0,0|1,0,0]=4 21370 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [0,2,0,1,0,0|1,0,0]=4 21371 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [0,2,0,1,0,0|1,0,0]=4 21372 B13R2.342 O=C1CCSc2c1cccc2O 271570a_203496583355_100011271337 [0,2,0,1,0,0|1,0,0]=4 21373 B13R2.342 O=C1NCCc2c1cccc2O 271570a_203496583355_100000695023 [0,2,0,1,0,0|0,0,0]=3 21374 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [0,2,0,1,0,0|0,0,1]=4 21375 B13R2.4857 Cc1cccc2c1c(nn2C)O 271570a_203496583355_100000123023 [0,2,0,1,0,0|0,0,1]=4 21376 B13R2.4857 Cn1nc(c2c1cccc2F)O 271570a_203496583355_200010161262 [0,2,0,1,0,0|0,0,1]=4 21377 B13R2.4857 Cn1nc(c2c1cccc2N)O 271570a_203496583355_100010235561 [0,2,0,1,0,0|0,0,1]=4 21378 B13R2.4857 Cn1nc(c2c1cccc2O)N 271570a_203496583355_100010211377 [0,2,0,1,0,0|1,0,0]=4 21379 B13R2.4857 O=C1NC(=O)c2c1cccc2O 271570a_203496583355_100010194295 [0,2,0,1,0,0|0,0,1]=4 21380 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [0,2,0,1,0,0|0,0,1]=4 21381 B13R2.690 O=C(CC1CC1)c2ccccc2 1458a_100000185807_100000742324 [0,2,0,1,0,0|1,0,0]=4 21382 B13R2.690 O=C(CC1CO1)c2ccccc2 1458a_100000185807_100011216344 [0,2,0,1,0,0|1,0,0]=4 21383 B13R2.690 O=C(CC1CS1)c2ccccc2 1458a_100000185807_100000031435 [0,2,0,1,0,0|1,0,0]=4 21384 B13R2.690 O=C(C[C@@H]1CO1)c2ccccc2 1458a_100000185807_100000745022 [0,2,0,1,0,0|1,0,0]=4 21385 B13R2.690 O=C(NC1CC1)c2ccccc2 1626a_100000212008_100000185807 [0,2,0,1,0,0|0,0,0]=3 21386 B13R2.690 O=C(NC1CC1)c2ccccc2 240690a_100000212008_100000185807 [0,2,0,1,0,0|0,0,0]=3 21387 B13R2.690 O=C(NC1CC1)c2ccccc2 527a_100000212008_100000185807 [0,2,0,1,0,0|0,0,0]=3 21388 B13R2.1028 CCNN=C1Cc2c1cccc2 4a_100000756455_100000051409 [0,2,0,1,0,0|1,0,0]=4 21389 B13R2.4818 O=C1CCCc2c1c(ccc2)O 271570a_203496583355_100009816782 [0,2,0,1,0,0|1,0,0]=4 21390 B13R2.4818 O=C1CCOc2c1c(ccc2)O 271570a_203496583355_100010205896 [0,2,0,1,0,0|1,0,0]=4 21391 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [0,2,0,1,0,0|0,0,1]=4 21392 B13R2.2130 C=Cc1ccc2c(=O)[nH][nH]c2c1 271570a_100011290941_100012353722 [0,2,0,1,0,0|1,0,0]=4 21393 B13R2.2130 C=Cc1ccc2c(c1)CCC2=O 271570a_100011290941_100000737041 [0,2,0,1,0,0|1,0,0]=4 21394 B13R2.2130 C=Cc1ccc2c(c1)CNC2=O 271570a_100011290941_100000692135 [0,2,0,1,0,0|0,0,0]=3 21395 B13R2.2130 C=Cc1ccc2c(c1)COC2=O 271570a_100011290941_100009816608 [0,2,0,1,0,0|1,0,0]=4 21396 B13R2.2130 C=Cc1ccc2c(n1)CNC2=O 271570a_100011290941_200009864240 [0,2,0,1,0,0|1,0,0]=4 21397 B13R2.2130 CNc1ccc2c(n1)CNC2=O 27a_100102657272_200009864240 [0,2,0,1,0,0|1,0,0]=4 21398 B13R2.2130 COc1ccc2c(c1)CCC2=O 34a_100000708912_200000210301 [0,2,0,1,0,0|1,0,0]=4 21399 B13R2.2130 COc1ccc2c(c1)CCC2=O 7a_100000708912_200000210301 [0,2,0,1,0,0|1,0,0]=4 21400 B13R2.2130 COc1ccc2c(c1)CNC2=O 34a_100000098542_200000210301 [0,2,0,1,0,0|0,0,0]=3 21401 B13R2.2130 COc1ccc2c(c1)COC2=O 7a_100000044543_200000210301 [0,2,0,1,0,0|1,0,0]=4 21402 B13R2.2130 CSc1ccc2c(=O)[nH][nH]c2c1 62a_200000210301_100012353722 [0,2,0,1,0,0|1,0,0]=4 21403 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_100000737041_200000210301 [0,2,0,1,0,0|1,0,0]=4 21404 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_200000210301_100000737041 [0,2,0,1,0,0|1,0,0]=4 21405 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_100000692135_200000210301 [0,2,0,1,0,0|0,0,0]=3 21406 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_200000210301_100000692135 [0,2,0,1,0,0|0,0,0]=3 21407 B13R2.2130 CSc1ccc2c(c1)COC2=O 62a_100009816608_200000210301 [0,2,0,1,0,0|1,0,0]=4 21408 B13R2.2130 CSc1ccc2c(n1)CNC2=O 62a_200000210301_200009864240 [0,2,0,1,0,0|1,0,0]=4 21409 B13R2.2130 CSc1ccc2c(n1)CNC2=O 62a_200009864240_200000210301 [0,2,0,1,0,0|1,0,0]=4 21410 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 34a_100000708912_200025704644 [0,2,0,1,0,0|1,0,0]=4 21411 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 7a_100000708912_200025704644 [0,2,0,1,0,0|1,0,0]=4 21412 B13R2.2130 [13CH3]Oc1ccc2c(c1)CNC2=O 34a_100000098542_200025704644 [0,2,0,1,0,0|0,0,0]=3 21413 B13R2.2130 [13CH3]Oc1ccc2c(c1)COC2=O 7a_100000044543_200025704644 [0,2,0,1,0,0|1,0,0]=4 21414 B13R2.2130 [13CH3]Sc1ccc2c(=O)[nH][nH]c2c1 62a_200025704644_100012353722 [0,2,0,1,0,0|1,0,0]=4 21415 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_100000737041_200025704644 [0,2,0,1,0,0|1,0,0]=4 21416 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_200025704644_100000737041 [0,2,0,1,0,0|1,0,0]=4 21417 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_100000692135_200025704644 [0,2,0,1,0,0|0,0,0]=3 21418 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_200025704644_100000692135 [0,2,0,1,0,0|0,0,0]=3 21419 B13R2.2130 [13CH3]Sc1ccc2c(c1)COC2=O 62a_100009816608_200025704644 [0,2,0,1,0,0|1,0,0]=4 21420 B13R2.2130 [13CH3]Sc1ccc2c(n1)CNC2=O 62a_200009864240_200025704644 [0,2,0,1,0,0|1,0,0]=4 21421 B13R2.2130 [13CH3]Sc1ccc2c(n1)CNC2=O 62a_200025704644_200009864240 [0,2,0,1,0,0|1,0,0]=4 21422 B13R2.5180 Cc1c(ccc2c1CCC2=O)O 271570a_203496583355_100010133460 [0,2,0,1,0,0|1,0,0]=4 21423 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [0,2,0,1,0,0|1,0,0]=4 21424 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,2,0,1,0,0|1,0,0]=4 21425 B13R2.5180 O=C1CCc2c1ccc(c2F)O 271570a_203496583355_100010133455 [0,2,0,1,0,0|1,0,0]=4 21426 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,2,0,1,0,0|1,0,0]=4 21427 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010133461 [0,2,0,1,0,0|1,0,0]=4 21428 B13R2.11634 Cc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010010902 [0,2,0,1,0,0|1,0,0]=4 21429 B13R2.11634 Nc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010080117 [0,2,0,1,0,0|1,0,0]=4 21430 B13R2.11634 O=C1CCc2c1cc(c(c2)F)O 271570a_203496583355_100010010871 [0,2,0,1,0,0|1,0,0]=4 21431 B13R2.11634 O=C1CCc2c1cc(c(c2)O)F 271570a_203496583355_100010010804 [0,2,0,1,0,0|1,0,0]=4 21432 B13R2.11642 Cc1cc(cc2c1C(=O)CC2)O 271570a_203496583355_100000721622 [0,2,0,1,0,0|1,0,0]=4 21433 B13R2.11642 Cc1cc(cc2c1C(=O)NC2)O 271570a_203496583355_200010764723 [0,2,0,1,0,0|0,0,0]=3 21434 B13R2.11642 O=C1CCc2c1c(cc(c2)F)O 271570a_203496583355_100010079923 [0,2,0,1,0,0|1,0,0]=4 21435 B13R2.11642 O=C1CCc2c1c(cc(c2)O)F 271570a_203496583355_100010125705 [0,2,0,1,0,0|1,0,0]=4 21436 B13R2.11642 O=C1CCc2c1c(cc(c2)O)O 271570a_203496583355_200010214548 [0,2,0,1,0,0|1,0,0]=4 21437 B13R2.11642 O=C1NCc2c1c(cc(c2)O)F 271570a_203496583355_100010161078 [0,2,0,1,0,0|0,0,0]=3 21438 B13R2.3790 Nc1ccc2c(c1O)C(=O)CC2 271570a_203496583355_100010218033 [0,2,0,1,0,0|1,0,0]=4 21439 B13R2.3790 O=C1CCc2c1c(c(cc2)F)O 271570a_203496583355_200010133456 [0,2,0,1,0,0|1,0,0]=4 21440 B13R2.5151 Cc1ccc(c2c1C(=O)CC2)O 271570a_203496583355_100010091368 [0,2,0,1,0,0|1,0,0]=4 21441 B13R2.5151 O=C1CCc2c1c(ccc2F)O 271570a_203496583355_100000694073 [0,2,0,1,0,0|1,0,0]=4 21442 B13R2.5151 O=C1CCc2c1c(ccc2O)F 271570a_203496583355_100012347972 [0,2,0,1,0,0|1,0,0]=4 21443 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_100009816527 [0,2,0,1,0,0|1,0,0]=4 21444 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_200010133748 [0,2,0,1,0,0|1,0,0]=4 21445 B13R2.3742 Cc1cc(c2c(c1)C(=O)CC2)O 271570a_203496583355_200012347971 [0,2,0,1,0,0|1,0,0]=4 21446 B13R2.3742 Cc1cc(cc2c1CCC2=O)O 271570a_203496583355_200010133532 [0,2,0,1,0,0|1,0,0]=4 21447 B13R2.3742 O=C1CCc2c1cc(cc2F)O 271570a_203496583355_100000751134 [0,2,0,1,0,0|1,0,0]=4 21448 B13R2.3742 O=C1CCc2c1cc(cc2O)F 271570a_203496583355_100012355282 [0,2,0,1,0,0|1,0,0]=4 21449 B13R2.573 C=Cc1cccc2c1CCC2=O 271570a_100011290941_100000744605 [0,2,0,1,0,0|1,0,0]=4 21450 B13R2.573 C=Cc1cccc2c1CNC2=O 271570a_100011290941_100000688282 [0,2,0,1,0,0|0,0,0]=3 21451 B13R2.573 C=Cc1cccc2c1COC2=O 271570a_100011290941_100010167076 [0,2,0,1,0,0|1,0,0]=4 21452 B13R2.573 C=Cc1cccc2c1[nH][nH]c2=O 271570a_100011290941_100012199144 [0,2,0,1,0,0|1,0,0]=4 21453 B13R2.573 CNc1cccc2c1CNC2=O 2230a_100000087543_200000210301 [0,2,0,1,0,0|0,0,0]=3 21454 B13R2.573 COc1cccc2c1CCC2=O 34a_100000240044_200000210301 [0,2,0,1,0,0|1,0,0]=4 21455 B13R2.573 COc1cccc2c1CCC2=O 7a_100000240044_200000210301 [0,2,0,1,0,0|1,0,0]=4 21456 B13R2.573 COc1cccc2c1CNC2=O 34a_100000098541_200000210301 [0,2,0,1,0,0|0,0,0]=3 21457 B13R2.573 CSc1cccc2c1CCC2=O 62a_100000049675_200000210301 [0,2,0,1,0,0|1,0,0]=4 21458 B13R2.573 CSc1cccc2c1CCC2=O 62a_200000210301_100000049675 [0,2,0,1,0,0|1,0,0]=4 21459 B13R2.573 CSc1cccc2c1CNC2=O 62a_100000688282_200000210301 [0,2,0,1,0,0|0,0,0]=3 21460 B13R2.573 CSc1cccc2c1COC2=O 62a_100010167076_200000210301 [0,2,0,1,0,0|1,0,0]=4 21461 B13R2.573 [13CH3]Nc1cccc2c1CNC2=O 2230a_100000087543_200025704644 [0,2,0,1,0,0|0,0,0]=3 21462 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 34a_100000240044_200025704644 [0,2,0,1,0,0|1,0,0]=4 21463 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 7a_100000240044_200025704644 [0,2,0,1,0,0|1,0,0]=4 21464 B13R2.573 [13CH3]Oc1cccc2c1CNC2=O 34a_100000098541_200025704644 [0,2,0,1,0,0|0,0,0]=3 21465 B13R2.573 [13CH3]Sc1cccc2c1CCC2=O 62a_100000049675_200025704644 [0,2,0,1,0,0|1,0,0]=4 21466 B13R2.573 [13CH3]Sc1cccc2c1CCC2=O 62a_200025704644_100000049675 [0,2,0,1,0,0|1,0,0]=4 21467 B13R2.573 [13CH3]Sc1cccc2c1CNC2=O 62a_100000688282_200025704644 [0,2,0,1,0,0|0,0,0]=3 21468 B13R2.573 [13CH3]Sc1cccc2c1COC2=O 62a_100010167076_200025704644 [0,2,0,1,0,0|1,0,0]=4 21469 B13R2.669 C=Cc1ccc2[nH][nH]c(=O)c2c1 271570a_100011290941_100012353726 [0,2,0,1,0,0|1,0,0]=4 21470 B13R2.669 C=Cc1ccc2c(c1)C(=O)CC2 271570a_100011290941_100000759401 [0,2,0,1,0,0|1,0,0]=4 21471 B13R2.669 C=Cc1ccc2c(c1)C(=O)NC2 271570a_100011290941_100010171230 [0,2,0,1,0,0|0,0,0]=3 21472 B13R2.669 C=Cc1ccc2c(c1)C(=O)OC2 271570a_100011290941_100000693025 [0,2,0,1,0,0|1,0,0]=4 21473 B13R2.669 C=Cc1ccc2o[nH]c(=O)c2c1 271570a_100011290941_100000732257 [0,2,0,1,0,0|1,0,0]=4 21474 B13R2.669 COc1ccc2c(c1)C(=O)CC2 34a_100009827925_200000210301 [0,2,0,1,0,0|1,0,0]=4 21475 B13R2.669 COc1ccc2c(c1)C(=O)CC2 7a_100009827925_200000210301 [0,2,0,1,0,0|1,0,0]=4 21476 B13R2.669 COc1ccc2c(c1)C(=O)NC2 34a_100000087830_200000210301 [0,2,0,1,0,0|0,0,0]=3 21477 B13R2.669 CSc1ccc2[nH][nH]c(=O)c2c1 62a_200000210301_100012353726 [0,2,0,1,0,0|1,0,0]=4 21478 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_100000759401_200000210301 [0,2,0,1,0,0|1,0,0]=4 21479 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_200000210301_100000759401 [0,2,0,1,0,0|1,0,0]=4 21480 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_100000688121_200000210301 [0,2,0,1,0,0|0,0,0]=3 21481 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_200000210301_100000688121 [0,2,0,1,0,0|0,0,0]=3 21482 B13R2.669 CSc1ccc2c(c1)C(=O)OC2 62a_100000693025_200000210301 [0,2,0,1,0,0|1,0,0]=4 21483 B13R2.669 CSc1ccc2o[nH]c(=O)c2c1 62a_200000210301_100000732257 [0,2,0,1,0,0|1,0,0]=4 21484 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_200025704644 [0,2,0,1,0,0|1,0,0]=4 21485 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_200025704644 [0,2,0,1,0,0|1,0,0]=4 21486 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)NC2 34a_100000087830_200025704644 [0,2,0,1,0,0|0,0,0]=3 21487 B13R2.669 [13CH3]Sc1ccc2[nH][nH]c(=O)c2c1 62a_200025704644_100012353726 [0,2,0,1,0,0|1,0,0]=4 21488 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_100000759401_200025704644 [0,2,0,1,0,0|1,0,0]=4 21489 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_200025704644_100000759401 [0,2,0,1,0,0|1,0,0]=4 21490 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_100000688121_200025704644 [0,2,0,1,0,0|0,0,0]=3 21491 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_200025704644_100000688121 [0,2,0,1,0,0|0,0,0]=3 21492 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)OC2 62a_100000693025_200025704644 [0,2,0,1,0,0|1,0,0]=4 21493 B13R2.669 [13CH3]Sc1ccc2o[nH]c(=O)c2c1 62a_200025704644_100000732257 [0,2,0,1,0,0|1,0,0]=4 21494 B13R2.582 C=Cc1cccc2c1C(=O)CC2 271570a_100011290941_100009816781 [0,2,0,1,0,0|1,0,0]=4 21495 B13R2.582 C=Cc1cccc2c1C(=O)NC2 271570a_100011290941_100000724024 [0,2,0,1,0,0|0,0,0]=3 21496 B13R2.582 C=Cc1cccc2c1C(=O)OC2 271570a_100011290941_100010132333 [0,2,0,1,0,0|1,0,0]=4 21497 B13R2.582 C=Cc1cccc2c1c(=O)[nH][nH]2 271570a_100011290941_100010170957 [0,2,0,1,0,0|1,0,0]=4 21498 B13R2.582 COc1cccc2c1C(=O)CC2 34a_100000066596_200000210301 [0,2,0,1,0,0|1,0,0]=4 21499 B13R2.582 COc1cccc2c1C(=O)CC2 7a_100000066596_200000210301 [0,2,0,1,0,0|1,0,0]=4 21500 B13R2.582 CSc1cccc2c1C(=O)CC2 62a_100009816781_200000210301 [0,2,0,1,0,0|1,0,0]=4 21501 B13R2.582 CSc1cccc2c1C(=O)CC2 62a_200000210301_100009816781 [0,2,0,1,0,0|1,0,0]=4 21502 B13R2.582 CSc1cccc2c1C(=O)NC2 62a_100000724024_200000210301 [0,2,0,1,0,0|0,0,0]=3 21503 B13R2.582 CSc1cccc2c1C(=O)NC2 62a_200000210301_100000724024 [0,2,0,1,0,0|0,0,0]=3 21504 B13R2.582 CSc1cccc2c1C(=O)OC2 62a_100010132333_200000210301 [0,2,0,1,0,0|1,0,0]=4 21505 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 34a_100000066596_200025704644 [0,2,0,1,0,0|1,0,0]=4 21506 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 7a_100000066596_200025704644 [0,2,0,1,0,0|1,0,0]=4 21507 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CC2 62a_100009816781_200025704644 [0,2,0,1,0,0|1,0,0]=4 21508 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CC2 62a_200025704644_100009816781 [0,2,0,1,0,0|1,0,0]=4 21509 B13R2.582 [13CH3]Sc1cccc2c1C(=O)NC2 62a_100000724024_200025704644 [0,2,0,1,0,0|0,0,0]=3 21510 B13R2.582 [13CH3]Sc1cccc2c1C(=O)NC2 62a_200025704644_100000724024 [0,2,0,1,0,0|0,0,0]=3 21511 B13R2.582 [13CH3]Sc1cccc2c1C(=O)OC2 62a_100010132333_200025704644 [0,2,0,1,0,0|1,0,0]=4 21512 B13R1.718 CCC(=O)C/C=C/c1ccccc1 1458a_100000210414_100016265936 [0,0,0,0,0,3|1,0,0]=4 21513 B13R1.718 CCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000210202 [0,0,0,0,0,3|1,0,0]=4 21514 B13R1.718 CCC(=O)C=CSc1ccccc1 1458a_100016262050_100000210202 [0,0,0,0,0,3|1,0,0]=4 21515 B13R1.718 CCC(=O)CC#Cc1ccccc1 1458a_100000210414_100011352542 [0,0,0,0,0,3|1,0,0]=4 21516 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100000210414_100000211621 [0,0,0,0,0,3|1,0,0]=4 21517 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100011207963_100000210202 [0,0,0,0,0,3|1,0,0]=4 21518 B13R1.718 CCC(=O)CCOc1ccccc1 1458a_100000182761_100000210202 [0,0,0,0,0,3|1,0,0]=4 21519 B13R1.718 CCC(=O)CCOc1ccccc1 1458a_100000210414_100000184471 [0,0,0,0,0,3|1,0,0]=4 21520 B13R1.718 CCC(=O)CCSc1ccccc1 1458a_100000182436_100000210202 [0,0,0,0,0,3|1,0,0]=4 21521 B13R1.718 CCC(=O)CCSc1ccccc1 1458a_100000210414_100000246102 [0,0,0,0,0,3|1,0,0]=4 21522 B13R1.718 CCC(=O)COCc1ccccc1 1458a_100000230186_100000210202 [0,0,0,0,0,3|1,0,0]=4 21523 B13R1.718 CCC(=O)COCc1ccccc1 34a_100000725409_100015291786 [0,0,0,0,0,3|1,0,0]=4 21524 B13R1.718 CCC(=O)COCc1ccccc1 7a_100000210790_100000747405 [0,0,0,0,0,3|1,0,0]=4 21525 B13R1.718 CCC(=O)CSCc1ccccc1 1458a_100000150264_100000210202 [0,0,0,0,0,3|1,0,0]=4 21526 B13R1.718 CCC(=O)CSCc1ccccc1 1458a_100000210414_200011217039 [0,0,0,0,0,3|1,0,0]=4 21527 B13R1.718 CCC(=O)CSCc1ccccc1 62a_100000211182_100000747405 [0,0,0,0,0,3|1,0,0]=4 21528 B13R1.718 CCC(=O)CSCc1ccccc1 62a_100000747405_100015291786 [0,0,0,0,0,3|1,0,0]=4 21529 B13R1.718 CCC(=O)NCCc1ccccc1 11a_100000106460_100000210414 [0,0,0,0,0,3|1,0,0]=4 21530 B13R1.718 CCC(=O)NCCc1ccccc1 1626a_100000106460_100000210414 [0,0,0,0,0,3|1,0,0]=4 21531 B13R1.718 CCC(=O)NCCc1ccccc1 240690a_100000106460_100000210414 [0,0,0,0,0,3|1,0,0]=4 21532 B13R1.718 CCC(=O)NCCc1ccccc1 527a_100000106460_100000210414 [0,0,0,0,0,3|1,0,0]=4 21533 B13R1.718 CCC(=O)NN=Cc1ccccc1 4a_100000183195_100015611070 [0,0,0,0,0,3|1,0,0]=4 21534 B13R1.718 CCC(=O)NNCc1ccccc1 22a_100000007032_100000210414 [0,0,0,0,0,3|1,0,0]=4 21535 B13R1.718 CNC(=O)C/C=C/c1ccccc1 11a_106832991635_100011219626 [0,0,0,0,0,3|0,0,0]=3 21536 B13R1.718 CNC(=O)C/C=C/c1ccccc1 1626a_100102657272_100011219626 [0,0,0,0,0,3|0,0,0]=3 21537 B13R1.718 CNC(=O)C/C=C/c1ccccc1 240690a_100102657272_100011219626 [0,0,0,0,0,3|0,0,0]=3 21538 B13R1.718 CNC(=O)C=CSc1ccccc1 11a_106832991635_100016262050 [0,0,0,0,0,3|0,0,0]=3 21539 B13R1.718 CNC(=O)C=CSc1ccccc1 1626a_100102657272_100016262050 [0,0,0,0,0,3|0,0,0]=3 21540 B13R1.718 CNC(=O)C=CSc1ccccc1 240690a_100102657272_100016262050 [0,0,0,0,0,3|0,0,0]=3 21541 B13R1.718 CNC(=O)CCCc1ccccc1 11a_106832991635_100011207963 [0,0,0,0,0,3|0,0,0]=3 21542 B13R1.718 CNC(=O)CCCc1ccccc1 1626a_100102657272_100011207963 [0,0,0,0,0,3|0,0,0]=3 21543 B13R1.718 CNC(=O)CCCc1ccccc1 240690a_100102657272_100011207963 [0,0,0,0,0,3|0,0,0]=3 21544 B13R1.718 CNC(=O)CCCc1ccccc1 527a_100102657272_100011207963 [0,0,0,0,0,3|0,0,0]=3 21545 B13R1.718 CNC(=O)CCCc1ccccn1 11a_106832991635_100000752327 [0,0,0,0,0,3|1,0,0]=4 21546 B13R1.718 CNC(=O)CCCc1ccccn1 1626a_100102657272_100000752327 [0,0,0,0,0,3|1,0,0]=4 21547 B13R1.718 CNC(=O)CCCc1ccccn1 240690a_100102657272_100000752327 [0,0,0,0,0,3|1,0,0]=4 21548 B13R1.718 CNC(=O)CCCc1ccccn1 527a_100102657272_100000752327 [0,0,0,0,0,3|1,0,0]=4 21549 B13R1.718 CNC(=O)CCCc1ccncc1 11a_106832991635_100020654287 [0,0,0,0,0,3|1,0,0]=4 21550 B13R1.718 CNC(=O)CCCc1ccncc1 1626a_100102657272_100020654287 [0,0,0,0,0,3|1,0,0]=4 21551 B13R1.718 CNC(=O)CCCc1ccncc1 240690a_100102657272_100020654287 [0,0,0,0,0,3|1,0,0]=4 21552 B13R1.718 CNC(=O)CCCc1ccncc1 527a_100102657272_100020654287 [0,0,0,0,0,3|1,0,0]=4 21553 B13R1.718 CNC(=O)CCNc1ccccc1 34a_100000106764_100012179268 [0,0,0,0,0,3|0,0,0]=3 21554 B13R1.718 CNC(=O)CCOc1ccccc1 11a_106832991635_100000182761 [0,0,0,0,0,3|0,0,0]=3 21555 B13R1.718 CNC(=O)CCOc1ccccc1 1626a_100102657272_100000182761 [0,0,0,0,0,3|0,0,0]=3 21556 B13R1.718 CNC(=O)CCOc1ccccc1 240690a_100102657272_100000182761 [0,0,0,0,0,3|0,0,0]=3 21557 B13R1.718 CNC(=O)CCOc1ccccc1 34a_100000210340_100012179268 [0,0,0,0,0,3|0,0,0]=3 21558 B13R1.718 CNC(=O)CCOc1ccccc1 7a_100000210340_100000737683 [0,0,0,0,0,3|0,0,0]=3 21559 B13R1.718 CNC(=O)CCOc1cccnc1 34a_100000210849_100012179268 [0,0,0,0,0,3|1,0,0]=4 21560 B13R1.718 CNC(=O)CCOc1cccnc1 7a_100000210849_100000737683 [0,0,0,0,0,3|1,0,0]=4 21561 B13R1.718 CNC(=O)CCOc1ccncc1 34a_100000212176_100012179268 [0,0,0,0,0,3|1,0,0]=4 21562 B13R1.718 CNC(=O)CCSc1ccccc1 11a_106832991635_100000182436 [0,0,0,0,0,3|0,0,0]=3 21563 B13R1.718 CNC(=O)CCSc1ccccc1 1626a_100102657272_100000182436 [0,0,0,0,0,3|0,0,0]=3 21564 B13R1.718 CNC(=O)CCSc1ccccc1 240690a_100102657272_100000182436 [0,0,0,0,0,3|0,0,0]=3 21565 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000719477_100000737683 [0,0,0,0,0,3|0,0,0]=3 21566 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000737683_100000041952 [0,0,0,0,0,3|0,0,0]=3 21567 B13R1.718 CNC(=O)CCSc1ccccn1 62a_100000737683_100011216584 [0,0,0,0,0,3|1,0,0]=4 21568 B13R1.718 CNC(=O)CCSc1ccccn1 62a_100011216584_100000737683 [0,0,0,0,0,3|1,0,0]=4 21569 B13R1.718 CNC(=O)CCSc1cccnc1 62a_100000210063_100000737683 [0,0,0,0,0,3|1,0,0]=4 21570 B13R1.718 CNC(=O)CCSc1cccnc1 62a_100000737683_100000210063 [0,0,0,0,0,3|1,0,0]=4 21571 B13R1.718 CNC(=O)CCSc1ccncc1 62a_100000728582_100000737683 [0,0,0,0,0,3|1,0,0]=4 21572 B13R1.718 CNC(=O)CCSc1ccncc1 62a_100000737683_100000728582 [0,0,0,0,0,3|1,0,0]=4 21573 B13R1.718 CNC(=O)CNCc1ccccc1 207a_100000693194_100015611070 [0,0,0,0,0,3|0,0,0]=3 21574 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100000693194_100015291786 [0,0,0,0,0,3|0,0,0]=3 21575 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100015324214_100000183359 [0,0,0,0,0,3|0,0,0]=3 21576 B13R1.718 CNC(=O)CNCc1ccccc1 270004a_100000693194_100015611070 [0,0,0,0,0,3|0,0,0]=3 21577 B13R1.718 CNC(=O)CNCc1ccccc1 34a_100015324214_100000183359 [0,0,0,0,0,3|0,0,0]=3 21578 B13R1.718 CNC(=O)CNCc1ccccn1 207a_100000693194_100000209966 [0,0,0,0,0,3|1,0,0]=4 21579 B13R1.718 CNC(=O)CNCc1ccccn1 2230a_100000693194_100000721315 [0,0,0,0,0,3|1,0,0]=4 21580 B13R1.718 CNC(=O)CNCc1ccccn1 270004a_100000693194_100000209966 [0,0,0,0,0,3|1,0,0]=4 21581 B13R1.718 CNC(=O)CNCc1cccnc1 207a_100000693194_100000209961 [0,0,0,0,0,3|1,0,0]=4 21582 B13R1.718 CNC(=O)CNCc1cccnc1 2230a_100000693194_100000741622 [0,0,0,0,0,3|1,0,0]=4 21583 B13R1.718 CNC(=O)CNCc1cccnc1 270004a_100000693194_100000209961 [0,0,0,0,0,3|1,0,0]=4 21584 B13R1.718 CNC(=O)CNCc1ccncc1 207a_100000693194_100000186114 [0,0,0,0,0,3|1,0,0]=4 21585 B13R1.718 CNC(=O)CNCc1ccncc1 2230a_100000693194_100015193705 [0,0,0,0,0,3|1,0,0]=4 21586 B13R1.718 CNC(=O)COCc1ccccc1 11a_106832991635_100000230186 [0,0,0,0,0,3|0,0,0]=3 21587 B13R1.718 CNC(=O)COCc1ccccc1 1626a_100102657272_100000230186 [0,0,0,0,0,3|0,0,0]=3 21588 B13R1.718 CNC(=O)COCc1ccccc1 240690a_100102657272_100000230186 [0,0,0,0,0,3|0,0,0]=3 21589 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000210790_100000183359 [0,0,0,0,0,3|0,0,0]=3 21590 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000750040_100015291786 [0,0,0,0,0,3|0,0,0]=3 21591 B13R1.718 CNC(=O)COCc1ccccc1 527a_100102657272_100000230186 [0,0,0,0,0,3|0,0,0]=3 21592 B13R1.718 CNC(=O)COCc1ccccc1 7a_100000210790_100000183359 [0,0,0,0,0,3|0,0,0]=3 21593 B13R1.718 CNC(=O)COCc1ccccn1 34a_100000750040_100000721315 [0,0,0,0,0,3|1,0,0]=4 21594 B13R1.718 CNC(=O)COCc1cccnc1 34a_100000750040_100000733263 [0,0,0,0,0,3|1,0,0]=4 21595 B13R1.718 CNC(=O)CSCc1ccccc1 11a_106832991635_100000150264 [0,0,0,0,0,3|0,0,0]=3 21596 B13R1.718 CNC(=O)CSCc1ccccc1 1626a_100102657272_100000150264 [0,0,0,0,0,3|0,0,0]=3 21597 B13R1.718 CNC(=O)CSCc1ccccc1 240690a_100102657272_100000150264 [0,0,0,0,0,3|0,0,0]=3 21598 B13R1.718 CNC(=O)CSCc1ccccc1 527a_100102657272_100000150264 [0,0,0,0,0,3|0,0,0]=3 21599 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000183359_100015291786 [0,0,0,0,0,3|0,0,0]=3 21600 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000211182_100000183359 [0,0,0,0,0,3|0,0,0]=3 21601 B13R1.718 CNC(=O)CSCc1ccccn1 11a_106832991635_100000742634 [0,0,0,0,0,3|1,0,0]=4 21602 B13R1.718 CNC(=O)CSCc1ccccn1 1626a_100102657272_100000742634 [0,0,0,0,0,3|1,0,0]=4 21603 B13R1.718 CNC(=O)CSCc1ccccn1 240690a_100102657272_100000742634 [0,0,0,0,0,3|1,0,0]=4 21604 B13R1.718 CNC(=O)CSCc1ccccn1 527a_100102657272_100000742634 [0,0,0,0,0,3|1,0,0]=4 21605 B13R1.718 CNC(=O)CSCc1ccccn1 62a_100000183359_100000721315 [0,0,0,0,0,3|1,0,0]=4 21606 B13R1.718 CNC(=O)CSCc1ccccn1 62a_100000721315_100000183359 [0,0,0,0,0,3|1,0,0]=4 21607 B13R1.718 CNC(=O)CSCc1cccnc1 62a_100000183359_100000741622 [0,0,0,0,0,3|1,0,0]=4 21608 B13R1.718 CNC(=O)CSCc1cccnc1 62a_100000741622_100000183359 [0,0,0,0,0,3|1,0,0]=4 21609 B13R1.718 CNC(=O)CSCc1ccncc1 1626a_100102657272_100000742635 [0,0,0,0,0,3|1,0,0]=4 21610 B13R1.718 CNC(=O)CSCc1ccncc1 240690a_100102657272_100000742635 [0,0,0,0,0,3|1,0,0]=4 21611 B13R1.718 CNC(=O)CSCc1ccncc1 527a_100102657272_100000742635 [0,0,0,0,0,3|1,0,0]=4 21612 B13R1.718 CNC(=O)CSCc1ccncc1 62a_100000183359_100015193705 [0,0,0,0,0,3|1,0,0]=4 21613 B13R1.718 CNC(=O)CSCc1ccncc1 62a_100015193705_100000183359 [0,0,0,0,0,3|1,0,0]=4 21614 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100000106460_106832991635 [0,0,0,0,0,3|0,0,0]=3 21615 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100102657272_100000106460 [0,0,0,0,0,3|0,0,0]=3 21616 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100000106460_100102657272 [0,0,0,0,0,3|0,0,0]=3 21617 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100102657272_100000106460 [0,0,0,0,0,3|0,0,0]=3 21618 B13R1.718 CNC(=O)NCCc1ccccc1 512a_100000106460_100102657272 [0,0,0,0,0,3|0,0,0]=3 21619 B13R1.718 CNC(=O)NCCc1ccccc1 512a_106832991638_100000106460 [0,0,0,0,0,3|0,0,0]=3 21620 B13R1.718 CNC(=O)NCCc1ccccn1 2708a_100000211156_106832991635 [0,0,0,0,0,3|1,0,0]=4 21621 B13R1.718 CNC(=O)NCCc1ccccn1 2708a_100102657272_100000211156 [0,0,0,0,0,3|1,0,0]=4 21622 B13R1.718 CNC(=O)NCCc1ccccn1 273464a_100000211156_100102657272 [0,0,0,0,0,3|1,0,0]=4 21623 B13R1.718 CNC(=O)NCCc1ccccn1 273464a_100102657272_100000211156 [0,0,0,0,0,3|1,0,0]=4 21624 B13R1.718 CNC(=O)NCCc1ccccn1 512a_106832991638_100000211156 [0,0,0,0,0,3|1,0,0]=4 21625 B13R1.718 CNC(=O)NCCc1cccnc1 2708a_100000736294_106832991635 [0,0,0,0,0,3|1,0,0]=4 21626 B13R1.718 CNC(=O)NCCc1cccnc1 2708a_100102657272_100000736294 [0,0,0,0,0,3|1,0,0]=4 21627 B13R1.718 CNC(=O)NCCc1cccnc1 273464a_100000736294_100102657272 [0,0,0,0,0,3|1,0,0]=4 21628 B13R1.718 CNC(=O)NCCc1cccnc1 273464a_100102657272_100000736294 [0,0,0,0,0,3|1,0,0]=4 21629 B13R1.718 CNC(=O)NCCc1cccnc1 512a_100000736294_100102657272 [0,0,0,0,0,3|1,0,0]=4 21630 B13R1.718 CNC(=O)NCCc1cccnc1 512a_106832991638_100000736294 [0,0,0,0,0,3|1,0,0]=4 21631 B13R1.718 CNC(=O)NCCc1ccncc1 2708a_100000742849_106832991635 [0,0,0,0,0,3|1,0,0]=4 21632 B13R1.718 CNC(=O)NCCc1ccncc1 2708a_100102657272_100000742849 [0,0,0,0,0,3|1,0,0]=4 21633 B13R1.718 CNC(=O)NCCc1ccncc1 273464a_100000742849_100102657272 [0,0,0,0,0,3|1,0,0]=4 21634 B13R1.718 CNC(=O)NCCc1ccncc1 273464a_100102657272_100000742849 [0,0,0,0,0,3|1,0,0]=4 21635 B13R1.718 CNC(=O)NCCc1ccncc1 512a_106832991638_100000742849 [0,0,0,0,0,3|1,0,0]=4 21636 B13R1.718 CNC(=O)NNCc1ccccc1 273464a_100102657272_100000007032 [0,0,0,0,0,3|0,0,0]=3 21637 B13R1.718 CNC(=O)NNCc1ccccc1 512a_106832991638_100000007032 [0,0,0,0,0,3|0,0,0]=3 21638 B13R1.718 CNC(=O)NNCc1ccccn1 273464a_100102657272_100000736832 [0,0,0,0,0,3|1,0,0]=4 21639 B13R1.718 CNC(=O)NNCc1ccccn1 512a_106832991638_100000736832 [0,0,0,0,0,3|1,0,0]=4 21640 B13R1.718 CNC(=O)NNCc1cccnc1 273464a_100102657272_100000738295 [0,0,0,0,0,3|1,0,0]=4 21641 B13R1.718 CNC(=O)NNCc1cccnc1 512a_100000738295_100102657272 [0,0,0,0,0,3|1,0,0]=4 21642 B13R1.718 CNC(=O)NNCc1cccnc1 512a_106832991638_100000738295 [0,0,0,0,0,3|1,0,0]=4 21643 B13R1.718 CNC(=O)NNCc1ccncc1 273464a_100102657272_100000736929 [0,0,0,0,0,3|1,0,0]=4 21644 B13R1.718 CNC(=O)NNCc1ccncc1 512a_106832991638_100000736929 [0,0,0,0,0,3|1,0,0]=4 21645 B13R1.718 COC(=O)C=NNc1ccccc1 4a_100015195140_200011823558 [0,0,0,0,0,3|1,0,0]=4 21646 B13R1.718 COC(=O)CCNc1ccccc1 34a_100000106764_100000742370 [0,0,0,0,0,3|1,0,0]=4 21647 B13R1.718 COC(=O)CCOc1ccccc1 34a_100000210340_100000742370 [0,0,0,0,0,3|1,0,0]=4 21648 B13R1.718 COC(=O)CCOc1ccccc1 7a_100000210340_100000204255 [0,0,0,0,0,3|1,0,0]=4 21649 B13R1.718 COC(=O)CCSc1ccccc1 62a_100000204255_100000041952 [0,0,0,0,0,3|1,0,0]=4 21650 B13R1.718 COC(=O)CCSc1ccccc1 62a_100000719477_100000204255 [0,0,0,0,0,3|1,0,0]=4 21651 B13R1.718 COC(=O)CNCc1ccccc1 2230a_100015324214_100000747449 [0,0,0,0,0,3|1,0,0]=4 21652 B13R1.718 COC(=O)CNCc1ccccc1 34a_100015324214_100000747449 [0,0,0,0,0,3|1,0,0]=4 21653 B13R1.718 COC(=O)COCc1ccccc1 34a_100000210790_100000747449 [0,0,0,0,0,3|1,0,0]=4 21654 B13R1.718 COC(=O)COCc1ccccc1 7a_100000210790_100000747449 [0,0,0,0,0,3|1,0,0]=4 21655 B13R1.718 COC(=O)CSCc1ccccc1 62a_100000211182_100000747449 [0,0,0,0,0,3|1,0,0]=4 21656 B13R1.718 COC(=O)CSCc1ccccc1 62a_100000747449_100015291786 [0,0,0,0,0,3|1,0,0]=4 21657 B13R1.718 COC(=O)OCSc1ccccc1 62a_100000719477_100000139417 [0,0,0,0,0,3|1,0,0]=4