0 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [0,0,0,0,0,0|1,0,1]=2 8 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.13 C=C(C)c1ncc(cn1)O 271570a_100000694244_100000730009 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [0,0,0,0,0,0|1,0,0]=1 34 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.13 CC(C)c1cnc(nc1)O 271570a_203496583355_100000102307 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.13 CC(C)c1ncc(cn1)O 271570a_203496583355_200009814916 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [0,0,0,0,0,0|1,0,0]=1 43 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [0,0,0,0,0,0|1,0,0]=1 44 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [0,0,0,0,0,0|1,0,0]=1 45 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [0,0,0,0,0,0|1,0,0]=1 46 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [0,0,0,0,0,0|1,0,0]=1 47 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [0,0,0,0,0,0|1,0,0]=1 48 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [0,0,0,0,0,0|1,0,0]=1 49 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [0,0,0,0,0,0|1,0,0]=1 50 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [0,0,0,0,0,0|1,0,0]=1 51 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [0,0,0,0,0,0|1,0,0]=1 53 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [0,0,0,0,0,0|1,0,0]=1 54 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [0,0,0,0,0,0|0,0,0]=0 55 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [0,0,0,0,0,0|0,0,0]=0 56 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [0,0,0,0,0,0|0,0,0]=0 57 B10R1.13 CN(C)c1ccc(cn1)Br 27a_100102631434_100000686858 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [0,0,0,0,0,0|1,0,0]=1 59 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [0,0,0,0,0,0|1,0,0]=1 60 B10R1.13 CN(C)c1ccc(nn1)O 271570a_203496583355_100000215273 [0,0,0,0,0,0|2,0,0]=2 61 B10R1.13 CN(C)c1cnc(cn1)Br 27a_100102631434_100010187541 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.13 CN(C)c1cnc(cn1)F 27a_100102631434_100009856528 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.13 CN(C)c1cnc(cn1)O 271570a_203496583355_100012356732 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.13 CN(C)c1cnc(nn1)N 27a_100102631434_100000691435 [0,0,0,0,0,0|4,0,0]=4 65 B10R1.13 CN(C)c1ncc(cn1)Br 27a_100102631434_100000690281 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.13 CN(C)c1ncc(cn1)Cl 27a_100102631434_100011356929 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.13 CN(C)c1ncc(cn1)F 27a_100102631434_100000685220 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.13 CN(C)c1ncc(cn1)O 271570a_203496583355_100011934759 [0,0,0,0,0,0|2,0,0]=2 69 B10R1.13 CN(N)c1ccc(nn1)O 271570a_203496583355_100000035375 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [0,0,0,0,0,0|1,0,0]=1 71 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [0,0,0,0,0,0|1,0,0]=1 72 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [0,0,0,0,0,0|1,0,0]=1 73 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [0,0,0,0,0,0|1,0,0]=1 74 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [0,0,0,0,0,0|1,0,0]=1 75 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [0,0,0,0,0,0|1,0,0]=1 76 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [0,0,0,0,0,0|1,0,0]=1 77 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [0,0,0,0,0,0|1,0,0]=1 78 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [0,0,0,0,0,0|1,0,0]=1 79 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [0,0,0,0,0,0|1,0,0]=1 80 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [0,0,0,0,0,0|1,0,0]=1 81 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [0,0,0,0,0,0|1,0,0]=1 82 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [0,0,0,0,0,0|0,0,0]=0 83 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [0,0,0,0,0,0|0,0,0]=0 84 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [0,0,0,0,0,0|2,0,0]=2 85 B10R1.13 CS(=O)c1ncc(cn1)O 271570a_203496583355_100010117237 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [0,0,0,0,0,0|2,0,0]=2 87 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [0,0,0,0,0,0|2,0,0]=2 88 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [0,0,0,0,0,0|1,0,0]=1 91 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [0,0,0,0,0,0|1,0,0]=1 92 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [0,0,0,0,0,0|1,0,0]=1 93 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [0,0,0,0,0,0|1,0,0]=1 94 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [0,0,0,0,0,0|1,0,0]=1 95 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [0,0,0,0,0,0|1,0,0]=1 96 B10R1.13 Cc1ccc(nn1)N(C)C 27a_100102631434_100000744512 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.13 Cc1cnc(cn1)N(C)C 27a_100102631434_100000074397 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.13 Cc1cnc(nc1)N(C)C 27a_100102631434_100000061069 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.13 OB(O)c1ccc(cn1)O 271570a_203496583355_200010198023 [0,0,0,0,0,0|4,0,0]=4 104 B10R1.13 OB(O)c1ccc(nc1)O 271570a_203496583355_100000688115 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.13 Oc1ccc(cn1)C(F)F 271570a_203496583355_100000720607 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.13 Oc1ccc(nc1)C(F)F 271570a_203496583355_100010253924 [0,0,0,0,0,0|4,0,0]=4 108 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [0,0,0,0,0,0|2,0,0]=2 113 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [1,0,0,0,0,0|1,0,1]=3 119 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.1 CCc1cnc(nc1)O 271570a_203496583355_100000033099 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [1,0,0,0,0,0|1,0,0]=2 127 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [1,0,0,0,0,0|1,0,0]=2 129 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [1,0,0,0,0,0|1,0,0]=2 130 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [1,0,0,0,0,0|1,0,0]=2 131 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [1,0,0,0,0,0|0,0,0]=1 132 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [1,0,0,0,0,0|0,0,0]=1 133 B9R1.1 CNc1ccc(cn1)Br 27a_100102657272_100000686858 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [1,0,0,0,0,0|1,0,0]=2 136 B9R1.1 CNc1ccc(nn1)C 27a_100102657272_100000744512 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.1 CNc1ccc(nn1)O 271570a_203496583355_100000215272 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.1 CNc1cnc(cn1)Br 27a_100102657272_100010187541 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.1 CNc1cnc(cn1)C 27a_100102657272_100000074397 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.1 CNc1cnc(cn1)F 27a_100102657272_100009856528 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 CNc1cnc(cn1)O 271570a_203496583355_100012000640 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 CNc1ncc(cn1)Br 27a_100102657272_100000690281 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.1 CNc1ncc(cn1)C 27a_100102657272_100000061069 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.1 CNc1ncc(cn1)Cl 27a_100102657272_100011356929 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.1 CNc1ncc(cn1)F 27a_100102657272_100000685220 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.1 CNc1ncc(cn1)O 271570a_203496583355_100000697329 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.1 COc1ccc(=O)[nH]c1 34a_100000075641_200000210301 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [1,0,0,0,0,0|1,0,0]=2 159 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.1 COc1ccc(cn1)Cl 34a_100011215309_200000210301 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.1 COc1ccc(cn1)F 34a_100000742473_200000210301 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 COc1ccc(cn1)N 34a_100000729260_200000210301 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.1 COc1ccc(nc1)Br 34a_100000685995_200000210301 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.1 COc1ccc(nc1)Br 7a_100000685995_200000210301 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.1 COc1ccc(nc1)Cl 34a_100000744096_200000210301 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.1 COc1ccc(nc1)Cl 7a_100000744096_200000210301 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.1 COc1ccc(nc1)F 34a_100000688820_200000210301 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.1 COc1ccc(nc1)F 7a_100000688820_200000210301 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.1 COc1ccc(nc1)I 34a_100000687607_200000210301 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.1 COc1ccc(nc1)I 7a_100000687607_200000210301 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.1 COc1ccc(nc1)N 34a_100015188713_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.1 COc1ccc(nc1)N 7a_100015188713_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.1 COc1ccc(nn1)O 271570a_203496583355_100009819040 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.1 COc1cnc(cn1)O 271570a_203496583355_100011998698 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.1 COc1cnc(nc1)O 271570a_203496583355_100000069167 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.1 COc1ncc(cn1)O 271570a_203496583355_100000686852 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.1 CSc1cc[n+](cc1)[O-] 62a_200000210301_100000039755 [1,0,0,0,0,0|2,0,1]=4 182 B9R1.1 CSc1ccc(=O)[nH]c1 62a_100000212171_200000210301 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.1 CSc1ccc(=O)[nH]c1 62a_200000210301_100000212171 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [1,0,0,0,0,0|2,0,0]=3 185 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [1,0,0,0,0,0|2,0,0]=3 186 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [1,0,0,0,0,0|2,0,0]=3 194 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [1,0,0,0,0,0|1,0,0]=2 195 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [1,0,0,0,0,0|1,0,0]=2 196 B9R1.1 CSc1ccc(cn1)Br 62a_100000686858_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.1 CSc1ccc(cn1)Br 62a_200000210301_100000686858 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 CSc1ccc(cn1)Cl 62a_100011356976_200000210301 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 CSc1ccc(cn1)Cl 62a_200000210301_100011356976 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 CSc1ccc(cn1)F 62a_100000744514_200000210301 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.1 CSc1ccc(cn1)F 62a_200000210301_100000744514 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.1 CSc1ccc(cn1)N 62a_100000737798_200000210301 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.1 CSc1ccc(cn1)N 62a_200000210301_100000737798 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [1,0,0,0,0,0|2,0,0]=3 207 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [1,0,0,0,0,0|2,0,0]=3 209 B9R1.1 CSc1ccc(nc1)Br 62a_100009814638_200000210301 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.1 CSc1ccc(nc1)Br 62a_200000210301_100009814638 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.1 CSc1ccc(nc1)Cl 62a_100000034144_200000210301 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.1 CSc1ccc(nc1)Cl 62a_200000210301_100000034144 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.1 CSc1ccc(nc1)F 62a_100000042367_200000210301 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.1 CSc1ccc(nc1)F 62a_200000210301_100000042367 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.1 CSc1ccc(nc1)N 62a_100000187370_200000210301 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.1 CSc1ccc(nc1)N 62a_200000210301_100000187370 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [1,0,0,0,0,0|2,0,0]=3 220 B9R1.1 CSc1cnc(cn1)O 271570a_203496583355_200012356277 [1,0,0,0,0,0|3,0,0]=4 221 B9R1.1 CSc1cnc(cn1)O 62a_100011934580_200000210301 [1,0,0,0,0,0|3,0,0]=4 222 B9R1.1 CSc1cnc(cn1)O 62a_200000210301_100015839800 [1,0,0,0,0,0|3,0,0]=4 223 B9R1.1 CSc1cnc(nc1)O 271570a_203496583355_100000718988 [1,0,0,0,0,0|3,0,0]=4 224 B9R1.1 CSc1ncc(cn1)O 271570a_203496583355_100000722549 [1,0,0,0,0,0|3,0,0]=4 225 B9R1.1 CSc1ncc(cn1)O 62a_100000730009_200000210301 [1,0,0,0,0,0|3,0,0]=4 226 B9R1.1 CSc1ncc(cn1)O 62a_200000210301_100000092845 [1,0,0,0,0,0|3,0,0]=4 227 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [1,0,0,0,0,0|1,0,0]=2 228 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [1,0,0,0,0,0|2,0,0]=3 232 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,0|3,0,0]=4 235 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.1 N#Cc1ccc(cn1)O 271570a_203496583355_100000760455 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.1 N#Cc1ccc(nc1)O 271570a_203496583355_100000241038 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [1,0,0,0,0,0|2,0,0]=3 243 B9R1.1 NCc1ccc(cn1)O 271570a_203496583355_100015188789 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.1 NCc1ccc(nc1)O 271570a_203496583355_100009817727 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [1,0,0,0,0,0|1,0,0]=2 246 B9R1.1 NNc1ccc(cn1)O 271570a_203496583355_100000750576 [1,0,0,0,0,0|2,0,0]=3 247 B9R1.1 NNc1ccc(nc1)O 271570a_203496583355_100000119030 [1,0,0,0,0,0|2,0,0]=3 248 B9R1.1 NNc1ccc(nn1)O 271570a_203496583355_100000182438 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.1 NNc1cnc(cn1)O 271570a_203496583355_100000121042 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.1 NNc1ncc(cn1)O 271570a_203496583355_100011203108 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [1,0,0,0,0,0|2,0,0]=3 252 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [1,0,0,0,0,0|3,0,0]=4 253 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [1,0,0,0,0,0|2,0,0]=3 255 B9R1.1 OCc1ccc(cn1)O 271570a_203496583355_100000754261 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [1,0,0,0,0,0|2,0,0]=3 258 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [1,0,0,0,0,0|1,0,0]=2 259 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [1,0,0,0,0,0|1,0,0]=2 260 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [1,0,0,0,0,0|1,0,0]=2 261 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [1,0,0,0,0,0|1,0,0]=2 262 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [1,0,0,0,0,0|1,0,0]=2 263 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [1,0,0,0,0,0|1,0,0]=2 264 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [1,0,0,0,0,0|0,0,0]=1 265 B9R1.1 [13CH3]Oc1ccc(=O)[nH]c1 34a_100000075641_200025704644 [1,0,0,0,0,0|2,0,1]=4 266 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [1,0,0,0,0,0|2,0,0]=3 267 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [1,0,0,0,0,0|2,0,0]=3 268 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [1,0,0,0,0,0|2,0,0]=3 269 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [1,0,0,0,0,0|2,0,0]=3 270 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [1,0,0,0,0,0|2,0,0]=3 271 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [1,0,0,0,0,0|2,0,0]=3 272 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [1,0,0,0,0,0|2,0,0]=3 273 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [1,0,0,0,0,0|2,0,0]=3 274 B9R1.1 [13CH3]Oc1ccc(cn1)Cl 34a_100011215309_200025704644 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.1 [13CH3]Oc1ccc(cn1)F 34a_100000742473_200025704644 [1,0,0,0,0,0|3,0,0]=4 276 B9R1.1 [13CH3]Oc1ccc(cn1)N 34a_100000729260_200025704644 [1,0,0,0,0,0|3,0,0]=4 277 B9R1.1 [13CH3]Oc1ccc(nc1)Br 34a_100000685995_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B9R1.1 [13CH3]Oc1ccc(nc1)Br 7a_100000685995_200025704644 [1,0,0,0,0,0|3,0,0]=4 279 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 34a_100000744096_200025704644 [1,0,0,0,0,0|3,0,0]=4 280 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 7a_100000744096_200025704644 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.1 [13CH3]Oc1ccc(nc1)F 34a_100000688820_200025704644 [1,0,0,0,0,0|3,0,0]=4 282 B9R1.1 [13CH3]Oc1ccc(nc1)F 7a_100000688820_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B9R1.1 [13CH3]Oc1ccc(nc1)I 34a_100000687607_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B9R1.1 [13CH3]Oc1ccc(nc1)I 7a_100000687607_200025704644 [1,0,0,0,0,0|3,0,0]=4 285 B9R1.1 [13CH3]Oc1ccc(nc1)N 34a_100015188713_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B9R1.1 [13CH3]Oc1ccc(nc1)N 7a_100015188713_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B9R1.1 [13CH3]Sc1cc[n+](cc1)[O-] 62a_200025704644_100000039755 [1,0,0,0,0,0|2,0,1]=4 288 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_100000212171_200025704644 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_200025704644_100000212171 [1,0,0,0,0,0|2,0,1]=4 290 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [1,0,0,0,0,0|2,0,0]=3 291 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [1,0,0,0,0,0|2,0,0]=3 292 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [1,0,0,0,0,0|2,0,0]=3 293 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [1,0,0,0,0,0|2,0,0]=3 294 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [1,0,0,0,0,0|2,0,0]=3 295 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [1,0,0,0,0,0|2,0,0]=3 296 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [1,0,0,0,0,0|2,0,0]=3 297 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [1,0,0,0,0,0|2,0,0]=3 298 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [1,0,0,0,0,0|1,0,0]=2 299 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_100000686858_200025704644 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_200025704644_100000686858 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_100011356976_200025704644 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_200025704644_100011356976 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_100000744514_200025704644 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_200025704644_100000744514 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_100000737798_200025704644 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_200025704644_100000737798 [1,0,0,0,0,0|3,0,0]=4 307 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [1,0,0,0,0,0|2,0,0]=3 309 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_100009814638_200025704644 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_200025704644_100009814638 [1,0,0,0,0,0|3,0,0]=4 311 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_100000034144_200025704644 [1,0,0,0,0,0|3,0,0]=4 312 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_200025704644_100000034144 [1,0,0,0,0,0|3,0,0]=4 313 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_100000042367_200025704644 [1,0,0,0,0,0|3,0,0]=4 314 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_200025704644_100000042367 [1,0,0,0,0,0|3,0,0]=4 315 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_100000187370_200025704644 [1,0,0,0,0,0|3,0,0]=4 316 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_200025704644_100000187370 [1,0,0,0,0,0|3,0,0]=4 317 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_100011934580_200025704644 [1,0,0,0,0,0|3,0,0]=4 318 B9R1.1 [13CH3]Sc1cnc(cn1)O 62a_200025704644_100015839800 [1,0,0,0,0,0|3,0,0]=4 319 B9R1.1 [13CH3]Sc1ncc(cn1)O 62a_100000730009_200025704644 [1,0,0,0,0,0|3,0,0]=4 320 B9R1.1 [13CH3]Sc1ncc(cn1)O 62a_200025704644_100000092845 [1,0,0,0,0,0|3,0,0]=4 321 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,0,0|1,0,1]=3 322 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,0,0,0,0|2,0,1]=4 323 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,0,0,0,0|2,0,1]=4 324 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,0,0,0,0|2,0,1]=4 325 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,0,0|2,0,0]=3 326 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,0,0|0,0,0]=1 327 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,0,0|0,0,0]=1 328 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,0,0|0,0,0]=1 329 B9R1.6 CN(C)c1cccnn1 27a_100102631434_100016991348 [1,0,0,0,0,0|2,0,0]=3 330 B9R1.6 CN(C)c1ccncn1 27a_100102631434_100000703185 [1,0,0,0,0,0|2,0,0]=3 331 B9R1.6 CN(C)c1cnccn1 27a_100102631434_100000211759 [1,0,0,0,0,0|2,0,0]=3 332 B9R1.6 CN(C)c1ncccn1 27a_100102631434_100000211032 [1,0,0,0,0,0|2,0,0]=3 333 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,0,0|0,0,0]=1 334 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,0,0|0,0,0]=1 335 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,0,0|0,0,0]=1 336 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,0,0|2,0,0]=3 337 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [0,1,0,0,0,0|3,0,0]=4 338 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [0,1,0,0,0,0|3,0,0]=4 339 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [0,1,0,0,0,0|1,0,2]=4 341 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,1,0,0,0,0|1,0,1]=3 345 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [0,1,0,0,0,0|1,0,1]=3 348 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [0,1,0,0,0,0|1,0,1]=3 349 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [0,1,0,0,0,0|1,0,1]=3 350 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [0,1,0,0,0,0|1,0,1]=3 351 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [0,1,0,0,0,0|1,0,1]=3 352 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [0,1,0,0,0,0|1,1,1]=4 353 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [0,1,0,0,0,0|1,1,1]=4 354 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [0,1,0,0,0,0|1,1,1]=4 355 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [0,1,0,0,0,0|1,1,1]=4 356 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [0,1,0,0,0,0|1,1,1]=4 357 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.3 C=Cc1ccc(cc1)C(C)C 271570a_100011290941_100000750031 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.3 C=Cc1ccc(cc1)C(C)O 271570a_100011290941_100000745893 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.3 C=Cc1ccc(cc1)N(C)C 271570a_100011290941_100000210421 [0,1,0,0,0,0|1,0,0]=2 368 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.3 C=Cc1ccc(cc1)[C@@H](C)N 271570a_100011290941_100000720352 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.3 C=Cc1ccc(cc1)[C@H](C)N 271570a_100011290941_100000753911 [0,1,0,0,0,0|3,0,0]=4 371 B11R1.3 C=Cc1ccc(cn1)C(C)C 271570a_100011290941_200009815286 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.3 C=Cc1ccc(cn1)N(C)C 271570a_100011290941_100009992925 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.3 C=Cc1ccc(nc1)C(C)C 271570a_100011290941_100010255768 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.3 C=Cc1ccc(nc1)N(C)C 271570a_100011290941_100011465347 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.3 C=Cc1ccc(nn1)N(C)C 271570a_100011290941_100000215273 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.3 C=Cc1cnc(cn1)N(C)C 271570a_100011290941_100012356732 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.3 C=Cc1cnc(nc1)N(C)C 271570a_100011290941_100011934759 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.3 C=Cc1cnc(nc1)N(C)C 27a_100102631434_200000143982 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [0,1,0,0,0,0|2,0,0]=3 383 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [0,1,0,0,0,0|2,1,0]=4 384 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [0,1,0,0,0,0|2,1,0]=4 385 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 2230a_100000210773_200025704644 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 34a_100000210773_200025704644 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 7a_100000210773_200025704644 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [0,1,0,0,0,0|1,0,0]=2 391 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [0,1,0,0,0,0|1,0,0]=2 392 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_100000750031_200025704644 [0,1,0,0,0,0|1,1,0]=3 393 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000750031 [0,1,0,0,0,0|1,1,0]=3 394 B11R1.3 CC(C)c1ccc(cn1)S[13CH3] 62a_100010255768_200025704644 [0,1,0,0,0,0|2,1,0]=4 395 B11R1.3 CC(C)c1ccc(cn1)S[13CH3] 62a_200025704644_100010255768 [0,1,0,0,0,0|2,1,0]=4 396 B11R1.3 CC(C)c1ccc(nc1)S[13CH3] 62a_200009815286_200025704644 [0,1,0,0,0,0|2,1,0]=4 397 B11R1.3 CC(C)c1ccc(nc1)S[13CH3] 62a_200025704644_200009815286 [0,1,0,0,0,0|2,1,0]=4 398 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 2230a_100011216399_200025704644 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 34a_100011216399_200025704644 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_100000745893_200025704644 [0,1,0,0,0,0|2,1,0]=4 403 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000745893 [0,1,0,0,0,0|2,1,0]=4 404 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.3 CCc1cnc(nc1)N(C)C 27a_100102631434_100000033099 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.3 CN(C)c1ccc(cc1)C#N 269982a_100000739737_200000210301 [0,1,0,0,0,0|1,0,0]=2 408 B11R1.3 CN(C)c1ccc(cc1)C#N 34a_100000739737_200000210301 [0,1,0,0,0,0|1,0,0]=2 409 B11R1.3 CN(C)c1ccc(cc1)N[13CH3] 34a_100016997997_200025704644 [0,1,0,0,0,0|1,0,0]=2 410 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [0,1,0,0,0,0|0,0,0]=1 411 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_100000210421_200025704644 [0,1,0,0,0,0|0,1,0]=2 412 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000210421 [0,1,0,0,0,0|0,1,0]=2 413 B11R1.3 CN(C)c1ccc(cn1)C#N 27a_100102631434_100000241038 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_100011465347_200025704644 [0,1,0,0,0,0|1,1,0]=3 415 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_200025704644_100011465347 [0,1,0,0,0,0|1,1,0]=3 416 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_100009992925_200025704644 [0,1,0,0,0,0|1,1,0]=3 417 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_200025704644_100009992925 [0,1,0,0,0,0|1,1,0]=3 418 B11R1.3 CN(C)c1ccc(nn1)C#N 27a_100102631434_100000094388 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.3 CN(C)c1ccc(nn1)S[13CH3] 62a_100000215273_200025704644 [0,1,0,0,0,0|2,1,0]=4 420 B11R1.3 CN(C)c1ccc(nn1)S[13CH3] 62a_200025704644_100000215273 [0,1,0,0,0,0|2,1,0]=4 421 B11R1.3 CN(C)c1cnc(cn1)C#N 27a_100102631434_100000059812 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.3 CN(C)c1cnc(cn1)C=O 27a_100102631434_100012001714 [0,1,0,0,0,0|2,0,1]=4 423 B11R1.3 CN(C)c1cnc(cn1)CO 27a_100102631434_100012002382 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.3 CN(C)c1cnc(cn1)S[13CH3] 62a_100012356732_200025704644 [0,1,0,0,0,0|2,1,0]=4 425 B11R1.3 CN(C)c1cnc(cn1)S[13CH3] 62a_200025704644_100012356732 [0,1,0,0,0,0|2,1,0]=4 426 B11R1.3 CN(C)c1cnc(nc1)C#N 27a_100102631434_100000079764 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.3 CN(C)c1ncc(cn1)C#N 27a_100102631434_100000099682 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.3 CN(C)c1ncc(cn1)C=O 27a_100102631434_100000070856 [0,1,0,0,0,0|2,0,1]=4 429 B11R1.3 CN(C)c1ncc(cn1)CO 27a_100102631434_100009855073 [0,1,0,0,0,0|2,0,0]=3 430 B11R1.3 CN(C)c1ncc(cn1)S[13CH3] 62a_100011934759_200025704644 [0,1,0,0,0,0|2,1,0]=4 431 B11R1.3 CN(C)c1ncc(cn1)S[13CH3] 62a_200025704644_100011934759 [0,1,0,0,0,0|2,1,0]=4 432 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 269982a_100000739737_200025704644 [0,1,0,0,0,0|1,0,0]=2 433 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 34a_100000739737_200025704644 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.3 CNc1ccc(cc1)C(C)C 2230a_100000210773_200000210301 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.3 CNc1ccc(cc1)C(C)C 34a_100000210773_200000210301 [0,1,0,0,0,0|2,0,0]=3 436 B11R1.3 CNc1ccc(cc1)C(C)C 7a_100000210773_200000210301 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.3 CNc1ccc(cc1)C(C)O 2230a_100011216399_200000210301 [0,1,0,0,0,0|3,0,0]=4 438 B11R1.3 CNc1ccc(cc1)C(C)O 34a_100011216399_200000210301 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.3 CNc1ccc(cc1)N(C)C 34a_100016997997_200000210301 [0,1,0,0,0,0|1,0,0]=2 440 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [0,1,0,0,0,0|2,0,0]=3 442 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [0,1,0,0,0,0|2,0,0]=3 443 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [0,1,0,0,0,0|1,0,0]=2 447 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [0,1,0,0,0,0|1,0,0]=2 448 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [0,1,0,0,0,0|0,0,0]=1 451 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [0,1,0,0,0,0|0,0,0]=1 452 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [0,1,0,0,0,0|0,0,0]=1 453 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [0,1,0,0,0,0|0,0,0]=1 454 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [0,1,0,0,0,0|0,0,0]=1 455 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [0,1,0,0,0,0|0,0,0]=1 456 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [0,1,0,0,0,0|0,0,0]=1 457 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [0,1,0,0,0,0|2,0,0]=3 459 B11R1.3 COc1ccc(cc1)[C@H](C)N 34a_100161106496_200000210301 [0,1,0,0,0,0|2,0,0]=3 460 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [0,1,0,0,0,0|1,0,0]=2 463 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [0,1,0,0,0,0|1,0,0]=2 464 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [0,1,0,0,0,0|3,0,0]=4 465 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.3 COc1ccc(nn1)N(C)C 27a_100102631434_100010231723 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.3 COc1cnc(nc1)N(C)C 27a_100102631434_100000069167 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [0,1,0,0,0,0|2,1,0]=4 471 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [0,1,0,0,0,0|2,1,0]=4 472 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [0,1,0,0,0,0|2,1,0]=4 473 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [0,1,0,0,0,0|2,1,0]=4 474 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [0,1,0,0,0,0|2,1,0]=4 475 B11R1.3 CSc1ccc(cc1)C(C)C 62a_100000750031_200000210301 [0,1,0,0,0,0|1,1,0]=3 476 B11R1.3 CSc1ccc(cc1)C(C)C 62a_200000210301_100000750031 [0,1,0,0,0,0|1,1,0]=3 477 B11R1.3 CSc1ccc(cc1)C(C)O 62a_100000745893_200000210301 [0,1,0,0,0,0|2,1,0]=4 478 B11R1.3 CSc1ccc(cc1)C(C)O 62a_200000210301_100000745893 [0,1,0,0,0,0|2,1,0]=4 479 B11R1.3 CSc1ccc(cc1)N(C)C 62a_100000210421_200000210301 [0,1,0,0,0,0|0,1,0]=2 480 B11R1.3 CSc1ccc(cc1)N(C)C 62a_200000210301_100000210421 [0,1,0,0,0,0|0,1,0]=2 481 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [0,1,0,0,0,0|2,1,0]=4 482 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_100000720352_200000210301 [0,1,0,0,0,0|2,1,0]=4 483 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_200000210301_100000720352 [0,1,0,0,0,0|2,1,0]=4 484 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_100000753911_200000210301 [0,1,0,0,0,0|2,1,0]=4 485 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_200000210301_100000753911 [0,1,0,0,0,0|2,1,0]=4 486 B11R1.3 CSc1ccc(cn1)C(C)C 62a_200000210301_200009815286 [0,1,0,0,0,0|2,1,0]=4 487 B11R1.3 CSc1ccc(cn1)C(C)C 62a_200009815286_200000210301 [0,1,0,0,0,0|2,1,0]=4 488 B11R1.3 CSc1ccc(cn1)N(C)C 62a_100009992925_200000210301 [0,1,0,0,0,0|1,1,0]=3 489 B11R1.3 CSc1ccc(cn1)N(C)C 62a_200000210301_100009992925 [0,1,0,0,0,0|1,1,0]=3 490 B11R1.3 CSc1ccc(nc1)C(C)C 62a_100010255768_200000210301 [0,1,0,0,0,0|2,1,0]=4 491 B11R1.3 CSc1ccc(nc1)C(C)C 62a_200000210301_100010255768 [0,1,0,0,0,0|2,1,0]=4 492 B11R1.3 CSc1ccc(nc1)N(C)C 27a_100102631434_100009820866 [0,1,0,0,0,0|1,1,0]=3 493 B11R1.3 CSc1ccc(nc1)N(C)C 62a_100011465347_200000210301 [0,1,0,0,0,0|1,1,0]=3 494 B11R1.3 CSc1ccc(nc1)N(C)C 62a_200000210301_100011465347 [0,1,0,0,0,0|1,1,0]=3 495 B11R1.3 CSc1ccc(nn1)N(C)C 62a_100000215273_200000210301 [0,1,0,0,0,0|2,1,0]=4 496 B11R1.3 CSc1ccc(nn1)N(C)C 62a_200000210301_100000215273 [0,1,0,0,0,0|2,1,0]=4 497 B11R1.3 CSc1cnc(cn1)N(C)C 27a_100102631434_200012356277 [0,1,0,0,0,0|2,1,0]=4 498 B11R1.3 CSc1cnc(cn1)N(C)C 62a_100012356732_200000210301 [0,1,0,0,0,0|2,1,0]=4 499 B11R1.3 CSc1cnc(cn1)N(C)C 62a_200000210301_100012356732 [0,1,0,0,0,0|2,1,0]=4 500 B11R1.3 CSc1cnc(nc1)N(C)C 27a_100102631434_100000718988 [0,1,0,0,0,0|2,1,0]=4 501 B11R1.3 CSc1cnc(nc1)N(C)C 62a_100011934759_200000210301 [0,1,0,0,0,0|2,1,0]=4 502 B11R1.3 CSc1cnc(nc1)N(C)C 62a_200000210301_100011934759 [0,1,0,0,0,0|2,1,0]=4 503 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_100000720352_200025704644 [0,1,0,0,0,0|2,1,0]=4 504 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000720352 [0,1,0,0,0,0|2,1,0]=4 505 B11R1.3 C[C@H](N)c1ccc(cc1)O[13CH3] 34a_100161106496_200025704644 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_100000753911_200025704644 [0,1,0,0,0,0|2,1,0]=4 507 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753911 [0,1,0,0,0,0|2,1,0]=4 508 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [0,1,0,0,0,0|1,0,0]=2 509 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [0,1,0,0,0,0|1,0,0]=2 510 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [0,1,0,0,0,0|3,0,0]=4 511 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [0,1,0,0,0,0|3,0,0]=4 513 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [0,1,0,0,0,0|3,0,0]=4 514 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [0,1,0,0,0,0|2,0,1]=4 515 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [0,1,0,0,0,0|2,0,1]=4 516 B11R1.19 CC(C)(C)c1ccc(cc1)O 271570a_203496583355_100011215385 [0,1,0,0,0,0|1,0,0]=2 517 B11R1.19 CC(C)(C)c1ccc(cn1)O 271570a_203496583355_100010245212 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.19 CC(C)(C)c1ccc(nc1)O 271570a_203496583355_100000686854 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.19 CC(C)(N)c1ccc(cc1)O 271570a_203496583355_100000739617 [0,1,0,0,0,0|1,0,0]=2 520 B11R1.19 CC(C)(O)c1ccc(cc1)O 271570a_203496583355_100000753367 [0,1,0,0,0,0|1,0,0]=2 521 B11R1.19 CC(C)(O)c1ccc(cn1)O 271570a_203496583355_100010246419 [0,1,0,0,0,0|2,0,0]=3 522 B11R1.19 CC(C)(O)c1ccc(nc1)O 271570a_203496583355_100010080785 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.19 CC(C)(O)c1ncc(cn1)O 271570a_203496583355_100010115376 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.19 CC(F)(F)c1ccc(cc1)O 271570a_203496583355_100009817129 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.19 CC(F)(F)c1ccc(nc1)O 271570a_203496583355_100010208559 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.19 CS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814649 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.19 CS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100009816761 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.19 C[Si](C)(C)c1ccc(cc1)O 271570a_203496583355_100009813420 [0,1,0,0,0,0|1,0,0]=2 530 B11R1.19 C[Si](C)(C)c1ccc(cn1)O 271570a_203496583355_100010073730 [0,1,0,0,0,0|2,0,0]=3 531 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.19 Oc1ccc(cc1)C(F)(F)F 271570a_203496583355_100000727837 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.21 C=C(C)c1cc(c(cn1)O)N 271570a_100000694244_100009819941 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [0,1,0,0,0,0|2,0,1]=4 538 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [0,1,0,0,0,0|2,0,1]=4 539 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [0,1,0,0,0,0|1,0,1]=3 541 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [0,1,0,0,0,0|2,0,1]=4 545 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [0,1,0,0,0,0|1,0,1]=3 547 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [0,1,0,0,0,0|1,0,1]=3 553 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [0,1,0,0,0,0|2,0,1]=4 558 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [0,1,0,0,0,0|1,0,1]=3 559 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [0,1,0,0,0,0|2,0,1]=4 560 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [0,1,0,0,0,0|2,0,1]=4 562 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [0,1,0,0,0,0|2,0,1]=4 564 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [0,1,0,0,0,0|1,0,1]=3 565 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [0,1,0,0,0,0|2,0,1]=4 566 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,1,0,0,0,0|2,0,1]=4 567 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [0,1,0,0,0,0|2,0,1]=4 568 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [0,1,0,0,0,0|2,0,1]=4 569 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [0,1,0,0,0,0|1,0,1]=3 571 B11R1.21 C=C(C)c1ccc(c(n1)Br)O 271570a_100000694244_100000725334 [0,1,0,0,0,0|2,0,1]=4 572 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [0,1,0,0,0,0|2,0,1]=4 573 B11R1.21 C=C(C)c1ccc(c(n1)Cl)O 271570a_100000694244_100000721234 [0,1,0,0,0,0|2,0,1]=4 574 B11R1.21 C=C(C)c1ccc(c(n1)F)O 271570a_100000694244_100009819667 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.21 C=C(C)c1ccc(c(n1)N)O 271570a_100000694244_100000685527 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [0,1,0,0,0,0|2,0,1]=4 577 B11R1.21 C=C(C)c1cnc(c(c1)Cl)O 271570a_100000694244_100010238531 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.21 C=C(C)c1cnc(c(c1)N)O 271570a_100000694244_100000743729 [0,1,0,0,0,0|2,0,1]=4 579 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,1,0,0,0,0|3,0,0]=4 581 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,1,0,0,0,0|3,0,0]=4 582 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,1,0,0,0,0|3,0,0]=4 589 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,1,0,0,0,0|3,0,0]=4 590 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,1,0,0,0,0|3,0,0]=4 591 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,1,0,0,0,0|2,0,0]=3 593 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,1,0,0,0,0|2,0,0]=3 594 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,1,0,0,0,0|3,0,0]=4 597 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,1,0,0,0,0|3,0,0]=4 598 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,1,0,0,0,0|2,0,0]=3 600 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,1,0,0,0,0|3,0,0]=4 602 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,1,0,0,0,0|2,0,0]=3 606 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,1,0,0,0,0|2,0,0]=3 614 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,1,0,0,0,0|2,0,0]=3 624 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,1,0,0,0,0|2,0,0]=3 625 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [0,1,0,0,0,0|1,0,0]=2 627 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.21 CN(C)c1cc(=O)n(cn1)C 27a_100102631434_100012179353 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_200000210301 [0,1,0,0,0,0|1,0,0]=2 631 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_200000210301 [0,1,0,0,0,0|1,0,0]=2 632 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 34a_100000219944_200000210301 [0,1,0,0,0,0|1,0,0]=2 633 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 2230a_100000697440_200000210301 [0,1,0,0,0,0|1,0,0]=2 634 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 269982a_100000697440_200000210301 [0,1,0,0,0,0|1,0,0]=2 635 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 34a_100000697440_200000210301 [0,1,0,0,0,0|1,0,0]=2 636 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 38a_100000697440_200000210301 [0,1,0,0,0,0|1,0,0]=2 637 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 7a_100000697440_200000210301 [0,1,0,0,0,0|1,0,0]=2 638 B11R1.21 CN(C)c1ccc(c(c1)F)Br 2230a_100012285320_200000210301 [0,1,0,0,0,0|1,0,0]=2 639 B11R1.21 CN(C)c1ccc(c(c1)F)Br 269982a_100012285320_200000210301 [0,1,0,0,0,0|1,0,0]=2 640 B11R1.21 CN(C)c1ccc(c(c1)F)Br 34a_100012285320_200000210301 [0,1,0,0,0,0|1,0,0]=2 641 B11R1.21 CN(C)c1ccc(c(c1)F)Br 7a_100012285320_200000210301 [0,1,0,0,0,0|1,0,0]=2 642 B11R1.21 CN(C)c1ccc(c(c1)F)F 2230a_100000221014_200000210301 [0,1,0,0,0,0|1,0,0]=2 643 B11R1.21 CN(C)c1ccc(c(c1)F)F 269982a_100000221014_200000210301 [0,1,0,0,0,0|1,0,0]=2 644 B11R1.21 CN(C)c1ccc(c(c1)F)F 34a_100000221014_200000210301 [0,1,0,0,0,0|1,0,0]=2 645 B11R1.21 CN(C)c1ccc(c(c1)F)F 38a_100000221014_200000210301 [0,1,0,0,0,0|1,0,0]=2 646 B11R1.21 CN(C)c1ccc(c(c1)F)F 7a_100000221014_200000210301 [0,1,0,0,0,0|1,0,0]=2 647 B11R1.21 CN(C)c1ccc(c(c1)O)N 271570a_203496583355_200013039233 [0,1,0,0,0,0|1,0,0]=2 648 B11R1.21 CN(C)c1ccc(c(n1)F)Br 27a_100102631434_100010134343 [0,1,0,0,0,0|2,0,0]=3 649 B11R1.21 CN(C)c1ccn(c(=O)c1)C 27a_100102631434_100009820031 [0,1,0,0,0,0|2,0,0]=3 650 B11R1.21 CN(C)c1ncc(c(n1)N)F 27a_100102631434_100000185498 [0,1,0,0,0,0|3,0,0]=4 651 B11R1.21 CN(C)c1ncc(c(n1)O)F 27a_100102631434_100011995740 [0,1,0,0,0,0|3,0,0]=4 652 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000219944_200025704644 [0,1,0,0,0,0|1,0,0]=2 653 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 269982a_100000219944_200025704644 [0,1,0,0,0,0|1,0,0]=2 654 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 34a_100000219944_200025704644 [0,1,0,0,0,0|1,0,0]=2 655 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 2230a_100000697440_200025704644 [0,1,0,0,0,0|1,0,0]=2 656 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 269982a_100000697440_200025704644 [0,1,0,0,0,0|1,0,0]=2 657 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 34a_100000697440_200025704644 [0,1,0,0,0,0|1,0,0]=2 658 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 38a_100000697440_200025704644 [0,1,0,0,0,0|1,0,0]=2 659 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 7a_100000697440_200025704644 [0,1,0,0,0,0|1,0,0]=2 660 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 2230a_100012285320_200025704644 [0,1,0,0,0,0|1,0,0]=2 661 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 269982a_100012285320_200025704644 [0,1,0,0,0,0|1,0,0]=2 662 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 34a_100012285320_200025704644 [0,1,0,0,0,0|1,0,0]=2 663 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 7a_100012285320_200025704644 [0,1,0,0,0,0|1,0,0]=2 664 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 2230a_100000221014_200025704644 [0,1,0,0,0,0|1,0,0]=2 665 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 269982a_100000221014_200025704644 [0,1,0,0,0,0|1,0,0]=2 666 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 34a_100000221014_200025704644 [0,1,0,0,0,0|1,0,0]=2 667 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 38a_100000221014_200025704644 [0,1,0,0,0,0|1,0,0]=2 668 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 7a_100000221014_200025704644 [0,1,0,0,0,0|1,0,0]=2 669 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [0,1,0,0,0,0|3,0,0]=4 671 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,1,0,0,0,0|3,0,0]=4 672 B11R1.21 Cc1cc(ccc1Br)N(C)C 2230a_100102888905_200000210301 [0,1,0,0,0,0|1,0,0]=2 673 B11R1.21 Cc1cc(ccc1Br)N(C)C 269982a_100102888905_200000210301 [0,1,0,0,0,0|1,0,0]=2 674 B11R1.21 Cc1cc(ccc1Br)N(C)C 34a_100102888905_200000210301 [0,1,0,0,0,0|1,0,0]=2 675 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 2230a_100102888905_200025704644 [0,1,0,0,0,0|1,0,0]=2 676 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 269982a_100102888905_200025704644 [0,1,0,0,0,0|1,0,0]=2 677 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 34a_100102888905_200025704644 [0,1,0,0,0,0|1,0,0]=2 678 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.21 Cc1cc(ccc1Cl)N(C)C 2230a_114849113799_200000210301 [0,1,0,0,0,0|1,0,0]=2 680 B11R1.21 Cc1cc(ccc1Cl)N(C)C 269982a_114849113799_200000210301 [0,1,0,0,0,0|1,0,0]=2 681 B11R1.21 Cc1cc(ccc1Cl)N(C)C 34a_114849113799_200000210301 [0,1,0,0,0,0|1,0,0]=2 682 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 2230a_114849113799_200025704644 [0,1,0,0,0,0|1,0,0]=2 683 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 269982a_114849113799_200025704644 [0,1,0,0,0,0|1,0,0]=2 684 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 34a_114849113799_200025704644 [0,1,0,0,0,0|1,0,0]=2 685 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.21 Cc1cc(ccc1F)N(C)C 2230a_100011756966_200000210301 [0,1,0,0,0,0|1,0,0]=2 687 B11R1.21 Cc1cc(ccc1F)N(C)C 269982a_100011756966_200000210301 [0,1,0,0,0,0|1,0,0]=2 688 B11R1.21 Cc1cc(ccc1F)N(C)C 34a_100011756966_200000210301 [0,1,0,0,0,0|1,0,0]=2 689 B11R1.21 Cc1cc(ccc1F)N(C)C 38a_100011756966_200000210301 [0,1,0,0,0,0|1,0,0]=2 690 B11R1.21 Cc1cc(ccc1F)N(C)C 7a_100011756966_200000210301 [0,1,0,0,0,0|1,0,0]=2 691 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 2230a_100011756966_200025704644 [0,1,0,0,0,0|1,0,0]=2 692 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 269982a_100011756966_200025704644 [0,1,0,0,0,0|1,0,0]=2 693 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 34a_100011756966_200025704644 [0,1,0,0,0,0|1,0,0]=2 694 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 38a_100011756966_200025704644 [0,1,0,0,0,0|1,0,0]=2 695 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 7a_100011756966_200025704644 [0,1,0,0,0,0|1,0,0]=2 696 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.21 Cc1cc(ccc1O)B(O)O 271570a_203496583355_100010089846 [0,1,0,0,0,0|3,0,0]=4 698 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [0,1,0,0,0,0|3,0,0]=4 699 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,1,0,0,0,0|2,0,0]=3 700 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [0,1,0,0,0,0|0,0,0]=1 701 B11R1.21 Cc1cc(ncc1O)C(C)C 271570a_203496583355_100021475462 [0,1,0,0,0,0|2,0,0]=3 702 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.21 Cc1ccc(cc1Br)N(C)C 2230a_100000707694_200000210301 [0,1,0,0,0,0|1,0,0]=2 704 B11R1.21 Cc1ccc(cc1Br)N(C)C 269982a_100000707694_200000210301 [0,1,0,0,0,0|1,0,0]=2 705 B11R1.21 Cc1ccc(cc1Br)N(C)C 34a_100000707694_200000210301 [0,1,0,0,0,0|1,0,0]=2 706 B11R1.21 Cc1ccc(cc1Br)N(C)C 38a_100000707694_200000210301 [0,1,0,0,0,0|1,0,0]=2 707 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 2230a_100000707694_200025704644 [0,1,0,0,0,0|1,0,0]=2 708 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 269982a_100000707694_200025704644 [0,1,0,0,0,0|1,0,0]=2 709 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 34a_100000707694_200025704644 [0,1,0,0,0,0|1,0,0]=2 710 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 38a_100000707694_200025704644 [0,1,0,0,0,0|1,0,0]=2 711 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.21 Cc1ccc(cc1Cl)N(C)C 2230a_100000220120_200000210301 [0,1,0,0,0,0|1,0,0]=2 714 B11R1.21 Cc1ccc(cc1Cl)N(C)C 269982a_100000220120_200000210301 [0,1,0,0,0,0|1,0,0]=2 715 B11R1.21 Cc1ccc(cc1Cl)N(C)C 34a_100000220120_200000210301 [0,1,0,0,0,0|1,0,0]=2 716 B11R1.21 Cc1ccc(cc1Cl)N(C)C 38a_100000220120_200000210301 [0,1,0,0,0,0|1,0,0]=2 717 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 2230a_100000220120_200025704644 [0,1,0,0,0,0|1,0,0]=2 718 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 269982a_100000220120_200025704644 [0,1,0,0,0,0|1,0,0]=2 719 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 34a_100000220120_200025704644 [0,1,0,0,0,0|1,0,0]=2 720 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 38a_100000220120_200025704644 [0,1,0,0,0,0|1,0,0]=2 721 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.21 Cc1ccc(cc1F)N(C)C 2230a_100160572069_200000210301 [0,1,0,0,0,0|1,0,0]=2 723 B11R1.21 Cc1ccc(cc1F)N(C)C 269982a_100160572069_200000210301 [0,1,0,0,0,0|1,0,0]=2 724 B11R1.21 Cc1ccc(cc1F)N(C)C 34a_100160572069_200000210301 [0,1,0,0,0,0|1,0,0]=2 725 B11R1.21 Cc1ccc(cc1F)N(C)C 38a_100160572069_200000210301 [0,1,0,0,0,0|1,0,0]=2 726 B11R1.21 Cc1ccc(cc1F)N(C)C 7a_100160572069_200000210301 [0,1,0,0,0,0|1,0,0]=2 727 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 2230a_100160572069_200025704644 [0,1,0,0,0,0|1,0,0]=2 728 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 269982a_100160572069_200025704644 [0,1,0,0,0,0|1,0,0]=2 729 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 34a_100160572069_200025704644 [0,1,0,0,0,0|1,0,0]=2 730 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 38a_100160572069_200025704644 [0,1,0,0,0,0|1,0,0]=2 731 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 7a_100160572069_200025704644 [0,1,0,0,0,0|1,0,0]=2 732 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,1,0,0,0,0|3,0,0]=4 733 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,1,0,0,0,0|3,0,0]=4 734 B11R1.21 Cc1cnc(cc1F)N(C)C 27a_100102631434_100009841206 [0,1,0,0,0,0|2,0,0]=3 735 B11R1.21 Cc1cnc(nc1N)N(C)C 27a_100102631434_100011996698 [0,1,0,0,0,0|3,0,0]=4 736 B11R1.21 Cc1nc(ncc1Cl)N(C)C 27a_100102631434_100010174973 [0,1,0,0,0,0|3,0,0]=4 737 B11R1.21 Cc1nc(ncc1F)N(C)C 27a_100102631434_100015641512 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.21 Cc1nc(ncc1N)N(C)C 27a_100102631434_100000123670 [0,1,0,0,0,0|3,0,0]=4 739 B11R1.21 Cc1ncc(nc1C)N(C)C 27a_100102631434_100009878948 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [0,1,0,0,0,0|3,0,0]=4 741 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.21 OB(O)c1ccc(c(c1)F)O 271570a_203496583355_100009813512 [0,1,0,0,0,0|3,0,0]=4 744 B11R1.21 Oc1ccc(cc1F)C(F)F 271570a_203496583355_100010189893 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,1,0,0,0,0|3,0,0]=4 746 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,1,0,0,0,0|3,0,0]=4 747 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,1,0,0,0,0|3,0,0]=4 751 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,1,0,0,0,0|3,0,0]=4 752 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,1,0,0,0,0|2,0,0]=3 755 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,1,0,0,0,0|2,0,0]=3 760 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,1,0,0,0,0|3,0,0]=4 761 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,1,0,0,0,0|3,0,0]=4 762 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,1,0,0,0,0|3,0,0]=4 763 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,1,0,0,0,0|3,0,0]=4 766 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,1,0,0,0,0|3,0,0]=4 767 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,1,0,0,0,0|3,0,0]=4 768 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [0,1,0,0,0,0|1,0,1]=3 771 B11R1.22 CC(N[13CH3])c1ccc(cn1)Br 2230a_100000723930_200025704644 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,1,0,0,0,0|2,0,0]=3 773 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,1,0,0,0,0|2,0,0]=3 774 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,1,0,0,0,0|2,0,0]=3 775 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,1,0,0,0,0|2,0,0]=3 776 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,1,0,0,0,0|2,0,0]=3 777 B11R1.22 CC(O[13CH3])c1ccc(cn1)Br 34a_100012353650_200025704644 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.22 CC(O[13CH3])c1ccc(cn1)Br 7a_100012353650_200025704644 [0,1,0,0,0,0|3,0,0]=4 779 B11R1.22 CC(O[13CH3])c1ccc(nc1)Br 34a_200010274204_200025704644 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.22 CC(O[13CH3])c1ccc(nc1)Br 7a_200010274204_200025704644 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.22 CC(O[13CH3])c1ccc(nc1)Cl 34a_200012017543_200025704644 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.22 CC(O[13CH3])c1ccc(nc1)Cl 7a_200012017543_200025704644 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,1,0,0,0,0|2,0,0]=3 784 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,1,0,0,0,0|2,0,0]=3 785 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,1,0,0,0,0|2,0,0]=3 786 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,1,0,0,0,0|2,0,0]=3 787 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,1,0,0,0,0|2,0,0]=3 788 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,1,0,0,0,0|2,0,0]=3 789 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,0,0,0,0|2,0,0]=3 795 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,0,0,0,0|2,0,0]=3 796 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,0,0,0,0|3,0,0]=4 797 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,1,0,0,0,0|1,0,0]=2 798 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,1,0,0,0,0|2,0,0]=3 799 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,1,0,0,0,0|1,0,0]=2 800 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,1,0,0,0,0|1,0,0]=2 801 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,1,0,0,0,0|1,0,0]=2 802 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,1,0,0,0,0|1,0,0]=2 803 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,1,0,0,0,0|1,0,0]=2 804 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,1,0,0,0,0|1,0,0]=2 805 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,1,0,0,0,0|1,0,0]=2 806 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,1,0,0,0,0|1,0,0]=2 807 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,1,0,0,0,0|1,0,0]=2 808 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,1,0,0,0,0|1,0,0]=2 809 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,1,0,0,0,0|1,0,0]=2 810 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,1,0,0,0,0|1,0,0]=2 811 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,1,0,0,0,0|1,0,0]=2 812 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,1,0,0,0,0|1,0,0]=2 813 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,1,0,0,0,0|1,0,0]=2 814 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,1,0,0,0,0|1,0,0]=2 815 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,1,0,0,0,0|1,0,0]=2 816 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,1,0,0,0,0|1,0,0]=2 817 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,1,0,0,0,0|1,0,0]=2 818 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,1,0,0,0,0|1,0,0]=2 819 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,1,0,0,0,0|1,0,0]=2 820 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,1,0,0,0,0|1,0,0]=2 821 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,1,0,0,0,0|1,0,0]=2 822 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,1,0,0,0,0|1,0,0]=2 823 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,1,0,0,0,0|1,0,0]=2 824 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,1,0,0,0,0|1,0,0]=2 825 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,1,0,0,0,0|1,0,0]=2 826 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,1,0,0,0,0|0,0,0]=1 827 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,1,0,0,0,0|0,0,0]=1 828 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,1,0,0,0,0|0,0,0]=1 829 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,1,0,0,0,0|0,0,0]=1 830 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,1,0,0,0,0|0,0,0]=1 831 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,1,0,0,0,0|1,0,0]=2 832 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,1,0,0,0,0|1,0,0]=2 833 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,1,0,0,0,0|1,0,0]=2 834 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,1,0,0,0,0|1,0,0]=2 835 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,1,0,0,0,0|1,0,0]=2 836 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,1,0,0,0,0|1,0,0]=2 837 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,1,0,0,0,0|1,0,0]=2 838 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,1,0,0,0,0|1,0,0]=2 839 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,1,0,0,0,0|1,0,0]=2 840 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,1,0,0,0,0|1,0,0]=2 841 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,1,0,0,0,0|1,0,0]=2 842 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,1,0,0,0,0|1,0,0]=2 843 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,1,0,0,0,0|0,0,0]=1 844 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,1,0,0,0,0|0,0,0]=1 845 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,1,0,0,0,0|0,0,0]=1 846 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,1,0,0,0,0|2,0,0]=3 847 B11R1.22 CN(CF)c1ccc(cc1)Br 269982a_100000219623_100015361967 [0,1,0,0,0,0|1,0,0]=2 848 B11R1.22 CN(CF)c1ccc(cc1)Br 34a_100000219623_100015361967 [0,1,0,0,0,0|1,0,0]=2 849 B11R1.22 CN(CF)c1ccc(cc1)Cl 269982a_100020629279_100015361967 [0,1,0,0,0,0|1,0,0]=2 850 B11R1.22 CN(CF)c1ccc(cc1)Cl 34a_100020629279_100015361967 [0,1,0,0,0,0|1,0,0]=2 851 B11R1.22 CN(CF)c1ccc(cc1)F 269982a_100000219829_100015361967 [0,1,0,0,0,0|1,0,0]=2 852 B11R1.22 CN(CF)c1ccc(cc1)F 34a_100000219829_100015361967 [0,1,0,0,0,0|1,0,0]=2 853 B11R1.22 CN(CF)c1ccc(cc1)I 269982a_100000743151_100015361967 [0,1,0,0,0,0|1,0,0]=2 854 B11R1.22 CN(CF)c1ccc(cc1)I 34a_100000743151_100015361967 [0,1,0,0,0,0|1,0,0]=2 855 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [0,1,0,0,0,0|0,0,0]=1 856 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [0,1,0,0,0,0|0,0,0]=1 857 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 868 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,0,0,0,0|3,0,0]=4 869 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,0,0,0,0|3,0,0]=4 870 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 871 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 872 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,0,0,0,0|3,0,0]=4 873 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,0,0,0,0|3,0,0]=4 874 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 875 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 876 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,0,0,0,0|3,0,0]=4 877 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,0,0,0,0|2,0,0]=3 878 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,0,0,0,0|2,0,0]=3 879 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,0,0,0,0|2,0,0]=3 880 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,0,0,0,0|3,0,0]=4 881 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,0,0,0,0|3,0,0]=4 882 B11R1.22 CNC(C)c1cc[n+](cc1)[O-] 269862a_106832991636_100000076990 [0,1,0,0,0,0|2,0,1]=4 883 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,1,0,0,0,0|2,0,0]=3 884 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,1,0,0,0,0|2,0,0]=3 885 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,1,0,0,0,0|2,0,0]=3 886 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,1,0,0,0,0|2,0,0]=3 889 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,1,0,0,0,0|2,0,0]=3 890 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,1,0,0,0,0|2,0,0]=3 891 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,1,0,0,0,0|2,0,0]=3 892 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,1,0,0,0,0|2,0,0]=3 893 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,1,0,0,0,0|2,0,0]=3 894 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,1,0,0,0,0|2,0,0]=3 895 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,1,0,0,0,0|2,0,0]=3 896 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,1,0,0,0,0|2,0,0]=3 897 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,1,0,0,0,0|2,0,0]=3 898 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,1,0,0,0,0|1,0,0]=2 899 B11R1.22 CNC(C)c1ccc(cn1)Br 2230a_100000723930_200000210301 [0,1,0,0,0,0|3,0,0]=4 900 B11R1.22 CNC(C)c1ccc(cn1)Br 269862a_106832991636_100000686046 [0,1,0,0,0,0|3,0,0]=4 901 B11R1.22 CNC(C)c1ccc(cn1)Br 270004a_106832991635_100000686046 [0,1,0,0,0,0|3,0,0]=4 902 B11R1.22 CNC(C)c1ccc(cn1)C 269862a_106832991636_100000084104 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.22 CNC(C)c1ccc(cn1)C 270004a_106832991635_100000084104 [0,1,0,0,0,0|3,0,0]=4 904 B11R1.22 CNC(C)c1ccc(cn1)Cl 269862a_106832991636_100000692432 [0,1,0,0,0,0|3,0,0]=4 905 B11R1.22 CNC(C)c1ccc(cn1)Cl 270004a_106832991635_100000692432 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.22 CNC(C)c1ccc(cn1)F 269862a_106832991636_100102946652 [0,1,0,0,0,0|3,0,0]=4 907 B11R1.22 CNC(C)c1ccc(cn1)F 270004a_106832991635_100102946652 [0,1,0,0,0,0|3,0,0]=4 908 B11R1.22 CNC(C)c1ccc(nc1)Br 269862a_106832991636_100000684857 [0,1,0,0,0,0|3,0,0]=4 909 B11R1.22 CNC(C)c1ccc(nc1)C 2230a_100011815741_200000210301 [0,1,0,0,0,0|3,0,0]=4 910 B11R1.22 CNC(C)c1ccc(nc1)C 269862a_106832991636_100011280547 [0,1,0,0,0,0|3,0,0]=4 911 B11R1.22 CNC(C)c1ccc(nc1)C 34a_100011815741_200000210301 [0,1,0,0,0,0|3,0,0]=4 912 B11R1.22 CNC(C)c1ccc(nc1)Cl 269862a_106832991636_100000690552 [0,1,0,0,0,0|3,0,0]=4 913 B11R1.22 CNC(C)c1ccc(nc1)F 269862a_106832991636_100000085738 [0,1,0,0,0,0|3,0,0]=4 914 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,1,0,0,0,0|2,0,0]=3 915 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,1,0,0,0,0|2,0,0]=3 916 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,1,0,0,0,0|2,0,0]=3 917 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,1,0,0,0,0|1,0,0]=2 918 B11R1.22 CN[C@@H](C)c1ccc(nc1)Br 2230a_100015387476_200000210301 [0,1,0,0,0,0|3,0,0]=4 919 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,1,0,0,0,0|2,0,0]=3 920 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,1,0,0,0,0|2,0,0]=3 921 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,1,0,0,0,0|2,0,0]=3 922 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,1,0,0,0,0|2,0,0]=3 923 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,1,0,0,0,0|2,0,0]=3 924 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,0,0,0,0|2,0,0]=3 925 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,0,0,0,0|3,0,0]=4 926 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,0,0,0,0|3,0,0]=4 927 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,1,0,0,0,0|2,0,0]=3 928 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,1,0,0,0,0|2,0,0]=3 929 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,1,0,0,0,0|2,0,0]=3 930 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,1,0,0,0,0|2,0,0]=3 932 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,1,0,0,0,0|1,0,0]=2 936 B11R1.22 COC(C)c1ccc(cn1)Br 34a_100012353650_200000210301 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.22 COC(C)c1ccc(cn1)Br 7a_100012353650_200000210301 [0,1,0,0,0,0|3,0,0]=4 938 B11R1.22 COC(C)c1ccc(nc1)Br 34a_200010274204_200000210301 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.22 COC(C)c1ccc(nc1)Br 7a_200010274204_200000210301 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.22 COC(C)c1ccc(nc1)C 34a_200011815720_200000210301 [0,1,0,0,0,0|3,0,0]=4 941 B11R1.22 COC(C)c1ccc(nc1)C 7a_200011815720_200000210301 [0,1,0,0,0,0|3,0,0]=4 942 B11R1.22 COC(C)c1ccc(nc1)Cl 34a_200012017543_200000210301 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.22 COC(C)c1ccc(nc1)Cl 7a_200012017543_200000210301 [0,1,0,0,0,0|3,0,0]=4 944 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,1,0,0,0,0|2,0,0]=3 945 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,1,0,0,0,0|2,0,0]=3 946 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,1,0,0,0,0|2,0,0]=3 947 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,1,0,0,0,0|2,0,0]=3 948 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,1,0,0,0,0|2,0,0]=3 950 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,1,0,0,0,0|2,0,0]=3 951 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,1,0,0,0,0|2,0,0]=3 952 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,1,0,0,0,0|2,0,0]=3 953 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,1,0,0,0,0|2,0,0]=3 954 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,1,0,0,0,0|2,0,0]=3 955 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,1,0,0,0,0|2,0,0]=3 956 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,1,0,0,0,0|2,0,0]=3 957 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,1,0,0,0,0|2,0,0]=3 958 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,1,0,0,0,0|2,0,0]=3 959 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,1,0,0,0,0|2,0,0]=3 960 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,1,0,0,0,0|2,0,0]=3 961 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,1,0,0,0,0|2,0,0]=3 962 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,1,0,0,0,0|1,0,0]=2 963 B11R1.22 C[C@H](N[13CH3])c1ccc(nc1)Br 2230a_100015387476_200025704644 [0,1,0,0,0,0|3,0,0]=4 964 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,1,0,0,0,0|2,0,0]=3 965 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,1,0,0,0,0|2,0,0]=3 966 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,0,0,0,0|3,0,0]=4 967 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,1,0,0,0,0|2,0,0]=3 968 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,1,0,0,0,0|2,0,0]=3 969 B11R1.22 Cc1ccc(cc1)N(C)CF 269982a_100000219977_100015361967 [0,1,0,0,0,0|1,0,0]=2 970 B11R1.22 Cc1ccc(cc1)N(C)CF 34a_100000219977_100015361967 [0,1,0,0,0,0|1,0,0]=2 971 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,1,0,0,0,0|2,0,0]=3 972 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,1,0,0,0,0|2,0,0]=3 973 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,1,0,0,0,0|2,0,0]=3 974 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,1,0,0,0,0|2,0,0]=3 975 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 2230a_100011815741_200025704644 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 34a_100011815741_200025704644 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 34a_200011815720_200025704644 [0,1,0,0,0,0|3,0,0]=4 978 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 7a_200011815720_200025704644 [0,1,0,0,0,0|3,0,0]=4 979 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.22 N#CC(N)c1ccc(cc1)O 271570a_203496583355_106722365845 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [0,1,0,0,0,0|2,0,0]=3 982 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,0,0,0,0|3,0,0]=4 987 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,0,0,0,0|3,0,0]=4 988 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,0,0,0,0|3,0,0]=4 989 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,0,0,0,0|2,0,0]=3 990 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,0,0,0,0|2,0,0]=3 991 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,1,0,0,0,0|2,0,0]=3 993 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,1,0,0,0,0|3,0,0]=4 997 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [0,1,0,0,0,0|2,0,1]=4 998 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [0,1,0,0,0,0|2,0,1]=4 999 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [0,1,0,0,0,0|1,0,1]=3 1003 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [0,1,0,0,0,0|2,0,1]=4 1004 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,0,0,0,0|2,0,1]=4 1005 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [0,1,0,0,0,0|1,0,1]=3 1009 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [0,1,0,0,0,0|2,0,1]=4 1010 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [0,1,0,0,0,0|2,0,1]=4 1011 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [0,1,0,0,0,0|2,0,1]=4 1012 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [0,1,0,0,0,0|1,0,1]=3 1015 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [0,1,0,0,0,0|2,0,1]=4 1016 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [0,1,0,0,0,0|2,0,1]=4 1018 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [0,1,0,0,0,0|2,0,1]=4 1019 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [0,1,0,0,0,0|2,0,1]=4 1020 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [0,1,0,0,0,0|1,0,1]=3 1021 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [0,1,0,0,0,0|1,0,1]=3 1027 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [0,1,0,0,0,0|1,0,1]=3 1032 B11R1.166 C=C(C)c1ccc(nc1C)O 271570a_100000694244_100000691680 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.166 C=C(C)c1ccc(nc1F)O 271570a_100000694244_100009879308 [0,1,0,0,0,0|2,0,1]=4 1034 B11R1.166 C=C(C)c1cnc(cc1C)O 271570a_100000694244_100010114363 [0,1,0,0,0,0|2,0,1]=4 1035 B11R1.166 C=C(C)c1ncc(cc1C)O 271570a_100000694244_100012000486 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.166 C=C(C)c1ncc(cc1F)O 271570a_100000694244_100000063512 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,1,0,0,0,0|3,0,0]=4 1038 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,1,0,0,0,0|3,0,0]=4 1039 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,1,0,0,0,0|3,0,0]=4 1040 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,1,0,0,0,0|3,0,0]=4 1041 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,1,0,0,0,0|3,0,0]=4 1042 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,1,0,0,0,0|2,0,0]=3 1043 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,1,0,0,0,0|3,0,0]=4 1044 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,1,0,0,0,0|3,0,0]=4 1045 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,1,0,0,0,0|3,0,0]=4 1046 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,1,0,0,0,0|3,0,0]=4 1047 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,1,0,0,0,0|3,0,0]=4 1048 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,1,0,0,0,0|2,0,0]=3 1049 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,1,0,0,0,0|3,0,0]=4 1051 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,1,0,0,0,0|3,0,0]=4 1052 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,1,0,0,0,0|3,0,0]=4 1053 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,1,0,0,0,0|3,0,0]=4 1054 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,1,0,0,0,0|3,0,0]=4 1057 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,1,0,0,0,0|3,0,0]=4 1058 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,1,0,0,0,0|3,0,0]=4 1059 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,1,0,0,0,0|3,0,0]=4 1060 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,1,0,0,0,0|3,0,0]=4 1061 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,1,0,0,0,0|3,0,0]=4 1064 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,1,0,0,0,0|3,0,0]=4 1065 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,1,0,0,0,0|3,0,0]=4 1066 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,1,0,0,0,0|3,0,0]=4 1067 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,0,0,0,0|3,0,0]=4 1069 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,0,0,0,0|3,0,0]=4 1070 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,0,0,0,0|3,0,0]=4 1071 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,0,0,0,0|3,0,0]=4 1072 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,0,0,0,0|3,0,0]=4 1073 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,0,0,0,0|3,0,0]=4 1074 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,0,0,0,0|3,0,0]=4 1075 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,0,0,0,0|2,0,0]=3 1076 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,0,0,0,0|2,0,0]=3 1077 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,0,0,0,0|2,0,0]=3 1078 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.166 CC(N)c1ccc(cc1F)O 271570a_203496583355_100000730447 [0,1,0,0,0,0|2,0,0]=3 1080 B11R1.166 CN(C)c1ccc(cc1Br)Br 269982a_200000221195_200000210301 [0,1,0,0,0,0|1,0,0]=2 1081 B11R1.166 CN(C)c1ccc(cc1Br)Br 34a_200000221195_200000210301 [0,1,0,0,0,0|1,0,0]=2 1082 B11R1.166 CN(C)c1ccc(cc1Br)Cl 269982a_100020633009_200000210301 [0,1,0,0,0,0|1,0,0]=2 1083 B11R1.166 CN(C)c1ccc(cc1Br)Cl 34a_100020633009_200000210301 [0,1,0,0,0,0|1,0,0]=2 1084 B11R1.166 CN(C)c1ccc(cc1Br)F 269982a_100011246292_200000210301 [0,1,0,0,0,0|1,0,0]=2 1085 B11R1.166 CN(C)c1ccc(cc1Br)F 34a_100011246292_200000210301 [0,1,0,0,0,0|1,0,0]=2 1086 B11R1.166 CN(C)c1ccc(cc1Cl)Br 269982a_100000221650_200000210301 [0,1,0,0,0,0|1,0,0]=2 1087 B11R1.166 CN(C)c1ccc(cc1Cl)Br 34a_100000221650_200000210301 [0,1,0,0,0,0|1,0,0]=2 1088 B11R1.166 CN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_200000210301 [0,1,0,0,0,0|1,0,0]=2 1089 B11R1.166 CN(C)c1ccc(cc1Cl)Cl 34a_114849113696_200000210301 [0,1,0,0,0,0|1,0,0]=2 1090 B11R1.166 CN(C)c1ccc(cc1F)Br 2230a_100000743884_200000210301 [0,1,0,0,0,0|1,0,0]=2 1091 B11R1.166 CN(C)c1ccc(cc1F)Br 269982a_100000743884_200000210301 [0,1,0,0,0,0|1,0,0]=2 1092 B11R1.166 CN(C)c1ccc(cc1F)Br 34a_100000743884_200000210301 [0,1,0,0,0,0|1,0,0]=2 1093 B11R1.166 CN(C)c1ccc(cc1F)F 2230a_100020633734_200000210301 [0,1,0,0,0,0|1,0,0]=2 1094 B11R1.166 CN(C)c1ccc(cc1F)F 269982a_100020633734_200000210301 [0,1,0,0,0,0|1,0,0]=2 1095 B11R1.166 CN(C)c1ccc(cc1F)F 34a_100020633734_200000210301 [0,1,0,0,0,0|1,0,0]=2 1096 B11R1.166 CN(C)c1ccc(cc1F)F 38a_100020633734_200000210301 [0,1,0,0,0,0|1,0,0]=2 1097 B11R1.166 CN(C)c1ccc(cc1F)I 269982a_114948340911_200000210301 [0,1,0,0,0,0|1,0,0]=2 1098 B11R1.166 CN(C)c1ccc(cc1F)I 34a_114948340911_200000210301 [0,1,0,0,0,0|1,0,0]=2 1099 B11R1.166 CN(C)c1ccc(cc1F)I 38a_114948340911_200000210301 [0,1,0,0,0,0|1,0,0]=2 1100 B11R1.166 CN(C)c1ccc(cc1N)O 271570a_203496583355_100000737018 [0,1,0,0,0,0|0,0,0]=1 1101 B11R1.166 CN(C)c1ccc(cc1O)F 271570a_203496583355_100012349029 [0,1,0,0,0,0|1,0,0]=2 1102 B11R1.166 CN(C)c1ccc(cc1O)N 271570a_203496583355_100011534197 [0,1,0,0,0,0|1,0,0]=2 1103 B11R1.166 CN(C)c1ncc(cc1O)N 271570a_203496583355_200012353320 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.166 CN([13CH3])c1ccc(cc1Br)Br 269982a_200000221195_200025704644 [0,1,0,0,0,0|1,0,0]=2 1105 B11R1.166 CN([13CH3])c1ccc(cc1Br)Br 34a_200000221195_200025704644 [0,1,0,0,0,0|1,0,0]=2 1106 B11R1.166 CN([13CH3])c1ccc(cc1Br)Cl 269982a_100020633009_200025704644 [0,1,0,0,0,0|1,0,0]=2 1107 B11R1.166 CN([13CH3])c1ccc(cc1Br)Cl 34a_100020633009_200025704644 [0,1,0,0,0,0|1,0,0]=2 1108 B11R1.166 CN([13CH3])c1ccc(cc1Br)F 269982a_100011246292_200025704644 [0,1,0,0,0,0|1,0,0]=2 1109 B11R1.166 CN([13CH3])c1ccc(cc1Br)F 34a_100011246292_200025704644 [0,1,0,0,0,0|1,0,0]=2 1110 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Br 269982a_100000221650_200025704644 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Br 34a_100000221650_200025704644 [0,1,0,0,0,0|1,0,0]=2 1112 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Cl 269982a_114849113696_200025704644 [0,1,0,0,0,0|1,0,0]=2 1113 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Cl 34a_114849113696_200025704644 [0,1,0,0,0,0|1,0,0]=2 1114 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 2230a_100000743884_200025704644 [0,1,0,0,0,0|1,0,0]=2 1115 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 269982a_100000743884_200025704644 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 34a_100000743884_200025704644 [0,1,0,0,0,0|1,0,0]=2 1117 B11R1.166 CN([13CH3])c1ccc(cc1F)F 2230a_100020633734_200025704644 [0,1,0,0,0,0|1,0,0]=2 1118 B11R1.166 CN([13CH3])c1ccc(cc1F)F 269982a_100020633734_200025704644 [0,1,0,0,0,0|1,0,0]=2 1119 B11R1.166 CN([13CH3])c1ccc(cc1F)F 34a_100020633734_200025704644 [0,1,0,0,0,0|1,0,0]=2 1120 B11R1.166 CN([13CH3])c1ccc(cc1F)F 38a_100020633734_200025704644 [0,1,0,0,0,0|1,0,0]=2 1121 B11R1.166 CN([13CH3])c1ccc(cc1F)I 269982a_114948340911_200025704644 [0,1,0,0,0,0|1,0,0]=2 1122 B11R1.166 CN([13CH3])c1ccc(cc1F)I 34a_114948340911_200025704644 [0,1,0,0,0,0|1,0,0]=2 1123 B11R1.166 CN([13CH3])c1ccc(cc1F)I 38a_114948340911_200025704644 [0,1,0,0,0,0|1,0,0]=2 1124 B11R1.166 C[C@@H](N)c1ccc(cc1O)F 271570a_203496583355_100025704064 [0,1,0,0,0,0|3,0,0]=4 1125 B11R1.166 Cc1cc(ccc1B(O)O)O 271570a_203496583355_100010074995 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,1,0,0,0,0|3,0,0]=4 1129 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,1,0,0,0,0|3,0,0]=4 1130 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,1,0,0,0,0|3,0,0]=4 1131 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.166 Cc1cc(ccc1N(C)C)Br 2230a_100000221803_200000210301 [0,1,0,0,0,0|1,0,0]=2 1133 B11R1.166 Cc1cc(ccc1N(C)C)Br 269982a_100000221803_200000210301 [0,1,0,0,0,0|1,0,0]=2 1134 B11R1.166 Cc1cc(ccc1N(C)C)Br 34a_100000221803_200000210301 [0,1,0,0,0,0|1,0,0]=2 1135 B11R1.166 Cc1cc(ccc1N(C)C)Cl 2230a_114849113698_200000210301 [0,1,0,0,0,0|1,0,0]=2 1136 B11R1.166 Cc1cc(ccc1N(C)C)Cl 269982a_114849113698_200000210301 [0,1,0,0,0,0|1,0,0]=2 1137 B11R1.166 Cc1cc(ccc1N(C)C)Cl 34a_114849113698_200000210301 [0,1,0,0,0,0|1,0,0]=2 1138 B11R1.166 Cc1cc(ccc1N(C)C)Cl 38a_114849113698_200000210301 [0,1,0,0,0,0|1,0,0]=2 1139 B11R1.166 Cc1cc(ccc1N(C)C)O 269982a_100161107805_200000210301 [0,1,0,0,0,0|0,0,0]=1 1140 B11R1.166 Cc1cc(ccc1N(C)C)O 34a_100161107805_200000210301 [0,1,0,0,0,0|0,0,0]=1 1141 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 2230a_100000221803_200025704644 [0,1,0,0,0,0|1,0,0]=2 1142 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 269982a_100000221803_200025704644 [0,1,0,0,0,0|1,0,0]=2 1143 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 34a_100000221803_200025704644 [0,1,0,0,0,0|1,0,0]=2 1144 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 2230a_114849113698_200025704644 [0,1,0,0,0,0|1,0,0]=2 1145 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 269982a_114849113698_200025704644 [0,1,0,0,0,0|1,0,0]=2 1146 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 34a_114849113698_200025704644 [0,1,0,0,0,0|1,0,0]=2 1147 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 38a_114849113698_200025704644 [0,1,0,0,0,0|1,0,0]=2 1148 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 269982a_100161107805_200025704644 [0,1,0,0,0,0|0,0,0]=1 1149 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 34a_100161107805_200025704644 [0,1,0,0,0,0|0,0,0]=1 1150 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 2230a_100000221369_200000210301 [0,1,0,0,0,0|1,0,0]=2 1152 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 269982a_100000221369_200000210301 [0,1,0,0,0,0|1,0,0]=2 1153 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 34a_100000221369_200000210301 [0,1,0,0,0,0|1,0,0]=2 1154 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 2230a_100000221369_200025704644 [0,1,0,0,0,0|1,0,0]=2 1155 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 269982a_100000221369_200025704644 [0,1,0,0,0,0|1,0,0]=2 1156 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 34a_100000221369_200025704644 [0,1,0,0,0,0|1,0,0]=2 1157 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.166 Cc1ccc(c(c1)O)N(C)C 271570a_203496583355_100012353700 [0,1,0,0,0,0|1,0,0]=2 1163 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.166 OB(O)c1ccc(cc1F)O 271570a_203496583355_100009813958 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.166 OB(O)c1ccc(cc1O)O 271570a_203496583355_100010158982 [0,1,0,0,0,0|3,0,0]=4 1169 B11R1.166 Oc1ccc(c(c1)F)C(F)F 271570a_203496583355_100010169825 [0,1,0,0,0,0|3,0,0]=4 1170 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,1,0,0,0,0|3,0,0]=4 1173 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,1,0,0,0,0|2,0,0]=3 1175 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,1,0,0,0,0|2,0,0]=3 1180 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,1,0,0,0,0|3,0,0]=4 1181 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,1,0,0,0,0|2,0,0]=3 1185 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,1,0,0,0,0|3,0,0]=4 1187 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,1,0,0,0,0|3,0,0]=4 1188 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,0,0,0,0|3,0,0]=4 1190 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,0,0,0,0|3,0,0]=4 1191 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,0,0,0,0|3,0,0]=4 1192 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,0,0,0,0|2,0,0]=3 1193 B9R0.7 CC(=O)C=CC(=O)N(C)C 1458a_100011200747_200000210301 [0,0,1,0,0,0|1,0,2]=4 1194 B9R0.7 CN(C)C(=O)C=CC(=O)[13CH3] 1458a_100011200747_200025704644 [0,0,1,0,0,0|1,0,2]=4 1195 B11R2.34 Brc1ccc(cc1)C2CC2 271570a_100011220607_100000752885 [0,0,0,1,0,0|2,0,0]=3 1196 B11R2.34 Brc1ccc(cn1)C2CC2 271570a_100011220607_100009814638 [0,0,0,1,0,0|3,0,0]=4 1197 B11R2.34 Brc1ccc(nc1)C2CC2 271570a_100011220607_100000686858 [0,0,0,1,0,0|3,0,0]=4 1198 B11R2.34 Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186775 [0,0,0,1,0,0|2,0,0]=3 1199 B11R2.34 Cc1ccc(cn1)C2CC2 271570a_100011220607_100000751577 [0,0,0,1,0,0|3,0,0]=4 1200 B11R2.34 Cc1ccc(nc1)C2CC2 271570a_100011220607_100000754016 [0,0,0,1,0,0|3,0,0]=4 1201 B11R2.34 Clc1ccc(cc1)C2CC2 271570a_100011220607_100000755918 [0,0,0,1,0,0|2,0,0]=3 1202 B11R2.34 Clc1ccc(cn1)C2CC2 271570a_100011220607_100000034144 [0,0,0,1,0,0|3,0,0]=4 1203 B11R2.34 Clc1ccc(nc1)C2CC2 271570a_100011220607_100011356976 [0,0,0,1,0,0|3,0,0]=4 1204 B11R2.34 Fc1ccc(cc1)C2CC2 271570a_100011220607_100000211213 [0,0,0,1,0,0|2,0,0]=3 1205 B11R2.34 Fc1ccc(cn1)C2CC2 271570a_100011220607_100000748661 [0,0,0,1,0,0|3,0,0]=4 1206 B11R2.34 Fc1ccc(nc1)C2CC2 271570a_100011220607_100000744514 [0,0,0,1,0,0|3,0,0]=4 1207 B11R2.34 Nc1ccc(cc1)C2CC2 271570a_100011220607_100000185761 [0,0,0,1,0,0|2,0,0]=3 1208 B11R2.34 Nc1ccc(cn1)C2CC2 271570a_100011220607_100000187370 [0,0,0,1,0,0|3,0,0]=4 1209 B11R2.34 Nc1ccc(nc1)C2CC2 271570a_100011220607_100000744251 [0,0,0,1,0,0|3,0,0]=4 1210 B11R2.34 O=c1ccc(c[nH]1)C2CC2 271570a_100011220607_100000212171 [0,0,0,1,0,0|2,0,1]=4 1211 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [0,0,0,1,0,0|1,0,0]=2 1212 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [0,0,0,1,0,0|1,0,0]=2 1213 B11R2.34 Oc1ccc(cn1)C2CC2 271570a_203496583355_200000118129 [0,0,0,1,0,0|2,0,0]=3 1214 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_100011220607_100000685995 [0,0,0,1,0,0|2,0,0]=3 1215 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_203496583355_100009850895 [0,0,0,1,0,0|2,0,0]=3 1216 B11R2.34 Oc1ccc(nn1)C2CC2 271570a_203496583355_100000754422 [0,0,0,1,0,0|3,0,0]=4 1217 B11R2.34 Oc1cnc(cn1)C2CC2 271570a_203496583355_100012002519 [0,0,0,1,0,0|3,0,0]=4 1218 B11R2.34 Oc1cnc(nc1)C2CC2 271570a_100011220607_100000730009 [0,0,0,1,0,0|3,0,0]=4 1219 B11R2.34 Oc1cnc(nc1)C2CC2 271570a_203496583355_100009840968 [0,0,0,1,0,0|3,0,0]=4 1220 B11R2.34 Oc1ncc(cn1)C2CC2 271570a_203496583355_100009869053 [0,0,0,1,0,0|3,0,0]=4 1221 B11R2.34 [O-][n+]1ccc(cc1)C2CC2 271570a_100011220607_100000039755 [0,0,0,1,0,0|2,0,1]=4 1222 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [0,0,0,0,1,0|3,0,0]=4 1223 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [0,0,0,0,1,0|3,0,0]=4 1224 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [0,0,0,0,1,0|3,0,0]=4 1225 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [0,0,0,0,1,0|3,0,0]=4 1226 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [0,0,0,0,1,0|3,0,0]=4 1227 B9R1.35 CC(C)c1cnc(s1)O 271570a_203496583355_100000697854 [0,0,0,0,1,0|3,0,0]=4 1228 B9R1.35 CC(C)c1nc(cs1)O 271570a_203496583355_200011934575 [0,0,0,0,1,0|3,0,0]=4 1229 B9R1.35 CC(C)n1cc(cn1)O 271570a_203496583355_100012073297 [0,0,0,0,1,0|3,0,0]=4 1230 B9R1.35 CC(C)n1ccc(n1)O 271570a_203496583355_100012351941 [0,0,0,0,1,0|3,0,0]=4 1231 B9R1.35 CC(C)n1cnc(c1)O 271570a_203496583355_100010368367 [0,0,0,0,1,0|3,0,0]=4 1232 B9R1.35 CC(N)c1cc(cs1)O 271570a_203496583355_100159270200 [0,0,0,0,1,0|3,0,0]=4 1233 B9R1.35 CC(N)c1ccc(s1)O 271570a_203496583355_100102723530 [0,0,0,0,1,0|3,0,0]=4 1234 B9R1.35 CN(C)c1nc(cs1)O 271570a_203496583355_100012356714 [0,0,0,0,1,0|2,0,0]=3 1235 B9R1.35 CN(C)c1nc(n[nH]1)O 271570a_203496583355_106454656773 [0,0,0,0,1,0|3,0,0]=4 1236 B9R1.35 CN(C)c1ncc(s1)O 271570a_203496583355_100012356744 [0,0,0,0,1,0|2,0,0]=3 1237 B11R1.20 CC(=Cc1cc[n+](cc1)[O-])C 271570a_100102525489_100000039755 [0,0,0,0,0,1|2,0,1]=4 1238 B11R1.20 CC(=Cc1ccc(=O)[nH]c1)C 271570a_100102525489_100000212171 [0,0,0,0,0,1|2,0,1]=4 1239 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [0,0,0,0,0,1|2,0,0]=3 1240 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,0,0,0,0,1|2,0,0]=3 1241 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [0,0,0,0,0,1|2,0,0]=3 1242 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [0,0,0,0,0,1|2,0,0]=3 1243 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [0,0,0,0,0,1|2,0,0]=3 1244 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [0,0,0,0,0,1|1,0,0]=2 1245 B11R1.20 CC(=Cc1ccc(cn1)Br)C 271570a_100102525489_100000686858 [0,0,0,0,0,1|3,0,0]=4 1246 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,0,0,0,0,1|3,0,0]=4 1247 B11R1.20 CC(=Cc1ccc(cn1)Cl)C 271570a_100102525489_100011356976 [0,0,0,0,0,1|3,0,0]=4 1248 B11R1.20 CC(=Cc1ccc(cn1)F)C 271570a_100102525489_100000744514 [0,0,0,0,0,1|3,0,0]=4 1249 B11R1.20 CC(=Cc1ccc(cn1)N)C 271570a_100102525489_100000744251 [0,0,0,0,0,1|3,0,0]=4 1250 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [0,0,0,0,0,1|2,0,0]=3 1251 B11R1.20 CC(=Cc1ccc(nc1)Br)C 271570a_100102525489_100009814638 [0,0,0,0,0,1|3,0,0]=4 1252 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [0,0,0,0,0,1|3,0,0]=4 1253 B11R1.20 CC(=Cc1ccc(nc1)Cl)C 271570a_100102525489_100000034144 [0,0,0,0,0,1|3,0,0]=4 1254 B11R1.20 CC(=Cc1ccc(nc1)F)C 271570a_100102525489_100000748661 [0,0,0,0,0,1|3,0,0]=4 1255 B11R1.20 CC(=Cc1ccc(nc1)N)C 271570a_100102525489_100000187370 [0,0,0,0,0,1|3,0,0]=4 1256 B11R1.20 CC(=Cc1ncc(cn1)O)C 271570a_100102525489_100000730009 [0,0,0,0,0,1|3,0,0]=4 1257 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,0,0,0,0,1|3,0,0]=4 1258 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,0,0,0,0,1|3,0,0]=4 1259 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,0,0,0,0,1|3,0,0]=4 1260 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,0,0,0,0,1|3,0,0]=4 1261 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,0,0,0,0,1|3,0,0]=4 1262 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,0,0,0,0,1|3,0,0]=4 1263 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,0,0,0,0,1|3,0,0]=4 1264 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,0,0,0,0,1|3,0,0]=4 1265 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,0,0,0,0,1|3,0,0]=4 1266 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,0,0,0,0,1|3,0,0]=4 1267 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,0,0,0,0,1|2,0,0]=3 1268 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,0,0,0,0,1|2,0,0]=3 1269 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,0,0,0,0,1|3,0,0]=4 1270 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,0,0,0,0,1|3,0,0]=4 1271 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,0,0,0,0,1|3,0,0]=4 1272 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,0,0,0,0,1|3,0,0]=4 1273 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,0,0,0,0,1|3,0,0]=4 1274 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,0,0,0,0,1|3,0,0]=4 1275 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,0,0,0,0,1|3,0,0]=4 1276 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,0,0,0,0,1|3,0,0]=4 1277 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,0,0,0,0,1|3,0,0]=4 1278 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,0,0,0,0,1|3,0,0]=4 1279 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,0,0,0,0,1|3,0,0]=4 1280 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,0,0,0,0,1|3,0,0]=4 1281 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,0,0,0,0,1|3,0,0]=4 1282 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,0,0,0,0,1|3,0,0]=4 1283 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,0,0,0,0,1|3,0,0]=4 1284 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,0,0,0,0,1|3,0,0]=4 1285 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,0,0,0,0,1|3,0,0]=4 1286 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,0,0,0,0,1|3,0,0]=4 1287 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,0,0,0,0,1|3,0,0]=4 1288 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,0,0,0,0,1|3,0,0]=4 1289 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,0,0,0,0,1|2,0,0]=3 1290 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,0,0,0,0,1|2,0,0]=3 1291 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [0,0,0,0,0,1|3,0,0]=4 1292 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [0,0,0,0,0,1|3,0,0]=4 1293 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,0,0,0,0,1|2,0,0]=3 1294 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,0,0,0,0,1|2,0,0]=3 1295 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,0,0,0,0,1|2,0,0]=3 1296 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [0,0,0,0,0,1|1,0,0]=2 1297 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [0,0,0,0,0,1|2,0,0]=3 1298 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [0,0,0,0,0,1|2,0,0]=3 1299 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [0,0,0,0,0,1|2,0,0]=3 1300 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [0,0,0,0,0,1|2,0,0]=3 1301 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [0,0,0,0,0,1|2,0,0]=3 1302 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [0,0,0,0,0,1|2,0,0]=3 1303 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [0,0,0,0,0,1|1,0,0]=2 1304 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [0,0,0,0,0,1|1,0,0]=2 1305 B11R1.20 CC(C)Nc1ccc(cn1)Br 27a_100138425928_100000686858 [0,0,0,0,0,1|3,0,0]=4 1306 B11R1.20 CC(C)Nc1ccc(nn1)O 271570a_203496583355_200011242954 [0,0,0,0,0,1|3,0,0]=4 1307 B11R1.20 CC(C)Nc1ncc(cn1)O 271570a_203496583355_100011934052 [0,0,0,0,0,1|3,0,0]=4 1308 B11R1.20 CC(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100000210206 [0,0,0,0,0,1|2,0,1]=4 1309 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [0,0,0,0,0,1|2,0,0]=3 1310 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [0,0,0,0,0,1|2,0,0]=3 1311 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [0,0,0,0,0,1|2,0,0]=3 1312 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [0,0,0,0,0,1|2,0,0]=3 1313 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [0,0,0,0,0,1|2,0,0]=3 1314 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [0,0,0,0,0,1|2,0,0]=3 1315 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [0,0,0,0,0,1|2,0,0]=3 1316 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [0,0,0,0,0,1|2,0,0]=3 1317 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [0,0,0,0,0,1|1,0,0]=2 1318 B11R1.20 CC(C)Oc1ccc(cn1)Cl 34a_100011215309_100000210206 [0,0,0,0,0,1|3,0,0]=4 1319 B11R1.20 CC(C)Oc1ccc(cn1)F 34a_100000742473_100000210206 [0,0,0,0,0,1|3,0,0]=4 1320 B11R1.20 CC(C)Oc1ccc(cn1)N 34a_100000729260_100000210206 [0,0,0,0,0,1|3,0,0]=4 1321 B11R1.20 CC(C)Oc1ccc(cn1)O 271570a_203496583355_100000688564 [0,0,0,0,0,1|2,0,0]=3 1322 B11R1.20 CC(C)Oc1ccc(nc1)Br 34a_100000685995_100000210206 [0,0,0,0,0,1|3,0,0]=4 1323 B11R1.20 CC(C)Oc1ccc(nc1)Br 7a_100000685995_100000210206 [0,0,0,0,0,1|3,0,0]=4 1324 B11R1.20 CC(C)Oc1ccc(nc1)Cl 34a_100000744096_100000210206 [0,0,0,0,0,1|3,0,0]=4 1325 B11R1.20 CC(C)Oc1ccc(nc1)Cl 7a_100000744096_100000210206 [0,0,0,0,0,1|3,0,0]=4 1326 B11R1.20 CC(C)Oc1ccc(nc1)F 34a_100000688820_100000210206 [0,0,0,0,0,1|3,0,0]=4 1327 B11R1.20 CC(C)Oc1ccc(nc1)F 7a_100000688820_100000210206 [0,0,0,0,0,1|3,0,0]=4 1328 B11R1.20 CC(C)Oc1ccc(nc1)I 34a_100000687607_100000210206 [0,0,0,0,0,1|3,0,0]=4 1329 B11R1.20 CC(C)Oc1ccc(nc1)I 7a_100000687607_100000210206 [0,0,0,0,0,1|3,0,0]=4 1330 B11R1.20 CC(C)Oc1ccc(nc1)N 34a_100015188713_100000210206 [0,0,0,0,0,1|3,0,0]=4 1331 B11R1.20 CC(C)Oc1ccc(nc1)N 7a_100015188713_100000210206 [0,0,0,0,0,1|3,0,0]=4 1332 B11R1.20 CC(C)Oc1ccc(nc1)O 271570a_203496583355_100012354243 [0,0,0,0,0,1|2,0,0]=3 1333 B11R1.20 CC(C)Oc1ccc(nn1)O 271570a_203496583355_100011211678 [0,0,0,0,0,1|3,0,0]=4 1334 B11R1.20 CC(C)Oc1cnc(cn1)O 271570a_203496583355_200010967586 [0,0,0,0,0,1|3,0,0]=4 1335 B11R1.20 CC(C)Oc1ncc(cn1)O 271570a_203496583355_200011939451 [0,0,0,0,0,1|3,0,0]=4 1336 B11R1.20 CC(C)Sc1cc[n+](cc1)[O-] 62a_100000210206_100000039755 [0,0,0,0,0,1|2,0,1]=4 1337 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000210206_100000212171 [0,0,0,0,0,1|2,0,1]=4 1338 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000212171_100000210206 [0,0,0,0,0,1|2,0,1]=4 1339 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [0,0,0,0,0,1|2,0,0]=3 1340 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [0,0,0,0,0,1|2,0,0]=3 1341 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [0,0,0,0,0,1|2,0,0]=3 1342 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [0,0,0,0,0,1|2,0,0]=3 1343 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [0,0,0,0,0,1|2,0,0]=3 1344 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [0,0,0,0,0,1|2,0,0]=3 1345 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [0,0,0,0,0,1|2,0,0]=3 1346 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [0,0,0,0,0,1|2,0,0]=3 1347 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [0,0,0,0,0,1|1,0,0]=2 1348 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [0,0,0,0,0,1|1,0,0]=2 1349 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000210206_100000686858 [0,0,0,0,0,1|3,0,0]=4 1350 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000686858_100000210206 [0,0,0,0,0,1|3,0,0]=4 1351 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100000210206_100011356976 [0,0,0,0,0,1|3,0,0]=4 1352 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100011356976_100000210206 [0,0,0,0,0,1|3,0,0]=4 1353 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000210206_100000744514 [0,0,0,0,0,1|3,0,0]=4 1354 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000744514_100000210206 [0,0,0,0,0,1|3,0,0]=4 1355 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000210206_100000737798 [0,0,0,0,0,1|3,0,0]=4 1356 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000737798_100000210206 [0,0,0,0,0,1|3,0,0]=4 1357 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000210206_100000744096 [0,0,0,0,0,1|2,0,0]=3 1358 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000685995_100000210206 [0,0,0,0,0,1|2,0,0]=3 1359 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100000210206_100009814638 [0,0,0,0,0,1|3,0,0]=4 1360 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100009814638_100000210206 [0,0,0,0,0,1|3,0,0]=4 1361 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000034144_100000210206 [0,0,0,0,0,1|3,0,0]=4 1362 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000210206_100000034144 [0,0,0,0,0,1|3,0,0]=4 1363 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000042367_100000210206 [0,0,0,0,0,1|3,0,0]=4 1364 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000210206_100000042367 [0,0,0,0,0,1|3,0,0]=4 1365 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000187370_100000210206 [0,0,0,0,0,1|3,0,0]=4 1366 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000210206_100000187370 [0,0,0,0,0,1|3,0,0]=4 1367 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100000210206_100015839800 [0,0,0,0,0,1|3,0,0]=4 1368 B11R1.20 CC(C)Sc1cnc(cn1)O 62a_100011934580_100000210206 [0,0,0,0,0,1|3,0,0]=4 1369 B11R1.20 CC(C)Sc1ncc(cn1)O 271570a_203496583355_200011939557 [0,0,0,0,0,1|3,0,0]=4 1370 B11R1.20 CC(C)Sc1ncc(cn1)O 62a_100000210206_100000092845 [0,0,0,0,0,1|3,0,0]=4 1371 B11R1.20 CC(C)Sc1ncc(cn1)O 62a_100000730009_100000210206 [0,0,0,0,0,1|3,0,0]=4 1372 B11R1.20 CN(C)Cc1ccc(=O)[nH]n1 270004a_100102631434_100011361533 [0,0,0,0,0,1|2,0,1]=4 1373 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [0,0,0,0,0,1|1,0,0]=2 1374 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [0,0,0,0,0,1|1,0,0]=2 1375 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [0,0,0,0,0,1|1,0,0]=2 1376 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [0,0,0,0,0,1|1,0,0]=2 1377 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [0,0,0,0,0,1|1,0,0]=2 1378 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [0,0,0,0,0,1|1,0,0]=2 1379 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [0,0,0,0,0,1|1,0,0]=2 1380 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [0,0,0,0,0,1|1,0,0]=2 1381 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [0,0,0,0,0,1|1,0,0]=2 1382 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [0,0,0,0,0,1|1,0,0]=2 1383 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [0,0,0,0,0,1|1,0,0]=2 1384 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [0,0,0,0,0,1|1,0,0]=2 1385 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [0,0,0,0,0,1|1,0,0]=2 1386 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [0,0,0,0,0,1|1,0,0]=2 1387 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [0,0,0,0,0,1|1,0,0]=2 1388 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [0,0,0,0,0,1|1,0,0]=2 1389 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [0,0,0,0,0,1|1,0,0]=2 1390 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [0,0,0,0,0,1|1,0,0]=2 1391 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [0,0,0,0,0,1|1,0,0]=2 1392 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [0,0,0,0,0,1|0,0,0]=1 1393 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [0,0,0,0,0,1|0,0,0]=1 1394 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [0,0,0,0,0,1|0,0,0]=1 1395 B11R1.20 CN(C)Cc1ccc(cn1)Br 2230a_100102631434_100000702658 [0,0,0,0,0,1|2,0,0]=3 1396 B11R1.20 CN(C)Cc1ccc(cn1)Br 269982a_100102631434_100000702658 [0,0,0,0,0,1|2,0,0]=3 1397 B11R1.20 CN(C)Cc1ccc(cn1)Br 270004a_100102631434_100000754260 [0,0,0,0,0,1|2,0,0]=3 1398 B11R1.20 CN(C)Cc1ccc(cn1)Cl 2230a_100102631434_100012066911 [0,0,0,0,0,1|2,0,0]=3 1399 B11R1.20 CN(C)Cc1ccc(cn1)Cl 269982a_100102631434_100000697101 [0,0,0,0,0,1|2,0,0]=3 1400 B11R1.20 CN(C)Cc1ccc(cn1)Cl 270004a_100102631434_100011361569 [0,0,0,0,0,1|2,0,0]=3 1401 B11R1.20 CN(C)Cc1ccc(cn1)F 2230a_100102631434_100000703193 [0,0,0,0,0,1|2,0,0]=3 1402 B11R1.20 CN(C)Cc1ccc(cn1)F 269982a_100102631434_100000703193 [0,0,0,0,0,1|2,0,0]=3 1403 B11R1.20 CN(C)Cc1ccc(cn1)F 270004a_100102631434_100011934744 [0,0,0,0,0,1|2,0,0]=3 1404 B11R1.20 CN(C)Cc1ccc(nc1)Br 2230a_100102631434_100009831999 [0,0,0,0,0,1|2,0,0]=3 1405 B11R1.20 CN(C)Cc1ccc(nc1)Br 269982a_100102631434_100009831999 [0,0,0,0,0,1|2,0,0]=3 1406 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100000026953_200000210301 [0,0,0,0,0,1|2,0,0]=3 1407 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100102631434_100000735431 [0,0,0,0,0,1|2,0,0]=3 1408 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100000026953_200000210301 [0,0,0,0,0,1|2,0,0]=3 1409 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100102631434_100000735431 [0,0,0,0,0,1|2,0,0]=3 1410 B11R1.20 CN(C)Cc1ccc(nc1)Cl 34a_100000026953_200000210301 [0,0,0,0,0,1|2,0,0]=3 1411 B11R1.20 CN(C)Cc1ccc(nc1)F 2230a_100102631434_100009820150 [0,0,0,0,0,1|2,0,0]=3 1412 B11R1.20 CN(C)Cc1ccc(nc1)F 269982a_100102631434_100009820150 [0,0,0,0,0,1|2,0,0]=3 1413 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [0,0,0,0,0,1|1,0,0]=2 1414 B11R1.20 CN(C)Cc1ccc(nn1)Cl 2230a_100102631434_100016992710 [0,0,0,0,0,1|3,0,0]=4 1415 B11R1.20 CN(C)Cc1ccc(nn1)Cl 270004a_100102631434_100000044651 [0,0,0,0,0,1|3,0,0]=4 1416 B11R1.20 CN(C)Cc1cnc(cn1)Cl 270004a_100102631434_100012001714 [0,0,0,0,0,1|3,0,0]=4 1417 B11R1.20 CN(C)Cc1ncc(cn1)Br 269982a_100102631434_100010064664 [0,0,0,0,0,1|3,0,0]=4 1418 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [0,0,0,0,0,1|1,0,0]=2 1419 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [0,0,0,0,0,1|1,0,0]=2 1420 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [0,0,0,0,0,1|1,0,0]=2 1421 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [0,0,0,0,0,1|1,0,0]=2 1422 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [0,0,0,0,0,1|1,0,0]=2 1423 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [0,0,0,0,0,1|1,0,0]=2 1424 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [0,0,0,0,0,1|1,0,0]=2 1425 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [0,0,0,0,0,1|1,0,0]=2 1426 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [0,0,0,0,0,1|0,0,0]=1 1427 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [0,0,0,0,0,1|0,0,0]=1 1428 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 2230a_100000026953_200025704644 [0,0,0,0,0,1|2,0,0]=3 1429 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 269982a_100000026953_200025704644 [0,0,0,0,0,1|2,0,0]=3 1430 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 34a_100000026953_200025704644 [0,0,0,0,0,1|2,0,0]=3 1431 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,0,0,0,0,1|3,0,0]=4 1432 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [0,0,0,0,0,1|1,0,0]=2 1433 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [0,0,0,0,0,1|1,0,0]=2 1434 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [0,0,0,0,0,1|1,0,0]=2 1435 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [0,0,0,0,0,1|1,0,0]=2 1436 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [0,0,0,0,0,1|1,0,0]=2 1437 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [0,0,0,0,0,1|1,0,0]=2 1438 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [0,0,0,0,0,1|1,0,0]=2 1439 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [0,0,0,0,0,1|1,0,0]=2 1440 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [0,0,0,0,0,1|1,0,0]=2 1441 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [0,0,0,0,0,1|2,0,0]=3 1442 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [0,0,0,0,0,1|2,0,0]=3 1443 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [0,0,0,0,0,1|2,0,0]=3 1444 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [0,0,0,0,0,1|2,0,0]=3 1445 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [0,0,0,0,0,1|2,0,0]=3 1446 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_100102631434_100016987292 [0,0,0,0,0,1|2,0,0]=3 1447 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_106623407658_200000210301 [0,0,0,0,0,1|2,0,0]=3 1448 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_100102631434_100016987292 [0,0,0,0,0,1|2,0,0]=3 1449 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_106623407658_200000210301 [0,0,0,0,0,1|2,0,0]=3 1450 B11R1.20 Cc1ccc(cn1)CN(C)C 270004a_100102631434_100000743784 [0,0,0,0,0,1|2,0,0]=3 1451 B11R1.20 Cc1ccc(cn1)CN(C)C 34a_106623407658_200000210301 [0,0,0,0,0,1|2,0,0]=3 1452 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 2230a_106623407658_200025704644 [0,0,0,0,0,1|2,0,0]=3 1453 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 269982a_106623407658_200025704644 [0,0,0,0,0,1|2,0,0]=3 1454 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 34a_106623407658_200025704644 [0,0,0,0,0,1|2,0,0]=3 1455 B11R1.20 Cc1ccc(cn1)OC(C)C 34a_100000745506_100000210206 [0,0,0,0,0,1|3,0,0]=4 1456 B11R1.20 Cc1ccc(cn1)OC(C)C 7a_100000745506_100000210206 [0,0,0,0,0,1|3,0,0]=4 1457 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000210206_100000751577 [0,0,0,0,0,1|3,0,0]=4 1458 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000751577_100000210206 [0,0,0,0,0,1|3,0,0]=4 1459 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_100102631434_100000691093 [0,0,0,0,0,1|2,0,0]=3 1460 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_200000717808_200000210301 [0,0,0,0,0,1|2,0,0]=3 1461 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_100102631434_100000691093 [0,0,0,0,0,1|2,0,0]=3 1462 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_200000717808_200000210301 [0,0,0,0,0,1|2,0,0]=3 1463 B11R1.20 Cc1ccc(nc1)CN(C)C 270004a_100102631434_100000050478 [0,0,0,0,0,1|2,0,0]=3 1464 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 2230a_200000717808_200025704644 [0,0,0,0,0,1|2,0,0]=3 1465 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 269982a_200000717808_200025704644 [0,0,0,0,0,1|2,0,0]=3 1466 B11R1.20 Cc1ccc(nc1)OC(C)C 34a_100000759353_100000210206 [0,0,0,0,0,1|3,0,0]=4 1467 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100000210206_100000754016 [0,0,0,0,0,1|3,0,0]=4 1468 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100011192072_100000210206 [0,0,0,0,0,1|3,0,0]=4 1469 B11R1.20 Cc1cnc(cn1)CN(C)C 2230a_100102631434_100000752025 [0,0,0,0,0,1|3,0,0]=4 1470 B11R1.20 Cc1cnc(cn1)CN(C)C 269982a_100102631434_100000752025 [0,0,0,0,0,1|3,0,0]=4 1471 B11R1.20 Cc1cnc(cn1)CN(C)C 270004a_100102631434_100000685221 [0,0,0,0,0,1|3,0,0]=4 1472 B11R1.20 Cc1cnc(nc1)CN(C)C 2230a_100102631434_100000685645 [0,0,0,0,0,1|3,0,0]=4 1473 B11R1.20 Cc1cnc(nc1)CN(C)C 269982a_100102631434_100000685645 [0,0,0,0,0,1|3,0,0]=4 1474 B11R1.20 Cc1ncc(cn1)CN(C)C 270004a_100102631434_100011202771 [0,0,0,0,0,1|3,0,0]=4 1475 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [0,0,0,0,0,1|3,0,0]=4 1476 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [0,0,0,0,0,1|3,0,0]=4 1477 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [0,0,0,0,0,1|3,0,0]=4 1478 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [0,0,0,0,0,1|3,0,0]=4 1479 B11R1.20 Oc1ccc(cc1)OC(F)F 271570a_203496583355_100000179047 [0,0,0,0,0,1|3,0,0]=4 1480 B11R1.20 Oc1ccc(cc1)SC(F)F 271570a_203496583355_100000178776 [0,0,0,0,0,1|3,0,0]=4 1481 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,0,0,0,0,1|3,0,0]=4 1482 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,0,0,0,0,1|3,0,0]=4 1483 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,0,0,0,0,1|3,0,0]=4 1484 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,0,0,0,0,1|3,0,0]=4 1485 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,0,0,0,0,1|2,0,0]=3 1486 B8R0.8 C=CC=CC(=O)C(C)C 1458a_100016291481_100000210206 [1,0,1,0,0,0|2,0,0]=4 1487 B8R0.8 C=CC=CC(=O)N(C)C 1626a_100102631434_100016291481 [1,0,1,0,0,0|1,0,0]=3 1488 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|1,0,1]=4 1489 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|0,0,0]=2 1490 B8R1.2 CNc1cccnn1 27a_100102657272_100016991348 [2,0,0,0,0,0|2,0,0]=4 1491 B8R1.2 CNc1ccncn1 27a_100102657272_100000703185 [2,0,0,0,0,0|2,0,0]=4 1492 B8R1.2 CNc1cnccn1 27a_100102657272_100000211759 [2,0,0,0,0,0|2,0,0]=4 1493 B8R1.2 CNc1ncccn1 27a_100102657272_100000211032 [2,0,0,0,0,0|2,0,0]=4 1494 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1495 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1496 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1497 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1498 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 1499 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 1500 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 1501 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 1502 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 1503 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 1504 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 1505 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 1506 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 1507 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|0,0,0]=2 1508 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1509 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1510 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1511 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1512 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 1513 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 1514 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 1515 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 1516 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 1517 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 1518 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 1519 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 1520 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 1521 B8R1.3 Cc1ccc(cc1)O 271570a_203496583355_100000186775 [2,0,0,0,0,0|0,0,0]=2 1522 B8R1.3 Cc1ccc(cn1)O 271570a_203496583355_100000751577 [2,0,0,0,0,0|1,0,0]=3 1523 B8R1.3 Cc1ccc(nc1)O 271570a_203496583355_100000754016 [2,0,0,0,0,0|1,0,0]=3 1524 B8R1.3 Cc1ccc(nn1)O 271570a_203496583355_100011450037 [2,0,0,0,0,0|2,0,0]=4 1525 B8R1.3 Cc1cnc(cn1)O 271570a_203496583355_100011999403 [2,0,0,0,0,0|2,0,0]=4 1526 B8R1.3 Cc1cnc(nc1)O 271570a_203496583355_100011825175 [2,0,0,0,0,0|2,0,0]=4 1527 B8R1.3 Cc1ncc(cn1)O 271570a_203496583355_100000686985 [2,0,0,0,0,0|2,0,0]=4 1528 B8R1.3 Nc1ccc(cc1)O 271570a_203496583355_100000185761 [2,0,0,0,0,0|0,0,0]=2 1529 B8R1.3 Nc1ccc(cn1)O 271570a_203496583355_100000187370 [2,0,0,0,0,0|1,0,0]=3 1530 B8R1.3 Nc1ccc(nc1)O 271570a_203496583355_100000744251 [2,0,0,0,0,0|1,0,0]=3 1531 B8R1.3 Nc1ccc(nn1)O 271570a_203496583355_100009816609 [2,0,0,0,0,0|2,0,0]=4 1532 B8R1.3 Nc1cnc(cn1)O 271570a_203496583355_100000761932 [2,0,0,0,0,0|2,0,0]=4 1533 B8R1.3 Nc1cnc(nc1)O 271570a_203496583355_100000068403 [2,0,0,0,0,0|2,0,0]=4 1534 B8R1.3 Nc1ncc(cn1)O 271570a_203496583355_100000760574 [2,0,0,0,0,0|2,0,0]=4 1535 B8R1.3 O=c1ccc(c[nH]1)O 271570a_203496583355_100000212171 [2,0,0,0,0,0|2,0,0]=4 1536 B8R1.3 Oc1ccc(cc1)Br 271570a_203496583355_100000752885 [2,0,0,0,0,0|1,0,0]=3 1537 B8R1.3 Oc1ccc(cc1)Cl 271570a_203496583355_100000755918 [2,0,0,0,0,0|1,0,0]=3 1538 B8R1.3 Oc1ccc(cc1)F 271570a_203496583355_100000211213 [2,0,0,0,0,0|1,0,0]=3 1539 B8R1.3 Oc1ccc(cc1)O 271570a_203496583355_100000185759 [2,0,0,0,0,0|1,0,0]=3 1540 B8R1.3 Oc1ccc(cn1)Br 271570a_203496583355_100000686858 [2,0,0,0,0,0|2,0,0]=4 1541 B8R1.3 Oc1ccc(cn1)Cl 271570a_203496583355_100011356976 [2,0,0,0,0,0|2,0,0]=4 1542 B8R1.3 Oc1ccc(cn1)F 271570a_203496583355_100000744514 [2,0,0,0,0,0|2,0,0]=4 1543 B8R1.3 Oc1ccc(nc1)Br 271570a_203496583355_100009814638 [2,0,0,0,0,0|2,0,0]=4 1544 B8R1.3 Oc1ccc(nc1)Cl 271570a_203496583355_100000034144 [2,0,0,0,0,0|2,0,0]=4 1545 B8R1.3 Oc1ccc(nc1)F 271570a_203496583355_100000748661 [2,0,0,0,0,0|2,0,0]=4 1546 B8R1.3 Oc1ccc(nc1)O 271570a_203496583355_100000685995 [2,0,0,0,0,0|2,0,0]=4 1547 B8R1.3 [O-][n+]1ccc(cc1)O 271570a_203496583355_100000039755 [2,0,0,0,0,0|2,0,0]=4 1548 B10R0.3 C=CCC(=O)C=CCN(C)C 1458a_100000754359_100000210623 [0,1,1,0,0,0|0,0,2]=4 1549 B10R0.82 CC=C(C)C=CC(=O)N(C)C 1626a_100102631434_100000692105 [0,1,1,0,0,0|1,0,1]=4 1550 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|1,0,0]=3 1551 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|1,0,1]=4 1552 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|2,0,0]=4 1553 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|2,0,0]=4 1554 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|2,0,0]=4 1555 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|2,0,0]=4 1556 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|2,0,0]=4 1557 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|1,0,0]=3 1558 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [1,1,0,0,0,0|2,0,0]=4 1559 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|1,0,0]=3 1560 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,1,0,0,0,0|1,0,0]=3 1561 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,1,0,0,0,0|1,0,0]=3 1562 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|1,0,0]=3 1563 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,1,0,0,0,0|1,0,0]=3 1564 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,1,0,0,0,0|1,0,0]=3 1565 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,1,0,0,0,0|1,0,0]=3 1566 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,1,0,0,0,0|1,0,0]=3 1567 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,1,0,0,0,0|0,0,0]=2 1568 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,1,0,0,0,0|0,0,0]=2 1569 B10R1.1 CCNc1ccc(cn1)Br 27a_100015525214_100000686858 [1,1,0,0,0,0|2,0,0]=4 1570 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [1,1,0,0,0,0|1,0,0]=3 1571 B10R1.1 CCNc1ccc(nn1)O 271570a_203496583355_100000215268 [1,1,0,0,0,0|2,0,0]=4 1572 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,1,0,0,0,0|2,0,0]=4 1573 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,1,0,0,0,0|2,0,0]=4 1574 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1575 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1576 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,1,0,0,0,0|2,0,0]=4 1577 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,1,0,0,0,0|2,0,0]=4 1578 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,1,0,0,0,0|2,0,0]=4 1579 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,1,0,0,0,0|2,0,0]=4 1580 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,1,0,0,0,0|2,0,0]=4 1581 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,1,0,0,0,0|2,0,0]=4 1582 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,1,0,0,0,0|1,0,0]=3 1583 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [1,1,0,0,0,0|2,0,0]=4 1584 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [1,1,0,0,0,0|2,0,0]=4 1585 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,1,0,0,0,0|2,0,0]=4 1586 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,1,0,0,0,0|2,0,0]=4 1587 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|2,0,0]=4 1588 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|2,0,0]=4 1589 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,1,0,0,0,0|2,0,0]=4 1590 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,1,0,0,0,0|2,0,0]=4 1591 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,1,0,0,0,0|2,0,0]=4 1592 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,1,0,0,0,0|2,0,0]=4 1593 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,1,0,0,0,0|2,0,0]=4 1594 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,1,0,0,0,0|2,0,0]=4 1595 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,1,0,0,0,0|1,0,0]=3 1596 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,1,0,0,0,0|1,0,0]=3 1597 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [1,1,0,0,0,0|2,0,0]=4 1598 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [1,1,0,0,0,0|2,0,0]=4 1599 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [1,1,0,0,0,0|2,0,0]=4 1600 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|1,0,0]=3 1601 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 1602 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 1603 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|1,0,0]=3 1604 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|1,0,0]=3 1605 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 1606 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|1,0,0]=3 1607 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 1608 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|1,0,0]=3 1609 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 1610 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 1611 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|1,0,0]=3 1612 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|1,0,0]=3 1613 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 1614 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|1,0,0]=3 1615 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 1616 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|1,0,0]=3 1617 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 1618 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|1,0,0]=3 1619 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|1,0,0]=3 1620 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 1621 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|1,0,0]=3 1622 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|1,0,0]=3 1623 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|1,0,0]=3 1624 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 1625 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 1626 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|1,0,0]=3 1627 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 1628 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|1,0,0]=3 1629 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 1630 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|1,0,0]=3 1631 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 1632 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 1633 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 1634 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|1,0,0]=3 1635 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 1636 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|0,0,0]=2 1637 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|0,0,0]=2 1638 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [1,1,0,0,0,0|2,0,0]=4 1639 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 1640 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [1,1,0,0,0,0|2,0,0]=4 1641 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [1,1,0,0,0,0|2,0,0]=4 1642 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [1,1,0,0,0,0|2,0,0]=4 1643 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 1644 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [1,1,0,0,0,0|2,0,0]=4 1645 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 1646 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [1,1,0,0,0,0|2,0,0]=4 1647 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [1,1,0,0,0,0|2,0,0]=4 1648 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [1,1,0,0,0,0|2,0,0]=4 1649 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 1650 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [1,1,0,0,0,0|2,0,0]=4 1651 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 1652 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [1,1,0,0,0,0|2,0,0]=4 1653 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [1,1,0,0,0,0|2,0,0]=4 1654 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [1,1,0,0,0,0|2,0,0]=4 1655 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 1656 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [1,1,0,0,0,0|2,0,0]=4 1657 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 1658 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [1,1,0,0,0,0|2,0,0]=4 1659 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [1,1,0,0,0,0|2,0,0]=4 1660 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [1,1,0,0,0,0|2,0,0]=4 1661 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 1662 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 1663 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 1664 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 1665 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [1,1,0,0,0,0|2,0,0]=4 1666 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 1667 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 1668 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|2,0,0]=4 1669 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|2,0,0]=4 1670 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|2,0,0]=4 1671 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 1672 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1673 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 1674 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1675 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [1,1,0,0,0,0|2,0,0]=4 1676 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 1677 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 1678 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 1679 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 1680 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [1,1,0,0,0,0|2,0,0]=4 1681 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 1682 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,1,0,0,0,0|1,0,0]=3 1683 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,1,0,0,0,0|1,0,0]=3 1684 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,1,0,0,0,0|1,0,0]=3 1685 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|2,0,0]=4 1686 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|2,0,0]=4 1687 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|2,0,0]=4 1688 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|2,0,0]=4 1689 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|2,0,0]=4 1690 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|2,0,0]=4 1691 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|2,0,0]=4 1692 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|2,0,0]=4 1693 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|2,0,0]=4 1694 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|2,0,0]=4 1695 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|2,0,0]=4 1696 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|2,0,0]=4 1697 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|2,0,0]=4 1698 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|2,0,0]=4 1699 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|2,0,0]=4 1700 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,0]=3 1701 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|2,0,0]=4 1702 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|2,0,0]=4 1703 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|2,0,0]=4 1704 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|2,0,0]=4 1705 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|2,0,0]=4 1706 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|2,0,0]=4 1707 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|2,0,0]=4 1708 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|2,0,0]=4 1709 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|2,0,0]=4 1710 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|2,0,0]=4 1711 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [1,1,0,0,0,0|2,0,0]=4 1712 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 1713 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 1714 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|2,0,0]=4 1715 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|2,0,0]=4 1716 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|2,0,0]=4 1717 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|2,0,0]=4 1718 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [1,1,0,0,0,0|1,0,0]=3 1719 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [1,1,0,0,0,0|2,0,0]=4 1720 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [1,1,0,0,0,0|2,0,0]=4 1721 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [1,1,0,0,0,0|2,0,0]=4 1722 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [1,1,0,0,0,0|2,0,0]=4 1723 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|2,0,0]=4 1724 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [1,1,0,0,0,0|2,0,0]=4 1725 B10R1.1 FCNc1ccc(cc1)Br 34a_100000210018_100015361967 [1,1,0,0,0,0|1,0,0]=3 1726 B10R1.1 FCNc1ccc(cc1)Cl 34a_100000210052_100015361967 [1,1,0,0,0,0|1,0,0]=3 1727 B10R1.1 FCNc1ccc(cc1)F 34a_100000185862_100015361967 [1,1,0,0,0,0|1,0,0]=3 1728 B10R1.1 FCNc1ccc(cc1)I 34a_100000185761_100015361967 [1,1,0,0,0,0|1,0,0]=3 1729 B10R1.1 FCOc1ccc(cc1)Br 34a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 1730 B10R1.1 FCOc1ccc(cc1)Br 7a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 1731 B10R1.1 FCOc1ccc(cc1)Cl 34a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 1732 B10R1.1 FCOc1ccc(cc1)Cl 7a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 1733 B10R1.1 FCOc1ccc(cc1)F 34a_100000210339_100015361967 [1,1,0,0,0,0|2,0,0]=4 1734 B10R1.1 FCOc1ccc(cc1)I 34a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 1735 B10R1.1 FCOc1ccc(cc1)I 7a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 1736 B10R1.1 FCSc1ccc(cc1)Br 62a_100000752885_100015361967 [1,1,0,0,0,0|2,0,0]=4 1737 B10R1.1 FCSc1ccc(cc1)Br 62a_100015361967_100000752885 [1,1,0,0,0,0|2,0,0]=4 1738 B10R1.1 FCSc1ccc(cc1)Cl 62a_100000755918_100015361967 [1,1,0,0,0,0|2,0,0]=4 1739 B10R1.1 FCSc1ccc(cc1)Cl 62a_100015361967_100000755918 [1,1,0,0,0,0|2,0,0]=4 1740 B10R1.1 FCSc1ccc(cc1)F 62a_100000211213_100015361967 [1,1,0,0,0,0|2,0,0]=4 1741 B10R1.1 FCSc1ccc(cc1)F 62a_100015361967_100000211213 [1,1,0,0,0,0|2,0,0]=4 1742 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,1,0,0,0,0|1,0,1]=4 1743 B10R1.1 N#CNc1ccc(cc1)O 271570a_203496583355_100011685341 [1,1,0,0,0,0|0,0,1]=3 1744 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,1,0,0,0,0|1,0,0]=3 1745 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,1,0,0,0,0|1,0,0]=3 1746 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [1,1,0,0,0,0|2,0,0]=4 1747 B10R1.1 Nc1ccc(cc1)OCF 34a_100000185829_100015361967 [1,1,0,0,0,0|2,0,0]=4 1748 B10R1.1 Nc1ccc(cc1)SCF 62a_100000185761_100015361967 [1,1,0,0,0,0|2,0,0]=4 1749 B10R1.1 Nc1ccc(cc1)SCF 62a_100015361967_100000185761 [1,1,0,0,0,0|2,0,0]=4 1750 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,1]=4 1751 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,1,0,0,0,0|1,0,0]=3 1752 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [1,1,0,0,0,0|2,0,0]=4 1753 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [1,1,0,0,0,0|2,0,0]=4 1754 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|1,0,1]=4 1755 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [1,1,0,0,0,0|0,0,0]=2 1756 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [1,1,0,0,0,0|1,0,0]=3 1757 B10R1.1 Oc1ccc(nc1)SCF 62a_100000685995_100015361967 [1,1,0,0,0,0|2,0,0]=4 1758 B10R1.1 Oc1ccc(nc1)SCF 62a_100015361967_100000744096 [1,1,0,0,0,0|2,0,0]=4 1759 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 1760 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 1761 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 1762 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 1763 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 1764 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 1765 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 1766 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 1767 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|0,0,0]=2 1768 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [1,1,0,0,0,0|2,0,0]=4 1769 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [1,1,0,0,0,0|2,0,0]=4 1770 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [1,1,0,0,0,0|2,0,0]=4 1771 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 1772 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 1773 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1774 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1775 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 1776 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 1777 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,1,0,0,0,0|1,0,0]=3 1778 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|2,0,0]=4 1779 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|2,0,0]=4 1780 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|2,0,0]=4 1781 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|2,0,0]=4 1782 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|2,0,0]=4 1783 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|2,0,0]=4 1784 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|2,0,0]=4 1785 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|2,0,0]=4 1786 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|2,0,0]=4 1787 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|2,0,0]=4 1788 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|2,0,0]=4 1789 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|2,0,0]=4 1790 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|2,0,0]=4 1791 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|2,0,0]=4 1792 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|2,0,0]=4 1793 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|2,0,0]=4 1794 B10R1.1 [N-]=[N+]=Nc1ccc(cc1)O 271570a_203496583355_100000735661 [1,1,0,0,0,0|1,0,1]=4 1795 B10R1.3 C#Cc1ccc(cc1)NC 34a_100011215031_200000210301 [1,1,0,0,0,0|1,0,0]=3 1796 B10R1.3 C#Cc1ccc(cc1)N[13CH3] 34a_100011215031_200025704644 [1,1,0,0,0,0|1,0,0]=3 1797 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [1,1,0,0,0,0|2,0,0]=4 1798 B10R1.3 C=Cc1ccc(cc1)CO 271570a_100011290941_100000690907 [1,1,0,0,0,0|1,0,1]=4 1799 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [1,1,0,0,0,0|1,0,0]=3 1800 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [1,1,0,0,0,0|1,0,0]=3 1801 B10R1.3 C=Cc1ccc(cc1)NN 271570a_100011290941_100016988836 [1,1,0,0,0,0|2,0,0]=4 1802 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [1,1,0,0,0,0|1,0,0]=3 1803 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [1,1,0,0,0,0|1,0,1]=4 1804 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [1,1,0,0,0,0|1,0,1]=4 1805 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [1,1,0,0,0,0|1,0,1]=4 1806 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [1,1,0,0,0,0|1,0,1]=4 1807 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [1,1,0,0,0,0|1,0,1]=4 1808 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [1,1,0,0,0,0|2,0,0]=4 1809 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [1,1,0,0,0,0|2,0,0]=4 1810 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [1,1,0,0,0,0|2,0,0]=4 1811 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [1,1,0,0,0,0|2,0,0]=4 1812 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [1,1,0,0,0,0|2,0,0]=4 1813 B10R1.3 C=Cc1ccc(cn1)NC 271570a_100011290941_100000764248 [1,1,0,0,0,0|2,0,0]=4 1814 B10R1.3 C=Cc1ccc(nc1)NC 271570a_100011290941_100000741341 [1,1,0,0,0,0|2,0,0]=4 1815 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [1,1,0,0,0,0|1,0,0]=3 1816 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [1,1,0,0,0,0|1,0,0]=3 1817 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [1,1,0,0,0,0|1,0,0]=3 1818 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [1,1,0,0,0,0|1,0,0]=3 1819 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [1,1,0,0,0,0|1,0,0]=3 1820 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [1,1,0,0,0,0|1,0,0]=3 1821 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [1,1,0,0,0,0|1,0,0]=3 1822 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [1,1,0,0,0,0|1,0,0]=3 1823 B10R1.3 CCc1ccc(cc1)SC 62a_100011215824_200000210301 [1,1,0,0,0,0|1,1,0]=4 1824 B10R1.3 CCc1ccc(cc1)SC 62a_200000210301_100011215824 [1,1,0,0,0,0|1,1,0]=4 1825 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_100011215824_200025704644 [1,1,0,0,0,0|1,1,0]=4 1826 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_200025704644_100011215824 [1,1,0,0,0,0|1,1,0]=4 1827 B10R1.3 CNc1ccc(cc1)C#N 34a_100000185469_200000210301 [1,1,0,0,0,0|1,0,0]=3 1828 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [1,1,0,0,0,0|0,0,0]=2 1829 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [1,1,0,0,0,0|0,0,0]=2 1830 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [1,1,0,0,0,0|0,0,0]=2 1831 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [1,1,0,0,0,0|0,0,0]=2 1832 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [1,1,0,0,0,0|0,0,0]=2 1833 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [1,1,0,0,0,0|0,1,0]=3 1834 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [1,1,0,0,0,0|0,1,0]=3 1835 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [1,1,0,0,0,0|0,1,0]=3 1836 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [1,1,0,0,0,0|0,1,0]=3 1837 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [1,1,0,0,0,0|0,1,0]=3 1838 B10R1.3 CNc1ccc(cn1)C#N 27a_100102657272_100000241038 [1,1,0,0,0,0|2,0,0]=4 1839 B10R1.3 CNc1ccc(cn1)SC 27a_100102657272_100009820866 [1,1,0,0,0,0|1,1,0]=4 1840 B10R1.3 CNc1ccc(cn1)SC 62a_100000741341_200000210301 [1,1,0,0,0,0|1,1,0]=4 1841 B10R1.3 CNc1ccc(cn1)SC 62a_200000210301_100000741341 [1,1,0,0,0,0|1,1,0]=4 1842 B10R1.3 CNc1ccc(cn1)S[13CH3] 62a_100000741341_200025704644 [1,1,0,0,0,0|1,1,0]=4 1843 B10R1.3 CNc1ccc(cn1)S[13CH3] 62a_200025704644_100000741341 [1,1,0,0,0,0|1,1,0]=4 1844 B10R1.3 CNc1ccc(nc1)SC 62a_100000764248_200000210301 [1,1,0,0,0,0|1,1,0]=4 1845 B10R1.3 CNc1ccc(nc1)SC 62a_200000210301_100000764248 [1,1,0,0,0,0|1,1,0]=4 1846 B10R1.3 CNc1ccc(nc1)S[13CH3] 62a_100000764248_200025704644 [1,1,0,0,0,0|1,1,0]=4 1847 B10R1.3 CNc1ccc(nc1)S[13CH3] 62a_200025704644_100000764248 [1,1,0,0,0,0|1,1,0]=4 1848 B10R1.3 CNc1ccc(nn1)OC 27a_100102657272_100010231723 [1,1,0,0,0,0|2,0,0]=4 1849 B10R1.3 CNc1cnc(cn1)CO 27a_100102657272_100012002382 [1,1,0,0,0,0|2,0,0]=4 1850 B10R1.3 CNc1ncc(cn1)CO 27a_100102657272_100009855073 [1,1,0,0,0,0|2,0,0]=4 1851 B10R1.3 CNc1ncc(cn1)OC 27a_100102657272_100000069167 [1,1,0,0,0,0|2,0,0]=4 1852 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [1,1,0,0,0,0|2,0,0]=4 1853 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [1,1,0,0,0,0|2,0,0]=4 1854 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [1,1,0,0,0,0|2,0,0]=4 1855 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,1,0,0,0,0|1,0,0]=3 1856 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [1,1,0,0,0,0|0,0,0]=2 1857 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [1,1,0,0,0,0|1,0,0]=3 1858 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [1,1,0,0,0,0|1,0,0]=3 1859 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [1,1,0,0,0,0|1,0,0]=3 1860 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [1,1,0,0,0,0|1,0,0]=3 1861 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [1,1,0,0,0,0|1,0,0]=3 1862 B10R1.3 COc1ccc(cn1)O[13CH3] 34a_100011934560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1863 B10R1.3 COc1ccc(cn1)SC 62a_100000047065_200000210301 [1,1,0,0,0,0|2,0,0]=4 1864 B10R1.3 COc1ccc(cn1)SC 62a_200000210301_100000047065 [1,1,0,0,0,0|2,0,0]=4 1865 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_100000047065_200025704644 [1,1,0,0,0,0|2,0,0]=4 1866 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_200025704644_100000047065 [1,1,0,0,0,0|2,0,0]=4 1867 B10R1.3 COc1ccc(nc1)CO 34a_103436540053_200000210301 [1,1,0,0,0,0|2,0,0]=4 1868 B10R1.3 COc1ccc(nc1)OC 34a_100011934560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1869 B10R1.3 COc1ccc(nc1)OC 34a_100012002028_200000210301 [1,1,0,0,0,0|2,0,0]=4 1870 B10R1.3 COc1ccc(nc1)O[13CH3] 34a_100012002028_200025704644 [1,1,0,0,0,0|2,0,0]=4 1871 B10R1.3 COc1ccc(nc1)SC 62a_100000755202_200000210301 [1,1,0,0,0,0|2,0,0]=4 1872 B10R1.3 COc1ccc(nc1)SC 62a_200000210301_100000744180 [1,1,0,0,0,0|2,0,0]=4 1873 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_100000755202_200025704644 [1,1,0,0,0,0|2,0,0]=4 1874 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_200025704644_100000744180 [1,1,0,0,0,0|2,0,0]=4 1875 B10R1.3 CSc1ccc(cc1)C#N 62a_200000210301_100000184291 [1,1,0,0,0,0|2,0,0]=4 1876 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [1,1,0,0,0,0|1,0,1]=4 1877 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [1,1,0,0,0,0|1,0,1]=4 1878 B10R1.3 CSc1ccc(cc1)CF 62a_100010268989_200000210301 [1,1,0,0,0,0|2,0,0]=4 1879 B10R1.3 CSc1ccc(cc1)CF 62a_200000210301_100010268989 [1,1,0,0,0,0|2,0,0]=4 1880 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [1,1,0,0,0,0|2,0,0]=4 1881 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [1,1,0,0,0,0|2,0,0]=4 1882 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 1883 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [1,1,0,0,0,0|1,0,0]=3 1884 B10R1.3 CSc1ccc(cc1)NN 62a_100016988836_200000210301 [1,1,0,0,0,0|1,1,0]=4 1885 B10R1.3 CSc1ccc(cc1)NN 62a_200000210301_100016988836 [1,1,0,0,0,0|1,1,0]=4 1886 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [1,1,0,0,0,0|0,1,0]=3 1887 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [1,1,0,0,0,0|1,0,0]=3 1888 B10R1.3 CSc1ccc(cc1)SC 62a_100011263217_200000210301 [1,1,0,0,0,0|1,1,0]=4 1889 B10R1.3 CSc1ccc(cc1)SC 62a_200000210301_100011263217 [1,1,0,0,0,0|1,1,0]=4 1890 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_100011263217_200025704644 [1,1,0,0,0,0|1,1,0]=4 1891 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_200025704644_100011263217 [1,1,0,0,0,0|1,1,0]=4 1892 B10R1.3 CSc1ccc(cn1)CO 62a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 1893 B10R1.3 CSc1ccc(cn1)CO 62a_200000210301_100009816760 [1,1,0,0,0,0|2,0,0]=4 1894 B10R1.3 CSc1ccc(nc1)CO 62a_100000754261_200000210301 [1,1,0,0,0,0|2,0,0]=4 1895 B10R1.3 CSc1ccc(nc1)CO 62a_200000210301_100000754261 [1,1,0,0,0,0|2,0,0]=4 1896 B10R1.3 [13CH3]Nc1ccc(cc1)C#N 34a_100000185469_200025704644 [1,1,0,0,0,0|1,0,0]=3 1897 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [1,1,0,0,0,0|0,0,0]=2 1898 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [1,1,0,0,0,0|0,0,0]=2 1899 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [1,1,0,0,0,0|2,0,0]=4 1900 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [1,1,0,0,0,0|2,0,0]=4 1901 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [1,1,0,0,0,0|2,0,0]=4 1902 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,1,0,0,0,0|1,0,0]=3 1903 B10R1.3 [13CH3]Oc1ccc(nc1)CO 34a_103436540053_200025704644 [1,1,0,0,0,0|2,0,0]=4 1904 B10R1.3 [13CH3]Sc1ccc(cc1)C#N 62a_200025704644_100000184291 [1,1,0,0,0,0|2,0,0]=4 1905 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [1,1,0,0,0,0|1,0,1]=4 1906 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [1,1,0,0,0,0|1,0,1]=4 1907 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_100010268989_200025704644 [1,1,0,0,0,0|2,0,0]=4 1908 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_200025704644_100010268989 [1,1,0,0,0,0|2,0,0]=4 1909 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [1,1,0,0,0,0|2,0,0]=4 1910 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [1,1,0,0,0,0|2,0,0]=4 1911 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 1912 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [1,1,0,0,0,0|1,0,0]=3 1913 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_100016988836_200025704644 [1,1,0,0,0,0|1,1,0]=4 1914 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_200025704644_100016988836 [1,1,0,0,0,0|1,1,0]=4 1915 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 1916 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_200025704644_100009816760 [1,1,0,0,0,0|2,0,0]=4 1917 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_100000754261_200025704644 [1,1,0,0,0,0|2,0,0]=4 1918 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_200025704644_100000754261 [1,1,0,0,0,0|2,0,0]=4 1919 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,1,0,0,0,0|1,0,1]=4 1920 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,1,0,0,0,0|1,0,1]=4 1921 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,1,0,0,0,0|1,0,1]=4 1922 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,1,0,0,0,0|1,0,1]=4 1923 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,1,0,0,0,0|1,0,1]=4 1924 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,1,0,0,0,0|1,0,1]=4 1925 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [1,1,0,0,0,0|1,0,0]=3 1926 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,1,0,0,0,0|1,0,0]=3 1927 B10R1.25 CNc1ccc(cc1Br)Br 34a_100000211012_200000210301 [1,1,0,0,0,0|1,0,0]=3 1928 B10R1.25 CNc1ccc(cc1Br)C 34a_100000210942_200000210301 [1,1,0,0,0,0|1,0,0]=3 1929 B10R1.25 CNc1ccc(cc1Br)Cl 34a_100000752454_200000210301 [1,1,0,0,0,0|1,0,0]=3 1930 B10R1.25 CNc1ccc(cc1Br)F 34a_100000738039_200000210301 [1,1,0,0,0,0|1,0,0]=3 1931 B10R1.25 CNc1ccc(cc1Br)O 34a_100012001276_200000210301 [1,1,0,0,0,0|0,0,0]=2 1932 B10R1.25 CNc1ccc(cc1C)Br 34a_100000211769_200000210301 [1,1,0,0,0,0|1,0,0]=3 1933 B10R1.25 CNc1ccc(cc1C)Br 7a_100000211769_200000210301 [1,1,0,0,0,0|1,0,0]=3 1934 B10R1.25 CNc1ccc(cc1C)C 34a_100000736561_200000210301 [1,1,0,0,0,0|1,0,0]=3 1935 B10R1.25 CNc1ccc(cc1C)C 7a_100000736561_200000210301 [1,1,0,0,0,0|1,0,0]=3 1936 B10R1.25 CNc1ccc(cc1C)Cl 34a_100000210418_200000210301 [1,1,0,0,0,0|1,0,0]=3 1937 B10R1.25 CNc1ccc(cc1C)Cl 7a_100000210418_200000210301 [1,1,0,0,0,0|1,0,0]=3 1938 B10R1.25 CNc1ccc(cc1C)F 34a_100000211637_200000210301 [1,1,0,0,0,0|1,0,0]=3 1939 B10R1.25 CNc1ccc(cc1C)F 7a_100000211637_200000210301 [1,1,0,0,0,0|1,0,0]=3 1940 B10R1.25 CNc1ccc(cc1C)I 34a_100000184554_200000210301 [1,1,0,0,0,0|1,0,0]=3 1941 B10R1.25 CNc1ccc(cc1C)I 7a_100000184554_200000210301 [1,1,0,0,0,0|1,0,0]=3 1942 B10R1.25 CNc1ccc(cc1C)O 271570a_203496583355_100000221803 [1,1,0,0,0,0|0,0,0]=2 1943 B10R1.25 CNc1ccc(cc1C)O 34a_100000756630_200000210301 [1,1,0,0,0,0|0,0,0]=2 1944 B10R1.25 CNc1ccc(cc1Cl)Br 34a_100000211467_200000210301 [1,1,0,0,0,0|1,0,0]=3 1945 B10R1.25 CNc1ccc(cc1Cl)C 34a_100000210522_200000210301 [1,1,0,0,0,0|1,0,0]=3 1946 B10R1.25 CNc1ccc(cc1Cl)Cl 34a_100000185861_200000210301 [1,1,0,0,0,0|1,0,0]=3 1947 B10R1.25 CNc1ccc(cc1Cl)F 34a_100000212003_200000210301 [1,1,0,0,0,0|1,0,0]=3 1948 B10R1.25 CNc1ccc(cc1Cl)I 34a_100011218065_200000210301 [1,1,0,0,0,0|1,0,0]=3 1949 B10R1.25 CNc1ccc(cc1Cl)O 34a_100011215599_200000210301 [1,1,0,0,0,0|0,0,0]=2 1950 B10R1.25 CNc1ccc(cc1F)Br 34a_100000210722_200000210301 [1,1,0,0,0,0|1,0,0]=3 1951 B10R1.25 CNc1ccc(cc1F)C 34a_100000211023_200000210301 [1,1,0,0,0,0|1,0,0]=3 1952 B10R1.25 CNc1ccc(cc1F)Cl 34a_100000211020_200000210301 [1,1,0,0,0,0|1,0,0]=3 1953 B10R1.25 CNc1ccc(cc1F)F 34a_100000210720_200000210301 [1,1,0,0,0,0|1,0,0]=3 1954 B10R1.25 CNc1ccc(cc1F)I 34a_100011215594_200000210301 [1,1,0,0,0,0|1,0,0]=3 1955 B10R1.25 CNc1ccc(cc1F)O 271570a_203496583355_100000743884 [1,1,0,0,0,0|0,0,0]=2 1956 B10R1.25 CNc1ccc(cc1F)O 34a_100000759473_200000210301 [1,1,0,0,0,0|0,0,0]=2 1957 B10R1.25 CNc1ccc(cc1I)Br 34a_100000187925_200000210301 [1,1,0,0,0,0|1,0,0]=3 1958 B10R1.25 CNc1ccc(cc1I)C 34a_100011356834_200000210301 [1,1,0,0,0,0|1,0,0]=3 1959 B10R1.25 CNc1ccc(cc1I)Cl 34a_100000761889_200000210301 [1,1,0,0,0,0|1,0,0]=3 1960 B10R1.25 CNc1ccc(cc1I)F 34a_100000760547_200000210301 [1,1,0,0,0,0|1,0,0]=3 1961 B10R1.25 CNc1ccc(cc1I)O 34a_100010084370_200000210301 [1,1,0,0,0,0|0,0,0]=2 1962 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [1,1,0,0,0,0|0,0,0]=2 1963 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|1,0,0]=3 1964 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [1,1,0,0,0,0|1,0,0]=3 1965 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [1,1,0,0,0,0|1,0,0]=3 1966 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|1,0,0]=3 1967 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [1,1,0,0,0,0|1,0,0]=3 1968 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [1,1,0,0,0,0|1,0,0]=3 1969 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [1,1,0,0,0,0|0,0,0]=2 1970 B10R1.25 CNc1cnc(cc1N)O 271570a_203496583355_200015721873 [1,1,0,0,0,0|1,0,0]=3 1971 B10R1.25 CNc1ncc(cc1C)O 271570a_203496583355_100012357622 [1,1,0,0,0,0|1,0,0]=3 1972 B10R1.25 CNc1ncc(cc1N)O 271570a_203496583355_100011432983 [1,1,0,0,0,0|1,0,0]=3 1973 B10R1.25 CNc1nnc(cc1N)O 271570a_203496583355_200009938434 [1,1,0,0,0,0|2,0,0]=4 1974 B10R1.25 COc1ccc(cc1Br)Br 34a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 1975 B10R1.25 COc1ccc(cc1Br)Br 7a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 1976 B10R1.25 COc1ccc(cc1Br)C 34a_100000210800_200000210301 [1,1,0,0,0,0|2,0,0]=4 1977 B10R1.25 COc1ccc(cc1Br)C 7a_100000210800_200000210301 [1,1,0,0,0,0|2,0,0]=4 1978 B10R1.25 COc1ccc(cc1Br)Cl 34a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 1979 B10R1.25 COc1ccc(cc1Br)Cl 7a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 1980 B10R1.25 COc1ccc(cc1Br)F 34a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 1981 B10R1.25 COc1ccc(cc1Br)F 7a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 1982 B10R1.25 COc1ccc(cc1Br)I 34a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 1983 B10R1.25 COc1ccc(cc1Br)I 7a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 1984 B10R1.25 COc1ccc(cc1Br)N 34a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 1985 B10R1.25 COc1ccc(cc1Br)N 7a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 1986 B10R1.25 COc1ccc(cc1Br)O 271570a_203496583355_100011249507 [1,1,0,0,0,0|1,0,0]=3 1987 B10R1.25 COc1ccc(cc1C)Br 34a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 1988 B10R1.25 COc1ccc(cc1C)Br 7a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 1989 B10R1.25 COc1ccc(cc1C)C 34a_100000211776_200000210301 [1,1,0,0,0,0|2,0,0]=4 1990 B10R1.25 COc1ccc(cc1C)C 7a_100000211776_200000210301 [1,1,0,0,0,0|2,0,0]=4 1991 B10R1.25 COc1ccc(cc1C)Cl 34a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 1992 B10R1.25 COc1ccc(cc1C)Cl 7a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 1993 B10R1.25 COc1ccc(cc1C)F 34a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 1994 B10R1.25 COc1ccc(cc1C)F 7a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 1995 B10R1.25 COc1ccc(cc1C)I 34a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 1996 B10R1.25 COc1ccc(cc1C)I 7a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 1997 B10R1.25 COc1ccc(cc1C)N 34a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 1998 B10R1.25 COc1ccc(cc1C)N 7a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 1999 B10R1.25 COc1ccc(cc1C)O 271570a_203496583355_100011219705 [1,1,0,0,0,0|1,0,0]=3 2000 B10R1.25 COc1ccc(cc1Cl)Br 34a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2001 B10R1.25 COc1ccc(cc1Cl)Br 7a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2002 B10R1.25 COc1ccc(cc1Cl)C 34a_100000749699_200000210301 [1,1,0,0,0,0|2,0,0]=4 2003 B10R1.25 COc1ccc(cc1Cl)C 7a_100000749699_200000210301 [1,1,0,0,0,0|2,0,0]=4 2004 B10R1.25 COc1ccc(cc1Cl)Cl 34a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 2005 B10R1.25 COc1ccc(cc1Cl)Cl 7a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 2006 B10R1.25 COc1ccc(cc1Cl)F 34a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2007 B10R1.25 COc1ccc(cc1Cl)F 7a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2008 B10R1.25 COc1ccc(cc1Cl)I 34a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 2009 B10R1.25 COc1ccc(cc1Cl)I 7a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 2010 B10R1.25 COc1ccc(cc1Cl)N 34a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 2011 B10R1.25 COc1ccc(cc1Cl)N 7a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 2012 B10R1.25 COc1ccc(cc1Cl)O 271570a_203496583355_100012355395 [1,1,0,0,0,0|1,0,0]=3 2013 B10R1.25 COc1ccc(cc1F)Br 34a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2014 B10R1.25 COc1ccc(cc1F)Br 7a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2015 B10R1.25 COc1ccc(cc1F)C 34a_100011216688_200000210301 [1,1,0,0,0,0|2,0,0]=4 2016 B10R1.25 COc1ccc(cc1F)C 7a_100011216688_200000210301 [1,1,0,0,0,0|2,0,0]=4 2017 B10R1.25 COc1ccc(cc1F)Cl 34a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2018 B10R1.25 COc1ccc(cc1F)Cl 7a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2019 B10R1.25 COc1ccc(cc1F)F 34a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 2020 B10R1.25 COc1ccc(cc1F)F 7a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 2021 B10R1.25 COc1ccc(cc1F)I 34a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 2022 B10R1.25 COc1ccc(cc1F)I 7a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 2023 B10R1.25 COc1ccc(cc1F)N 34a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2024 B10R1.25 COc1ccc(cc1F)N 7a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2025 B10R1.25 COc1ccc(cc1F)O 271570a_203496583355_100000185480 [1,1,0,0,0,0|1,0,0]=3 2026 B10R1.25 COc1ccc(cc1I)Br 34a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 2027 B10R1.25 COc1ccc(cc1I)Br 7a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 2028 B10R1.25 COc1ccc(cc1I)C 34a_100000765521_200000210301 [1,1,0,0,0,0|2,0,0]=4 2029 B10R1.25 COc1ccc(cc1I)C 7a_100000765521_200000210301 [1,1,0,0,0,0|2,0,0]=4 2030 B10R1.25 COc1ccc(cc1I)Cl 34a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2031 B10R1.25 COc1ccc(cc1I)Cl 7a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2032 B10R1.25 COc1ccc(cc1I)F 34a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 2033 B10R1.25 COc1ccc(cc1I)F 7a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.25 COc1ccc(cc1I)I 7a_100010001573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2035 B10R1.25 COc1ccc(cc1N)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 2036 B10R1.25 COc1ccc(cc1N)Br 7a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 2037 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [1,1,0,0,0,0|2,0,0]=4 2038 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [1,1,0,0,0,0|2,0,0]=4 2039 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 2040 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 2041 B10R1.25 COc1ccc(cc1N)F 34a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2042 B10R1.25 COc1ccc(cc1N)F 7a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2043 B10R1.25 COc1ccc(cc1N)I 34a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 2044 B10R1.25 COc1ccc(cc1N)I 7a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 2045 B10R1.25 COc1ccc(cc1N)N 34a_100000725306_200000210301 [1,1,0,0,0,0|2,0,0]=4 2046 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [1,1,0,0,0,0|1,0,0]=3 2047 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [1,1,0,0,0,0|2,0,0]=4 2048 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [1,1,0,0,0,0|2,0,0]=4 2049 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [1,1,0,0,0,0|2,0,0]=4 2050 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [1,1,0,0,0,0|2,0,0]=4 2051 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [1,1,0,0,0,0|2,0,0]=4 2052 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [1,1,0,0,0,0|1,0,0]=3 2053 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [1,1,0,0,0,0|1,0,0]=3 2054 B10R1.25 COc1ccc(nc1Br)O 271570a_203496583355_100010214827 [1,1,0,0,0,0|2,0,0]=4 2055 B10R1.25 COc1ccc(nc1C)O 271570a_203496583355_100010244750 [1,1,0,0,0,0|2,0,0]=4 2056 B10R1.25 COc1ccc(nc1Cl)O 271570a_203496583355_100010233546 [1,1,0,0,0,0|2,0,0]=4 2057 B10R1.25 COc1ccc(nc1F)O 271570a_203496583355_100010138636 [1,1,0,0,0,0|2,0,0]=4 2058 B10R1.25 COc1ccc(nc1N)O 271570a_203496583355_100010192976 [1,1,0,0,0,0|2,0,0]=4 2059 B10R1.25 COc1cnc(cc1N)O 271570a_203496583355_100010896307 [1,1,0,0,0,0|2,0,0]=4 2060 B10R1.25 COc1cnc(cc1O)O 271570a_203496583355_100010264082 [1,1,0,0,0,0|2,0,0]=4 2061 B10R1.25 COc1ncc(cc1Br)O 271570a_203496583355_200010988584 [1,1,0,0,0,0|2,0,0]=4 2062 B10R1.25 COc1ncc(cc1C)O 271570a_203496583355_100011290809 [1,1,0,0,0,0|2,0,0]=4 2063 B10R1.25 COc1ncc(cc1F)O 271570a_203496583355_100011880707 [1,1,0,0,0,0|2,0,0]=4 2064 B10R1.25 COc1ncc(cc1N)O 271570a_203496583355_100000748608 [1,1,0,0,0,0|2,0,0]=4 2065 B10R1.25 COc1ncc(cc1O)O 271570a_203496583355_100010135713 [1,1,0,0,0,0|2,0,0]=4 2066 B10R1.25 CSc1ccc(cc1Br)Br 62a_100011484698_200000210301 [1,1,0,0,0,0|2,0,0]=4 2067 B10R1.25 CSc1ccc(cc1Br)Br 62a_200000210301_100011484698 [1,1,0,0,0,0|2,0,0]=4 2068 B10R1.25 CSc1ccc(cc1Br)C 62a_100009813563_200000210301 [1,1,0,0,0,0|2,0,0]=4 2069 B10R1.25 CSc1ccc(cc1Br)C 62a_200000210301_100009813563 [1,1,0,0,0,0|2,0,0]=4 2070 B10R1.25 CSc1ccc(cc1Br)Cl 62a_100011219703_200000210301 [1,1,0,0,0,0|2,0,0]=4 2071 B10R1.25 CSc1ccc(cc1Br)Cl 62a_200000210301_100011219703 [1,1,0,0,0,0|2,0,0]=4 2072 B10R1.25 CSc1ccc(cc1Br)F 62a_100011217111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.25 CSc1ccc(cc1Br)F 62a_200000210301_100011217111 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.25 CSc1ccc(cc1Br)N 62a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2075 B10R1.25 CSc1ccc(cc1Br)N 62a_200000210301_100000750458 [1,1,0,0,0,0|2,0,0]=4 2076 B10R1.25 CSc1ccc(cc1Br)O 62a_100000701344_200000210301 [1,1,0,0,0,0|1,0,0]=3 2077 B10R1.25 CSc1ccc(cc1Br)O 62a_200000210301_100000701344 [1,1,0,0,0,0|1,0,0]=3 2078 B10R1.25 CSc1ccc(cc1C)Br 62a_100000701812_200000210301 [1,1,0,0,0,0|2,0,0]=4 2079 B10R1.25 CSc1ccc(cc1C)Br 62a_200000210301_100000701812 [1,1,0,0,0,0|2,0,0]=4 2080 B10R1.25 CSc1ccc(cc1C)C 62a_100011217332_200000210301 [1,1,0,0,0,0|2,0,0]=4 2081 B10R1.25 CSc1ccc(cc1C)C 62a_200000210301_100011217332 [1,1,0,0,0,0|2,0,0]=4 2082 B10R1.25 CSc1ccc(cc1C)Cl 62a_100011219607_200000210301 [1,1,0,0,0,0|2,0,0]=4 2083 B10R1.25 CSc1ccc(cc1C)Cl 62a_200000210301_100011219607 [1,1,0,0,0,0|2,0,0]=4 2084 B10R1.25 CSc1ccc(cc1C)F 62a_100011205405_200000210301 [1,1,0,0,0,0|2,0,0]=4 2085 B10R1.25 CSc1ccc(cc1C)F 62a_200000210301_100011205405 [1,1,0,0,0,0|2,0,0]=4 2086 B10R1.25 CSc1ccc(cc1C)N 62a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2087 B10R1.25 CSc1ccc(cc1C)N 62a_200000210301_100000210723 [1,1,0,0,0,0|2,0,0]=4 2088 B10R1.25 CSc1ccc(cc1C)O 62a_200000210301_100000690111 [1,1,0,0,0,0|1,0,0]=3 2089 B10R1.25 CSc1ccc(cc1Cl)Br 62a_100011216062_200000210301 [1,1,0,0,0,0|2,0,0]=4 2090 B10R1.25 CSc1ccc(cc1Cl)Br 62a_200000210301_100011216062 [1,1,0,0,0,0|2,0,0]=4 2091 B10R1.25 CSc1ccc(cc1Cl)C 62a_100011263221_200000210301 [1,1,0,0,0,0|2,0,0]=4 2092 B10R1.25 CSc1ccc(cc1Cl)C 62a_200000210301_100011263221 [1,1,0,0,0,0|2,0,0]=4 2093 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_100000699841_200000210301 [1,1,0,0,0,0|2,0,0]=4 2094 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_200000210301_100000699841 [1,1,0,0,0,0|2,0,0]=4 2095 B10R1.25 CSc1ccc(cc1Cl)F 62a_100000733362_200000210301 [1,1,0,0,0,0|2,0,0]=4 2096 B10R1.25 CSc1ccc(cc1Cl)F 62a_200000210301_100000733362 [1,1,0,0,0,0|2,0,0]=4 2097 B10R1.25 CSc1ccc(cc1Cl)N 62a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 2098 B10R1.25 CSc1ccc(cc1Cl)N 62a_200000210301_100000761885 [1,1,0,0,0,0|2,0,0]=4 2099 B10R1.25 CSc1ccc(cc1Cl)O 271570a_203496583355_206447510565 [1,1,0,0,0,0|1,0,0]=3 2100 B10R1.25 CSc1ccc(cc1Cl)O 62a_100000047559_200000210301 [1,1,0,0,0,0|1,0,0]=3 2101 B10R1.25 CSc1ccc(cc1Cl)O 62a_200000210301_100000047559 [1,1,0,0,0,0|1,0,0]=3 2102 B10R1.25 CSc1ccc(cc1F)Br 62a_100009814013_200000210301 [1,1,0,0,0,0|2,0,0]=4 2103 B10R1.25 CSc1ccc(cc1F)Br 62a_200000210301_100009814013 [1,1,0,0,0,0|2,0,0]=4 2104 B10R1.25 CSc1ccc(cc1F)C 62a_100011216119_200000210301 [1,1,0,0,0,0|2,0,0]=4 2105 B10R1.25 CSc1ccc(cc1F)C 62a_200000210301_100011216119 [1,1,0,0,0,0|2,0,0]=4 2106 B10R1.25 CSc1ccc(cc1F)Cl 62a_100011216042_200000210301 [1,1,0,0,0,0|2,0,0]=4 2107 B10R1.25 CSc1ccc(cc1F)Cl 62a_200000210301_100011216042 [1,1,0,0,0,0|2,0,0]=4 2108 B10R1.25 CSc1ccc(cc1F)F 62a_100000750030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2109 B10R1.25 CSc1ccc(cc1F)F 62a_200000210301_100000750030 [1,1,0,0,0,0|2,0,0]=4 2110 B10R1.25 CSc1ccc(cc1F)N 62a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 2111 B10R1.25 CSc1ccc(cc1F)N 62a_200000210301_100011356925 [1,1,0,0,0,0|2,0,0]=4 2112 B10R1.25 CSc1ccc(cc1F)O 271570a_203496583355_100010161220 [1,1,0,0,0,0|1,0,0]=3 2113 B10R1.25 CSc1ccc(cc1F)O 62a_100000755031_200000210301 [1,1,0,0,0,0|1,0,0]=3 2114 B10R1.25 CSc1ccc(cc1F)O 62a_200000210301_100000755031 [1,1,0,0,0,0|1,0,0]=3 2115 B10R1.25 CSc1ccc(cc1N)Br 62a_100000743836_200000210301 [1,1,0,0,0,0|2,0,0]=4 2116 B10R1.25 CSc1ccc(cc1N)Br 62a_200000210301_100000743836 [1,1,0,0,0,0|2,0,0]=4 2117 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [1,1,0,0,0,0|2,0,0]=4 2118 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [1,1,0,0,0,0|2,0,0]=4 2119 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [1,1,0,0,0,0|2,0,0]=4 2120 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [1,1,0,0,0,0|2,0,0]=4 2121 B10R1.25 CSc1ccc(cc1N)F 62a_100000687223_200000210301 [1,1,0,0,0,0|2,0,0]=4 2122 B10R1.25 CSc1ccc(cc1N)F 62a_200000210301_100000687223 [1,1,0,0,0,0|2,0,0]=4 2123 B10R1.25 CSc1ccc(cc1N)N 62a_200000210301_200012175722 [1,1,0,0,0,0|2,0,0]=4 2124 B10R1.25 CSc1ccc(cc1N)N 62a_200012175722_200000210301 [1,1,0,0,0,0|2,0,0]=4 2125 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [1,1,0,0,0,0|1,0,0]=3 2126 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [1,1,0,0,0,0|1,0,0]=3 2127 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 2128 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [1,1,0,0,0,0|2,0,0]=4 2129 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [1,1,0,0,0,0|2,0,0]=4 2130 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [1,1,0,0,0,0|2,0,0]=4 2131 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [1,1,0,0,0,0|2,0,0]=4 2132 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 2133 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [1,1,0,0,0,0|2,0,0]=4 2134 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [1,1,0,0,0,0|2,0,0]=4 2135 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 2136 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [1,1,0,0,0,0|2,0,0]=4 2137 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [1,1,0,0,0,0|1,0,0]=3 2138 B10R1.25 CSc1ccc(nc1C)O 62a_100000691680_200000210301 [1,1,0,0,0,0|2,0,0]=4 2139 B10R1.25 CSc1ccc(nc1C)O 62a_200000210301_100000691680 [1,1,0,0,0,0|2,0,0]=4 2140 B10R1.25 CSc1ccc(nc1F)O 62a_100009879308_200000210301 [1,1,0,0,0,0|2,0,0]=4 2141 B10R1.25 CSc1ccc(nc1F)O 62a_200000210301_100009879308 [1,1,0,0,0,0|2,0,0]=4 2142 B10R1.25 CSc1cnc(cc1C)O 62a_100000766222_200000210301 [1,1,0,0,0,0|2,0,0]=4 2143 B10R1.25 CSc1cnc(cc1C)O 62a_200000210301_100000766222 [1,1,0,0,0,0|2,0,0]=4 2144 B10R1.25 CSc1ncc(cc1C)O 62a_100012000486_200000210301 [1,1,0,0,0,0|2,0,0]=4 2145 B10R1.25 CSc1ncc(cc1C)O 62a_200000210301_100012000486 [1,1,0,0,0,0|2,0,0]=4 2146 B10R1.25 CSc1ncc(cc1F)O 62a_200000210301_100000063512 [1,1,0,0,0,0|2,0,0]=4 2147 B10R1.25 Cc1cc(ccc1C#N)O 271570a_203496583355_100000687762 [1,1,0,0,0,0|2,0,0]=4 2148 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [1,1,0,0,0,0|2,0,0]=4 2149 B10R1.25 Cc1cc(ccc1CF)O 271570a_203496583355_200010711859 [1,1,0,0,0,0|2,0,0]=4 2150 B10R1.25 Cc1cc(ccc1CN)O 271570a_203496583355_100000753881 [1,1,0,0,0,0|2,0,0]=4 2151 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [1,1,0,0,0,0|2,0,0]=4 2152 B10R1.25 Cc1cc(ccc1NN)O 271570a_203496583355_100000751375 [1,1,0,0,0,0|1,0,0]=3 2153 B10R1.25 Cc1cc(ccc1N[13CH3])Br 34a_100000211769_200025704644 [1,1,0,0,0,0|1,0,0]=3 2154 B10R1.25 Cc1cc(ccc1N[13CH3])Br 7a_100000211769_200025704644 [1,1,0,0,0,0|1,0,0]=3 2155 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 34a_100000210418_200025704644 [1,1,0,0,0,0|1,0,0]=3 2156 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 7a_100000210418_200025704644 [1,1,0,0,0,0|1,0,0]=3 2157 B10R1.25 Cc1cc(ccc1N[13CH3])F 34a_100000211637_200025704644 [1,1,0,0,0,0|1,0,0]=3 2158 B10R1.25 Cc1cc(ccc1N[13CH3])F 7a_100000211637_200025704644 [1,1,0,0,0,0|1,0,0]=3 2159 B10R1.25 Cc1cc(ccc1N[13CH3])I 34a_100000184554_200025704644 [1,1,0,0,0,0|1,0,0]=3 2160 B10R1.25 Cc1cc(ccc1N[13CH3])I 7a_100000184554_200025704644 [1,1,0,0,0,0|1,0,0]=3 2161 B10R1.25 Cc1cc(ccc1N[13CH3])O 34a_100000756630_200025704644 [1,1,0,0,0,0|0,0,0]=2 2162 B10R1.25 Cc1cc(ccc1O[13CH3])Br 34a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 2163 B10R1.25 Cc1cc(ccc1O[13CH3])Br 7a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 2164 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 34a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2165 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 7a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2166 B10R1.25 Cc1cc(ccc1O[13CH3])F 34a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 2167 B10R1.25 Cc1cc(ccc1O[13CH3])F 7a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 2168 B10R1.25 Cc1cc(ccc1O[13CH3])I 34a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 2169 B10R1.25 Cc1cc(ccc1O[13CH3])I 7a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 2170 B10R1.25 Cc1cc(ccc1O[13CH3])N 34a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2171 B10R1.25 Cc1cc(ccc1O[13CH3])N 7a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2172 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_100000701812_200025704644 [1,1,0,0,0,0|2,0,0]=4 2173 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_200025704644_100000701812 [1,1,0,0,0,0|2,0,0]=4 2174 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_100011219607_200025704644 [1,1,0,0,0,0|2,0,0]=4 2175 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_200025704644_100011219607 [1,1,0,0,0,0|2,0,0]=4 2176 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_100011205405_200025704644 [1,1,0,0,0,0|2,0,0]=4 2177 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_200025704644_100011205405 [1,1,0,0,0,0|2,0,0]=4 2178 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2179 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_200025704644_100000210723 [1,1,0,0,0,0|2,0,0]=4 2180 B10R1.25 Cc1cc(ccc1S[13CH3])O 62a_200025704644_100000690111 [1,1,0,0,0,0|1,0,0]=3 2181 B10R1.25 Cc1cc(cnc1S[13CH3])O 62a_100012000486_200025704644 [1,1,0,0,0,0|2,0,0]=4 2182 B10R1.25 Cc1cc(cnc1S[13CH3])O 62a_200025704644_100012000486 [1,1,0,0,0,0|2,0,0]=4 2183 B10R1.25 Cc1cc(ncc1S[13CH3])O 62a_100000766222_200025704644 [1,1,0,0,0,0|2,0,0]=4 2184 B10R1.25 Cc1cc(ncc1S[13CH3])O 62a_200025704644_100000766222 [1,1,0,0,0,0|2,0,0]=4 2185 B10R1.25 Cc1ccc(c(c1)Br)N[13CH3] 34a_100000210942_200025704644 [1,1,0,0,0,0|1,0,0]=3 2186 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 34a_100000210800_200025704644 [1,1,0,0,0,0|2,0,0]=4 2187 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 7a_100000210800_200025704644 [1,1,0,0,0,0|2,0,0]=4 2188 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_100009813563_200025704644 [1,1,0,0,0,0|2,0,0]=4 2189 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100009813563 [1,1,0,0,0,0|2,0,0]=4 2190 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 34a_100000736561_200025704644 [1,1,0,0,0,0|1,0,0]=3 2191 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 7a_100000736561_200025704644 [1,1,0,0,0,0|1,0,0]=3 2192 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 34a_100000211776_200025704644 [1,1,0,0,0,0|2,0,0]=4 2193 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 7a_100000211776_200025704644 [1,1,0,0,0,0|2,0,0]=4 2194 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_100011217332_200025704644 [1,1,0,0,0,0|2,0,0]=4 2195 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011217332 [1,1,0,0,0,0|2,0,0]=4 2196 B10R1.25 Cc1ccc(c(c1)Cl)N[13CH3] 34a_100000210522_200025704644 [1,1,0,0,0,0|1,0,0]=3 2197 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 34a_100000749699_200025704644 [1,1,0,0,0,0|2,0,0]=4 2198 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 7a_100000749699_200025704644 [1,1,0,0,0,0|2,0,0]=4 2199 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_100011263221_200025704644 [1,1,0,0,0,0|2,0,0]=4 2200 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100011263221 [1,1,0,0,0,0|2,0,0]=4 2201 B10R1.25 Cc1ccc(c(c1)F)N[13CH3] 34a_100000211023_200025704644 [1,1,0,0,0,0|1,0,0]=3 2202 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 34a_100011216688_200025704644 [1,1,0,0,0,0|2,0,0]=4 2203 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 7a_100011216688_200025704644 [1,1,0,0,0,0|2,0,0]=4 2204 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_100011216119_200025704644 [1,1,0,0,0,0|2,0,0]=4 2205 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011216119 [1,1,0,0,0,0|2,0,0]=4 2206 B10R1.25 Cc1ccc(c(c1)I)N[13CH3] 34a_100011356834_200025704644 [1,1,0,0,0,0|1,0,0]=3 2207 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 34a_100000765521_200025704644 [1,1,0,0,0,0|2,0,0]=4 2208 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 7a_100000765521_200025704644 [1,1,0,0,0,0|2,0,0]=4 2209 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [1,1,0,0,0,0|2,0,0]=4 2210 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [1,1,0,0,0,0|2,0,0]=4 2211 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2212 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [1,1,0,0,0,0|2,0,0]=4 2213 B10R1.25 Cc1ccc(c(c1)O)NN 271570a_203496583355_100016996181 [1,1,0,0,0,0|2,0,0]=4 2214 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [1,1,0,0,0,0|1,0,0]=3 2215 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [1,1,0,0,0,0|2,0,0]=4 2216 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [1,1,0,0,0,0|2,0,0]=4 2217 B10R1.25 Cc1nc(ccc1S[13CH3])O 62a_100000691680_200025704644 [1,1,0,0,0,0|2,0,0]=4 2218 B10R1.25 Cc1nc(ccc1S[13CH3])O 62a_200025704644_100000691680 [1,1,0,0,0,0|2,0,0]=4 2219 B10R1.25 N#Cc1ccc(cc1Br)O 271570a_203496583355_100012349582 [1,1,0,0,0,0|2,0,0]=4 2220 B10R1.25 N#Cc1ccc(cc1Cl)O 271570a_203496583355_100012349662 [1,1,0,0,0,0|2,0,0]=4 2221 B10R1.25 N#Cc1ccc(cc1F)O 271570a_203496583355_100000037869 [1,1,0,0,0,0|2,0,0]=4 2222 B10R1.25 N#Cc1ccc(cc1N)O 271570a_203496583355_100000699244 [1,1,0,0,0,0|2,0,0]=4 2223 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100011934713 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.25 N#Cc1ccc(cc1O)O 271570a_203496583355_100012184851 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.25 NCc1ccc(cc1F)O 271570a_203496583355_100000754580 [1,1,0,0,0,0|2,0,0]=4 2226 B10R1.25 NNc1ccc(cc1F)O 271570a_203496583355_100000751572 [1,1,0,0,0,0|1,0,0]=3 2227 B10R1.25 NNc1ncc(cc1F)O 271570a_203496583355_100012357567 [1,1,0,0,0,0|2,0,0]=4 2228 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [1,1,0,0,0,0|2,0,0]=4 2229 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [1,1,0,0,0,0|2,0,0]=4 2230 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [1,1,0,0,0,0|2,0,0]=4 2231 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [1,1,0,0,0,0|2,0,0]=4 2232 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [1,1,0,0,0,0|2,0,0]=4 2233 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [1,1,0,0,0,0|2,0,0]=4 2234 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [1,1,0,0,0,0|2,0,0]=4 2235 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [1,1,0,0,0,0|2,0,0]=4 2236 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [1,1,0,0,0,0|2,0,0]=4 2237 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [1,1,0,0,0,0|2,0,0]=4 2238 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [1,1,0,0,0,0|2,0,0]=4 2239 B10R1.25 [13CH3]Nc1ccc(cc1Br)Br 34a_100000211012_200025704644 [1,1,0,0,0,0|1,0,0]=3 2240 B10R1.25 [13CH3]Nc1ccc(cc1Br)Cl 34a_100000752454_200025704644 [1,1,0,0,0,0|1,0,0]=3 2241 B10R1.25 [13CH3]Nc1ccc(cc1Br)F 34a_100000738039_200025704644 [1,1,0,0,0,0|1,0,0]=3 2242 B10R1.25 [13CH3]Nc1ccc(cc1Br)O 34a_100012001276_200025704644 [1,1,0,0,0,0|0,0,0]=2 2243 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Br 34a_100000211467_200025704644 [1,1,0,0,0,0|1,0,0]=3 2244 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Cl 34a_100000185861_200025704644 [1,1,0,0,0,0|1,0,0]=3 2245 B10R1.25 [13CH3]Nc1ccc(cc1Cl)F 34a_100000212003_200025704644 [1,1,0,0,0,0|1,0,0]=3 2246 B10R1.25 [13CH3]Nc1ccc(cc1Cl)I 34a_100011218065_200025704644 [1,1,0,0,0,0|1,0,0]=3 2247 B10R1.25 [13CH3]Nc1ccc(cc1Cl)O 34a_100011215599_200025704644 [1,1,0,0,0,0|0,0,0]=2 2248 B10R1.25 [13CH3]Nc1ccc(cc1F)Br 34a_100000210722_200025704644 [1,1,0,0,0,0|1,0,0]=3 2249 B10R1.25 [13CH3]Nc1ccc(cc1F)Cl 34a_100000211020_200025704644 [1,1,0,0,0,0|1,0,0]=3 2250 B10R1.25 [13CH3]Nc1ccc(cc1F)F 34a_100000210720_200025704644 [1,1,0,0,0,0|1,0,0]=3 2251 B10R1.25 [13CH3]Nc1ccc(cc1F)I 34a_100011215594_200025704644 [1,1,0,0,0,0|1,0,0]=3 2252 B10R1.25 [13CH3]Nc1ccc(cc1F)O 34a_100000759473_200025704644 [1,1,0,0,0,0|0,0,0]=2 2253 B10R1.25 [13CH3]Nc1ccc(cc1I)Br 34a_100000187925_200025704644 [1,1,0,0,0,0|1,0,0]=3 2254 B10R1.25 [13CH3]Nc1ccc(cc1I)Cl 34a_100000761889_200025704644 [1,1,0,0,0,0|1,0,0]=3 2255 B10R1.25 [13CH3]Nc1ccc(cc1I)F 34a_100000760547_200025704644 [1,1,0,0,0,0|1,0,0]=3 2256 B10R1.25 [13CH3]Nc1ccc(cc1I)O 34a_100010084370_200025704644 [1,1,0,0,0,0|0,0,0]=2 2257 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|1,0,0]=3 2258 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|1,0,0]=3 2259 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [1,1,0,0,0,0|1,0,0]=3 2260 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [1,1,0,0,0,0|0,0,0]=2 2261 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 34a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2262 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 7a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 34a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 7a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 34a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 2266 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 7a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 2267 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 34a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 2268 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 7a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 2269 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 34a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 2270 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 7a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 2271 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 34a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2272 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 7a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 34a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 7a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 34a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 7a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2277 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 34a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 7a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 34a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 7a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 34a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2282 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 7a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 34a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 7a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2285 B10R1.25 [13CH3]Oc1ccc(cc1F)F 34a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 2286 B10R1.25 [13CH3]Oc1ccc(cc1F)F 7a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 2287 B10R1.25 [13CH3]Oc1ccc(cc1F)I 34a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.25 [13CH3]Oc1ccc(cc1F)I 7a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 2289 B10R1.25 [13CH3]Oc1ccc(cc1F)N 34a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.25 [13CH3]Oc1ccc(cc1F)N 7a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 34a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 7a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 2293 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 34a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2294 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 7a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2295 B10R1.25 [13CH3]Oc1ccc(cc1I)F 34a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 2296 B10R1.25 [13CH3]Oc1ccc(cc1I)F 7a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 2297 B10R1.25 [13CH3]Oc1ccc(cc1I)I 7a_100010001573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2298 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 2299 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 7a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 2300 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 2301 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 2302 B10R1.25 [13CH3]Oc1ccc(cc1N)F 34a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2303 B10R1.25 [13CH3]Oc1ccc(cc1N)F 7a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2304 B10R1.25 [13CH3]Oc1ccc(cc1N)I 34a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 2305 B10R1.25 [13CH3]Oc1ccc(cc1N)I 7a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 2306 B10R1.25 [13CH3]Oc1ccc(cc1N)N 34a_100000725306_200025704644 [1,1,0,0,0,0|2,0,0]=4 2307 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_100011484698_200025704644 [1,1,0,0,0,0|2,0,0]=4 2308 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_200025704644_100011484698 [1,1,0,0,0,0|2,0,0]=4 2309 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_100011219703_200025704644 [1,1,0,0,0,0|2,0,0]=4 2310 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_200025704644_100011219703 [1,1,0,0,0,0|2,0,0]=4 2311 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_100011217111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2312 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_200025704644_100011217111 [1,1,0,0,0,0|2,0,0]=4 2313 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 2314 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_200025704644_100000750458 [1,1,0,0,0,0|2,0,0]=4 2315 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_100000701344_200025704644 [1,1,0,0,0,0|1,0,0]=3 2316 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_200025704644_100000701344 [1,1,0,0,0,0|1,0,0]=3 2317 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_100011216062_200025704644 [1,1,0,0,0,0|2,0,0]=4 2318 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_200025704644_100011216062 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_100000699841_200025704644 [1,1,0,0,0,0|2,0,0]=4 2320 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_200025704644_100000699841 [1,1,0,0,0,0|2,0,0]=4 2321 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_100000733362_200025704644 [1,1,0,0,0,0|2,0,0]=4 2322 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_200025704644_100000733362 [1,1,0,0,0,0|2,0,0]=4 2323 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 2324 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_200025704644_100000761885 [1,1,0,0,0,0|2,0,0]=4 2325 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_100000047559_200025704644 [1,1,0,0,0,0|1,0,0]=3 2326 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_200025704644_100000047559 [1,1,0,0,0,0|1,0,0]=3 2327 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_100009814013_200025704644 [1,1,0,0,0,0|2,0,0]=4 2328 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_200025704644_100009814013 [1,1,0,0,0,0|2,0,0]=4 2329 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_100011216042_200025704644 [1,1,0,0,0,0|2,0,0]=4 2330 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_200025704644_100011216042 [1,1,0,0,0,0|2,0,0]=4 2331 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_100000750030_200025704644 [1,1,0,0,0,0|2,0,0]=4 2332 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_200025704644_100000750030 [1,1,0,0,0,0|2,0,0]=4 2333 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 2334 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_200025704644_100011356925 [1,1,0,0,0,0|2,0,0]=4 2335 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_100000755031_200025704644 [1,1,0,0,0,0|1,0,0]=3 2336 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_200025704644_100000755031 [1,1,0,0,0,0|1,0,0]=3 2337 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_100000743836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2338 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_200025704644_100000743836 [1,1,0,0,0,0|2,0,0]=4 2339 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [1,1,0,0,0,0|2,0,0]=4 2341 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_100000687223_200025704644 [1,1,0,0,0,0|2,0,0]=4 2342 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_200025704644_100000687223 [1,1,0,0,0,0|2,0,0]=4 2343 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200012175722_200025704644 [1,1,0,0,0,0|2,0,0]=4 2344 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200025704644_200012175722 [1,1,0,0,0,0|2,0,0]=4 2345 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [1,1,0,0,0,0|1,0,0]=3 2346 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [1,1,0,0,0,0|1,0,0]=3 2347 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 2348 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [1,1,0,0,0,0|2,0,0]=4 2349 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 2350 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [1,1,0,0,0,0|2,0,0]=4 2351 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 2352 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [1,1,0,0,0,0|2,0,0]=4 2353 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [1,1,0,0,0,0|1,0,0]=3 2354 B10R1.25 [13CH3]Sc1ccc(nc1F)O 62a_100009879308_200025704644 [1,1,0,0,0,0|2,0,0]=4 2355 B10R1.25 [13CH3]Sc1ccc(nc1F)O 62a_200025704644_100009879308 [1,1,0,0,0,0|2,0,0]=4 2356 B10R1.25 [13CH3]Sc1ncc(cc1F)O 62a_200025704644_100000063512 [1,1,0,0,0,0|2,0,0]=4 2357 B10R1.176 C=Cc1ccc(c(c1)Br)O 271570a_100011290941_100012361655 [1,1,0,0,0,0|1,0,1]=4 2358 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [1,1,0,0,0,0|1,0,1]=4 2359 B10R1.176 C=Cc1ccc(c(c1)Cl)O 271570a_100011290941_100012360047 [1,1,0,0,0,0|1,0,1]=4 2360 B10R1.176 C=Cc1ccc(c(c1)F)O 271570a_100011290941_100000185481 [1,1,0,0,0,0|1,0,1]=4 2361 B10R1.176 C=Cc1ccc(c(c1)N)O 271570a_100011290941_100000752626 [1,1,0,0,0,0|1,0,1]=4 2362 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [1,1,0,0,0,0|1,0,1]=4 2363 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [1,1,0,0,0,0|1,0,0]=3 2364 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [1,1,0,0,0,0|1,0,0]=3 2365 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [1,1,0,0,0,0|2,0,0]=4 2366 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [1,1,0,0,0,0|1,0,0]=3 2368 B10R1.176 CNc1cc(c(cn1)C)F 27a_100102657272_100009841206 [1,1,0,0,0,0|2,0,0]=4 2369 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [1,1,0,0,0,0|1,0,0]=3 2370 B10R1.176 CNc1ccc(c(c1)Br)Br 2230a_100011306057_200000210301 [1,1,0,0,0,0|1,0,0]=3 2371 B10R1.176 CNc1ccc(c(c1)Br)Br 34a_100011306057_200000210301 [1,1,0,0,0,0|1,0,0]=3 2372 B10R1.176 CNc1ccc(c(c1)Br)Br 7a_100011306057_200000210301 [1,1,0,0,0,0|1,0,0]=3 2373 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2374 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2375 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2376 B10R1.176 CNc1ccc(c(c1)Br)Cl 2230a_100000686031_200000210301 [1,1,0,0,0,0|1,0,0]=3 2377 B10R1.176 CNc1ccc(c(c1)Br)Cl 34a_100000686031_200000210301 [1,1,0,0,0,0|1,0,0]=3 2378 B10R1.176 CNc1ccc(c(c1)Br)F 2230a_100000760356_200000210301 [1,1,0,0,0,0|1,0,0]=3 2379 B10R1.176 CNc1ccc(c(c1)Br)F 34a_100000760356_200000210301 [1,1,0,0,0,0|1,0,0]=3 2380 B10R1.176 CNc1ccc(c(c1)Br)F 7a_100000760356_200000210301 [1,1,0,0,0,0|1,0,0]=3 2381 B10R1.176 CNc1ccc(c(c1)Br)I 34a_100000750458_200000210301 [1,1,0,0,0,0|1,0,0]=3 2382 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [1,1,0,0,0,0|0,0,0]=2 2383 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 2384 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 2385 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 2386 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2387 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2388 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2389 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 2390 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 2391 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 2392 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 2393 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 2394 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 2395 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [1,1,0,0,0,0|1,0,0]=3 2396 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [1,1,0,0,0,0|1,0,0]=3 2397 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [1,1,0,0,0,0|0,0,0]=2 2398 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [1,1,0,0,0,0|0,0,0]=2 2399 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [1,1,0,0,0,0|0,0,0]=2 2400 B10R1.176 CNc1ccc(c(c1)Cl)Br 2230a_100000687081_200000210301 [1,1,0,0,0,0|1,0,0]=3 2401 B10R1.176 CNc1ccc(c(c1)Cl)Br 34a_100000687081_200000210301 [1,1,0,0,0,0|1,0,0]=3 2402 B10R1.176 CNc1ccc(c(c1)Cl)Br 7a_100000687081_200000210301 [1,1,0,0,0,0|1,0,0]=3 2403 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2404 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2405 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2406 B10R1.176 CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_200000210301 [1,1,0,0,0,0|1,0,0]=3 2407 B10R1.176 CNc1ccc(c(c1)Cl)Cl 34a_100000184108_200000210301 [1,1,0,0,0,0|1,0,0]=3 2408 B10R1.176 CNc1ccc(c(c1)Cl)F 2230a_100000211060_200000210301 [1,1,0,0,0,0|1,0,0]=3 2409 B10R1.176 CNc1ccc(c(c1)Cl)F 34a_100000211060_200000210301 [1,1,0,0,0,0|1,0,0]=3 2410 B10R1.176 CNc1ccc(c(c1)Cl)F 7a_100000211060_200000210301 [1,1,0,0,0,0|1,0,0]=3 2411 B10R1.176 CNc1ccc(c(c1)Cl)I 34a_100000761885_200000210301 [1,1,0,0,0,0|1,0,0]=3 2412 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [1,1,0,0,0,0|0,0,0]=2 2413 B10R1.176 CNc1ccc(c(c1)F)Br 2230a_100000759894_200000210301 [1,1,0,0,0,0|1,0,0]=3 2414 B10R1.176 CNc1ccc(c(c1)F)Br 34a_100000759894_200000210301 [1,1,0,0,0,0|1,0,0]=3 2415 B10R1.176 CNc1ccc(c(c1)F)Br 7a_100000759894_200000210301 [1,1,0,0,0,0|1,0,0]=3 2416 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2417 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2418 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2419 B10R1.176 CNc1ccc(c(c1)F)Cl 2230a_100000739366_200000210301 [1,1,0,0,0,0|1,0,0]=3 2420 B10R1.176 CNc1ccc(c(c1)F)Cl 34a_100000739366_200000210301 [1,1,0,0,0,0|1,0,0]=3 2421 B10R1.176 CNc1ccc(c(c1)F)Cl 7a_100000739366_200000210301 [1,1,0,0,0,0|1,0,0]=3 2422 B10R1.176 CNc1ccc(c(c1)F)F 2230a_100000210724_200000210301 [1,1,0,0,0,0|1,0,0]=3 2423 B10R1.176 CNc1ccc(c(c1)F)F 34a_100000210724_200000210301 [1,1,0,0,0,0|1,0,0]=3 2424 B10R1.176 CNc1ccc(c(c1)F)F 7a_100000210724_200000210301 [1,1,0,0,0,0|1,0,0]=3 2425 B10R1.176 CNc1ccc(c(c1)F)I 34a_100011356925_200000210301 [1,1,0,0,0,0|1,0,0]=3 2426 B10R1.176 CNc1ccc(c(c1)F)I 7a_100011356925_200000210301 [1,1,0,0,0,0|1,0,0]=3 2427 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [1,1,0,0,0,0|0,0,0]=2 2428 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [1,1,0,0,0,0|0,0,0]=2 2429 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [1,1,0,0,0,0|0,0,0]=2 2430 B10R1.176 CNc1ccc(c(c1)I)Br 34a_100000750459_200000210301 [1,1,0,0,0,0|1,0,0]=3 2431 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [1,1,0,0,0,0|1,0,0]=3 2432 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [1,1,0,0,0,0|1,0,0]=3 2433 B10R1.176 CNc1ccc(c(c1)I)Cl 34a_100012360549_200000210301 [1,1,0,0,0,0|1,0,0]=3 2434 B10R1.176 CNc1ccc(c(c1)I)F 34a_114828291077_200000210301 [1,1,0,0,0,0|1,0,0]=3 2435 B10R1.176 CNc1ccc(c(c1)I)F 7a_114828291077_200000210301 [1,1,0,0,0,0|1,0,0]=3 2436 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [1,1,0,0,0,0|1,0,0]=3 2437 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [1,1,0,0,0,0|1,0,0]=3 2438 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [1,1,0,0,0,0|1,0,0]=3 2439 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [1,1,0,0,0,0|1,0,0]=3 2440 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [1,1,0,0,0,0|1,0,0]=3 2441 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [1,1,0,0,0,0|1,0,0]=3 2442 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [1,1,0,0,0,0|0,0,0]=2 2443 B10R1.176 CNc1ccc(c(n1)F)Br 27a_100102657272_100010134343 [1,1,0,0,0,0|2,0,0]=4 2444 B10R1.176 CNc1ccn(c(=O)c1)C 27a_100102657272_100009820031 [1,1,0,0,0,0|2,0,0]=4 2445 B10R1.176 COc1cc(c(cn1)O)C 271570a_203496583355_100011934368 [1,1,0,0,0,0|2,0,0]=4 2446 B10R1.176 COc1cc(c(cn1)O)F 271570a_203496583355_100010136277 [1,1,0,0,0,0|2,0,0]=4 2447 B10R1.176 COc1cc(c(cn1)O)N 271570a_203496583355_100010254562 [1,1,0,0,0,0|2,0,0]=4 2448 B10R1.176 COc1cc(c(cn1)O)O 271570a_203496583355_100010738159 [1,1,0,0,0,0|2,0,0]=4 2449 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 2450 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 2451 B10R1.176 COc1ccc(c(c1)Br)Cl 34a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 2452 B10R1.176 COc1ccc(c(c1)Br)Cl 7a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 2453 B10R1.176 COc1ccc(c(c1)Br)F 34a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2454 B10R1.176 COc1ccc(c(c1)Br)F 7a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2455 B10R1.176 COc1ccc(c(c1)Br)I 34a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2456 B10R1.176 COc1ccc(c(c1)Br)I 7a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2457 B10R1.176 COc1ccc(c(c1)Br)N 34a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2458 B10R1.176 COc1ccc(c(c1)Br)N 7a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2459 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [1,1,0,0,0,0|1,0,0]=3 2460 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2461 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2462 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,1,0,0,0,0|2,0,0]=4 2463 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,1,0,0,0,0|2,0,0]=4 2464 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [1,1,0,0,0,0|2,0,0]=4 2465 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [1,1,0,0,0,0|2,0,0]=4 2466 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2467 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2468 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [1,1,0,0,0,0|2,0,0]=4 2469 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [1,1,0,0,0,0|2,0,0]=4 2470 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2471 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2472 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [1,1,0,0,0,0|1,0,0]=3 2473 B10R1.176 COc1ccc(c(c1)Cl)Br 34a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2474 B10R1.176 COc1ccc(c(c1)Cl)Br 7a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2475 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 2476 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 2477 B10R1.176 COc1ccc(c(c1)Cl)Cl 34a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 2478 B10R1.176 COc1ccc(c(c1)Cl)Cl 7a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 2479 B10R1.176 COc1ccc(c(c1)Cl)F 34a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2480 B10R1.176 COc1ccc(c(c1)Cl)F 7a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2481 B10R1.176 COc1ccc(c(c1)Cl)I 34a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 2482 B10R1.176 COc1ccc(c(c1)Cl)I 7a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 2483 B10R1.176 COc1ccc(c(c1)Cl)N 34a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 2484 B10R1.176 COc1ccc(c(c1)Cl)N 7a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 2485 B10R1.176 COc1ccc(c(c1)F)Br 34a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2486 B10R1.176 COc1ccc(c(c1)F)Br 7a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2487 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 2488 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 2489 B10R1.176 COc1ccc(c(c1)F)Cl 34a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 2490 B10R1.176 COc1ccc(c(c1)F)Cl 7a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 2491 B10R1.176 COc1ccc(c(c1)F)F 34a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 2492 B10R1.176 COc1ccc(c(c1)F)F 7a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 2493 B10R1.176 COc1ccc(c(c1)F)I 34a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 2494 B10R1.176 COc1ccc(c(c1)F)I 7a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 2495 B10R1.176 COc1ccc(c(c1)F)N 34a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 2496 B10R1.176 COc1ccc(c(c1)F)N 7a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 2497 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [1,1,0,0,0,0|1,0,0]=3 2498 B10R1.176 COc1ccc(c(c1)I)Br 34a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2499 B10R1.176 COc1ccc(c(c1)I)Br 7a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2500 B10R1.176 COc1ccc(c(c1)I)Cl 34a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 2501 B10R1.176 COc1ccc(c(c1)I)Cl 7a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 2502 B10R1.176 COc1ccc(c(c1)I)N 34a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.176 COc1ccc(c(c1)I)N 7a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 2504 B10R1.176 COc1ccc(c(c1)N)Br 34a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2505 B10R1.176 COc1ccc(c(c1)N)Br 7a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2506 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 2507 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 2508 B10R1.176 COc1ccc(c(c1)N)Cl 34a_100011934297_200000210301 [1,1,0,0,0,0|2,0,0]=4 2509 B10R1.176 COc1ccc(c(c1)N)F 34a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 2510 B10R1.176 COc1ccc(c(c1)N)F 7a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 2511 B10R1.176 COc1ccc(c(c1)N)N 34a_100025771000_200000210301 [1,1,0,0,0,0|2,0,0]=4 2512 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [1,1,0,0,0,0|1,0,0]=3 2513 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [1,1,0,0,0,0|2,0,0]=4 2514 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,1,0,0,0,0|2,0,0]=4 2515 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [1,1,0,0,0,0|2,0,0]=4 2516 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [1,1,0,0,0,0|2,0,0]=4 2517 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [1,1,0,0,0,0|2,0,0]=4 2518 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [1,1,0,0,0,0|1,0,0]=3 2519 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [1,1,0,0,0,0|1,0,0]=3 2520 B10R1.176 COc1ccc(c(n1)C)O 271570a_203496583355_100000766551 [1,1,0,0,0,0|2,0,0]=4 2521 B10R1.176 COc1ccc(c(n1)F)O 271570a_203496583355_100010067559 [1,1,0,0,0,0|2,0,0]=4 2522 B10R1.176 COc1ccc(c(n1)N)O 271570a_203496583355_100010187629 [1,1,0,0,0,0|2,0,0]=4 2523 B10R1.176 COc1cnc(c(c1)C)O 271570a_203496583355_200009851512 [1,1,0,0,0,0|2,0,0]=4 2524 B10R1.176 COc1cnc(c(c1)N)O 271570a_203496583355_100010074831 [1,1,0,0,0,0|2,0,0]=4 2525 B10R1.176 CSc1cc(c(cn1)O)C 62a_200000210301_100000692680 [1,1,0,0,0,0|2,0,0]=4 2526 B10R1.176 CSc1cc(c(cn1)O)N 62a_100009819941_200000210301 [1,1,0,0,0,0|2,0,0]=4 2527 B10R1.176 CSc1cc(c(cn1)O)N 62a_200000210301_100009819941 [1,1,0,0,0,0|2,0,0]=4 2528 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_100012356285_200000210301 [1,1,0,0,0,0|2,0,0]=4 2529 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_200000210301_100012356285 [1,1,0,0,0,0|2,0,0]=4 2530 B10R1.176 CSc1ccc(c(c1)Br)C 62a_100011847877_200000210301 [1,1,0,0,0,0|2,0,0]=4 2531 B10R1.176 CSc1ccc(c(c1)Br)C 62a_200000210301_100011847877 [1,1,0,0,0,0|2,0,0]=4 2532 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_100012353702_200000210301 [1,1,0,0,0,0|2,0,0]=4 2533 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_200000210301_100012353702 [1,1,0,0,0,0|2,0,0]=4 2534 B10R1.176 CSc1ccc(c(c1)Br)F 62a_100012047266_200000210301 [1,1,0,0,0,0|2,0,0]=4 2535 B10R1.176 CSc1ccc(c(c1)Br)F 62a_200000210301_100012047266 [1,1,0,0,0,0|2,0,0]=4 2536 B10R1.176 CSc1ccc(c(c1)Br)N 62a_100000750455_200000210301 [1,1,0,0,0,0|2,0,0]=4 2537 B10R1.176 CSc1ccc(c(c1)Br)N 62a_200000210301_100000750455 [1,1,0,0,0,0|2,0,0]=4 2538 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [1,1,0,0,0,0|1,0,0]=3 2539 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [1,1,0,0,0,0|1,0,0]=3 2540 B10R1.176 CSc1ccc(c(c1)C)Br 62a_100009813585_200000210301 [1,1,0,0,0,0|2,0,0]=4 2541 B10R1.176 CSc1ccc(c(c1)C)Br 62a_200000210301_100009813585 [1,1,0,0,0,0|2,0,0]=4 2542 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [1,1,0,0,0,0|2,0,0]=4 2543 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [1,1,0,0,0,0|2,0,0]=4 2544 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_100000049509_200000210301 [1,1,0,0,0,0|2,0,0]=4 2545 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_200000210301_100000049509 [1,1,0,0,0,0|2,0,0]=4 2546 B10R1.176 CSc1ccc(c(c1)C)F 62a_100011218330_200000210301 [1,1,0,0,0,0|2,0,0]=4 2547 B10R1.176 CSc1ccc(c(c1)C)F 62a_200000210301_100011218330 [1,1,0,0,0,0|2,0,0]=4 2548 B10R1.176 CSc1ccc(c(c1)C)N 62a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2549 B10R1.176 CSc1ccc(c(c1)C)N 62a_200000210301_100000211769 [1,1,0,0,0,0|2,0,0]=4 2550 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [1,1,0,0,0,0|1,0,0]=3 2551 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_100012047281_200000210301 [1,1,0,0,0,0|2,0,0]=4 2552 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_200000210301_100012047281 [1,1,0,0,0,0|2,0,0]=4 2553 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_100011216363_200000210301 [1,1,0,0,0,0|2,0,0]=4 2554 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_200000210301_100011216363 [1,1,0,0,0,0|2,0,0]=4 2555 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_100011214914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2556 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_200000210301_100011214914 [1,1,0,0,0,0|2,0,0]=4 2557 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_100011215976_200000210301 [1,1,0,0,0,0|2,0,0]=4 2558 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_200000210301_100011215976 [1,1,0,0,0,0|2,0,0]=4 2559 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 2560 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_200000210301_100011218065 [1,1,0,0,0,0|2,0,0]=4 2561 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [1,1,0,0,0,0|1,0,0]=3 2562 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [1,1,0,0,0,0|1,0,0]=3 2563 B10R1.176 CSc1ccc(c(c1)F)Br 62a_100000685389_200000210301 [1,1,0,0,0,0|2,0,0]=4 2564 B10R1.176 CSc1ccc(c(c1)F)Br 62a_200000210301_100000685389 [1,1,0,0,0,0|2,0,0]=4 2565 B10R1.176 CSc1ccc(c(c1)F)C 62a_100000720648_200000210301 [1,1,0,0,0,0|2,0,0]=4 2566 B10R1.176 CSc1ccc(c(c1)F)C 62a_200000210301_100000720648 [1,1,0,0,0,0|2,0,0]=4 2567 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_100011216805_200000210301 [1,1,0,0,0,0|2,0,0]=4 2568 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_200000210301_100011216805 [1,1,0,0,0,0|2,0,0]=4 2569 B10R1.176 CSc1ccc(c(c1)F)F 62a_100000703953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2570 B10R1.176 CSc1ccc(c(c1)F)F 62a_200000210301_100000703953 [1,1,0,0,0,0|2,0,0]=4 2571 B10R1.176 CSc1ccc(c(c1)F)N 62a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 2572 B10R1.176 CSc1ccc(c(c1)F)N 62a_200000210301_100011215594 [1,1,0,0,0,0|2,0,0]=4 2573 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [1,1,0,0,0,0|1,0,0]=3 2574 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [1,1,0,0,0,0|1,0,0]=3 2575 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [1,1,0,0,0,0|1,0,0]=3 2576 B10R1.176 CSc1ccc(c(c1)N)Br 62a_100000750456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2577 B10R1.176 CSc1ccc(c(c1)N)Br 62a_200000210301_100000750456 [1,1,0,0,0,0|2,0,0]=4 2578 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,1,0,0,0,0|2,0,0]=4 2579 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,1,0,0,0,0|2,0,0]=4 2580 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000210301_200000761891 [1,1,0,0,0,0|2,0,0]=4 2581 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000761891_200000210301 [1,1,0,0,0,0|2,0,0]=4 2582 B10R1.176 CSc1ccc(c(c1)N)F 62a_100000740924_200000210301 [1,1,0,0,0,0|2,0,0]=4 2583 B10R1.176 CSc1ccc(c(c1)N)F 62a_200000210301_100000740924 [1,1,0,0,0,0|2,0,0]=4 2584 B10R1.176 CSc1ccc(c(c1)N)N 62a_100000741789_200000210301 [1,1,0,0,0,0|2,0,0]=4 2585 B10R1.176 CSc1ccc(c(c1)N)N 62a_200000210301_100011534411 [1,1,0,0,0,0|2,0,0]=4 2586 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [1,1,0,0,0,0|1,0,0]=3 2587 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [1,1,0,0,0,0|1,0,0]=3 2588 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 2589 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [1,1,0,0,0,0|2,0,0]=4 2590 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 2591 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [1,1,0,0,0,0|2,0,0]=4 2592 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 2593 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [1,1,0,0,0,0|2,0,0]=4 2594 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [1,1,0,0,0,0|2,0,0]=4 2595 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2596 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [1,1,0,0,0,0|2,0,0]=4 2597 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 2598 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [1,1,0,0,0,0|1,0,0]=3 2600 B10R1.176 CSc1ccc(c(n1)Br)O 62a_100000725334_200000210301 [1,1,0,0,0,0|2,0,0]=4 2601 B10R1.176 CSc1ccc(c(n1)Br)O 62a_200000210301_100000725334 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.176 CSc1ccc(c(n1)C)O 62a_100010233687_200000210301 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.176 CSc1ccc(c(n1)C)O 62a_200000210301_100010233687 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.176 CSc1ccc(c(n1)Cl)O 62a_200000210301_100000721234 [1,1,0,0,0,0|2,0,0]=4 2605 B10R1.176 CSc1ccc(c(n1)F)O 62a_100009819667_200000210301 [1,1,0,0,0,0|2,0,0]=4 2606 B10R1.176 CSc1ccc(c(n1)F)O 62a_200000210301_100009819667 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.176 CSc1ccc(c(n1)N)O 62a_100000685527_200000210301 [1,1,0,0,0,0|2,0,0]=4 2608 B10R1.176 CSc1ccc(c(n1)N)O 62a_200000210301_100000685527 [1,1,0,0,0,0|2,0,0]=4 2609 B10R1.176 CSc1cnc(c(c1)C)O 271570a_203496583355_203440288091 [1,1,0,0,0,0|2,0,0]=4 2610 B10R1.176 CSc1cnc(c(c1)C)O 62a_100000685391_200000210301 [1,1,0,0,0,0|2,0,0]=4 2611 B10R1.176 CSc1cnc(c(c1)C)O 62a_200000210301_100000685391 [1,1,0,0,0,0|2,0,0]=4 2612 B10R1.176 CSc1cnc(c(c1)Cl)O 62a_100010238531_200000210301 [1,1,0,0,0,0|2,0,0]=4 2613 B10R1.176 CSc1cnc(c(c1)Cl)O 62a_200000210301_100010238531 [1,1,0,0,0,0|2,0,0]=4 2614 B10R1.176 CSc1cnc(c(c1)F)O 271570a_203496583355_100010884644 [1,1,0,0,0,0|2,0,0]=4 2615 B10R1.176 CSc1cnc(c(c1)N)O 62a_100000743729_200000210301 [1,1,0,0,0,0|2,0,0]=4 2616 B10R1.176 CSc1cnc(c(c1)N)O 62a_200000210301_100000743729 [1,1,0,0,0,0|2,0,0]=4 2617 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 2618 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 2619 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 2620 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2621 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2622 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_100009813585_200025704644 [1,1,0,0,0,0|2,0,0]=4 2623 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_200025704644_100009813585 [1,1,0,0,0,0|2,0,0]=4 2624 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 2625 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 2626 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 2627 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [1,1,0,0,0,0|2,0,0]=4 2628 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [1,1,0,0,0,0|2,0,0]=4 2629 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_100000049509_200025704644 [1,1,0,0,0,0|2,0,0]=4 2630 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100000049509 [1,1,0,0,0,0|2,0,0]=4 2631 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 2632 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 2633 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 2634 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2635 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2636 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_100011218330_200025704644 [1,1,0,0,0,0|2,0,0]=4 2637 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100011218330 [1,1,0,0,0,0|2,0,0]=4 2638 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [1,1,0,0,0,0|1,0,0]=3 2639 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [1,1,0,0,0,0|1,0,0]=3 2640 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [1,1,0,0,0,0|2,0,0]=4 2641 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [1,1,0,0,0,0|2,0,0]=4 2642 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2643 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2644 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 2645 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_200025704644_100000211769 [1,1,0,0,0,0|2,0,0]=4 2646 B10R1.176 Cc1cc(ccc1O)C#N 271570a_203496583355_100000212329 [1,1,0,0,0,0|2,0,0]=4 2647 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [1,1,0,0,0,0|2,0,0]=4 2648 B10R1.176 Cc1cc(ccc1O)CN 271570a_203496583355_100015205234 [1,1,0,0,0,0|2,0,0]=4 2649 B10R1.176 Cc1cc(ccc1O)CO 271570a_203496583355_100000718852 [1,1,0,0,0,0|2,0,0]=4 2650 B10R1.176 Cc1cc(ccc1O)NN 271570a_203496583355_100000745493 [1,1,0,0,0,0|1,0,0]=3 2651 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [1,1,0,0,0,0|0,0,0]=2 2652 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [1,1,0,0,0,0|0,0,0]=2 2653 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [1,1,0,0,0,0|1,0,0]=3 2654 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_100000685391_200025704644 [1,1,0,0,0,0|2,0,0]=4 2655 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_200025704644_100000685391 [1,1,0,0,0,0|2,0,0]=4 2656 B10R1.176 Cc1cc(ncc1O)NN 271570a_203496583355_100012357568 [1,1,0,0,0,0|2,0,0]=4 2657 B10R1.176 Cc1cc(ncc1O)S[13CH3] 62a_200025704644_100000692680 [1,1,0,0,0,0|2,0,0]=4 2658 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2659 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2660 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2661 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 2662 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 2663 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_100011847877_200025704644 [1,1,0,0,0,0|2,0,0]=4 2664 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011847877 [1,1,0,0,0,0|2,0,0]=4 2665 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2666 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2667 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2668 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,1,0,0,0,0|2,0,0]=4 2669 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,1,0,0,0,0|2,0,0]=4 2670 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [1,1,0,0,0,0|2,0,0]=4 2671 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [1,1,0,0,0,0|2,0,0]=4 2672 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2673 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2674 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2675 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 2676 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 2677 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_100011216363_200025704644 [1,1,0,0,0,0|2,0,0]=4 2678 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011216363 [1,1,0,0,0,0|2,0,0]=4 2679 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2680 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2681 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2682 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 2683 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_100000720648_200025704644 [1,1,0,0,0,0|2,0,0]=4 2685 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000720648 [1,1,0,0,0,0|2,0,0]=4 2686 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [1,1,0,0,0,0|1,0,0]=3 2687 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [1,1,0,0,0,0|1,0,0]=3 2688 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 2689 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 2690 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,1,0,0,0,0|2,0,0]=4 2691 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,1,0,0,0,0|2,0,0]=4 2692 B10R1.176 Cc1ccc(cc1O)NN 271570a_203496583355_100016991967 [1,1,0,0,0,0|2,0,0]=4 2693 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [1,1,0,0,0,0|1,0,0]=3 2694 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [1,1,0,0,0,0|1,0,0]=3 2695 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 2696 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [1,1,0,0,0,0|2,0,0]=4 2697 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_100010233687_200025704644 [1,1,0,0,0,0|2,0,0]=4 2698 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_200025704644_100010233687 [1,1,0,0,0,0|2,0,0]=4 2699 B10R1.176 N#Cc1ccc(c(c1)Br)O 271570a_203496583355_100012356348 [1,1,0,0,0,0|2,0,0]=4 2700 B10R1.176 N#Cc1ccc(c(c1)Cl)O 271570a_203496583355_100012349663 [1,1,0,0,0,0|2,0,0]=4 2701 B10R1.176 N#Cc1ccc(c(c1)F)O 271570a_203496583355_100011794375 [1,1,0,0,0,0|2,0,0]=4 2702 B10R1.176 N#Cc1ccc(c(c1)N)O 271570a_203496583355_100012001879 [1,1,0,0,0,0|2,0,0]=4 2703 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000724445 [1,1,0,0,0,0|2,0,0]=4 2704 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000725478 [1,1,0,0,0,0|2,0,0]=4 2705 B10R1.176 NCc1ccc(c(c1)F)O 271570a_203496583355_100000755036 [1,1,0,0,0,0|2,0,0]=4 2706 B10R1.176 NNc1ccc(c(c1)F)O 271570a_203496583355_100016992936 [1,1,0,0,0,0|1,0,0]=3 2707 B10R1.176 NNc1ccc(c(c1)O)F 271570a_203496583355_200025705588 [1,1,0,0,0,0|2,0,0]=4 2708 B10R1.176 Nc1cc(ccc1O)CO 271570a_203496583355_100012347568 [1,1,0,0,0,0|2,0,0]=4 2709 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [1,1,0,0,0,0|2,0,0]=4 2710 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [1,1,0,0,0,0|2,0,0]=4 2711 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [1,1,0,0,0,0|2,0,0]=4 2712 B10R1.176 OCc1ccc(c(c1)Cl)O 271570a_203496583355_100000718186 [1,1,0,0,0,0|2,0,0]=4 2713 B10R1.176 OCc1ccc(c(c1)F)O 271570a_203496583355_100011533735 [1,1,0,0,0,0|2,0,0]=4 2714 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100000049605 [1,1,0,0,0,0|2,0,0]=4 2715 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100011191544 [1,1,0,0,0,0|2,0,0]=4 2716 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 2230a_100011306057_200025704644 [1,1,0,0,0,0|1,0,0]=3 2717 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 34a_100011306057_200025704644 [1,1,0,0,0,0|1,0,0]=3 2718 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 7a_100011306057_200025704644 [1,1,0,0,0,0|1,0,0]=3 2719 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 2230a_100000686031_200025704644 [1,1,0,0,0,0|1,0,0]=3 2720 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 34a_100000686031_200025704644 [1,1,0,0,0,0|1,0,0]=3 2721 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 2230a_100000760356_200025704644 [1,1,0,0,0,0|1,0,0]=3 2722 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 34a_100000760356_200025704644 [1,1,0,0,0,0|1,0,0]=3 2723 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 7a_100000760356_200025704644 [1,1,0,0,0,0|1,0,0]=3 2724 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)I 34a_100000750458_200025704644 [1,1,0,0,0,0|1,0,0]=3 2725 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [1,1,0,0,0,0|0,0,0]=2 2726 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 2230a_100000687081_200025704644 [1,1,0,0,0,0|1,0,0]=3 2727 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 34a_100000687081_200025704644 [1,1,0,0,0,0|1,0,0]=3 2728 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 7a_100000687081_200025704644 [1,1,0,0,0,0|1,0,0]=3 2729 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_200025704644 [1,1,0,0,0,0|1,0,0]=3 2730 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 34a_100000184108_200025704644 [1,1,0,0,0,0|1,0,0]=3 2731 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 2230a_100000211060_200025704644 [1,1,0,0,0,0|1,0,0]=3 2732 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 34a_100000211060_200025704644 [1,1,0,0,0,0|1,0,0]=3 2733 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 7a_100000211060_200025704644 [1,1,0,0,0,0|1,0,0]=3 2734 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)I 34a_100000761885_200025704644 [1,1,0,0,0,0|1,0,0]=3 2735 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [1,1,0,0,0,0|0,0,0]=2 2736 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 2230a_100000759894_200025704644 [1,1,0,0,0,0|1,0,0]=3 2737 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 34a_100000759894_200025704644 [1,1,0,0,0,0|1,0,0]=3 2738 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 7a_100000759894_200025704644 [1,1,0,0,0,0|1,0,0]=3 2739 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 2230a_100000739366_200025704644 [1,1,0,0,0,0|1,0,0]=3 2740 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 34a_100000739366_200025704644 [1,1,0,0,0,0|1,0,0]=3 2741 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 7a_100000739366_200025704644 [1,1,0,0,0,0|1,0,0]=3 2742 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 2230a_100000210724_200025704644 [1,1,0,0,0,0|1,0,0]=3 2743 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 34a_100000210724_200025704644 [1,1,0,0,0,0|1,0,0]=3 2744 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 7a_100000210724_200025704644 [1,1,0,0,0,0|1,0,0]=3 2745 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 34a_100011356925_200025704644 [1,1,0,0,0,0|1,0,0]=3 2746 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 7a_100011356925_200025704644 [1,1,0,0,0,0|1,0,0]=3 2747 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [1,1,0,0,0,0|0,0,0]=2 2748 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [1,1,0,0,0,0|0,0,0]=2 2749 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Br 34a_100000750459_200025704644 [1,1,0,0,0,0|1,0,0]=3 2750 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Cl 34a_100012360549_200025704644 [1,1,0,0,0,0|1,0,0]=3 2751 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 34a_114828291077_200025704644 [1,1,0,0,0,0|1,0,0]=3 2752 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 7a_114828291077_200025704644 [1,1,0,0,0,0|1,0,0]=3 2753 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [1,1,0,0,0,0|1,0,0]=3 2754 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [1,1,0,0,0,0|1,0,0]=3 2755 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [1,1,0,0,0,0|1,0,0]=3 2756 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [1,1,0,0,0,0|0,0,0]=2 2757 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 34a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 2758 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 7a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 2759 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 34a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2760 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 7a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2761 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 34a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 2762 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 7a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 2763 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 34a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 2764 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 7a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 2765 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 34a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2766 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 7a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2767 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 34a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 2768 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 7a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 2769 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 34a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 2770 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 7a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 2771 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 34a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 2772 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 7a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 2773 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 34a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 2774 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 7a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 2775 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 34a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 2776 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 7a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 2777 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 34a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 2778 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 7a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 2779 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 34a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 2780 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 7a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 2781 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 34a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 2782 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 7a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 2783 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 34a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 2784 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 7a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 2785 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 34a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2786 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 7a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2787 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 34a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 2788 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 7a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 2789 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 34a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 2790 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 7a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 2791 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 34a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 2792 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 7a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 2793 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Cl 34a_100011934297_200025704644 [1,1,0,0,0,0|2,0,0]=4 2794 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 34a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 2795 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 7a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 2796 B10R1.176 [13CH3]Oc1ccc(c(c1)N)N 34a_100025771000_200025704644 [1,1,0,0,0,0|2,0,0]=4 2797 B10R1.176 [13CH3]Sc1cc(c(cn1)O)N 62a_100009819941_200025704644 [1,1,0,0,0,0|2,0,0]=4 2798 B10R1.176 [13CH3]Sc1cc(c(cn1)O)N 62a_200025704644_100009819941 [1,1,0,0,0,0|2,0,0]=4 2799 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_100012356285_200025704644 [1,1,0,0,0,0|2,0,0]=4 2800 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_200025704644_100012356285 [1,1,0,0,0,0|2,0,0]=4 2801 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_100012353702_200025704644 [1,1,0,0,0,0|2,0,0]=4 2802 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_200025704644_100012353702 [1,1,0,0,0,0|2,0,0]=4 2803 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_100012047266_200025704644 [1,1,0,0,0,0|2,0,0]=4 2804 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_200025704644_100012047266 [1,1,0,0,0,0|2,0,0]=4 2805 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_100000750455_200025704644 [1,1,0,0,0,0|2,0,0]=4 2806 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_200025704644_100000750455 [1,1,0,0,0,0|2,0,0]=4 2807 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [1,1,0,0,0,0|1,0,0]=3 2808 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [1,1,0,0,0,0|1,0,0]=3 2809 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_100012047281_200025704644 [1,1,0,0,0,0|2,0,0]=4 2810 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_200025704644_100012047281 [1,1,0,0,0,0|2,0,0]=4 2811 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_100011214914_200025704644 [1,1,0,0,0,0|2,0,0]=4 2812 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_200025704644_100011214914 [1,1,0,0,0,0|2,0,0]=4 2813 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_100011215976_200025704644 [1,1,0,0,0,0|2,0,0]=4 2814 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_200025704644_100011215976 [1,1,0,0,0,0|2,0,0]=4 2815 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 2816 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_200025704644_100011218065 [1,1,0,0,0,0|2,0,0]=4 2817 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [1,1,0,0,0,0|1,0,0]=3 2818 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [1,1,0,0,0,0|1,0,0]=3 2819 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_100000685389_200025704644 [1,1,0,0,0,0|2,0,0]=4 2820 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_200025704644_100000685389 [1,1,0,0,0,0|2,0,0]=4 2821 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_100011216805_200025704644 [1,1,0,0,0,0|2,0,0]=4 2822 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_200025704644_100011216805 [1,1,0,0,0,0|2,0,0]=4 2823 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_100000703953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2824 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_200025704644_100000703953 [1,1,0,0,0,0|2,0,0]=4 2825 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 2826 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_200025704644_100011215594 [1,1,0,0,0,0|2,0,0]=4 2827 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [1,1,0,0,0,0|1,0,0]=3 2828 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [1,1,0,0,0,0|1,0,0]=3 2829 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_100000750456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2830 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_200025704644_100000750456 [1,1,0,0,0,0|2,0,0]=4 2831 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200000761891_200025704644 [1,1,0,0,0,0|2,0,0]=4 2832 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200025704644_200000761891 [1,1,0,0,0,0|2,0,0]=4 2833 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_100000740924_200025704644 [1,1,0,0,0,0|2,0,0]=4 2834 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_200025704644_100000740924 [1,1,0,0,0,0|2,0,0]=4 2835 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_100000741789_200025704644 [1,1,0,0,0,0|2,0,0]=4 2836 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_200025704644_100011534411 [1,1,0,0,0,0|2,0,0]=4 2837 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [1,1,0,0,0,0|1,0,0]=3 2838 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [1,1,0,0,0,0|1,0,0]=3 2839 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 2840 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [1,1,0,0,0,0|2,0,0]=4 2841 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 2842 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [1,1,0,0,0,0|2,0,0]=4 2843 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2844 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [1,1,0,0,0,0|2,0,0]=4 2845 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 2846 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [1,1,0,0,0,0|2,0,0]=4 2847 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [1,1,0,0,0,0|1,0,0]=3 2848 B10R1.176 [13CH3]Sc1ccc(c(n1)Br)O 62a_100000725334_200025704644 [1,1,0,0,0,0|2,0,0]=4 2849 B10R1.176 [13CH3]Sc1ccc(c(n1)Br)O 62a_200025704644_100000725334 [1,1,0,0,0,0|2,0,0]=4 2850 B10R1.176 [13CH3]Sc1ccc(c(n1)Cl)O 62a_200025704644_100000721234 [1,1,0,0,0,0|2,0,0]=4 2851 B10R1.176 [13CH3]Sc1ccc(c(n1)F)O 62a_100009819667_200025704644 [1,1,0,0,0,0|2,0,0]=4 2852 B10R1.176 [13CH3]Sc1ccc(c(n1)F)O 62a_200025704644_100009819667 [1,1,0,0,0,0|2,0,0]=4 2853 B10R1.176 [13CH3]Sc1ccc(c(n1)N)O 62a_100000685527_200025704644 [1,1,0,0,0,0|2,0,0]=4 2854 B10R1.176 [13CH3]Sc1ccc(c(n1)N)O 62a_200025704644_100000685527 [1,1,0,0,0,0|2,0,0]=4 2855 B10R1.176 [13CH3]Sc1cnc(c(c1)Cl)O 62a_100010238531_200025704644 [1,1,0,0,0,0|2,0,0]=4 2856 B10R1.176 [13CH3]Sc1cnc(c(c1)Cl)O 62a_200025704644_100010238531 [1,1,0,0,0,0|2,0,0]=4 2857 B10R1.176 [13CH3]Sc1cnc(c(c1)N)O 62a_100000743729_200025704644 [1,1,0,0,0,0|2,0,0]=4 2858 B10R1.176 [13CH3]Sc1cnc(c(c1)N)O 62a_200025704644_100000743729 [1,1,0,0,0,0|2,0,0]=4 2859 B10R1.15 CC(N[13CH3])c1ccccn1 2230a_100000181244_200025704644 [1,1,0,0,0,0|2,0,0]=4 2860 B10R1.15 CC(N[13CH3])c1cccnc1 2230a_100000195435_200025704644 [1,1,0,0,0,0|2,0,0]=4 2861 B10R1.15 CC(N[13CH3])c1ccncc1 2230a_100000181269_200025704644 [1,1,0,0,0,0|2,0,0]=4 2862 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|1,0,0]=3 2863 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|1,0,0]=3 2864 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|2,0,0]=4 2865 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|0,0,0]=2 2866 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|0,0,0]=2 2867 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|0,0,0]=2 2868 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|0,0,0]=2 2869 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|0,0,0]=2 2870 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|0,0,0]=2 2871 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|0,0,0]=2 2872 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|0,0,0]=2 2873 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|0,0,0]=2 2874 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,1,0,0,0,0|0,0,0]=2 2875 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,1,0,0,0,0|0,0,0]=2 2876 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|2,0,0]=4 2877 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 2878 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 2879 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|2,0,0]=4 2880 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 2881 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,0]=3 2882 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,0]=3 2883 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 2884 B10R1.15 CNC(C)c1ccccn1 2230a_100000181244_200000210301 [1,1,0,0,0,0|2,0,0]=4 2885 B10R1.15 CNC(C)c1ccccn1 269862a_106832991636_100000210467 [1,1,0,0,0,0|2,0,0]=4 2886 B10R1.15 CNC(C)c1cccnc1 2230a_100000195435_200000210301 [1,1,0,0,0,0|2,0,0]=4 2887 B10R1.15 CNC(C)c1cccnc1 269862a_106832991636_100000210468 [1,1,0,0,0,0|2,0,0]=4 2888 B10R1.15 CNC(C)c1ccncc1 2230a_100000181269_200000210301 [1,1,0,0,0,0|2,0,0]=4 2889 B10R1.15 CNC(C)c1ccncc1 269862a_106832991636_100000185792 [1,1,0,0,0,0|2,0,0]=4 2890 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,0]=3 2891 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|1,0,0]=3 2892 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 2893 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 2894 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|1,0,0]=3 2895 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|1,0,0]=3 2896 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,0]=3 2897 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 2898 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 2899 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,1,0,0,0,0|2,0,0]=4 2900 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,1]=4 2901 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,1]=4 2902 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,1]=4 2903 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,1]=4 2904 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,1]=4 2905 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|1,0,1]=4 2906 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|2,0,0]=4 2907 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|2,0,0]=4 2908 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|2,0,0]=4 2909 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|2,0,0]=4 2910 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|2,0,0]=4 2913 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|2,0,0]=4 2914 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|1,0,0]=3 2915 B10R1.61 CC(C)c1cccnc1O 271570a_203496583355_200010382935 [1,1,0,0,0,0|2,0,0]=4 2916 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|2,0,0]=4 2917 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|2,0,0]=4 2918 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,1,0,0,0,0|0,0,0]=2 2919 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,1,0,0,0,0|0,0,0]=2 2920 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,1,0,0,0,0|0,0,0]=2 2921 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,1,0,0,0,0|0,0,0]=2 2922 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,1,0,0,0,0|0,0,0]=2 2923 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,1,0,0,0,0|0,0,0]=2 2924 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,1,0,0,0,0|0,0,0]=2 2925 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,1,0,0,0,0|0,0,0]=2 2926 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,1,0,0,0,0|0,0,0]=2 2927 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,1,0,0,0,0|0,0,0]=2 2928 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|0,0,0]=2 2929 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|0,0,0]=2 2930 B10R1.61 CN(C)c1ccn[nH]c1=O 27a_100102631434_100000087129 [1,1,0,0,0,0|2,0,0]=4 2931 B10R1.61 CN(C)c1ccncc1Br 27a_100102631434_100000726257 [1,1,0,0,0,0|1,0,0]=3 2932 B10R1.61 CN(C)c1ccncc1F 27a_100102631434_100000035921 [1,1,0,0,0,0|1,0,0]=3 2933 B10R1.61 CN(C)c1ccncc1O 271570a_203496583355_100012355995 [1,1,0,0,0,0|1,0,0]=3 2934 B10R1.61 CN(C)c1ncccc1Br 27a_100102631434_100000696092 [1,1,0,0,0,0|1,0,0]=3 2935 B10R1.61 CN(C)c1ncccc1O 271570a_203496583355_100011465059 [1,1,0,0,0,0|1,0,0]=3 2936 B10R1.61 CN(C)c1nccnc1F 27a_100102631434_200010125657 [1,1,0,0,0,0|2,0,0]=4 2937 B10R1.61 CN(C)c1nccnc1O 271570a_203496583355_100000703087 [1,1,0,0,0,0|2,0,0]=4 2938 B10R1.61 CN(C)c1ncncc1F 27a_100102631434_100000069762 [1,1,0,0,0,0|2,0,0]=4 2939 B10R1.61 CN(C)c1ncncc1N 27a_100102631434_100000709731 [1,1,0,0,0,0|2,0,0]=4 2940 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,1,0,0,0,0|0,0,0]=2 2941 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,1,0,0,0,0|0,0,0]=2 2942 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,1,0,0,0,0|0,0,0]=2 2943 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,1,0,0,0,0|0,0,0]=2 2944 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,1,0,0,0,0|0,0,0]=2 2945 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,1,0,0,0,0|0,0,0]=2 2946 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,1,0,0,0,0|0,0,0]=2 2947 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,1,0,0,0,0|0,0,0]=2 2948 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,1,0,0,0,0|0,0,0]=2 2949 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,1,0,0,0,0|0,0,0]=2 2950 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|0,0,0]=2 2951 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|2,0,0]=4 2952 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|2,0,0]=4 2953 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,1,0,0,0,0|0,0,0]=2 2954 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,1,0,0,0,0|0,0,0]=2 2955 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,1,0,0,0,0|0,0,0]=2 2956 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,1,0,0,0,0|0,0,0]=2 2957 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,1,0,0,0,0|0,0,0]=2 2958 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,1,0,0,0,0|0,0,0]=2 2959 B10R1.61 Cc1ccnnc1N(C)C 27a_100102631434_100000089043 [1,1,0,0,0,0|2,0,0]=4 2960 B10R1.61 Cc1cnccc1N(C)C 27a_100102631434_100000765111 [1,1,0,0,0,0|1,0,0]=3 2961 B10R1.61 Cc1cncnc1N(C)C 27a_100102631434_100011998708 [1,1,0,0,0,0|2,0,0]=4 2962 B10R1.61 Cc1nccnc1N(C)C 27a_100102631434_100011999405 [1,1,0,0,0,0|2,0,0]=4 2963 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|2,0,0]=4 2964 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|2,0,0]=4 2965 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|2,0,0]=4 2966 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|2,0,0]=4 2967 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|2,0,0]=4 2968 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|2,0,0]=4 2969 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,1,0,0,0,0|1,0,1]=4 2970 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,1,0,0,0,0|1,0,1]=4 2971 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,1,0,0,0,0|1,0,1]=4 2972 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,1,0,0,0,0|1,0,1]=4 2973 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,1,0,0,0,0|1,0,1]=4 2974 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,1,0,0,0,0|1,0,1]=4 2975 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,1,0,0,0,0|1,0,1]=4 2976 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,1,0,0,0,0|1,0,1]=4 2977 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,1,0,0,0,0|2,0,0]=4 2978 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,1,0,0,0,0|2,0,0]=4 2979 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,1,0,0,0,0|2,0,0]=4 2980 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,1,0,0,0,0|2,0,0]=4 2981 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,1,0,0,0,0|2,0,0]=4 2982 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2983 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,1,0,0,0,0|2,0,0]=4 2984 B10R1.113 CC(C)c1cc(ccn1)O 271570a_203496583355_100010237922 [1,1,0,0,0,0|2,0,0]=4 2985 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,1,0,0,0,0|1,0,0]=3 2986 B10R1.113 CC(C)c1cccc(n1)O 271570a_203496583355_100012318657 [1,1,0,0,0,0|2,0,0]=4 2987 B10R1.113 CC(C)c1ccnc(c1)O 271570a_203496583355_100010237925 [1,1,0,0,0,0|2,0,0]=4 2988 B10R1.113 CC(C)c1cncc(c1)O 271570a_203496583355_200010191214 [1,1,0,0,0,0|2,0,0]=4 2989 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,1,0,0,0,0|2,0,0]=4 2990 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,1,0,0,0,0|2,0,0]=4 2991 B10R1.113 CN(C)c1c[n+](ccn1)[O-] 27a_100102631434_100009880115 [1,1,0,0,0,0|2,0,0]=4 2992 B10R1.113 CN(C)c1cc(ccn1)F 27a_100102631434_100000764206 [1,1,0,0,0,0|1,0,0]=3 2993 B10R1.113 CN(C)c1cc(ccn1)O 271570a_203496583355_100012361627 [1,1,0,0,0,0|1,0,0]=3 2994 B10R1.113 CN(C)c1cc(ncn1)F 27a_100102631434_200009880791 [1,1,0,0,0,0|2,0,0]=4 2995 B10R1.113 CN(C)c1cc(ncn1)N 27a_100102631434_100000701291 [1,1,0,0,0,0|2,0,0]=4 2996 B10R1.113 CN(C)c1cc(ncn1)O 271570a_203496583355_100011443277 [1,1,0,0,0,0|2,0,0]=4 2997 B10R1.113 CN(C)c1cc(ncn1)O 27a_100102631434_100000765262 [1,1,0,0,0,0|2,0,0]=4 2998 B10R1.113 CN(C)c1cc[nH]c(=O)c1 27a_100102631434_100000061649 [1,1,0,0,0,0|1,0,0]=3 2999 B10R1.113 CN(C)c1cc[nH]c(=O)n1 27a_100102631434_200000134032 [1,1,0,0,0,0|2,0,0]=4 3000 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [1,1,0,0,0,0|0,0,0]=2 3001 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [1,1,0,0,0,0|0,0,0]=2 3002 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [1,1,0,0,0,0|0,0,0]=2 3003 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [1,1,0,0,0,0|0,0,0]=2 3004 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [1,1,0,0,0,0|0,0,0]=2 3005 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [1,1,0,0,0,0|0,0,0]=2 3006 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [1,1,0,0,0,0|0,0,0]=2 3007 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [1,1,0,0,0,0|0,0,0]=2 3008 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [1,1,0,0,0,0|0,0,0]=2 3009 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [1,1,0,0,0,0|0,0,0]=2 3010 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [1,1,0,0,0,0|0,0,0]=2 3011 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [1,1,0,0,0,0|0,0,0]=2 3012 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,1,0,0,0,0|0,0,0]=2 3013 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,1,0,0,0,0|0,0,0]=2 3014 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,1,0,0,0,0|0,0,0]=2 3015 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,1,0,0,0,0|0,0,0]=2 3016 B10R1.113 CN(C)c1cccc(n1)F 27a_100102631434_100009815982 [1,1,0,0,0,0|1,0,0]=3 3017 B10R1.113 CN(C)c1cccc(n1)O 271570a_203496583355_100011960435 [1,1,0,0,0,0|1,0,0]=3 3018 B10R1.113 CN(C)c1ccnc(c1)F 27a_100102631434_100009816116 [1,1,0,0,0,0|1,0,0]=3 3019 B10R1.113 CN(C)c1ccnc(c1)O 271570a_203496583355_100000766659 [1,1,0,0,0,0|1,0,0]=3 3020 B10R1.113 CN(C)c1ccnc(n1)N 27a_100102631434_100000055538 [1,1,0,0,0,0|2,0,0]=4 3021 B10R1.113 CN(C)c1ccnc(n1)O 271570a_203496583355_100000688391 [1,1,0,0,0,0|2,0,0]=4 3022 B10R1.113 CN(C)c1cncc(c1)O 271570a_203496583355_100012350714 [1,1,0,0,0,0|1,0,0]=3 3023 B10R1.113 CN(C)c1cncc(n1)Cl 27a_100102631434_100010892449 [1,1,0,0,0,0|2,0,0]=4 3024 B10R1.113 CN(C)c1cncc(n1)F 27a_100102631434_200009863489 [1,1,0,0,0,0|2,0,0]=4 3025 B10R1.113 CN(C)c1cncc(n1)O 271570a_203496583355_100000749133 [1,1,0,0,0,0|2,0,0]=4 3026 B10R1.113 CN(C)c1cnnc(c1)O 271570a_203496583355_200013022705 [1,1,0,0,0,0|2,0,0]=4 3027 B10R1.113 CN(C)c1nccc(n1)N 27a_100102631434_100000757536 [1,1,0,0,0,0|2,0,0]=4 3028 B10R1.113 CN(C)c1nccc(n1)O 271570a_203496583355_100000757975 [1,1,0,0,0,0|2,0,0]=4 3029 B10R1.113 CN(C)c1nccc(n1)O 27a_100102631434_100011649813 [1,1,0,0,0,0|2,0,0]=4 3030 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [1,1,0,0,0,0|0,0,0]=2 3031 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [1,1,0,0,0,0|0,0,0]=2 3032 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [1,1,0,0,0,0|0,0,0]=2 3033 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [1,1,0,0,0,0|0,0,0]=2 3034 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [1,1,0,0,0,0|0,0,0]=2 3035 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [1,1,0,0,0,0|0,0,0]=2 3036 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [1,1,0,0,0,0|0,0,0]=2 3037 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [1,1,0,0,0,0|0,0,0]=2 3038 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [1,1,0,0,0,0|0,0,0]=2 3039 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [1,1,0,0,0,0|0,0,0]=2 3040 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [1,1,0,0,0,0|0,0,0]=2 3041 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [1,1,0,0,0,0|0,0,0]=2 3042 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,1,0,0,0,0|0,0,0]=2 3043 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,1,0,0,0,0|0,0,0]=2 3044 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,1,0,0,0,0|0,0,0]=2 3045 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,1,0,0,0,0|2,0,0]=4 3046 B10R1.113 Cc1cc(ccn1)N(C)C 27a_100102631434_100000758586 [1,1,0,0,0,0|1,0,0]=3 3047 B10R1.113 Cc1cc(ncn1)N(C)C 27a_100102631434_100000744208 [1,1,0,0,0,0|2,0,0]=4 3048 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,1,0,0,0,0|2,0,0]=4 3049 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [1,1,0,0,0,0|0,0,0]=2 3050 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [1,1,0,0,0,0|0,0,0]=2 3051 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [1,1,0,0,0,0|0,0,0]=2 3052 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [1,1,0,0,0,0|0,0,0]=2 3053 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [1,1,0,0,0,0|0,0,0]=2 3054 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [1,1,0,0,0,0|0,0,0]=2 3055 B10R1.113 Cc1ccnc(n1)N(C)C 27a_100102631434_100000750684 [1,1,0,0,0,0|2,0,0]=4 3056 B10R1.113 Cc1cncc(n1)N(C)C 27a_100102631434_100000754123 [1,1,0,0,0,0|2,0,0]=4 3057 B10R1.113 Cc1cnnc(c1)N(C)C 27a_100102631434_100000070100 [1,1,0,0,0,0|2,0,0]=4 3058 B10R1.113 Cc1nccc(n1)N(C)C 27a_100102631434_100000749937 [1,1,0,0,0,0|2,0,0]=4 3059 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,1,0,0,0,0|2,0,0]=4 3060 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,1,0,0,0,0|2,0,0]=4 3061 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,1,0,0,0,0|2,0,0]=4 3062 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,1,0,0,0,0|2,0,0]=4 3063 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,1,0,0,0,0|2,0,0]=4 3064 B10R1.55 C[Si](C)(C)c1ccc(s1)O 271570a_203496583355_100015817213 [0,1,0,0,1,0|2,0,0]=4 3065 B12R1.4 C#Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000140223 [0,1,0,0,0,1|1,0,0]=3 3066 B12R1.4 C#Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000140223 [0,1,0,0,0,1|1,0,0]=3 3067 B12R1.4 C#Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361452 [0,1,0,0,0,1|1,0,0]=3 3068 B12R1.4 C#Cc1ccc(cc1)NC(C)C 34a_100011215031_100000210206 [0,1,0,0,0,1|2,0,0]=4 3069 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [0,1,0,0,0,1|2,0,0]=4 3070 B12R1.4 C=Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000034074 [0,1,0,0,0,1|1,0,0]=3 3071 B12R1.4 C=Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000034074 [0,1,0,0,0,1|1,0,0]=3 3072 B12R1.4 C=Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361436 [0,1,0,0,0,1|1,0,0]=3 3073 B12R1.4 C=Cc1ccc(cc1)CN(C)C 271570a_100011290941_100000174694 [0,1,0,0,0,1|1,0,0]=3 3074 B12R1.4 C=Cc1ccc(cc1)NC(C)C 271570a_100011290941_100000219625 [0,1,0,0,0,1|2,0,0]=4 3075 B12R1.4 C=Cc1ccc(cc1)NC(C)C 34a_100011218248_100000210206 [0,1,0,0,0,1|2,0,0]=4 3076 B12R1.4 C=Cc1ccc(cc1)OC(C)C 271570a_100011290941_100000169947 [0,1,0,0,0,1|2,0,0]=4 3077 B12R1.4 C=Cc1ccc(cc1)OC(C)C 34a_100000189437_100000210206 [0,1,0,0,0,1|2,0,0]=4 3078 B12R1.4 C=Cc1ccc(cc1)OC(C)C 7a_100000189437_100000210206 [0,1,0,0,0,1|2,0,0]=4 3079 B12R1.4 C=Cc1ccc(cc1)SC(C)C 271570a_100011290941_100009811894 [0,1,0,0,0,1|2,0,0]=4 3080 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000210206_100000748128 [0,1,0,0,0,1|2,0,0]=4 3081 B12R1.4 C=Cc1ccc(cc1)SC(C)C 62a_100000748128_100000210206 [0,1,0,0,0,1|2,0,0]=4 3082 B12R1.4 C=Cc1ccc(cn1)CN(C)C 271570a_100011290941_106446545466 [0,1,0,0,0,1|2,0,0]=4 3083 B12R1.4 CC(=Cc1ccc(cc1)C#N)C 271570a_100102525489_100000179745 [0,1,0,0,0,1|2,0,0]=4 3084 B12R1.4 CC(=Cc1ccc(cc1)C=O)C 271570a_100102525489_100000186029 [0,1,0,0,0,1|1,0,1]=4 3085 B12R1.4 CC(=Cc1ccc(cc1)CF)C 271570a_100102525489_100010268989 [0,1,0,0,0,1|2,0,0]=4 3086 B12R1.4 CC(=Cc1ccc(cc1)CN)C 271570a_100102525489_100016989417 [0,1,0,0,0,1|2,0,0]=4 3087 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [0,1,0,0,0,1|1,0,0]=3 3088 B12R1.4 CC(=Cc1ccc(cc1)NN)C 271570a_100102525489_100016988836 [0,1,0,0,0,1|2,0,0]=4 3089 B12R1.4 CC(=Cc1ccc(cn1)CO)C 271570a_100102525489_100009816760 [0,1,0,0,0,1|2,0,0]=4 3090 B12R1.4 CC(=Cc1ccc(nc1)CO)C 271570a_100102525489_100000754261 [0,1,0,0,0,1|2,0,0]=4 3091 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [0,1,0,0,0,1|2,0,0]=4 3092 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [0,1,0,0,0,1|2,0,0]=4 3093 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,1,0,0,0,1|2,0,0]=4 3094 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,1,0,0,0,1|2,0,0]=4 3095 B12R1.4 CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000070787 [0,1,0,0,0,1|2,0,0]=4 3096 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,1,0,0,0,1|2,0,0]=4 3097 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,1,0,0,0,1|2,0,0]=4 3098 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [0,1,0,0,0,1|2,0,0]=4 3099 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [0,1,0,0,0,1|2,0,0]=4 3100 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [0,1,0,0,0,1|1,1,0]=4 3101 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [0,1,0,0,0,1|1,1,0]=4 3102 B12R1.4 CC(C)Nc1ccc(cc1)C#N 34a_100000185469_100000210206 [0,1,0,0,0,1|2,0,0]=4 3103 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [0,1,0,0,0,1|1,0,0]=3 3104 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [0,1,0,0,0,1|1,0,0]=3 3105 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_100000219625_200025704644 [0,1,0,0,0,1|1,1,0]=4 3106 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000219625 [0,1,0,0,0,1|1,1,0]=4 3107 B12R1.4 CC(C)Oc1ccc(cc1)C#N 34a_100000210344_100000210206 [0,1,0,0,0,1|2,0,0]=4 3108 B12R1.4 CC(C)Oc1ccc(cc1)C#N 7a_100000210344_100000210206 [0,1,0,0,0,1|2,0,0]=4 3109 B12R1.4 CC(C)Oc1ccc(cc1)CN 34a_100000185549_100000210206 [0,1,0,0,0,1|2,0,0]=4 3110 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [0,1,0,0,0,1|1,0,0]=3 3111 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 2230a_100011194259_200025704644 [0,1,0,0,0,1|2,0,0]=4 3112 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 34a_100011194259_200025704644 [0,1,0,0,0,1|2,0,0]=4 3113 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [0,1,0,0,0,1|1,0,0]=3 3114 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [0,1,0,0,0,1|1,0,0]=3 3115 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_100000169947_200025704644 [0,1,0,0,0,1|1,1,0]=4 3116 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000169947 [0,1,0,0,0,1|1,1,0]=4 3117 B12R1.4 CC(C)Oc1ccc(cn1)O[13CH3] 34a_100009858630_200025704644 [0,1,0,0,0,1|2,0,0]=4 3118 B12R1.4 CC(C)Oc1ccc(nc1)CO 34a_103436540053_100000210206 [0,1,0,0,0,1|2,0,0]=4 3119 B12R1.4 CC(C)Sc1ccc(cc1)C#N 62a_100000210206_100000184291 [0,1,0,0,0,1|2,0,0]=4 3120 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000188517_100000210206 [0,1,0,0,0,1|1,0,1]=4 3121 B12R1.4 CC(C)Sc1ccc(cc1)C=O 62a_100000210206_100000188517 [0,1,0,0,0,1|1,0,1]=4 3122 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100000210206_100010268989 [0,1,0,0,0,1|2,0,0]=4 3123 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100010268989_100000210206 [0,1,0,0,0,1|2,0,0]=4 3124 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100000210206_100016989417 [0,1,0,0,0,1|2,0,0]=4 3125 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100016989417_100000210206 [0,1,0,0,0,1|2,0,0]=4 3126 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [0,1,0,0,0,1|1,0,0]=3 3127 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [0,1,0,0,0,1|1,0,0]=3 3128 B12R1.4 CC(C)Sc1ccc(cc1)NN 62a_100000210206_100016988836 [0,1,0,0,0,1|2,0,0]=4 3129 B12R1.4 CC(C)Sc1ccc(cc1)NN 62a_100016988836_100000210206 [0,1,0,0,0,1|2,0,0]=4 3130 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_100009811894_200025704644 [0,1,0,0,0,1|1,1,0]=4 3131 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_200025704644_100009811894 [0,1,0,0,0,1|1,1,0]=4 3132 B12R1.4 CC(C)Sc1ccc(cn1)CO 62a_100000210206_100009816760 [0,1,0,0,0,1|2,0,0]=4 3133 B12R1.4 CC(C)Sc1ccc(cn1)CO 62a_100009816760_100000210206 [0,1,0,0,0,1|2,0,0]=4 3134 B12R1.4 CC(C)Sc1ccc(nc1)CO 62a_100000210206_100000754261 [0,1,0,0,0,1|2,0,0]=4 3135 B12R1.4 CC(C)Sc1ccc(nc1)CO 62a_100000754261_100000210206 [0,1,0,0,0,1|2,0,0]=4 3136 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,1,0,0,0,1|2,0,0]=4 3137 B12R1.4 CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011215824 [0,1,0,0,0,1|2,0,0]=4 3138 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100000683253_200000210301 [0,1,0,0,0,1|1,0,0]=3 3139 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100102631434_100000747183 [0,1,0,0,0,1|1,0,0]=3 3140 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100000683253_200000210301 [0,1,0,0,0,1|1,0,0]=3 3141 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100102631434_100000747183 [0,1,0,0,0,1|1,0,0]=3 3142 B12R1.4 CCc1ccc(cc1)CN(C)C 270004a_100102631434_100000211036 [0,1,0,0,0,1|1,0,0]=3 3143 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 2230a_100000683253_200025704644 [0,1,0,0,0,1|1,0,0]=3 3144 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 269982a_100000683253_200025704644 [0,1,0,0,0,1|1,0,0]=3 3145 B12R1.4 CCc1ccc(cc1)NC(C)C 2230a_100000211069_100000210206 [0,1,0,0,0,1|2,0,0]=4 3146 B12R1.4 CCc1ccc(cc1)NC(C)C 34a_100000211069_100000210206 [0,1,0,0,0,1|2,0,0]=4 3147 B12R1.4 CCc1ccc(cc1)OC(C)C 34a_100000211359_100000210206 [0,1,0,0,0,1|2,0,0]=4 3148 B12R1.4 CCc1ccc(cc1)OC(C)C 7a_100000211359_100000210206 [0,1,0,0,0,1|2,0,0]=4 3149 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100000210206_100011215824 [0,1,0,0,0,1|2,0,0]=4 3150 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100011215824_100000210206 [0,1,0,0,0,1|2,0,0]=4 3151 B12R1.4 CCc1ccc(nc1)CN(C)C 270004a_100102631434_100000069529 [0,1,0,0,0,1|2,0,0]=4 3152 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100000217971_200000210301 [0,1,0,0,0,1|1,0,0]=3 3153 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100102631434_100000184898 [0,1,0,0,0,1|1,0,0]=3 3154 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100000217971_200000210301 [0,1,0,0,0,1|1,0,0]=3 3155 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100102631434_100000184898 [0,1,0,0,0,1|1,0,0]=3 3156 B12R1.4 CN(C)Cc1ccc(cc1)C#N 270004a_100102631434_100000211122 [0,1,0,0,0,1|1,0,0]=3 3157 B12R1.4 CN(C)Cc1ccc(cc1)C#N 34a_100000217971_200000210301 [0,1,0,0,0,1|1,0,0]=3 3158 B12R1.4 CN(C)Cc1ccc(cc1)C=O 2230a_100102631434_100009816848 [0,1,0,0,0,1|0,0,1]=3 3159 B12R1.4 CN(C)Cc1ccc(cc1)C=O 269982a_100102631434_100009816848 [0,1,0,0,0,1|0,0,1]=3 3160 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [0,1,0,0,0,1|0,0,0]=2 3161 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [0,1,0,0,0,1|0,0,0]=2 3162 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [0,1,0,0,0,1|0,0,0]=2 3163 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_100000174694_200025704644 [0,1,0,0,0,1|0,1,0]=3 3164 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000174694 [0,1,0,0,0,1|0,1,0]=3 3165 B12R1.4 CN(C)Cc1ccc(cn1)C#N 2230a_100102631434_100000693164 [0,1,0,0,0,1|2,0,0]=4 3166 B12R1.4 CN(C)Cc1ccc(cn1)C#N 269982a_100102631434_100000693164 [0,1,0,0,0,1|2,0,0]=4 3167 B12R1.4 CN(C)Cc1ccc(cn1)C#N 270004a_100102631434_100009884217 [0,1,0,0,0,1|2,0,0]=4 3168 B12R1.4 CN(C)Cc1ccc(nc1)C#N 2230a_100102631434_100009816919 [0,1,0,0,0,1|2,0,0]=4 3169 B12R1.4 CN(C)Cc1ccc(nc1)C#N 269982a_100102631434_100009816919 [0,1,0,0,0,1|2,0,0]=4 3170 B12R1.4 CN(C)Cc1ccc(nc1)C#N 270004a_100102631434_100000064383 [0,1,0,0,0,1|2,0,0]=4 3171 B12R1.4 CN(C)Cc1ccc(nc1)S[13CH3] 62a_106446545466_200025704644 [0,1,0,0,0,1|1,1,0]=4 3172 B12R1.4 CN(C)Cc1ccc(nc1)S[13CH3] 62a_200025704644_106446545466 [0,1,0,0,0,1|1,1,0]=4 3173 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 2230a_100000217971_200025704644 [0,1,0,0,0,1|1,0,0]=3 3174 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 269982a_100000217971_200025704644 [0,1,0,0,0,1|1,0,0]=3 3175 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 34a_100000217971_200025704644 [0,1,0,0,0,1|1,0,0]=3 3176 B12R1.4 CNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219623 [0,1,0,0,0,1|2,0,0]=4 3177 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [0,1,0,0,0,1|2,0,0]=4 3178 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [0,1,0,0,0,1|2,0,0]=4 3179 B12R1.4 CNc1ccc(cc1)OC(C)C 2230a_100011194259_200000210301 [0,1,0,0,0,1|2,0,0]=4 3180 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100000182112_100000210206 [0,1,0,0,0,1|2,0,0]=4 3181 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100011194259_200000210301 [0,1,0,0,0,1|2,0,0]=4 3182 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000210206_100000743151 [0,1,0,0,0,1|2,0,0]=4 3183 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000743151_100000210206 [0,1,0,0,0,1|2,0,0]=4 3184 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,1,0,0,0,1|1,0,0]=3 3185 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,1,0,0,0,1|2,0,0]=4 3186 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,1,0,0,0,1|2,0,0]=4 3187 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,1,0,0,0,1|2,0,0]=4 3188 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,1,0,0,0,1|2,0,0]=4 3189 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,1,0,0,0,1|2,0,0]=4 3190 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [0,1,0,0,0,1|0,0,0]=2 3191 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [0,1,0,0,0,1|0,0,0]=2 3192 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [0,1,0,0,0,1|0,0,0]=2 3193 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [0,1,0,0,0,1|0,0,0]=2 3194 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [0,1,0,0,0,1|0,0,0]=2 3195 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [0,1,0,0,0,1|0,0,0]=2 3196 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [0,1,0,0,0,1|0,0,0]=2 3197 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,1,0,0,0,1|2,0,0]=4 3198 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,1,0,0,0,1|2,0,0]=4 3199 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,1,0,0,0,1|2,0,0]=4 3200 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,1,0,0,0,1|2,0,0]=4 3201 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,1,0,0,0,1|2,0,0]=4 3202 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,1,0,0,0,1|2,0,0]=4 3203 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [0,1,0,0,0,1|1,0,0]=3 3204 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [0,1,0,0,0,1|1,0,0]=3 3205 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [0,1,0,0,0,1|1,0,0]=3 3206 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [0,1,0,0,0,1|1,0,0]=3 3207 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [0,1,0,0,0,1|1,0,0]=3 3208 B12R1.4 COc1ccc(cn1)C=C(C)C 271570a_100102525489_100000047065 [0,1,0,0,0,1|2,0,0]=4 3209 B12R1.4 COc1ccc(cn1)CN(C)C 2230a_100102631434_100020631284 [0,1,0,0,0,1|1,0,0]=3 3210 B12R1.4 COc1ccc(cn1)CN(C)C 269982a_100102631434_100020631284 [0,1,0,0,0,1|1,0,0]=3 3211 B12R1.4 COc1ccc(cn1)CN(C)C 270004a_100102631434_100000761633 [0,1,0,0,0,1|1,0,0]=3 3212 B12R1.4 COc1ccc(cn1)OC(C)C 34a_100011934560_100000210206 [0,1,0,0,0,1|2,0,0]=4 3213 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000047065_100000210206 [0,1,0,0,0,1|2,0,0]=4 3214 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000210206_100000047065 [0,1,0,0,0,1|2,0,0]=4 3215 B12R1.4 COc1ccc(nc1)C=C(C)C 271570a_100102525489_100000755202 [0,1,0,0,0,1|2,0,0]=4 3216 B12R1.4 COc1ccc(nc1)CN(C)C 2230a_100102631434_200000757186 [0,1,0,0,0,1|1,0,0]=3 3217 B12R1.4 COc1ccc(nc1)CN(C)C 269982a_100102631434_200000757186 [0,1,0,0,0,1|1,0,0]=3 3218 B12R1.4 COc1ccc(nc1)CN(C)C 270004a_100102631434_100000701244 [0,1,0,0,0,1|1,0,0]=3 3219 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100009858630_200000210301 [0,1,0,0,0,1|2,0,0]=4 3220 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100012002028_100000210206 [0,1,0,0,0,1|2,0,0]=4 3221 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000210206_100000744180 [0,1,0,0,0,1|2,0,0]=4 3222 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000755202_100000210206 [0,1,0,0,0,1|2,0,0]=4 3223 B12R1.4 COc1cnc(cn1)CN(C)C 270004a_100102631434_100000099869 [0,1,0,0,0,1|2,0,0]=4 3224 B12R1.4 COc1ncc(cn1)CN(C)C 270004a_100102631434_100011202752 [0,1,0,0,0,1|2,0,0]=4 3225 B12R1.4 CSc1ccc(cc1)C=C(C)C 271570a_100102525489_100011263217 [0,1,0,0,0,1|1,1,0]=4 3226 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [0,1,0,0,0,1|1,1,0]=4 3227 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [0,1,0,0,0,1|1,1,0]=4 3228 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_100102631434_100000181263 [0,1,0,0,0,1|0,1,0]=3 3229 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_102495365258_200000210301 [0,1,0,0,0,1|0,1,0]=3 3230 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_100102631434_100011934452 [0,1,0,0,0,1|0,1,0]=3 3231 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_102495365258_200000210301 [0,1,0,0,0,1|0,1,0]=3 3232 B12R1.4 CSc1ccc(cc1)CN(C)C 270004a_100102631434_100000211154 [0,1,0,0,0,1|0,1,0]=3 3233 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_100000174694_200000210301 [0,1,0,0,0,1|0,1,0]=3 3234 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_200000210301_100000174694 [0,1,0,0,0,1|0,1,0]=3 3235 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 2230a_102495365258_200025704644 [0,1,0,0,0,1|0,1,0]=3 3236 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 269982a_102495365258_200025704644 [0,1,0,0,0,1|0,1,0]=3 3237 B12R1.4 CSc1ccc(cc1)NC(C)C 34a_100000212337_100000210206 [0,1,0,0,0,1|1,1,0]=4 3238 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_100000219625_200000210301 [0,1,0,0,0,1|1,1,0]=4 3239 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_200000210301_100000219625 [0,1,0,0,0,1|1,1,0]=4 3240 B12R1.4 CSc1ccc(cc1)OC(C)C 34a_100000211864_100000210206 [0,1,0,0,0,1|1,1,0]=4 3241 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_100000169947_200000210301 [0,1,0,0,0,1|1,1,0]=4 3242 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_200000210301_100000169947 [0,1,0,0,0,1|1,1,0]=4 3243 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100000210206_100011263217 [0,1,0,0,0,1|1,1,0]=4 3244 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100009811894_200000210301 [0,1,0,0,0,1|1,1,0]=4 3245 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100011263217_100000210206 [0,1,0,0,0,1|1,1,0]=4 3246 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_200000210301_100009811894 [0,1,0,0,0,1|1,1,0]=4 3247 B12R1.4 CSc1ccc(cn1)CN(C)C 62a_106446545466_200000210301 [0,1,0,0,0,1|1,1,0]=4 3248 B12R1.4 CSc1ccc(cn1)CN(C)C 62a_200000210301_106446545466 [0,1,0,0,0,1|1,1,0]=4 3249 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [0,1,0,0,0,1|2,0,0]=4 3250 B12R1.19 CC(=Cc1cc(c(cn1)O)C)C 271570a_100102525489_100000692680 [0,1,0,0,0,1|2,0,0]=4 3251 B12R1.19 CC(=Cc1cc(c(cn1)O)N)C 271570a_100102525489_100009819941 [0,1,0,0,0,1|2,0,0]=4 3252 B12R1.19 CC(=Cc1ccc(c(c1)Br)Br)C 271570a_100102525489_100012356285 [0,1,0,0,0,1|2,0,0]=4 3253 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [0,1,0,0,0,1|2,0,0]=4 3254 B12R1.19 CC(=Cc1ccc(c(c1)Br)Cl)C 271570a_100102525489_100012353702 [0,1,0,0,0,1|2,0,0]=4 3255 B12R1.19 CC(=Cc1ccc(c(c1)Br)F)C 271570a_100102525489_100012047266 [0,1,0,0,0,1|2,0,0]=4 3256 B12R1.19 CC(=Cc1ccc(c(c1)Br)N)C 271570a_100102525489_100000750455 [0,1,0,0,0,1|2,0,0]=4 3257 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,1,0,0,0,1|1,0,0]=3 3258 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [0,1,0,0,0,1|2,0,0]=4 3259 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [0,1,0,0,0,1|2,0,0]=4 3260 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [0,1,0,0,0,1|2,0,0]=4 3261 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [0,1,0,0,0,1|2,0,0]=4 3262 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [0,1,0,0,0,1|2,0,0]=4 3263 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,1,0,0,0,1|1,0,0]=3 3264 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Br)C 271570a_100102525489_100012047281 [0,1,0,0,0,1|2,0,0]=4 3265 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [0,1,0,0,0,1|2,0,0]=4 3266 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Cl)C 271570a_100102525489_100011214914 [0,1,0,0,0,1|2,0,0]=4 3267 B12R1.19 CC(=Cc1ccc(c(c1)Cl)F)C 271570a_100102525489_100011215976 [0,1,0,0,0,1|2,0,0]=4 3268 B12R1.19 CC(=Cc1ccc(c(c1)Cl)N)C 271570a_100102525489_100011218065 [0,1,0,0,0,1|2,0,0]=4 3269 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,1,0,0,0,1|1,0,0]=3 3270 B12R1.19 CC(=Cc1ccc(c(c1)F)Br)C 271570a_100102525489_100000685389 [0,1,0,0,0,1|2,0,0]=4 3271 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [0,1,0,0,0,1|2,0,0]=4 3272 B12R1.19 CC(=Cc1ccc(c(c1)F)Cl)C 271570a_100102525489_100011216805 [0,1,0,0,0,1|2,0,0]=4 3273 B12R1.19 CC(=Cc1ccc(c(c1)F)F)C 271570a_100102525489_100000750028 [0,1,0,0,0,1|2,0,0]=4 3274 B12R1.19 CC(=Cc1ccc(c(c1)F)N)C 271570a_100102525489_100011215594 [0,1,0,0,0,1|2,0,0]=4 3275 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,1,0,0,0,1|1,0,0]=3 3276 B12R1.19 CC(=Cc1ccc(c(c1)N)Br)C 271570a_100102525489_100000750456 [0,1,0,0,0,1|2,0,0]=4 3277 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [0,1,0,0,0,1|2,0,0]=4 3278 B12R1.19 CC(=Cc1ccc(c(c1)N)Cl)C 271570a_100102525489_200000761891 [0,1,0,0,0,1|2,0,0]=4 3279 B12R1.19 CC(=Cc1ccc(c(c1)N)F)C 271570a_100102525489_100000740924 [0,1,0,0,0,1|2,0,0]=4 3280 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C 271570a_100102525489_100000741789 [0,1,0,0,0,1|2,0,0]=4 3281 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,1,0,0,0,1|1,0,0]=3 3282 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [0,1,0,0,0,1|2,0,0]=4 3283 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [0,1,0,0,0,1|2,0,0]=4 3284 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [0,1,0,0,0,1|2,0,0]=4 3285 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [0,1,0,0,0,1|2,0,0]=4 3286 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [0,1,0,0,0,1|2,0,0]=4 3287 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,1,0,0,0,1|1,0,0]=3 3288 B12R1.19 CC(=Cc1ccc(c(n1)Br)O)C 271570a_100102525489_100000725334 [0,1,0,0,0,1|2,0,0]=4 3289 B12R1.19 CC(=Cc1ccc(c(n1)C)O)C 271570a_100102525489_100010233687 [0,1,0,0,0,1|2,0,0]=4 3290 B12R1.19 CC(=Cc1ccc(c(n1)Cl)O)C 271570a_100102525489_100000721234 [0,1,0,0,0,1|2,0,0]=4 3291 B12R1.19 CC(=Cc1ccc(c(n1)F)O)C 271570a_100102525489_100009819667 [0,1,0,0,0,1|2,0,0]=4 3292 B12R1.19 CC(=Cc1ccc(c(n1)N)O)C 271570a_100102525489_100000685527 [0,1,0,0,0,1|2,0,0]=4 3293 B12R1.19 CC(=Cc1cnc(c(c1)C)O)C 271570a_100102525489_100000685391 [0,1,0,0,0,1|2,0,0]=4 3294 B12R1.19 CC(=Cc1cnc(c(c1)Cl)O)C 271570a_100102525489_100010238531 [0,1,0,0,0,1|2,0,0]=4 3295 B12R1.19 CC(=Cc1cnc(c(c1)N)O)C 271570a_100102525489_100000743729 [0,1,0,0,0,1|2,0,0]=4 3296 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,1,0,0,0,1|2,0,0]=4 3297 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,1,0,0,0,1|2,0,0]=4 3298 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,1,0,0,0,1|2,0,0]=4 3299 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,1,0,0,0,1|2,0,0]=4 3300 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,1,0,0,0,1|2,0,0]=4 3301 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,1,0,0,0,1|2,0,0]=4 3302 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,1,0,0,0,1|2,0,0]=4 3303 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,1,0,0,0,1|2,0,0]=4 3304 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,1,0,0,0,1|2,0,0]=4 3305 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,1,0,0,0,1|2,0,0]=4 3306 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,1,0,0,0,1|2,0,0]=4 3307 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,1,0,0,0,1|2,0,0]=4 3308 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,1,0,0,0,1|2,0,0]=4 3309 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,1,0,0,0,1|2,0,0]=4 3310 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,1,0,0,0,1|2,0,0]=4 3311 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,1,0,0,0,1|2,0,0]=4 3312 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,1,0,0,0,1|2,0,0]=4 3313 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,1,0,0,0,1|2,0,0]=4 3314 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 2230a_100011306057_100000210206 [0,1,0,0,0,1|2,0,0]=4 3315 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 34a_100011306057_100000210206 [0,1,0,0,0,1|2,0,0]=4 3316 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Br 7a_100011306057_100000210206 [0,1,0,0,0,1|2,0,0]=4 3317 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210206 [0,1,0,0,0,1|2,0,0]=4 3318 B12R1.19 CC(C)Nc1ccc(c(c1)Br)Cl 34a_100000686031_100000210206 [0,1,0,0,0,1|2,0,0]=4 3319 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 2230a_100000760356_100000210206 [0,1,0,0,0,1|2,0,0]=4 3320 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 34a_100000760356_100000210206 [0,1,0,0,0,1|2,0,0]=4 3321 B12R1.19 CC(C)Nc1ccc(c(c1)Br)F 7a_100000760356_100000210206 [0,1,0,0,0,1|2,0,0]=4 3322 B12R1.19 CC(C)Nc1ccc(c(c1)Br)I 34a_100000750458_100000210206 [0,1,0,0,0,1|2,0,0]=4 3323 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [0,1,0,0,0,1|1,0,0]=3 3324 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210206 [0,1,0,0,0,1|2,0,0]=4 3325 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 34a_100000687081_100000210206 [0,1,0,0,0,1|2,0,0]=4 3326 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br 7a_100000687081_100000210206 [0,1,0,0,0,1|2,0,0]=4 3327 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210206 [0,1,0,0,0,1|2,0,0]=4 3328 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210206 [0,1,0,0,0,1|2,0,0]=4 3329 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 2230a_100000211060_100000210206 [0,1,0,0,0,1|2,0,0]=4 3330 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 34a_100000211060_100000210206 [0,1,0,0,0,1|2,0,0]=4 3331 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F 7a_100000211060_100000210206 [0,1,0,0,0,1|2,0,0]=4 3332 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)I 34a_100000761885_100000210206 [0,1,0,0,0,1|2,0,0]=4 3333 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [0,1,0,0,0,1|1,0,0]=3 3334 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 2230a_100000759894_100000210206 [0,1,0,0,0,1|2,0,0]=4 3335 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 34a_100000759894_100000210206 [0,1,0,0,0,1|2,0,0]=4 3336 B12R1.19 CC(C)Nc1ccc(c(c1)F)Br 7a_100000759894_100000210206 [0,1,0,0,0,1|2,0,0]=4 3337 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 2230a_100000739366_100000210206 [0,1,0,0,0,1|2,0,0]=4 3338 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 34a_100000739366_100000210206 [0,1,0,0,0,1|2,0,0]=4 3339 B12R1.19 CC(C)Nc1ccc(c(c1)F)Cl 7a_100000739366_100000210206 [0,1,0,0,0,1|2,0,0]=4 3340 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 2230a_100000210724_100000210206 [0,1,0,0,0,1|2,0,0]=4 3341 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 34a_100000210724_100000210206 [0,1,0,0,0,1|2,0,0]=4 3342 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 7a_100000210724_100000210206 [0,1,0,0,0,1|2,0,0]=4 3343 B12R1.19 CC(C)Nc1ccc(c(c1)F)I 34a_100011356925_100000210206 [0,1,0,0,0,1|2,0,0]=4 3344 B12R1.19 CC(C)Nc1ccc(c(c1)F)I 7a_100011356925_100000210206 [0,1,0,0,0,1|2,0,0]=4 3345 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [0,1,0,0,0,1|1,0,0]=3 3346 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [0,1,0,0,0,1|1,0,0]=3 3347 B12R1.19 CC(C)Nc1ccc(c(c1)I)Br 34a_100000750459_100000210206 [0,1,0,0,0,1|2,0,0]=4 3348 B12R1.19 CC(C)Nc1ccc(c(c1)I)Cl 34a_100012360549_100000210206 [0,1,0,0,0,1|2,0,0]=4 3349 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 34a_114828291077_100000210206 [0,1,0,0,0,1|2,0,0]=4 3350 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 7a_114828291077_100000210206 [0,1,0,0,0,1|2,0,0]=4 3351 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [0,1,0,0,0,1|2,0,0]=4 3352 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [0,1,0,0,0,1|2,0,0]=4 3353 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [0,1,0,0,0,1|2,0,0]=4 3354 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [0,1,0,0,0,1|1,0,0]=3 3355 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 34a_100011933957_100000210206 [0,1,0,0,0,1|2,0,0]=4 3356 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 7a_100011933957_100000210206 [0,1,0,0,0,1|2,0,0]=4 3357 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 34a_100000693481_100000210206 [0,1,0,0,0,1|2,0,0]=4 3358 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 7a_100000693481_100000210206 [0,1,0,0,0,1|2,0,0]=4 3359 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 34a_100000701344_100000210206 [0,1,0,0,0,1|2,0,0]=4 3360 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 7a_100000701344_100000210206 [0,1,0,0,0,1|2,0,0]=4 3361 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 34a_100012001276_100000210206 [0,1,0,0,0,1|2,0,0]=4 3362 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 7a_100012001276_100000210206 [0,1,0,0,0,1|2,0,0]=4 3363 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 34a_100011215161_100000210206 [0,1,0,0,0,1|2,0,0]=4 3364 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 7a_100011215161_100000210206 [0,1,0,0,0,1|2,0,0]=4 3365 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210206 [0,1,0,0,0,1|2,0,0]=4 3366 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210206 [0,1,0,0,0,1|2,0,0]=4 3367 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 34a_100000211030_100000210206 [0,1,0,0,0,1|2,0,0]=4 3368 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 7a_100000211030_100000210206 [0,1,0,0,0,1|2,0,0]=4 3369 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 34a_100000047559_100000210206 [0,1,0,0,0,1|2,0,0]=4 3370 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 7a_100000047559_100000210206 [0,1,0,0,0,1|2,0,0]=4 3371 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 34a_100011215599_100000210206 [0,1,0,0,0,1|2,0,0]=4 3372 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 7a_100011215599_100000210206 [0,1,0,0,0,1|2,0,0]=4 3373 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 34a_100000755031_100000210206 [0,1,0,0,0,1|2,0,0]=4 3374 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 7a_100000755031_100000210206 [0,1,0,0,0,1|2,0,0]=4 3375 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 34a_100000691581_100000210206 [0,1,0,0,0,1|2,0,0]=4 3376 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 7a_100000691581_100000210206 [0,1,0,0,0,1|2,0,0]=4 3377 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 34a_100000181275_100000210206 [0,1,0,0,0,1|2,0,0]=4 3378 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 7a_100000181275_100000210206 [0,1,0,0,0,1|2,0,0]=4 3379 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 34a_100009990212_100000210206 [0,1,0,0,0,1|2,0,0]=4 3380 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 7a_100009990212_100000210206 [0,1,0,0,0,1|2,0,0]=4 3381 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 34a_100000759473_100000210206 [0,1,0,0,0,1|2,0,0]=4 3382 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 7a_100000759473_100000210206 [0,1,0,0,0,1|2,0,0]=4 3383 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [0,1,0,0,0,1|1,0,0]=3 3384 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 34a_100012339312_100000210206 [0,1,0,0,0,1|2,0,0]=4 3385 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 7a_100012339312_100000210206 [0,1,0,0,0,1|2,0,0]=4 3386 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 34a_100000049588_100000210206 [0,1,0,0,0,1|2,0,0]=4 3387 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 7a_100000049588_100000210206 [0,1,0,0,0,1|2,0,0]=4 3388 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 34a_100010084370_100000210206 [0,1,0,0,0,1|2,0,0]=4 3389 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 7a_100010084370_100000210206 [0,1,0,0,0,1|2,0,0]=4 3390 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 34a_100011999798_100000210206 [0,1,0,0,0,1|2,0,0]=4 3391 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 7a_100011999798_100000210206 [0,1,0,0,0,1|2,0,0]=4 3392 B12R1.19 CC(C)Oc1ccc(c(c1)N)Cl 34a_100011934297_100000210206 [0,1,0,0,0,1|2,0,0]=4 3393 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 34a_100012017239_100000210206 [0,1,0,0,0,1|2,0,0]=4 3394 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 7a_100012017239_100000210206 [0,1,0,0,0,1|2,0,0]=4 3395 B12R1.19 CC(C)Oc1ccc(c(c1)N)N 34a_100025771000_100000210206 [0,1,0,0,0,1|2,0,0]=4 3396 B12R1.19 CC(C)Sc1cc(c(cn1)O)N 62a_100000210206_100009819941 [0,1,0,0,0,1|2,0,0]=4 3397 B12R1.19 CC(C)Sc1cc(c(cn1)O)N 62a_100009819941_100000210206 [0,1,0,0,0,1|2,0,0]=4 3398 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Br 62a_100000210206_100012356285 [0,1,0,0,0,1|2,0,0]=4 3399 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Br 62a_100012356285_100000210206 [0,1,0,0,0,1|2,0,0]=4 3400 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Cl 62a_100000210206_100012353702 [0,1,0,0,0,1|2,0,0]=4 3401 B12R1.19 CC(C)Sc1ccc(c(c1)Br)Cl 62a_100012353702_100000210206 [0,1,0,0,0,1|2,0,0]=4 3402 B12R1.19 CC(C)Sc1ccc(c(c1)Br)F 62a_100000210206_100012047266 [0,1,0,0,0,1|2,0,0]=4 3403 B12R1.19 CC(C)Sc1ccc(c(c1)Br)F 62a_100012047266_100000210206 [0,1,0,0,0,1|2,0,0]=4 3404 B12R1.19 CC(C)Sc1ccc(c(c1)Br)N 62a_100000210206_100000750455 [0,1,0,0,0,1|2,0,0]=4 3405 B12R1.19 CC(C)Sc1ccc(c(c1)Br)N 62a_100000750455_100000210206 [0,1,0,0,0,1|2,0,0]=4 3406 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [0,1,0,0,0,1|1,0,0]=3 3407 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [0,1,0,0,0,1|1,0,0]=3 3408 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Br 62a_100000210206_100012047281 [0,1,0,0,0,1|2,0,0]=4 3409 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Br 62a_100012047281_100000210206 [0,1,0,0,0,1|2,0,0]=4 3410 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Cl 62a_100000210206_100011214914 [0,1,0,0,0,1|2,0,0]=4 3411 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210206 [0,1,0,0,0,1|2,0,0]=4 3412 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)F 62a_100000210206_100011215976 [0,1,0,0,0,1|2,0,0]=4 3413 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)F 62a_100011215976_100000210206 [0,1,0,0,0,1|2,0,0]=4 3414 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)N 62a_100000210206_100011218065 [0,1,0,0,0,1|2,0,0]=4 3415 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)N 62a_100011218065_100000210206 [0,1,0,0,0,1|2,0,0]=4 3416 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [0,1,0,0,0,1|1,0,0]=3 3417 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [0,1,0,0,0,1|1,0,0]=3 3418 B12R1.19 CC(C)Sc1ccc(c(c1)F)Br 62a_100000210206_100000685389 [0,1,0,0,0,1|2,0,0]=4 3419 B12R1.19 CC(C)Sc1ccc(c(c1)F)Br 62a_100000685389_100000210206 [0,1,0,0,0,1|2,0,0]=4 3420 B12R1.19 CC(C)Sc1ccc(c(c1)F)Cl 62a_100000210206_100011216805 [0,1,0,0,0,1|2,0,0]=4 3421 B12R1.19 CC(C)Sc1ccc(c(c1)F)Cl 62a_100011216805_100000210206 [0,1,0,0,0,1|2,0,0]=4 3422 B12R1.19 CC(C)Sc1ccc(c(c1)F)F 62a_100000210206_100000703953 [0,1,0,0,0,1|2,0,0]=4 3423 B12R1.19 CC(C)Sc1ccc(c(c1)F)F 62a_100000703953_100000210206 [0,1,0,0,0,1|2,0,0]=4 3424 B12R1.19 CC(C)Sc1ccc(c(c1)F)N 62a_100000210206_100011215594 [0,1,0,0,0,1|2,0,0]=4 3425 B12R1.19 CC(C)Sc1ccc(c(c1)F)N 62a_100011215594_100000210206 [0,1,0,0,0,1|2,0,0]=4 3426 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [0,1,0,0,0,1|1,0,0]=3 3427 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [0,1,0,0,0,1|1,0,0]=3 3428 B12R1.19 CC(C)Sc1ccc(c(c1)N)Br 62a_100000210206_100000750456 [0,1,0,0,0,1|2,0,0]=4 3429 B12R1.19 CC(C)Sc1ccc(c(c1)N)Br 62a_100000750456_100000210206 [0,1,0,0,0,1|2,0,0]=4 3430 B12R1.19 CC(C)Sc1ccc(c(c1)N)Cl 62a_100000210206_200000761891 [0,1,0,0,0,1|2,0,0]=4 3431 B12R1.19 CC(C)Sc1ccc(c(c1)N)Cl 62a_200000761891_100000210206 [0,1,0,0,0,1|2,0,0]=4 3432 B12R1.19 CC(C)Sc1ccc(c(c1)N)F 62a_100000210206_100000740924 [0,1,0,0,0,1|2,0,0]=4 3433 B12R1.19 CC(C)Sc1ccc(c(c1)N)F 62a_100000740924_100000210206 [0,1,0,0,0,1|2,0,0]=4 3434 B12R1.19 CC(C)Sc1ccc(c(c1)N)N 62a_100000210206_100011534411 [0,1,0,0,0,1|2,0,0]=4 3435 B12R1.19 CC(C)Sc1ccc(c(c1)N)N 62a_100000741789_100000210206 [0,1,0,0,0,1|2,0,0]=4 3436 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [0,1,0,0,0,1|1,0,0]=3 3437 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [0,1,0,0,0,1|1,0,0]=3 3438 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [0,1,0,0,0,1|2,0,0]=4 3439 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [0,1,0,0,0,1|2,0,0]=4 3440 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [0,1,0,0,0,1|2,0,0]=4 3441 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [0,1,0,0,0,1|2,0,0]=4 3442 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [0,1,0,0,0,1|2,0,0]=4 3443 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [0,1,0,0,0,1|2,0,0]=4 3444 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [0,1,0,0,0,1|2,0,0]=4 3445 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [0,1,0,0,0,1|2,0,0]=4 3446 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [0,1,0,0,0,1|1,0,0]=3 3447 B12R1.19 CC(C)Sc1ccc(c(n1)Br)O 62a_100000210206_100000725334 [0,1,0,0,0,1|2,0,0]=4 3448 B12R1.19 CC(C)Sc1ccc(c(n1)Br)O 62a_100000725334_100000210206 [0,1,0,0,0,1|2,0,0]=4 3449 B12R1.19 CC(C)Sc1ccc(c(n1)Cl)O 62a_100000210206_100000721234 [0,1,0,0,0,1|2,0,0]=4 3450 B12R1.19 CC(C)Sc1ccc(c(n1)F)O 62a_100000210206_100009819667 [0,1,0,0,0,1|2,0,0]=4 3451 B12R1.19 CC(C)Sc1ccc(c(n1)F)O 62a_100009819667_100000210206 [0,1,0,0,0,1|2,0,0]=4 3452 B12R1.19 CC(C)Sc1ccc(c(n1)N)O 62a_100000210206_100000685527 [0,1,0,0,0,1|2,0,0]=4 3453 B12R1.19 CC(C)Sc1ccc(c(n1)N)O 62a_100000685527_100000210206 [0,1,0,0,0,1|2,0,0]=4 3454 B12R1.19 CC(C)Sc1cnc(c(c1)Cl)O 62a_100000210206_100010238531 [0,1,0,0,0,1|2,0,0]=4 3455 B12R1.19 CC(C)Sc1cnc(c(c1)Cl)O 62a_100010238531_100000210206 [0,1,0,0,0,1|2,0,0]=4 3456 B12R1.19 CC(C)Sc1cnc(c(c1)N)O 62a_100000210206_100000743729 [0,1,0,0,0,1|2,0,0]=4 3457 B12R1.19 CC(C)Sc1cnc(c(c1)N)O 62a_100000743729_100000210206 [0,1,0,0,0,1|2,0,0]=4 3458 B12R1.19 CN(C)Cc1c[nH]c(=O)c(c1)Cl 270004a_100102631434_100000051075 [0,1,0,0,0,1|1,0,1]=4 3459 B12R1.19 CN(C)Cc1cc(=O)c(co1)O 2230a_100102631434_100000010605 [0,1,0,0,0,1|1,0,0]=3 3460 B12R1.19 CN(C)Cc1cc(=O)c(co1)O 269982a_100102631434_100000010605 [0,1,0,0,0,1|1,0,0]=3 3461 B12R1.19 CN(C)Cc1ccc(=O)n(c1)C 270004a_100102631434_100010620449 [0,1,0,0,0,1|1,0,1]=4 3462 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 2230a_100102631434_100012353900 [0,1,0,0,0,1|1,0,0]=3 3463 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 269982a_100102631434_100012353900 [0,1,0,0,0,1|1,0,0]=3 3464 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 270004a_100102631434_100011215943 [0,1,0,0,0,1|1,0,0]=3 3465 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 2230a_100102631434_100012353894 [0,1,0,0,0,1|1,0,0]=3 3466 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 269982a_100102631434_100012353894 [0,1,0,0,0,1|1,0,0]=3 3467 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 270004a_100102631434_100000693810 [0,1,0,0,0,1|1,0,0]=3 3468 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 2230a_100102631434_100011206884 [0,1,0,0,0,1|1,0,0]=3 3469 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 269982a_100102631434_100000743011 [0,1,0,0,0,1|1,0,0]=3 3470 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 270004a_100102631434_100000211747 [0,1,0,0,0,1|1,0,0]=3 3471 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 2230a_100102631434_100012353895 [0,1,0,0,0,1|1,0,0]=3 3472 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 269982a_100102631434_100012353895 [0,1,0,0,0,1|1,0,0]=3 3473 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 270004a_100102631434_100000690054 [0,1,0,0,0,1|1,0,0]=3 3474 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200000210301 [0,1,0,0,0,1|1,0,0]=3 3475 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100102631434_100000184707 [0,1,0,0,0,1|1,0,0]=3 3476 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200000210301 [0,1,0,0,0,1|1,0,0]=3 3477 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100102631434_100000188800 [0,1,0,0,0,1|1,0,0]=3 3478 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 270004a_100102631434_100000188533 [0,1,0,0,0,1|1,0,0]=3 3479 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200000210301 [0,1,0,0,0,1|1,0,0]=3 3480 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 2230a_100102631434_100000717365 [0,1,0,0,0,1|1,0,0]=3 3481 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 269982a_100102631434_100011934319 [0,1,0,0,0,1|1,0,0]=3 3482 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 270004a_100102631434_100000742290 [0,1,0,0,0,1|1,0,0]=3 3483 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 2230a_100102631434_100012349665 [0,1,0,0,0,1|1,0,0]=3 3484 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 269982a_100102631434_100012349665 [0,1,0,0,0,1|1,0,0]=3 3485 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 2230a_100102631434_100000767054 [0,1,0,0,0,1|1,0,0]=3 3486 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 269982a_100102631434_100000767054 [0,1,0,0,0,1|1,0,0]=3 3487 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 270004a_100102631434_100000686674 [0,1,0,0,0,1|1,0,0]=3 3488 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 2230a_100102631434_100000716492 [0,1,0,0,0,1|1,0,0]=3 3489 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 269982a_100102631434_100000716492 [0,1,0,0,0,1|1,0,0]=3 3490 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 270004a_100102631434_100000745630 [0,1,0,0,0,1|1,0,0]=3 3491 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 2230a_100102631434_100000757363 [0,1,0,0,0,1|1,0,0]=3 3492 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 269982a_100102631434_100000757363 [0,1,0,0,0,1|1,0,0]=3 3493 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 270004a_100102631434_100000211062 [0,1,0,0,0,1|1,0,0]=3 3494 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 2230a_100102631434_100010149604 [0,1,0,0,0,1|1,0,0]=3 3495 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 269982a_100102631434_100010149604 [0,1,0,0,0,1|1,0,0]=3 3496 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 270004a_100102631434_100000050832 [0,1,0,0,0,1|1,0,0]=3 3497 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 2230a_100102631434_100010146616 [0,1,0,0,0,1|1,0,0]=3 3498 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 269982a_100102631434_100010146616 [0,1,0,0,0,1|1,0,0]=3 3499 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 270004a_100102631434_100010146563 [0,1,0,0,0,1|1,0,0]=3 3500 B12R1.19 CN(C)Cc1ccc(c(c1)I)Cl 270004a_100102631434_100010209939 [0,1,0,0,0,1|1,0,0]=3 3501 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 2230a_100102631434_100010188208 [0,1,0,0,0,1|1,0,0]=3 3502 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 269982a_100102631434_100010188208 [0,1,0,0,0,1|1,0,0]=3 3503 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 270004a_100102631434_100010188209 [0,1,0,0,0,1|1,0,0]=3 3504 B12R1.19 CN(C)Cc1cnc(c(c1)Br)F 2230a_100102631434_200010066439 [0,1,0,0,0,1|2,0,0]=4 3505 B12R1.19 CN(C)Cc1cnc(c(c1)Br)F 269982a_100102631434_200010066439 [0,1,0,0,0,1|2,0,0]=4 3506 B12R1.19 CN(C)Cc1cnc(c(c1)Br)O 270004a_100102631434_100010064886 [0,1,0,0,0,1|1,0,0]=3 3507 B12R1.19 CN(C)Cc1cnc(c(c1)Cl)Cl 2230a_100102631434_100009843750 [0,1,0,0,0,1|2,0,0]=4 3508 B12R1.19 CN(C)Cc1cnc(c(c1)Cl)Cl 269982a_100102631434_100009843750 [0,1,0,0,0,1|2,0,0]=4 3509 B12R1.19 CN(C)Cc1cnc(c(c1)F)Br 270004a_100102631434_100010064875 [0,1,0,0,0,1|2,0,0]=4 3510 B12R1.19 CN(C)Cc1cnc(c(c1)F)Cl 270004a_100102631434_100009866847 [0,1,0,0,0,1|2,0,0]=4 3511 B12R1.19 CN(C)Cc1cnc(c(c1)I)Cl 2230a_100102631434_100011072623 [0,1,0,0,0,1|2,0,0]=4 3512 B12R1.19 CN(C)Cc1cnc(c(c1)I)Cl 269982a_100102631434_100011072623 [0,1,0,0,0,1|2,0,0]=4 3513 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200025704644 [0,1,0,0,0,1|1,0,0]=3 3514 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200025704644 [0,1,0,0,0,1|1,0,0]=3 3515 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200025704644 [0,1,0,0,0,1|1,0,0]=3 3516 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [0,1,0,0,0,1|1,0,0]=3 3517 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [0,1,0,0,0,1|1,0,0]=3 3518 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [0,1,0,0,0,1|1,0,0]=3 3519 B12R1.19 Cc1cc(ccc1Br)NC(C)C 2230a_100000210723_100000210206 [0,1,0,0,0,1|2,0,0]=4 3520 B12R1.19 Cc1cc(ccc1Br)NC(C)C 34a_100000210723_100000210206 [0,1,0,0,0,1|2,0,0]=4 3521 B12R1.19 Cc1cc(ccc1Br)NC(C)C 7a_100000210723_100000210206 [0,1,0,0,0,1|2,0,0]=4 3522 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [0,1,0,0,0,1|2,0,0]=4 3523 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [0,1,0,0,0,1|2,0,0]=4 3524 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100000210206_100009813585 [0,1,0,0,0,1|2,0,0]=4 3525 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100009813585_100000210206 [0,1,0,0,0,1|2,0,0]=4 3526 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [0,1,0,0,0,1|1,0,0]=3 3527 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [0,1,0,0,0,1|1,0,0]=3 3528 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [0,1,0,0,0,1|1,0,0]=3 3529 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 2230a_100000187808_100000210206 [0,1,0,0,0,1|2,0,0]=4 3530 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 34a_100000187808_100000210206 [0,1,0,0,0,1|2,0,0]=4 3531 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 7a_100000187808_100000210206 [0,1,0,0,0,1|2,0,0]=4 3532 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [0,1,0,0,0,1|2,0,0]=4 3533 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [0,1,0,0,0,1|2,0,0]=4 3534 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000049509_100000210206 [0,1,0,0,0,1|2,0,0]=4 3535 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000210206_100000049509 [0,1,0,0,0,1|2,0,0]=4 3536 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [0,1,0,0,0,1|1,0,0]=3 3537 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [0,1,0,0,0,1|1,0,0]=3 3538 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [0,1,0,0,0,1|1,0,0]=3 3539 B12R1.19 Cc1cc(ccc1F)NC(C)C 2230a_100000750164_100000210206 [0,1,0,0,0,1|2,0,0]=4 3540 B12R1.19 Cc1cc(ccc1F)NC(C)C 34a_100000750164_100000210206 [0,1,0,0,0,1|2,0,0]=4 3541 B12R1.19 Cc1cc(ccc1F)NC(C)C 7a_100000750164_100000210206 [0,1,0,0,0,1|2,0,0]=4 3542 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [0,1,0,0,0,1|2,0,0]=4 3543 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [0,1,0,0,0,1|2,0,0]=4 3544 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100000210206_100011218330 [0,1,0,0,0,1|2,0,0]=4 3545 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100011218330_100000210206 [0,1,0,0,0,1|2,0,0]=4 3546 B12R1.19 Cc1cc(ccc1I)NC(C)C 34a_100000198070_100000210206 [0,1,0,0,0,1|2,0,0]=4 3547 B12R1.19 Cc1cc(ccc1I)NC(C)C 7a_100000198070_100000210206 [0,1,0,0,0,1|2,0,0]=4 3548 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [0,1,0,0,0,1|2,0,0]=4 3549 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [0,1,0,0,0,1|2,0,0]=4 3550 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [0,1,0,0,0,1|2,0,0]=4 3551 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [0,1,0,0,0,1|2,0,0]=4 3552 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000210206_100000211769 [0,1,0,0,0,1|2,0,0]=4 3553 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000211769_100000210206 [0,1,0,0,0,1|2,0,0]=4 3554 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,1,0,0,0,1|2,0,0]=4 3555 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [0,1,0,0,0,1|1,0,0]=3 3556 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [0,1,0,0,0,1|1,0,0]=3 3557 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [0,1,0,0,0,1|1,0,0]=3 3558 B12R1.19 Cc1cc(cnc1Br)CN(C)C 270004a_100102631434_100009814818 [0,1,0,0,0,1|2,0,0]=4 3559 B12R1.19 Cc1cc(cnc1Cl)CN(C)C 270004a_100102631434_100000070293 [0,1,0,0,0,1|2,0,0]=4 3560 B12R1.19 Cc1cc(cnc1F)CN(C)C 270004a_100102631434_100000050577 [0,1,0,0,0,1|2,0,0]=4 3561 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000210206_100000685391 [0,1,0,0,0,1|2,0,0]=4 3562 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000685391_100000210206 [0,1,0,0,0,1|2,0,0]=4 3563 B12R1.19 Cc1cc(ncc1Br)CN(C)C 270004a_100102631434_100009814806 [0,1,0,0,0,1|2,0,0]=4 3564 B12R1.19 Cc1cc(ncc1O)SC(C)C 62a_100000210206_100000692680 [0,1,0,0,0,1|2,0,0]=4 3565 B12R1.19 Cc1ccc(cc1Br)CN(C)C 2230a_100102631434_100012232412 [0,1,0,0,0,1|1,0,0]=3 3566 B12R1.19 Cc1ccc(cc1Br)CN(C)C 269982a_100102631434_100012232412 [0,1,0,0,0,1|1,0,0]=3 3567 B12R1.19 Cc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000695567 [0,1,0,0,0,1|1,0,0]=3 3568 B12R1.19 Cc1ccc(cc1Br)NC(C)C 2230a_100000736455_100000210206 [0,1,0,0,0,1|2,0,0]=4 3569 B12R1.19 Cc1ccc(cc1Br)NC(C)C 34a_100000736455_100000210206 [0,1,0,0,0,1|2,0,0]=4 3570 B12R1.19 Cc1ccc(cc1Br)NC(C)C 7a_100000736455_100000210206 [0,1,0,0,0,1|2,0,0]=4 3571 B12R1.19 Cc1ccc(cc1Br)OC(C)C 34a_100011380479_100000210206 [0,1,0,0,0,1|2,0,0]=4 3572 B12R1.19 Cc1ccc(cc1Br)OC(C)C 7a_100011380479_100000210206 [0,1,0,0,0,1|2,0,0]=4 3573 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100000210206_100011847877 [0,1,0,0,0,1|2,0,0]=4 3574 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100011847877_100000210206 [0,1,0,0,0,1|2,0,0]=4 3575 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [0,1,0,0,0,1|1,0,0]=3 3576 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [0,1,0,0,0,1|1,0,0]=3 3577 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [0,1,0,0,0,1|1,0,0]=3 3578 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [0,1,0,0,0,1|1,0,0]=3 3579 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [0,1,0,0,0,1|1,0,0]=3 3580 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [0,1,0,0,0,1|1,0,0]=3 3581 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [0,1,0,0,0,1|1,0,0]=3 3582 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [0,1,0,0,0,1|1,0,0]=3 3583 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [0,1,0,0,0,1|1,0,0]=3 3584 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [0,1,0,0,0,1|2,0,0]=4 3585 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [0,1,0,0,0,1|2,0,0]=4 3586 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [0,1,0,0,0,1|2,0,0]=4 3587 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [0,1,0,0,0,1|2,0,0]=4 3588 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [0,1,0,0,0,1|2,0,0]=4 3589 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [0,1,0,0,0,1|2,0,0]=4 3590 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [0,1,0,0,0,1|2,0,0]=4 3591 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100011823929 [0,1,0,0,0,1|1,0,0]=3 3592 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100011823929 [0,1,0,0,0,1|1,0,0]=3 3593 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000760539 [0,1,0,0,0,1|1,0,0]=3 3594 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 2230a_100000188892_100000210206 [0,1,0,0,0,1|2,0,0]=4 3595 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 34a_100000188892_100000210206 [0,1,0,0,0,1|2,0,0]=4 3596 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 7a_100000188892_100000210206 [0,1,0,0,0,1|2,0,0]=4 3597 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 34a_100011265682_100000210206 [0,1,0,0,0,1|2,0,0]=4 3598 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 7a_100011265682_100000210206 [0,1,0,0,0,1|2,0,0]=4 3599 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100000210206_100011216363 [0,1,0,0,0,1|2,0,0]=4 3600 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100011216363_100000210206 [0,1,0,0,0,1|2,0,0]=4 3601 B12R1.19 Cc1ccc(cc1F)CN(C)C 2230a_100102631434_100011217369 [0,1,0,0,0,1|1,0,0]=3 3602 B12R1.19 Cc1ccc(cc1F)CN(C)C 269982a_100102631434_100011217369 [0,1,0,0,0,1|1,0,0]=3 3603 B12R1.19 Cc1ccc(cc1F)CN(C)C 270004a_100102631434_100000753222 [0,1,0,0,0,1|1,0,0]=3 3604 B12R1.19 Cc1ccc(cc1F)NC(C)C 2230a_100000210958_100000210206 [0,1,0,0,0,1|2,0,0]=4 3605 B12R1.19 Cc1ccc(cc1F)NC(C)C 34a_100000210958_100000210206 [0,1,0,0,0,1|2,0,0]=4 3606 B12R1.19 Cc1ccc(cc1F)NC(C)C 7a_100000210958_100000210206 [0,1,0,0,0,1|2,0,0]=4 3607 B12R1.19 Cc1ccc(cc1F)OC(C)C 34a_100000722560_100000210206 [0,1,0,0,0,1|2,0,0]=4 3608 B12R1.19 Cc1ccc(cc1F)OC(C)C 7a_100000722560_100000210206 [0,1,0,0,0,1|2,0,0]=4 3609 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000210206_100000720648 [0,1,0,0,0,1|2,0,0]=4 3610 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000720648_100000210206 [0,1,0,0,0,1|2,0,0]=4 3611 B12R1.19 Cc1ccc(cc1I)CN(C)C 2230a_100102631434_100010206137 [0,1,0,0,0,1|1,0,0]=3 3612 B12R1.19 Cc1ccc(cc1I)CN(C)C 269982a_100102631434_100010206137 [0,1,0,0,0,1|1,0,0]=3 3613 B12R1.19 Cc1ccc(cc1I)CN(C)C 270004a_100102631434_100010197721 [0,1,0,0,0,1|1,0,0]=3 3614 B12R1.19 Cc1ccc(cc1I)NC(C)C 34a_100000184131_100000210206 [0,1,0,0,0,1|2,0,0]=4 3615 B12R1.19 Cc1ccc(cc1I)NC(C)C 7a_100000184131_100000210206 [0,1,0,0,0,1|2,0,0]=4 3616 B12R1.19 Cc1ccc(cc1N)OC(C)C 34a_100011216113_100000210206 [0,1,0,0,0,1|2,0,0]=4 3617 B12R1.19 Cc1ccc(cc1N)OC(C)C 7a_100011216113_100000210206 [0,1,0,0,0,1|2,0,0]=4 3618 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000210206_100000761890 [0,1,0,0,0,1|2,0,0]=4 3619 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000761890_100000210206 [0,1,0,0,0,1|2,0,0]=4 3620 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [0,1,0,0,0,1|2,0,0]=4 3621 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [0,1,0,0,0,1|2,0,0]=4 3622 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [0,1,0,0,0,1|2,0,0]=4 3623 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [0,1,0,0,0,1|2,0,0]=4 3624 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [0,1,0,0,0,1|2,0,0]=4 3625 B12R1.19 Cc1cnc(cc1Br)CN(C)C 270004a_100102631434_100010174032 [0,1,0,0,0,1|2,0,0]=4 3626 B12R1.19 Cc1nc(ccc1Br)CN(C)C 270004a_100102631434_100010238520 [0,1,0,0,0,1|2,0,0]=4 3627 B12R1.19 Cc1nc(ccc1O)OC(C)C 271570a_203496583355_200012350186 [0,1,0,0,0,1|2,0,0]=4 3628 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100000210206_100010233687 [0,1,0,0,0,1|2,0,0]=4 3629 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100010233687_100000210206 [0,1,0,0,0,1|2,0,0]=4 3630 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,1,0,0,0,1|2,0,0]=4 3631 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,1,0,0,0,1|2,0,0]=4 3632 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,1,0,0,0,1|2,0,0]=4 3633 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,1,0,0,0,1|2,0,0]=4 3634 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,1,0,0,0,1|2,0,0]=4 3635 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,1,0,0,0,1|2,0,0]=4 3636 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,1,0,0,0,1|2,0,0]=4 3637 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,1,0,0,0,1|2,0,0]=4 3638 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,1,0,0,0,1|2,0,0]=4 3639 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,1,0,0,0,1|1,0,0]=3 3640 B12R1.20 CC(=C(C)c1ccc(cn1)O)C 271570a_200000049429_100000685995 [0,1,0,0,0,1|2,0,0]=4 3641 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,1,0,0,0,1|2,0,0]=4 3642 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,1,0,0,0,1|2,0,0]=4 3643 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,1,0,0,0,1|2,0,0]=4 3644 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,1,0,0,0,1|2,0,0]=4 3645 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,1,0,0,0,1|2,0,0]=4 3646 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,1,0,0,0,1|2,0,0]=4 3647 B12R1.20 CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000210206 [0,1,0,0,0,1|2,0,0]=4 3648 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210206 [0,1,0,0,0,1|2,0,0]=4 3649 B12R1.20 CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000210206 [0,1,0,0,0,1|2,0,0]=4 3650 B12R1.20 CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000210206 [0,1,0,0,0,1|2,0,0]=4 3651 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,1,0,0,0,1|1,0,0]=3 3652 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,1,0,0,0,1|1,0,0]=3 3653 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219623_100000210206 [0,1,0,0,0,1|2,0,0]=4 3654 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219625_200000210301 [0,1,0,0,0,1|2,0,0]=4 3655 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219623_100000210206 [0,1,0,0,0,1|2,0,0]=4 3656 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219625_200000210301 [0,1,0,0,0,1|2,0,0]=4 3657 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219623_100000210206 [0,1,0,0,0,1|2,0,0]=4 3658 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219625_200000210301 [0,1,0,0,0,1|2,0,0]=4 3659 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 7a_100000219625_200000210301 [0,1,0,0,0,1|2,0,0]=4 3660 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100000749197_200000210301 [0,1,0,0,0,1|2,0,0]=4 3661 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100020629279_100000210206 [0,1,0,0,0,1|2,0,0]=4 3662 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100000749197_200000210301 [0,1,0,0,0,1|2,0,0]=4 3663 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100020629279_100000210206 [0,1,0,0,0,1|2,0,0]=4 3664 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100000749197_200000210301 [0,1,0,0,0,1|2,0,0]=4 3665 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100020629279_100000210206 [0,1,0,0,0,1|2,0,0]=4 3666 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 7a_100000749197_200000210301 [0,1,0,0,0,1|2,0,0]=4 3667 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219829_100000210206 [0,1,0,0,0,1|2,0,0]=4 3668 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219830_200000210301 [0,1,0,0,0,1|2,0,0]=4 3669 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219829_100000210206 [0,1,0,0,0,1|2,0,0]=4 3670 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219830_200000210301 [0,1,0,0,0,1|2,0,0]=4 3671 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219829_100000210206 [0,1,0,0,0,1|2,0,0]=4 3672 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219830_200000210301 [0,1,0,0,0,1|2,0,0]=4 3673 B12R1.20 CC(C)N(C)c1ccc(cc1)F 7a_100000219830_200000210301 [0,1,0,0,0,1|2,0,0]=4 3674 B12R1.20 CC(C)N(C)c1ccc(cc1)I 2230a_100000743151_100000210206 [0,1,0,0,0,1|2,0,0]=4 3675 B12R1.20 CC(C)N(C)c1ccc(cc1)I 269982a_100000743151_100000210206 [0,1,0,0,0,1|2,0,0]=4 3676 B12R1.20 CC(C)N(C)c1ccc(cc1)I 34a_100000743151_100000210206 [0,1,0,0,0,1|2,0,0]=4 3677 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [0,1,0,0,0,1|1,0,0]=3 3678 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [0,1,0,0,0,1|1,0,0]=3 3679 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 2230a_100000219625_200025704644 [0,1,0,0,0,1|2,0,0]=4 3680 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 269982a_100000219625_200025704644 [0,1,0,0,0,1|2,0,0]=4 3681 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 34a_100000219625_200025704644 [0,1,0,0,0,1|2,0,0]=4 3682 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 7a_100000219625_200025704644 [0,1,0,0,0,1|2,0,0]=4 3683 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 2230a_100000749197_200025704644 [0,1,0,0,0,1|2,0,0]=4 3684 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 269982a_100000749197_200025704644 [0,1,0,0,0,1|2,0,0]=4 3685 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 34a_100000749197_200025704644 [0,1,0,0,0,1|2,0,0]=4 3686 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 7a_100000749197_200025704644 [0,1,0,0,0,1|2,0,0]=4 3687 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 2230a_100000219830_200025704644 [0,1,0,0,0,1|2,0,0]=4 3688 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 269982a_100000219830_200025704644 [0,1,0,0,0,1|2,0,0]=4 3689 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 34a_100000219830_200025704644 [0,1,0,0,0,1|2,0,0]=4 3690 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 7a_100000219830_200025704644 [0,1,0,0,0,1|2,0,0]=4 3691 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,1,0,0,0,1|1,0,0]=3 3692 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,1,0,0,0,1|1,0,0]=3 3693 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100000231103_200000210301 [0,1,0,0,0,1|1,0,0]=3 3694 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100102631434_100000755118 [0,1,0,0,0,1|1,0,0]=3 3695 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100000231103_200000210301 [0,1,0,0,0,1|1,0,0]=3 3696 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100102631434_100000755118 [0,1,0,0,0,1|1,0,0]=3 3697 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 2230a_100000231103_200025704644 [0,1,0,0,0,1|1,0,0]=3 3698 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 269982a_100000231103_200025704644 [0,1,0,0,0,1|1,0,0]=3 3699 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100000231102_200000210301 [0,1,0,0,0,1|1,0,0]=3 3700 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100102631434_100000684792 [0,1,0,0,0,1|1,0,0]=3 3701 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100000231102_200000210301 [0,1,0,0,0,1|1,0,0]=3 3702 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100102631434_100000684792 [0,1,0,0,0,1|1,0,0]=3 3703 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 2230a_100000231102_200025704644 [0,1,0,0,0,1|1,0,0]=3 3704 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 269982a_100000231102_200025704644 [0,1,0,0,0,1|1,0,0]=3 3705 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100000222788_200000210301 [0,1,0,0,0,1|1,0,0]=3 3706 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100102631434_100000743420 [0,1,0,0,0,1|1,0,0]=3 3707 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100000222788_200000210301 [0,1,0,0,0,1|1,0,0]=3 3708 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100102631434_100000743420 [0,1,0,0,0,1|1,0,0]=3 3709 B12R1.20 CC(c1ccc(cc1)F)N(C)C 34a_100000222788_200000210301 [0,1,0,0,0,1|1,0,0]=3 3710 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 2230a_100000222788_200025704644 [0,1,0,0,0,1|1,0,0]=3 3711 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 269982a_100000222788_200025704644 [0,1,0,0,0,1|1,0,0]=3 3712 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 34a_100000222788_200025704644 [0,1,0,0,0,1|1,0,0]=3 3713 B12R1.20 CC(c1ccc(cn1)Br)N(C)C 270004a_100102631434_100000686046 [0,1,0,0,0,1|2,0,0]=4 3714 B12R1.20 CC(c1ccc(cn1)Cl)N(C)C 270004a_100102631434_100000692432 [0,1,0,0,0,1|2,0,0]=4 3715 B12R1.20 CC(c1ccc(cn1)F)N(C)C 270004a_100102631434_100102946652 [0,1,0,0,0,1|2,0,0]=4 3716 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 11a_100102631434_100000185839 [0,1,0,0,0,1|1,0,0]=3 3717 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 1626a_100102631434_100000185839 [0,1,0,0,0,1|1,0,0]=3 3718 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 240690a_100102631434_100000185839 [0,1,0,0,0,1|1,0,0]=3 3719 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 527a_100102631434_100000185839 [0,1,0,0,0,1|1,0,0]=3 3720 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 11a_100102631434_100000210187 [0,1,0,0,0,1|1,0,0]=3 3721 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 1626a_100102631434_100000210187 [0,1,0,0,0,1|1,0,0]=3 3722 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 240690a_100102631434_100000210187 [0,1,0,0,0,1|1,0,0]=3 3723 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 527a_100102631434_100000210187 [0,1,0,0,0,1|1,0,0]=3 3724 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 11a_100102631434_100000187176 [0,1,0,0,0,1|1,0,0]=3 3725 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 1626a_100102631434_100000187176 [0,1,0,0,0,1|1,0,0]=3 3726 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 240690a_100102631434_100000187176 [0,1,0,0,0,1|1,0,0]=3 3727 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 527a_100102631434_100000187176 [0,1,0,0,0,1|1,0,0]=3 3728 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 11a_100102631434_100000187904 [0,1,0,0,0,1|1,0,0]=3 3729 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 1626a_100102631434_100000187904 [0,1,0,0,0,1|1,0,0]=3 3730 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 240690a_100102631434_100000187904 [0,1,0,0,0,1|1,0,0]=3 3731 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 527a_100102631434_100000187904 [0,1,0,0,0,1|1,0,0]=3 3732 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,1,0,0,0,1|0,0,0]=2 3733 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,1,0,0,0,1|0,0,0]=2 3734 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,1,0,0,0,1|0,0,0]=2 3735 B12R1.20 CN(C)C(=O)c1ccc(cn1)O 271570a_203496583355_200011781295 [0,1,0,0,0,1|1,0,0]=3 3736 B12R1.20 CN(C)C(=O)c1ccc(nc1)O 271570a_203496583355_100000159593 [0,1,0,0,0,1|1,0,0]=3 3737 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,1,0,0,0,1|2,0,0]=4 3738 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000188618 [0,1,0,0,0,1|1,0,0]=3 3739 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000188618 [0,1,0,0,0,1|1,0,0]=3 3740 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000188618 [0,1,0,0,0,1|1,0,0]=3 3741 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000188618 [0,1,0,0,0,1|1,0,0]=3 3742 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [0,1,0,0,0,1|1,0,0]=3 3743 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [0,1,0,0,0,1|1,0,0]=3 3744 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000219977_100000210206 [0,1,0,0,0,1|2,0,0]=4 3745 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000748792_200000210301 [0,1,0,0,0,1|2,0,0]=4 3746 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000219977_100000210206 [0,1,0,0,0,1|2,0,0]=4 3747 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000748792_200000210301 [0,1,0,0,0,1|2,0,0]=4 3748 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000219977_100000210206 [0,1,0,0,0,1|2,0,0]=4 3749 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000748792_200000210301 [0,1,0,0,0,1|2,0,0]=4 3750 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 7a_100000748792_200000210301 [0,1,0,0,0,1|2,0,0]=4 3751 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 2230a_100000748792_200025704644 [0,1,0,0,0,1|2,0,0]=4 3752 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 269982a_100000748792_200025704644 [0,1,0,0,0,1|2,0,0]=4 3753 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 34a_100000748792_200025704644 [0,1,0,0,0,1|2,0,0]=4 3754 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 7a_100000748792_200025704644 [0,1,0,0,0,1|2,0,0]=4 3755 B12R1.20 Cc1ccc(nc1)C(C)N(C)C 270004a_100102631434_100000084104 [0,1,0,0,0,1|2,0,0]=4 3756 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,1,0,0,0,1|2,0,0]=4 3757 B12R1.49 C#CC(C)Nc1ccc(cc1)O 34a_100000185829_200000035995 [0,1,0,0,0,1|1,0,1]=4 3758 B12R1.49 C#CC(C)Sc1ccc(cc1)O 62a_200000035995_100000185759 [0,1,0,0,0,1|1,0,1]=4 3759 B12R1.49 C=CC(C)Sc1ccc(cc1)O 62a_100011215867_100000185759 [0,1,0,0,0,1|1,0,1]=4 3760 B12R1.49 CC(C#N)Sc1ccc(cc1)O 62a_100000703298_100000185759 [0,1,0,0,0,1|1,0,1]=4 3761 B12R1.49 CC(CO)Nc1ccc(cc1)Br 2230a_100000210018_100012180447 [0,1,0,0,0,1|2,0,0]=4 3762 B12R1.49 CC(CO)Nc1ccc(cc1)Br 34a_100000210018_100012180447 [0,1,0,0,0,1|2,0,0]=4 3763 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 2230a_100000210052_100012180447 [0,1,0,0,0,1|2,0,0]=4 3764 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 34a_100000210052_100012180447 [0,1,0,0,0,1|2,0,0]=4 3765 B12R1.49 CC(CO)Nc1ccc(cc1)F 34a_100000185862_100012180447 [0,1,0,0,0,1|2,0,0]=4 3766 B12R1.49 CC(CO)Nc1ccc(cc1)I 34a_100000185761_100012180447 [0,1,0,0,0,1|2,0,0]=4 3767 B12R1.49 CC(CO)Nc1ccc(cc1)O 34a_100000185829_100012180447 [0,1,0,0,0,1|1,0,0]=3 3768 B12R1.49 CC(CO)Oc1ccc(cc1)Br 34a_100000185759_100012180447 [0,1,0,0,0,1|2,0,0]=4 3769 B12R1.49 CC(CO)Oc1ccc(cc1)Br 7a_100000185759_100012180447 [0,1,0,0,0,1|2,0,0]=4 3770 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 34a_100000210216_100012180447 [0,1,0,0,0,1|2,0,0]=4 3771 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 7a_100000210216_100012180447 [0,1,0,0,0,1|2,0,0]=4 3772 B12R1.49 CC(CO)Oc1ccc(cc1)F 34a_100000210339_100012180447 [0,1,0,0,0,1|2,0,0]=4 3773 B12R1.49 CC(CO)Oc1ccc(cc1)I 34a_100000212066_100012180447 [0,1,0,0,0,1|2,0,0]=4 3774 B12R1.49 CC(CO)Oc1ccc(cc1)I 7a_100000212066_100012180447 [0,1,0,0,0,1|2,0,0]=4 3775 B12R1.49 CC(CO)Oc1ccc(cc1)N 34a_100000185829_100012180447 [0,1,0,0,0,1|2,0,0]=4 3776 B12R1.49 CC(CO)Sc1ccc(cc1)Br 62a_100012180447_100000752885 [0,1,0,0,0,1|2,0,0]=4 3777 B12R1.49 CC(CO)Sc1ccc(cc1)Cl 62a_100012180447_100000755918 [0,1,0,0,0,1|2,0,0]=4 3778 B12R1.49 CC(CO)Sc1ccc(cc1)F 62a_100012180447_100000211213 [0,1,0,0,0,1|2,0,0]=4 3779 B12R1.49 CC(CO)Sc1ccc(cc1)N 62a_100012180447_100000185761 [0,1,0,0,0,1|2,0,0]=4 3780 B12R1.49 CC(CO)Sc1ccc(cc1)O 62a_100012180447_100000185759 [0,1,0,0,0,1|1,0,0]=3 3781 B12R1.49 CC(CO)Sc1ccc(cn1)O 62a_100012180447_100000744096 [0,1,0,0,0,1|2,0,0]=4 3782 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [0,1,0,0,0,1|2,0,0]=4 3783 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [0,1,0,0,0,1|2,0,0]=4 3784 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,1,0,0,0,1|1,0,0]=3 3785 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,1,0,0,0,1|1,0,0]=3 3786 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,1,0,0,0,1|2,0,0]=4 3787 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,1,0,0,0,1|2,0,0]=4 3788 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,1,0,0,0,1|2,0,0]=4 3789 B12R1.49 CCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000758301 [0,1,0,0,0,1|2,0,0]=4 3790 B12R1.49 CCC(C)Nc1ccc(cc1)Br 34a_100000210018_100011215416 [0,1,0,0,0,1|2,0,0]=4 3791 B12R1.49 CCC(C)Nc1ccc(cc1)C 34a_100000124888_100011215416 [0,1,0,0,0,1|2,0,0]=4 3792 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000758301 [0,1,0,0,0,1|2,0,0]=4 3793 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100011215416 [0,1,0,0,0,1|2,0,0]=4 3794 B12R1.49 CCC(C)Nc1ccc(cc1)F 34a_100000185862_100011215416 [0,1,0,0,0,1|2,0,0]=4 3795 B12R1.49 CCC(C)Nc1ccc(cc1)I 34a_100000185761_100011215416 [0,1,0,0,0,1|2,0,0]=4 3796 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [0,1,0,0,0,1|1,0,0]=3 3797 B12R1.49 CCC(C)Oc1ccc(cc1)Br 34a_100000185759_100011215416 [0,1,0,0,0,1|2,0,0]=4 3798 B12R1.49 CCC(C)Oc1ccc(cc1)Br 7a_100000185759_100000758301 [0,1,0,0,0,1|2,0,0]=4 3799 B12R1.49 CCC(C)Oc1ccc(cc1)C 34a_100000210336_100011215416 [0,1,0,0,0,1|2,0,0]=4 3800 B12R1.49 CCC(C)Oc1ccc(cc1)C 7a_100000210336_100000758301 [0,1,0,0,0,1|2,0,0]=4 3801 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 34a_100000210216_100011215416 [0,1,0,0,0,1|2,0,0]=4 3802 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000758301 [0,1,0,0,0,1|2,0,0]=4 3803 B12R1.49 CCC(C)Oc1ccc(cc1)F 34a_100000210339_100011215416 [0,1,0,0,0,1|2,0,0]=4 3804 B12R1.49 CCC(C)Oc1ccc(cc1)I 34a_100000212066_100011215416 [0,1,0,0,0,1|2,0,0]=4 3805 B12R1.49 CCC(C)Oc1ccc(cc1)I 7a_100000212066_100000758301 [0,1,0,0,0,1|2,0,0]=4 3806 B12R1.49 CCC(C)Oc1ccc(cc1)N 34a_100000185829_100011215416 [0,1,0,0,0,1|2,0,0]=4 3807 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000752885_100000758301 [0,1,0,0,0,1|2,0,0]=4 3808 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000758301_100000752885 [0,1,0,0,0,1|2,0,0]=4 3809 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000186775_100000758301 [0,1,0,0,0,1|2,0,0]=4 3810 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000758301_100000186775 [0,1,0,0,0,1|2,0,0]=4 3811 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000758301 [0,1,0,0,0,1|2,0,0]=4 3812 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000758301_100000755918 [0,1,0,0,0,1|2,0,0]=4 3813 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000211213_100000758301 [0,1,0,0,0,1|2,0,0]=4 3814 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000758301_100000211213 [0,1,0,0,0,1|2,0,0]=4 3815 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000185761_100000758301 [0,1,0,0,0,1|2,0,0]=4 3816 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000758301_100000185761 [0,1,0,0,0,1|2,0,0]=4 3817 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [0,1,0,0,0,1|1,0,0]=3 3818 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000685995_100000758301 [0,1,0,0,0,1|2,0,0]=4 3819 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000758301_100000744096 [0,1,0,0,0,1|2,0,0]=4 3820 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210202 [0,1,0,0,0,1|1,0,0]=3 3821 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000187385_200000210301 [0,1,0,0,0,1|1,0,0]=3 3822 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000225621_100011217064 [0,1,0,0,0,1|1,0,0]=3 3823 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000204670 [0,1,0,0,0,1|1,0,0]=3 3824 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000187385_200000210301 [0,1,0,0,0,1|1,0,0]=3 3825 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000225621_100011217064 [0,1,0,0,0,1|1,0,0]=3 3826 B12R1.49 CCN(C)Cc1ccc(cc1)Br 26a_100000225621_100000185759 [0,1,0,0,0,1|1,0,0]=3 3827 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [0,1,0,0,0,1|1,0,0]=3 3828 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [0,1,0,0,0,1|1,0,0]=3 3829 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [0,1,0,0,0,1|1,0,0]=3 3830 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [0,1,0,0,0,1|1,0,0]=3 3831 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [0,1,0,0,0,1|1,0,0]=3 3832 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [0,1,0,0,0,1|1,0,0]=3 3833 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [0,1,0,0,0,1|1,0,0]=3 3834 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [0,1,0,0,0,1|1,0,0]=3 3835 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000180830_200000210301 [0,1,0,0,0,1|1,0,0]=3 3836 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210202 [0,1,0,0,0,1|1,0,0]=3 3837 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000225621_100000694040 [0,1,0,0,0,1|1,0,0]=3 3838 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000180830_200000210301 [0,1,0,0,0,1|1,0,0]=3 3839 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000204670 [0,1,0,0,0,1|1,0,0]=3 3840 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000225621_100000187161 [0,1,0,0,0,1|1,0,0]=3 3841 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000210202 [0,1,0,0,0,1|1,0,0]=3 3842 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210202 [0,1,0,0,0,1|1,0,0]=3 3843 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000225621_100000198546 [0,1,0,0,0,1|1,0,0]=3 3844 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100015183324_200000210301 [0,1,0,0,0,1|1,0,0]=3 3845 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000204670 [0,1,0,0,0,1|1,0,0]=3 3846 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000225621_100000198546 [0,1,0,0,0,1|1,0,0]=3 3847 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100015183324_200000210301 [0,1,0,0,0,1|1,0,0]=3 3848 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100000184576_100000210202 [0,1,0,0,0,1|1,0,0]=3 3849 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100015183324_200000210301 [0,1,0,0,0,1|1,0,0]=3 3850 B12R1.49 CCN(C)Cc1ccc(cc1)I 2230a_100000225621_100000189116 [0,1,0,0,0,1|1,0,0]=3 3851 B12R1.49 CCN(C)Cc1ccc(cc1)I 269982a_100000225621_100000189116 [0,1,0,0,0,1|1,0,0]=3 3852 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [0,1,0,0,0,1|0,0,0]=2 3853 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [0,1,0,0,0,1|0,0,0]=2 3854 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [0,1,0,0,0,1|0,0,0]=2 3855 B12R1.49 CCN(C)Cc1ccc(cn1)Br 2230a_100000225621_100000702658 [0,1,0,0,0,1|2,0,0]=4 3856 B12R1.49 CCN(C)Cc1ccc(cn1)Br 269982a_100000225621_100000702658 [0,1,0,0,0,1|2,0,0]=4 3857 B12R1.49 CCN(C)Cc1ccc(cn1)C 2230a_100000225621_100000691093 [0,1,0,0,0,1|2,0,0]=4 3858 B12R1.49 CCN(C)Cc1ccc(cn1)C 2230a_200000717808_100000210202 [0,1,0,0,0,1|2,0,0]=4 3859 B12R1.49 CCN(C)Cc1ccc(cn1)C 269982a_100000225621_100000691093 [0,1,0,0,0,1|2,0,0]=4 3860 B12R1.49 CCN(C)Cc1ccc(cn1)C 269982a_200000717808_100000204670 [0,1,0,0,0,1|2,0,0]=4 3861 B12R1.49 CCN(C)Cc1ccc(cn1)Cl 2230a_100000225621_100012066911 [0,1,0,0,0,1|2,0,0]=4 3862 B12R1.49 CCN(C)Cc1ccc(cn1)Cl 269982a_100000225621_100000697101 [0,1,0,0,0,1|2,0,0]=4 3863 B12R1.49 CCN(C)Cc1ccc(cn1)F 2230a_100000225621_100000703193 [0,1,0,0,0,1|2,0,0]=4 3864 B12R1.49 CCN(C)Cc1ccc(cn1)F 269982a_100000225621_100000703193 [0,1,0,0,0,1|2,0,0]=4 3865 B12R1.49 CCN(C)Cc1ccc(nc1)Br 2230a_100000225621_100009831999 [0,1,0,0,0,1|2,0,0]=4 3866 B12R1.49 CCN(C)Cc1ccc(nc1)Br 269982a_100000225621_100009831999 [0,1,0,0,0,1|2,0,0]=4 3867 B12R1.49 CCN(C)Cc1ccc(nc1)C 2230a_100000225621_100016987292 [0,1,0,0,0,1|2,0,0]=4 3868 B12R1.49 CCN(C)Cc1ccc(nc1)C 2230a_106623407658_100000210202 [0,1,0,0,0,1|2,0,0]=4 3869 B12R1.49 CCN(C)Cc1ccc(nc1)C 269982a_100000225621_100016987292 [0,1,0,0,0,1|2,0,0]=4 3870 B12R1.49 CCN(C)Cc1ccc(nc1)C 269982a_106623407658_100000204670 [0,1,0,0,0,1|2,0,0]=4 3871 B12R1.49 CCN(C)Cc1ccc(nc1)C 34a_106623407658_100000210202 [0,1,0,0,0,1|2,0,0]=4 3872 B12R1.49 CCN(C)Cc1ccc(nc1)Cl 2230a_100000026953_100000210202 [0,1,0,0,0,1|2,0,0]=4 3873 B12R1.49 CCN(C)Cc1ccc(nc1)Cl 2230a_100000225621_100000735431 [0,1,0,0,0,1|2,0,0]=4 3874 B12R1.49 CCN(C)Cc1ccc(nc1)Cl 269982a_100000026953_100000204670 [0,1,0,0,0,1|2,0,0]=4 3875 B12R1.49 CCN(C)Cc1ccc(nc1)Cl 269982a_100000225621_100000735431 [0,1,0,0,0,1|2,0,0]=4 3876 B12R1.49 CCN(C)Cc1ccc(nc1)Cl 34a_100000026953_100000210202 [0,1,0,0,0,1|2,0,0]=4 3877 B12R1.49 CCN(C)Cc1ccc(nc1)F 2230a_100000225621_100009820150 [0,1,0,0,0,1|2,0,0]=4 3878 B12R1.49 CCN(C)Cc1ccc(nc1)F 269982a_100000225621_100009820150 [0,1,0,0,0,1|2,0,0]=4 3879 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 2230a_100000187385_200025704644 [0,1,0,0,0,1|1,0,0]=3 3880 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 269982a_100000187385_200025704644 [0,1,0,0,0,1|1,0,0]=3 3881 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [0,1,0,0,0,1|1,0,0]=3 3882 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [0,1,0,0,0,1|1,0,0]=3 3883 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 2230a_100000180830_200025704644 [0,1,0,0,0,1|1,0,0]=3 3884 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 269982a_100000180830_200025704644 [0,1,0,0,0,1|1,0,0]=3 3885 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 2230a_100015183324_200025704644 [0,1,0,0,0,1|1,0,0]=3 3886 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 269982a_100015183324_200025704644 [0,1,0,0,0,1|1,0,0]=3 3887 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 34a_100015183324_200025704644 [0,1,0,0,0,1|1,0,0]=3 3888 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [0,1,0,0,0,1|0,0,0]=2 3889 B12R1.49 CN(CF)Cc1ccc(cc1)Br 269982a_100000180866_100015361967 [0,1,0,0,0,1|1,0,0]=3 3890 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 269982a_100000184517_100015361967 [0,1,0,0,0,1|1,0,0]=3 3891 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 34a_100000184517_100015361967 [0,1,0,0,0,1|1,0,0]=3 3892 B12R1.49 CN(CF)Cc1ccc(cc1)F 269982a_100000184576_100015361967 [0,1,0,0,0,1|1,0,0]=3 3893 B12R1.49 CN(CF)Cc1ccc(cc1)F 34a_100000184576_100015361967 [0,1,0,0,0,1|1,0,0]=3 3894 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [0,1,0,0,0,1|0,0,0]=2 3895 B12R1.49 CN(CF)Cc1ccc(nc1)Cl 269982a_100000026953_100015361967 [0,1,0,0,0,1|2,0,0]=4 3896 B12R1.49 CN(CF)Cc1ccc(nc1)Cl 34a_100000026953_100015361967 [0,1,0,0,0,1|2,0,0]=4 3897 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,1,0,0,0,1|2,0,0]=4 3898 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,1,0,0,0,1|2,0,0]=4 3899 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,1,0,0,0,1|2,0,0]=4 3900 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,1,0,0,0,1|2,0,0]=4 3901 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,1,0,0,0,1|2,0,0]=4 3902 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [0,1,0,0,0,1|2,0,0]=4 3903 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [0,1,0,0,0,1|2,0,0]=4 3904 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [0,1,0,0,0,1|2,0,0]=4 3905 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [0,1,0,0,0,1|2,0,0]=4 3906 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,1,0,0,0,1|1,0,0]=3 3907 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,1,0,0,0,1|1,0,0]=3 3908 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,1,0,0,0,1|1,0,0]=3 3909 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,1,0,0,0,1|2,0,0]=4 3910 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,1,0,0,0,1|2,0,0]=4 3911 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [0,1,0,0,0,1|2,0,0]=4 3912 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [0,1,0,0,0,1|2,0,0]=4 3913 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100000752885_100009879195 [0,1,0,0,0,1|2,0,0]=4 3914 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100009879195_100000752885 [0,1,0,0,0,1|2,0,0]=4 3915 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100000186775_100009879195 [0,1,0,0,0,1|2,0,0]=4 3916 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100009879195_100000186775 [0,1,0,0,0,1|2,0,0]=4 3917 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100000755918_100009879195 [0,1,0,0,0,1|2,0,0]=4 3918 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100009879195_100000755918 [0,1,0,0,0,1|2,0,0]=4 3919 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100000211213_100009879195 [0,1,0,0,0,1|2,0,0]=4 3920 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100009879195_100000211213 [0,1,0,0,0,1|2,0,0]=4 3921 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100000185761_100009879195 [0,1,0,0,0,1|2,0,0]=4 3922 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100009879195_100000185761 [0,1,0,0,0,1|2,0,0]=4 3923 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [0,1,0,0,0,1|1,0,0]=3 3924 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100000685995_100009879195 [0,1,0,0,0,1|2,0,0]=4 3925 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100009879195_100000744096 [0,1,0,0,0,1|2,0,0]=4 3926 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100000752885_100016084084 [0,1,0,0,0,1|2,0,0]=4 3927 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100016084084_100000752885 [0,1,0,0,0,1|2,0,0]=4 3928 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100000755918_100016084084 [0,1,0,0,0,1|2,0,0]=4 3929 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100016084084_100000755918 [0,1,0,0,0,1|2,0,0]=4 3930 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100000211213_100016084084 [0,1,0,0,0,1|2,0,0]=4 3931 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100016084084_100000211213 [0,1,0,0,0,1|2,0,0]=4 3932 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100000185761_100016084084 [0,1,0,0,0,1|2,0,0]=4 3933 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100016084084_100000185761 [0,1,0,0,0,1|2,0,0]=4 3934 B12R1.49 C[C@H](CO)Sc1ccc(cc1)O 62a_100016084084_100000185759 [0,1,0,0,0,1|1,0,0]=3 3935 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100000685995_100016084084 [0,1,0,0,0,1|2,0,0]=4 3936 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100016084084_100000744096 [0,1,0,0,0,1|2,0,0]=4 3937 B12R1.49 Cc1ccc(cc1)CN(C)CF 269982a_100000744650_100015361967 [0,1,0,0,0,1|1,0,0]=3 3938 B12R1.49 Cc1ccc(cc1)CN(C)CF 34a_100000744650_100015361967 [0,1,0,0,0,1|1,0,0]=3 3939 B12R1.49 Cc1ccc(cc1)NC(C)CO 34a_100000124888_100012180447 [0,1,0,0,0,1|2,0,0]=4 3940 B12R1.49 Cc1ccc(cc1)OC(C)CO 34a_100000210336_100012180447 [0,1,0,0,0,1|2,0,0]=4 3941 B12R1.49 Cc1ccc(cc1)OC(C)CO 7a_100000210336_100012180447 [0,1,0,0,0,1|2,0,0]=4 3942 B12R1.49 Cc1ccc(cc1)SC(C)CO 62a_100012180447_100000186775 [0,1,0,0,0,1|2,0,0]=4 3943 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100000186775_100016084084 [0,1,0,0,0,1|2,0,0]=4 3944 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000186775 [0,1,0,0,0,1|2,0,0]=4 3945 B12R1.49 Cc1ccc(cn1)CN(C)CF 269982a_106623407658_100015361967 [0,1,0,0,0,1|2,0,0]=4 3946 B12R1.49 Cc1ccc(cn1)CN(C)CF 34a_106623407658_100015361967 [0,1,0,0,0,1|2,0,0]=4 3947 B12R1.49 Cc1ccc(nc1)CN(C)CF 269982a_200000717808_100015361967 [0,1,0,0,0,1|2,0,0]=4 3948 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,1,0,0,0,1|2,0,0]=4 3949 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,1,0,0,0,1|2,0,0]=4 3950 B12R1.106 CC(C)(C)Nc1ccc(cc1)Br 34a_100000210018_100000210625 [0,1,0,0,0,1|2,0,0]=4 3951 B12R1.106 CC(C)(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210625 [0,1,0,0,0,1|2,0,0]=4 3952 B12R1.106 CC(C)(C)Nc1ccc(cc1)F 34a_100000185862_100000210625 [0,1,0,0,0,1|2,0,0]=4 3953 B12R1.106 CC(C)(C)Nc1ccc(cc1)I 34a_100000185761_100000210625 [0,1,0,0,0,1|2,0,0]=4 3954 B12R1.106 CC(C)(C)Nc1ccc(cc1)O 34a_100000185829_100000210625 [0,1,0,0,0,1|1,0,0]=3 3955 B12R1.106 CC(C)(C)Oc1ccc(cc1)Br 34a_100000185759_100000210625 [0,1,0,0,0,1|2,0,0]=4 3956 B12R1.106 CC(C)(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210625 [0,1,0,0,0,1|2,0,0]=4 3957 B12R1.106 CC(C)(C)Oc1ccc(cc1)F 34a_100000210339_100000210625 [0,1,0,0,0,1|2,0,0]=4 3958 B12R1.106 CC(C)(C)Oc1ccc(cc1)I 34a_100000212066_100000210625 [0,1,0,0,0,1|2,0,0]=4 3959 B12R1.106 CC(C)(C)Oc1ccc(cc1)N 34a_100000185829_100000210625 [0,1,0,0,0,1|2,0,0]=4 3960 B12R1.106 CC(C)(C)Oc1ccc(cc1)O 271570a_203496583355_100000701926 [0,1,0,0,0,1|1,0,0]=3 3961 B12R1.106 CC(C)(C)Oc1ccc(cn1)O 271570a_203496583355_200000688780 [0,1,0,0,0,1|2,0,0]=4 3962 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000211941_100000752885 [0,1,0,0,0,1|2,0,0]=4 3963 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000211941 [0,1,0,0,0,1|2,0,0]=4 3964 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000211941_100000755918 [0,1,0,0,0,1|2,0,0]=4 3965 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000211941 [0,1,0,0,0,1|2,0,0]=4 3966 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000211941 [0,1,0,0,0,1|2,0,0]=4 3967 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211941_100000211213 [0,1,0,0,0,1|2,0,0]=4 3968 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000211941 [0,1,0,0,0,1|2,0,0]=4 3969 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000211941_100000185761 [0,1,0,0,0,1|2,0,0]=4 3970 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 271570a_203496583355_200009816747 [0,1,0,0,0,1|1,0,0]=3 3971 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 62a_100000211941_100000185759 [0,1,0,0,0,1|1,0,0]=3 3972 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000211941_100000744096 [0,1,0,0,0,1|2,0,0]=4 3973 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000685995_100000211941 [0,1,0,0,0,1|2,0,0]=4 3974 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [0,1,0,0,0,1|2,0,0]=4 3975 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [0,1,0,0,0,1|2,0,0]=4 3976 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O 271570a_203496583355_200000165602 [0,1,0,0,0,1|2,0,0]=4 3977 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [0,1,0,0,0,1|1,0,0]=3 3978 B12R1.106 C[Si](C)(C)Oc1ccc(cc1)O 271570a_203496583355_100009813852 [0,1,0,0,0,1|1,0,0]=3 3979 B12R1.106 Cc1ccc(cc1)NC(C)(C)C 34a_100000124888_100000210625 [0,1,0,0,0,1|2,0,0]=4 3980 B12R1.106 Cc1ccc(cc1)OC(C)(C)C 34a_100000210336_100000210625 [0,1,0,0,0,1|2,0,0]=4 3981 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000186775_100000211941 [0,1,0,0,0,1|2,0,0]=4 3982 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000186775 [0,1,0,0,0,1|2,0,0]=4 3983 B12R1.233 CC(=Cc1ccc(cc1Br)Br)C 271570a_100102525489_100011484698 [0,1,0,0,0,1|2,0,0]=4 3984 B12R1.233 CC(=Cc1ccc(cc1Br)C)C 271570a_100102525489_100009813563 [0,1,0,0,0,1|2,0,0]=4 3985 B12R1.233 CC(=Cc1ccc(cc1Br)Cl)C 271570a_100102525489_100011219703 [0,1,0,0,0,1|2,0,0]=4 3986 B12R1.233 CC(=Cc1ccc(cc1Br)F)C 271570a_100102525489_100011217111 [0,1,0,0,0,1|2,0,0]=4 3987 B12R1.233 CC(=Cc1ccc(cc1Br)N)C 271570a_100102525489_100000750458 [0,1,0,0,0,1|2,0,0]=4 3988 B12R1.233 CC(=Cc1ccc(cc1Br)O)C 271570a_100102525489_100000701344 [0,1,0,0,0,1|1,0,0]=3 3989 B12R1.233 CC(=Cc1ccc(cc1C)Br)C 271570a_100102525489_100000701812 [0,1,0,0,0,1|2,0,0]=4 3990 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [0,1,0,0,0,1|2,0,0]=4 3991 B12R1.233 CC(=Cc1ccc(cc1C)Cl)C 271570a_100102525489_100011219607 [0,1,0,0,0,1|2,0,0]=4 3992 B12R1.233 CC(=Cc1ccc(cc1C)F)C 271570a_100102525489_100011205405 [0,1,0,0,0,1|2,0,0]=4 3993 B12R1.233 CC(=Cc1ccc(cc1C)N)C 271570a_100102525489_100000210723 [0,1,0,0,0,1|2,0,0]=4 3994 B12R1.233 CC(=Cc1ccc(cc1C)O)C 271570a_100102525489_100000729255 [0,1,0,0,0,1|1,0,0]=3 3995 B12R1.233 CC(=Cc1ccc(cc1Cl)Br)C 271570a_100102525489_100011216062 [0,1,0,0,0,1|2,0,0]=4 3996 B12R1.233 CC(=Cc1ccc(cc1Cl)C)C 271570a_100102525489_100011263221 [0,1,0,0,0,1|2,0,0]=4 3997 B12R1.233 CC(=Cc1ccc(cc1Cl)Cl)C 271570a_100102525489_100000699841 [0,1,0,0,0,1|2,0,0]=4 3998 B12R1.233 CC(=Cc1ccc(cc1Cl)F)C 271570a_100102525489_100000733362 [0,1,0,0,0,1|2,0,0]=4 3999 B12R1.233 CC(=Cc1ccc(cc1Cl)N)C 271570a_100102525489_100000761885 [0,1,0,0,0,1|2,0,0]=4 4000 B12R1.233 CC(=Cc1ccc(cc1Cl)O)C 271570a_100102525489_100000047559 [0,1,0,0,0,1|1,0,0]=3 4001 B12R1.233 CC(=Cc1ccc(cc1F)Br)C 271570a_100102525489_100009814013 [0,1,0,0,0,1|2,0,0]=4 4002 B12R1.233 CC(=Cc1ccc(cc1F)C)C 271570a_100102525489_100011216119 [0,1,0,0,0,1|2,0,0]=4 4003 B12R1.233 CC(=Cc1ccc(cc1F)Cl)C 271570a_100102525489_100011216042 [0,1,0,0,0,1|2,0,0]=4 4004 B12R1.233 CC(=Cc1ccc(cc1F)F)C 271570a_100102525489_100000750030 [0,1,0,0,0,1|2,0,0]=4 4005 B12R1.233 CC(=Cc1ccc(cc1F)N)C 271570a_100102525489_100011356925 [0,1,0,0,0,1|2,0,0]=4 4006 B12R1.233 CC(=Cc1ccc(cc1F)O)C 271570a_100102525489_100000755031 [0,1,0,0,0,1|1,0,0]=3 4007 B12R1.233 CC(=Cc1ccc(cc1N)Br)C 271570a_100102525489_100000743836 [0,1,0,0,0,1|2,0,0]=4 4008 B12R1.233 CC(=Cc1ccc(cc1N)C)C 271570a_100102525489_100011216686 [0,1,0,0,0,1|2,0,0]=4 4009 B12R1.233 CC(=Cc1ccc(cc1N)Cl)C 271570a_100102525489_100000761886 [0,1,0,0,0,1|2,0,0]=4 4010 B12R1.233 CC(=Cc1ccc(cc1N)F)C 271570a_100102525489_100011218093 [0,1,0,0,0,1|2,0,0]=4 4011 B12R1.233 CC(=Cc1ccc(cc1N)N)C 271570a_100102525489_200012175722 [0,1,0,0,0,1|2,0,0]=4 4012 B12R1.233 CC(=Cc1ccc(cc1N)O)C 271570a_100102525489_100011999798 [0,1,0,0,0,1|1,0,0]=3 4013 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,1,0,0,0,1|2,0,0]=4 4014 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,1,0,0,0,1|2,0,0]=4 4015 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,1,0,0,0,1|2,0,0]=4 4016 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,1,0,0,0,1|2,0,0]=4 4017 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,1,0,0,0,1|1,0,0]=3 4018 B12R1.233 CC(=Cc1ccc(nc1C)O)C 271570a_100102525489_100000691680 [0,1,0,0,0,1|2,0,0]=4 4019 B12R1.233 CC(=Cc1ccc(nc1F)O)C 271570a_100102525489_100009879308 [0,1,0,0,0,1|2,0,0]=4 4020 B12R1.233 CC(=Cc1cnc(cc1C)O)C 271570a_100102525489_100010114363 [0,1,0,0,0,1|2,0,0]=4 4021 B12R1.233 CC(=Cc1ncc(cc1C)O)C 271570a_100102525489_100012000486 [0,1,0,0,0,1|2,0,0]=4 4022 B12R1.233 CC(=Cc1ncc(cc1F)O)C 271570a_100102525489_100000063512 [0,1,0,0,0,1|2,0,0]=4 4023 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,1,0,0,0,1|2,0,0]=4 4024 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,1,0,0,0,1|2,0,0]=4 4025 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [0,1,0,0,0,1|2,0,0]=4 4026 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [0,1,0,0,0,1|2,0,0]=4 4027 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [0,1,0,0,0,1|2,0,0]=4 4028 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [0,1,0,0,0,1|2,0,0]=4 4029 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [0,1,0,0,0,1|2,0,0]=4 4030 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [0,1,0,0,0,1|2,0,0]=4 4031 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [0,1,0,0,0,1|2,0,0]=4 4032 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [0,1,0,0,0,1|2,0,0]=4 4033 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [0,1,0,0,0,1|2,0,0]=4 4034 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [0,1,0,0,0,1|2,0,0]=4 4035 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [0,1,0,0,0,1|2,0,0]=4 4036 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [0,1,0,0,0,1|2,0,0]=4 4037 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [0,1,0,0,0,1|2,0,0]=4 4038 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [0,1,0,0,0,1|2,0,0]=4 4039 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,1,0,0,0,1|2,0,0]=4 4040 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,1,0,0,0,1|2,0,0]=4 4041 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [0,1,0,0,0,1|2,0,0]=4 4042 B12R1.233 CC(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000210206 [0,1,0,0,0,1|2,0,0]=4 4043 B12R1.233 CC(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000210206 [0,1,0,0,0,1|2,0,0]=4 4044 B12R1.233 CC(C)Nc1ccc(cc1Br)F 34a_100000738039_100000210206 [0,1,0,0,0,1|2,0,0]=4 4045 B12R1.233 CC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210206 [0,1,0,0,0,1|1,0,0]=3 4046 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000210206 [0,1,0,0,0,1|2,0,0]=4 4047 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000210206 [0,1,0,0,0,1|2,0,0]=4 4048 B12R1.233 CC(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000210206 [0,1,0,0,0,1|2,0,0]=4 4049 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000210206 [0,1,0,0,0,1|2,0,0]=4 4050 B12R1.233 CC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210206 [0,1,0,0,0,1|1,0,0]=3 4051 B12R1.233 CC(C)Nc1ccc(cc1F)Br 34a_100000210722_100000210206 [0,1,0,0,0,1|2,0,0]=4 4052 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000210206 [0,1,0,0,0,1|2,0,0]=4 4053 B12R1.233 CC(C)Nc1ccc(cc1F)F 34a_100000210720_100000210206 [0,1,0,0,0,1|2,0,0]=4 4054 B12R1.233 CC(C)Nc1ccc(cc1F)I 34a_100011215594_100000210206 [0,1,0,0,0,1|2,0,0]=4 4055 B12R1.233 CC(C)Nc1ccc(cc1F)O 34a_100000759473_100000210206 [0,1,0,0,0,1|1,0,0]=3 4056 B12R1.233 CC(C)Nc1ccc(cc1I)Br 34a_100000187925_100000210206 [0,1,0,0,0,1|2,0,0]=4 4057 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000210206 [0,1,0,0,0,1|2,0,0]=4 4058 B12R1.233 CC(C)Nc1ccc(cc1I)F 34a_100000760547_100000210206 [0,1,0,0,0,1|2,0,0]=4 4059 B12R1.233 CC(C)Nc1ccc(cc1I)O 34a_100010084370_100000210206 [0,1,0,0,0,1|1,0,0]=3 4060 B12R1.233 CC(C)Nc1ccc(cc1O)Br 34a_100000739049_100000210206 [0,1,0,0,0,1|2,0,0]=4 4061 B12R1.233 CC(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000210206 [0,1,0,0,0,1|2,0,0]=4 4062 B12R1.233 CC(C)Nc1ccc(cc1O)F 34a_100000753323_100000210206 [0,1,0,0,0,1|2,0,0]=4 4063 B12R1.233 CC(C)Nc1ccc(cc1O)O 34a_100000106777_100000210206 [0,1,0,0,0,1|1,0,0]=3 4064 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 34a_100000188717_100000210206 [0,1,0,0,0,1|2,0,0]=4 4065 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 7a_100000188717_100000210206 [0,1,0,0,0,1|2,0,0]=4 4066 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 34a_100000211998_100000210206 [0,1,0,0,0,1|2,0,0]=4 4067 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl 7a_100000211998_100000210206 [0,1,0,0,0,1|2,0,0]=4 4068 B12R1.233 CC(C)Oc1ccc(cc1Br)F 34a_100000211999_100000210206 [0,1,0,0,0,1|2,0,0]=4 4069 B12R1.233 CC(C)Oc1ccc(cc1Br)F 7a_100000211999_100000210206 [0,1,0,0,0,1|2,0,0]=4 4070 B12R1.233 CC(C)Oc1ccc(cc1Br)I 34a_100012361655_100000210206 [0,1,0,0,0,1|2,0,0]=4 4071 B12R1.233 CC(C)Oc1ccc(cc1Br)I 7a_100012361655_100000210206 [0,1,0,0,0,1|2,0,0]=4 4072 B12R1.233 CC(C)Oc1ccc(cc1Br)N 34a_100011534360_100000210206 [0,1,0,0,0,1|2,0,0]=4 4073 B12R1.233 CC(C)Oc1ccc(cc1Br)N 7a_100011534360_100000210206 [0,1,0,0,0,1|2,0,0]=4 4074 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 34a_100000186472_100000210206 [0,1,0,0,0,1|2,0,0]=4 4075 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br 7a_100000186472_100000210206 [0,1,0,0,0,1|2,0,0]=4 4076 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 34a_100015191787_100000210206 [0,1,0,0,0,1|2,0,0]=4 4077 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 7a_100015191787_100000210206 [0,1,0,0,0,1|2,0,0]=4 4078 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 34a_100000212004_100000210206 [0,1,0,0,0,1|2,0,0]=4 4079 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 7a_100000212004_100000210206 [0,1,0,0,0,1|2,0,0]=4 4080 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 34a_100012360047_100000210206 [0,1,0,0,0,1|2,0,0]=4 4081 B12R1.233 CC(C)Oc1ccc(cc1Cl)I 7a_100012360047_100000210206 [0,1,0,0,0,1|2,0,0]=4 4082 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 34a_100000744943_100000210206 [0,1,0,0,0,1|2,0,0]=4 4083 B12R1.233 CC(C)Oc1ccc(cc1Cl)N 7a_100000744943_100000210206 [0,1,0,0,0,1|2,0,0]=4 4084 B12R1.233 CC(C)Oc1ccc(cc1F)Br 34a_100000185481_100000210206 [0,1,0,0,0,1|2,0,0]=4 4085 B12R1.233 CC(C)Oc1ccc(cc1F)Br 7a_100000185481_100000210206 [0,1,0,0,0,1|2,0,0]=4 4086 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 34a_100000230166_100000210206 [0,1,0,0,0,1|2,0,0]=4 4087 B12R1.233 CC(C)Oc1ccc(cc1F)Cl 7a_100000230166_100000210206 [0,1,0,0,0,1|2,0,0]=4 4088 B12R1.233 CC(C)Oc1ccc(cc1F)F 34a_100000230127_100000210206 [0,1,0,0,0,1|2,0,0]=4 4089 B12R1.233 CC(C)Oc1ccc(cc1F)F 7a_100000230127_100000210206 [0,1,0,0,0,1|2,0,0]=4 4090 B12R1.233 CC(C)Oc1ccc(cc1F)I 34a_100011356965_100000210206 [0,1,0,0,0,1|2,0,0]=4 4091 B12R1.233 CC(C)Oc1ccc(cc1F)I 7a_100011356965_100000210206 [0,1,0,0,0,1|2,0,0]=4 4092 B12R1.233 CC(C)Oc1ccc(cc1F)N 34a_100011220035_100000210206 [0,1,0,0,0,1|2,0,0]=4 4093 B12R1.233 CC(C)Oc1ccc(cc1F)N 7a_100011220035_100000210206 [0,1,0,0,0,1|2,0,0]=4 4094 B12R1.233 CC(C)Oc1ccc(cc1F)O 271570a_203496583355_100009811877 [0,1,0,0,0,1|1,0,0]=3 4095 B12R1.233 CC(C)Oc1ccc(cc1I)Br 34a_100012355227_100000210206 [0,1,0,0,0,1|2,0,0]=4 4096 B12R1.233 CC(C)Oc1ccc(cc1I)Br 7a_100012355227_100000210206 [0,1,0,0,0,1|2,0,0]=4 4097 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 34a_100011356953_100000210206 [0,1,0,0,0,1|2,0,0]=4 4098 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 7a_100011356953_100000210206 [0,1,0,0,0,1|2,0,0]=4 4099 B12R1.233 CC(C)Oc1ccc(cc1I)F 34a_100012355409_100000210206 [0,1,0,0,0,1|2,0,0]=4 4100 B12R1.233 CC(C)Oc1ccc(cc1I)F 7a_100012355409_100000210206 [0,1,0,0,0,1|2,0,0]=4 4101 B12R1.233 CC(C)Oc1ccc(cc1I)I 7a_100010001573_100000210206 [0,1,0,0,0,1|2,0,0]=4 4102 B12R1.233 CC(C)Oc1ccc(cc1N)Br 34a_100000752626_100000210206 [0,1,0,0,0,1|2,0,0]=4 4103 B12R1.233 CC(C)Oc1ccc(cc1N)Br 7a_100000752626_100000210206 [0,1,0,0,0,1|2,0,0]=4 4104 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 34a_100000210500_100000210206 [0,1,0,0,0,1|2,0,0]=4 4105 B12R1.233 CC(C)Oc1ccc(cc1N)Cl 7a_100000210500_100000210206 [0,1,0,0,0,1|2,0,0]=4 4106 B12R1.233 CC(C)Oc1ccc(cc1N)F 34a_100000759472_100000210206 [0,1,0,0,0,1|2,0,0]=4 4107 B12R1.233 CC(C)Oc1ccc(cc1N)F 7a_100000759472_100000210206 [0,1,0,0,0,1|2,0,0]=4 4108 B12R1.233 CC(C)Oc1ccc(cc1N)I 34a_100000753495_100000210206 [0,1,0,0,0,1|2,0,0]=4 4109 B12R1.233 CC(C)Oc1ccc(cc1N)I 7a_100000753495_100000210206 [0,1,0,0,0,1|2,0,0]=4 4110 B12R1.233 CC(C)Oc1ccc(cc1N)N 34a_100000725306_100000210206 [0,1,0,0,0,1|2,0,0]=4 4111 B12R1.233 CC(C)Oc1ccc(cc1N)O 271570a_203496583355_100000690130 [0,1,0,0,0,1|1,0,0]=3 4112 B12R1.233 CC(C)Oc1ccc(cc1O)F 271570a_203496583355_100000171696 [0,1,0,0,0,1|2,0,0]=4 4113 B12R1.233 CC(C)Oc1ccc(cc1O)N 271570a_203496583355_200000706018 [0,1,0,0,0,1|2,0,0]=4 4114 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100000210206_100011484698 [0,1,0,0,0,1|2,0,0]=4 4115 B12R1.233 CC(C)Sc1ccc(cc1Br)Br 62a_100011484698_100000210206 [0,1,0,0,0,1|2,0,0]=4 4116 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100000210206_100011219703 [0,1,0,0,0,1|2,0,0]=4 4117 B12R1.233 CC(C)Sc1ccc(cc1Br)Cl 62a_100011219703_100000210206 [0,1,0,0,0,1|2,0,0]=4 4118 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100000210206_100011217111 [0,1,0,0,0,1|2,0,0]=4 4119 B12R1.233 CC(C)Sc1ccc(cc1Br)F 62a_100011217111_100000210206 [0,1,0,0,0,1|2,0,0]=4 4120 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000210206_100000750458 [0,1,0,0,0,1|2,0,0]=4 4121 B12R1.233 CC(C)Sc1ccc(cc1Br)N 62a_100000750458_100000210206 [0,1,0,0,0,1|2,0,0]=4 4122 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000210206_100000701344 [0,1,0,0,0,1|1,0,0]=3 4123 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000701344_100000210206 [0,1,0,0,0,1|1,0,0]=3 4124 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100000210206_100011216062 [0,1,0,0,0,1|2,0,0]=4 4125 B12R1.233 CC(C)Sc1ccc(cc1Cl)Br 62a_100011216062_100000210206 [0,1,0,0,0,1|2,0,0]=4 4126 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000210206_100000699841 [0,1,0,0,0,1|2,0,0]=4 4127 B12R1.233 CC(C)Sc1ccc(cc1Cl)Cl 62a_100000699841_100000210206 [0,1,0,0,0,1|2,0,0]=4 4128 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000210206_100000733362 [0,1,0,0,0,1|2,0,0]=4 4129 B12R1.233 CC(C)Sc1ccc(cc1Cl)F 62a_100000733362_100000210206 [0,1,0,0,0,1|2,0,0]=4 4130 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000210206_100000761885 [0,1,0,0,0,1|2,0,0]=4 4131 B12R1.233 CC(C)Sc1ccc(cc1Cl)N 62a_100000761885_100000210206 [0,1,0,0,0,1|2,0,0]=4 4132 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000210206 [0,1,0,0,0,1|1,0,0]=3 4133 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000210206_100000047559 [0,1,0,0,0,1|1,0,0]=3 4134 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100000210206_100009814013 [0,1,0,0,0,1|2,0,0]=4 4135 B12R1.233 CC(C)Sc1ccc(cc1F)Br 62a_100009814013_100000210206 [0,1,0,0,0,1|2,0,0]=4 4136 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100000210206_100011216042 [0,1,0,0,0,1|2,0,0]=4 4137 B12R1.233 CC(C)Sc1ccc(cc1F)Cl 62a_100011216042_100000210206 [0,1,0,0,0,1|2,0,0]=4 4138 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000210206_100000750030 [0,1,0,0,0,1|2,0,0]=4 4139 B12R1.233 CC(C)Sc1ccc(cc1F)F 62a_100000750030_100000210206 [0,1,0,0,0,1|2,0,0]=4 4140 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100000210206_100011356925 [0,1,0,0,0,1|2,0,0]=4 4141 B12R1.233 CC(C)Sc1ccc(cc1F)N 62a_100011356925_100000210206 [0,1,0,0,0,1|2,0,0]=4 4142 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000210206_100000755031 [0,1,0,0,0,1|1,0,0]=3 4143 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000755031_100000210206 [0,1,0,0,0,1|1,0,0]=3 4144 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000210206_100000743836 [0,1,0,0,0,1|2,0,0]=4 4145 B12R1.233 CC(C)Sc1ccc(cc1N)Br 62a_100000743836_100000210206 [0,1,0,0,0,1|2,0,0]=4 4146 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000210206_100000761886 [0,1,0,0,0,1|2,0,0]=4 4147 B12R1.233 CC(C)Sc1ccc(cc1N)Cl 62a_100000761886_100000210206 [0,1,0,0,0,1|2,0,0]=4 4148 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000210206_100000687223 [0,1,0,0,0,1|2,0,0]=4 4149 B12R1.233 CC(C)Sc1ccc(cc1N)F 62a_100000687223_100000210206 [0,1,0,0,0,1|2,0,0]=4 4150 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_100000210206_200012175722 [0,1,0,0,0,1|2,0,0]=4 4151 B12R1.233 CC(C)Sc1ccc(cc1N)N 62a_200012175722_100000210206 [0,1,0,0,0,1|2,0,0]=4 4152 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100000210206_100011999798 [0,1,0,0,0,1|1,0,0]=3 4153 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100011999798_100000210206 [0,1,0,0,0,1|1,0,0]=3 4154 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100000210206_100012344904 [0,1,0,0,0,1|2,0,0]=4 4155 B12R1.233 CC(C)Sc1ccc(cc1O)Br 62a_100012344904_100000210206 [0,1,0,0,0,1|2,0,0]=4 4156 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000050036_100000210206 [0,1,0,0,0,1|2,0,0]=4 4157 B12R1.233 CC(C)Sc1ccc(cc1O)Cl 62a_100000210206_100000050036 [0,1,0,0,0,1|2,0,0]=4 4158 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000210206_100000690578 [0,1,0,0,0,1|2,0,0]=4 4159 B12R1.233 CC(C)Sc1ccc(cc1O)F 62a_100000690578_100000210206 [0,1,0,0,0,1|2,0,0]=4 4160 B12R1.233 CC(C)Sc1ccc(cc1O)O 62a_100000210206_100009813921 [0,1,0,0,0,1|1,0,0]=3 4161 B12R1.233 CC(C)Sc1ccc(nc1F)O 62a_100000210206_100009879308 [0,1,0,0,0,1|2,0,0]=4 4162 B12R1.233 CC(C)Sc1ccc(nc1F)O 62a_100009879308_100000210206 [0,1,0,0,0,1|2,0,0]=4 4163 B12R1.233 CC(C)Sc1ncc(cc1F)O 62a_100000210206_100000063512 [0,1,0,0,0,1|2,0,0]=4 4164 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 2230a_100102631434_200012351560 [0,1,0,0,0,1|1,0,0]=3 4165 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 269982a_100102631434_200012351560 [0,1,0,0,0,1|1,0,0]=3 4166 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 270004a_100102631434_100012351556 [0,1,0,0,0,1|1,0,0]=3 4167 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 2230a_100102631434_100000755608 [0,1,0,0,0,1|1,0,0]=3 4168 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 269982a_100102631434_100000755608 [0,1,0,0,0,1|1,0,0]=3 4169 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 270004a_100102631434_100000687667 [0,1,0,0,0,1|1,0,0]=3 4170 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_100102631434_100000243222 [0,1,0,0,0,1|1,0,0]=3 4171 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_200011192132_200000210301 [0,1,0,0,0,1|1,0,0]=3 4172 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_100102631434_100000243222 [0,1,0,0,0,1|1,0,0]=3 4173 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_200011192132_200000210301 [0,1,0,0,0,1|1,0,0]=3 4174 B12R1.233 CN(C)Cc1ccc(cc1Br)F 270004a_100102631434_100000685661 [0,1,0,0,0,1|1,0,0]=3 4175 B12R1.233 CN(C)Cc1ccc(cc1Br)F 34a_200011192132_200000210301 [0,1,0,0,0,1|1,0,0]=3 4176 B12R1.233 CN(C)Cc1ccc(cc1Br)I 2230a_100102631434_100010146610 [0,1,0,0,0,1|1,0,0]=3 4177 B12R1.233 CN(C)Cc1ccc(cc1Br)I 269982a_100102631434_100010146610 [0,1,0,0,0,1|1,0,0]=3 4178 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 2230a_100102631434_100011740631 [0,1,0,0,0,1|1,0,0]=3 4179 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 269982a_100102631434_100011740631 [0,1,0,0,0,1|1,0,0]=3 4180 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 270004a_100102631434_100000764164 [0,1,0,0,0,1|1,0,0]=3 4181 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100015189987_200000210301 [0,1,0,0,0,1|1,0,0]=3 4182 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100102631434_100000188473 [0,1,0,0,0,1|1,0,0]=3 4183 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100015189987_200000210301 [0,1,0,0,0,1|1,0,0]=3 4184 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100102631434_100000188473 [0,1,0,0,0,1|1,0,0]=3 4185 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 270004a_100102631434_100000188887 [0,1,0,0,0,1|1,0,0]=3 4186 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 34a_100015189987_200000210301 [0,1,0,0,0,1|1,0,0]=3 4187 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 2230a_100102631434_100011216360 [0,1,0,0,0,1|1,0,0]=3 4188 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 269982a_100102631434_100011216360 [0,1,0,0,0,1|1,0,0]=3 4189 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 270004a_100102631434_100000752949 [0,1,0,0,0,1|1,0,0]=3 4190 B12R1.233 CN(C)Cc1ccc(cc1F)Br 2230a_100102631434_100000211606 [0,1,0,0,0,1|1,0,0]=3 4191 B12R1.233 CN(C)Cc1ccc(cc1F)Br 269982a_100102631434_100000211606 [0,1,0,0,0,1|1,0,0]=3 4192 B12R1.233 CN(C)Cc1ccc(cc1F)Br 270004a_100102631434_100000211676 [0,1,0,0,0,1|1,0,0]=3 4193 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 2230a_100102631434_100000709361 [0,1,0,0,0,1|1,0,0]=3 4194 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 269982a_100102631434_100000709361 [0,1,0,0,0,1|1,0,0]=3 4195 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 270004a_100102631434_100000697372 [0,1,0,0,0,1|1,0,0]=3 4196 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100000207661_200000210301 [0,1,0,0,0,1|1,0,0]=3 4197 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100102631434_100000748237 [0,1,0,0,0,1|1,0,0]=3 4198 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100000207661_200000210301 [0,1,0,0,0,1|1,0,0]=3 4199 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100102631434_100000748237 [0,1,0,0,0,1|1,0,0]=3 4200 B12R1.233 CN(C)Cc1ccc(cc1F)F 270004a_100102631434_100000211964 [0,1,0,0,0,1|1,0,0]=3 4201 B12R1.233 CN(C)Cc1ccc(cc1F)F 34a_100000207661_200000210301 [0,1,0,0,0,1|1,0,0]=3 4202 B12R1.233 CN(C)Cc1ccc(cc1F)I 2230a_100102631434_100010244991 [0,1,0,0,0,1|1,0,0]=3 4203 B12R1.233 CN(C)Cc1ccc(cc1F)I 269982a_100102631434_100010244991 [0,1,0,0,0,1|1,0,0]=3 4204 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [0,1,0,0,0,1|0,0,0]=2 4205 B12R1.233 CN(C)Cc1ccc(cc1I)Br 2230a_100102631434_100010146615 [0,1,0,0,0,1|1,0,0]=3 4206 B12R1.233 CN(C)Cc1ccc(cc1I)Br 269982a_100102631434_100010146615 [0,1,0,0,0,1|1,0,0]=3 4207 B12R1.233 CN(C)Cc1ccc(cc1I)Br 270004a_100102631434_100010146562 [0,1,0,0,0,1|1,0,0]=3 4208 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 2230a_100102631434_100010254388 [0,1,0,0,0,1|1,0,0]=3 4209 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 269982a_100102631434_100010254388 [0,1,0,0,0,1|1,0,0]=3 4210 B12R1.233 CN(C)Cc1ccc(cc1I)F 2230a_100102631434_100012354799 [0,1,0,0,0,1|1,0,0]=3 4211 B12R1.233 CN(C)Cc1ccc(cc1I)F 269982a_100102631434_100012354799 [0,1,0,0,0,1|1,0,0]=3 4212 B12R1.233 CN(C)Cc1ccc(nc1Cl)Cl 2230a_100102631434_100000722033 [0,1,0,0,0,1|2,0,0]=4 4213 B12R1.233 CN(C)Cc1ccc(nc1Cl)Cl 269982a_100102631434_100000722033 [0,1,0,0,0,1|2,0,0]=4 4214 B12R1.233 CN(C)Cc1cnc(cc1Br)Cl 270004a_100102631434_100009892795 [0,1,0,0,0,1|2,0,0]=4 4215 B12R1.233 CN(C)Cc1cnc(cc1Cl)Cl 2230a_100102631434_100011997056 [0,1,0,0,0,1|2,0,0]=4 4216 B12R1.233 CN(C)Cc1cnc(cc1Cl)Cl 269982a_100102631434_100011997056 [0,1,0,0,0,1|2,0,0]=4 4217 B12R1.233 CN(C)Cc1ncc(cc1Br)Br 270004a_100102631434_100000688198 [0,1,0,0,0,1|2,0,0]=4 4218 B12R1.233 CN(C)Cc1ncc(cc1Br)Cl 270004a_100102631434_100010064872 [0,1,0,0,0,1|2,0,0]=4 4219 B12R1.233 CN(C)Cc1ncc(cc1Cl)Br 270004a_100102631434_100009814801 [0,1,0,0,0,1|2,0,0]=4 4220 B12R1.233 CN(C)Cc1ncc(cc1Cl)Cl 270004a_100102631434_100011361609 [0,1,0,0,0,1|2,0,0]=4 4221 B12R1.233 CN(C)Cc1ncc(cc1F)Br 270004a_100102631434_100010180630 [0,1,0,0,0,1|2,0,0]=4 4222 B12R1.233 CN(C)Cc1ncc(cc1F)Cl 2230a_100102631434_200009879301 [0,1,0,0,0,1|2,0,0]=4 4223 B12R1.233 CN(C)Cc1ncc(cc1F)Cl 269982a_100102631434_200009879301 [0,1,0,0,0,1|2,0,0]=4 4224 B12R1.233 CN(C)Cc1ncc(cc1F)Cl 270004a_100102631434_100009858488 [0,1,0,0,0,1|2,0,0]=4 4225 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 2230a_200011192132_200025704644 [0,1,0,0,0,1|1,0,0]=3 4226 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 269982a_200011192132_200025704644 [0,1,0,0,0,1|1,0,0]=3 4227 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 34a_200011192132_200025704644 [0,1,0,0,0,1|1,0,0]=3 4228 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 2230a_100015189987_200025704644 [0,1,0,0,0,1|1,0,0]=3 4229 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 269982a_100015189987_200025704644 [0,1,0,0,0,1|1,0,0]=3 4230 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 34a_100015189987_200025704644 [0,1,0,0,0,1|1,0,0]=3 4231 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 2230a_100000207661_200025704644 [0,1,0,0,0,1|1,0,0]=3 4232 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 269982a_100000207661_200025704644 [0,1,0,0,0,1|1,0,0]=3 4233 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 34a_100000207661_200025704644 [0,1,0,0,0,1|1,0,0]=3 4234 B12R1.233 Cc1cc(c(cn1)CN(C)C)C 270004a_100102631434_200009869383 [0,1,0,0,0,1|2,0,0]=4 4235 B12R1.233 Cc1cc(ccc1CN(C)C)Br 2230a_100102631434_100000708836 [0,1,0,0,0,1|1,0,0]=3 4236 B12R1.233 Cc1cc(ccc1CN(C)C)Br 269982a_100102631434_100000708836 [0,1,0,0,0,1|1,0,0]=3 4237 B12R1.233 Cc1cc(ccc1CN(C)C)Br 270004a_100102631434_100000687586 [0,1,0,0,0,1|1,0,0]=3 4238 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 2230a_100102631434_100012361307 [0,1,0,0,0,1|1,0,0]=3 4239 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 269982a_100102631434_100012361307 [0,1,0,0,0,1|1,0,0]=3 4240 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 270004a_100102631434_100000766358 [0,1,0,0,0,1|1,0,0]=3 4241 B12R1.233 Cc1cc(ccc1CN(C)C)F 2230a_100102631434_100000700533 [0,1,0,0,0,1|1,0,0]=3 4242 B12R1.233 Cc1cc(ccc1CN(C)C)F 269982a_100102631434_100000700533 [0,1,0,0,0,1|1,0,0]=3 4243 B12R1.233 Cc1cc(ccc1CN(C)C)F 270004a_100102631434_100000745986 [0,1,0,0,0,1|1,0,0]=3 4244 B12R1.233 Cc1cc(ccc1NC(C)C)Br 34a_100000211769_100000210206 [0,1,0,0,0,1|2,0,0]=4 4245 B12R1.233 Cc1cc(ccc1NC(C)C)Br 7a_100000211769_100000210206 [0,1,0,0,0,1|2,0,0]=4 4246 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 34a_100000210418_100000210206 [0,1,0,0,0,1|2,0,0]=4 4247 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 7a_100000210418_100000210206 [0,1,0,0,0,1|2,0,0]=4 4248 B12R1.233 Cc1cc(ccc1NC(C)C)F 34a_100000211637_100000210206 [0,1,0,0,0,1|2,0,0]=4 4249 B12R1.233 Cc1cc(ccc1NC(C)C)F 7a_100000211637_100000210206 [0,1,0,0,0,1|2,0,0]=4 4250 B12R1.233 Cc1cc(ccc1NC(C)C)I 34a_100000184554_100000210206 [0,1,0,0,0,1|2,0,0]=4 4251 B12R1.233 Cc1cc(ccc1NC(C)C)I 7a_100000184554_100000210206 [0,1,0,0,0,1|2,0,0]=4 4252 B12R1.233 Cc1cc(ccc1NC(C)C)O 34a_100000756630_100000210206 [0,1,0,0,0,1|1,0,0]=3 4253 B12R1.233 Cc1cc(ccc1OC(C)C)Br 34a_100000186361_100000210206 [0,1,0,0,0,1|2,0,0]=4 4254 B12R1.233 Cc1cc(ccc1OC(C)C)Br 7a_100000186361_100000210206 [0,1,0,0,0,1|2,0,0]=4 4255 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 34a_100000211091_100000210206 [0,1,0,0,0,1|2,0,0]=4 4256 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 7a_100000211091_100000210206 [0,1,0,0,0,1|2,0,0]=4 4257 B12R1.233 Cc1cc(ccc1OC(C)C)F 34a_100000764316_100000210206 [0,1,0,0,0,1|2,0,0]=4 4258 B12R1.233 Cc1cc(ccc1OC(C)C)F 7a_100000764316_100000210206 [0,1,0,0,0,1|2,0,0]=4 4259 B12R1.233 Cc1cc(ccc1OC(C)C)I 34a_100011218673_100000210206 [0,1,0,0,0,1|2,0,0]=4 4260 B12R1.233 Cc1cc(ccc1OC(C)C)I 7a_100011218673_100000210206 [0,1,0,0,0,1|2,0,0]=4 4261 B12R1.233 Cc1cc(ccc1OC(C)C)N 34a_100011218179_100000210206 [0,1,0,0,0,1|2,0,0]=4 4262 B12R1.233 Cc1cc(ccc1OC(C)C)N 7a_100011218179_100000210206 [0,1,0,0,0,1|2,0,0]=4 4263 B12R1.233 Cc1cc(ccc1OC(C)C)O 271570a_203496583355_200011825982 [0,1,0,0,0,1|1,0,0]=3 4264 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000210206_100000701812 [0,1,0,0,0,1|2,0,0]=4 4265 B12R1.233 Cc1cc(ccc1SC(C)C)Br 62a_100000701812_100000210206 [0,1,0,0,0,1|2,0,0]=4 4266 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100000210206_100011219607 [0,1,0,0,0,1|2,0,0]=4 4267 B12R1.233 Cc1cc(ccc1SC(C)C)Cl 62a_100011219607_100000210206 [0,1,0,0,0,1|2,0,0]=4 4268 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100000210206_100011205405 [0,1,0,0,0,1|2,0,0]=4 4269 B12R1.233 Cc1cc(ccc1SC(C)C)F 62a_100011205405_100000210206 [0,1,0,0,0,1|2,0,0]=4 4270 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210206_100000210723 [0,1,0,0,0,1|2,0,0]=4 4271 B12R1.233 Cc1cc(ccc1SC(C)C)N 62a_100000210723_100000210206 [0,1,0,0,0,1|2,0,0]=4 4272 B12R1.233 Cc1cc(ccc1SC(C)C)O 62a_100000210206_100000690111 [0,1,0,0,0,1|1,0,0]=3 4273 B12R1.233 Cc1cc(cnc1CN(C)C)Br 270004a_100102631434_100010185443 [0,1,0,0,0,1|2,0,0]=4 4274 B12R1.233 Cc1cc(cnc1CN(C)C)Cl 270004a_100102631434_200009887756 [0,1,0,0,0,1|2,0,0]=4 4275 B12R1.233 Cc1cc(cnc1SC(C)C)O 62a_100000210206_100012000486 [0,1,0,0,0,1|2,0,0]=4 4276 B12R1.233 Cc1cc(cnc1SC(C)C)O 62a_100012000486_100000210206 [0,1,0,0,0,1|2,0,0]=4 4277 B12R1.233 Cc1cc(ncc1CN(C)C)F 2230a_100102631434_100010382440 [0,1,0,0,0,1|2,0,0]=4 4278 B12R1.233 Cc1cc(ncc1CN(C)C)F 269982a_100102631434_100010382440 [0,1,0,0,0,1|2,0,0]=4 4279 B12R1.233 Cc1cc(ncc1SC(C)C)O 62a_100000210206_100000766222 [0,1,0,0,0,1|2,0,0]=4 4280 B12R1.233 Cc1cc(ncc1SC(C)C)O 62a_100000766222_100000210206 [0,1,0,0,0,1|2,0,0]=4 4281 B12R1.233 Cc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000692596 [0,1,0,0,0,1|1,0,0]=3 4282 B12R1.233 Cc1ccc(c(c1)Br)NC(C)C 34a_100000210942_100000210206 [0,1,0,0,0,1|2,0,0]=4 4283 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 34a_100000210800_100000210206 [0,1,0,0,0,1|2,0,0]=4 4284 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 7a_100000210800_100000210206 [0,1,0,0,0,1|2,0,0]=4 4285 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100009813563 [0,1,0,0,0,1|2,0,0]=4 4286 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100009813563_100000210206 [0,1,0,0,0,1|2,0,0]=4 4287 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [0,1,0,0,0,1|1,0,0]=3 4288 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [0,1,0,0,0,1|1,0,0]=3 4289 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [0,1,0,0,0,1|1,0,0]=3 4290 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [0,1,0,0,0,1|1,0,0]=3 4291 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [0,1,0,0,0,1|1,0,0]=3 4292 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [0,1,0,0,0,1|1,0,0]=3 4293 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [0,1,0,0,0,1|1,0,0]=3 4294 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [0,1,0,0,0,1|1,0,0]=3 4295 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [0,1,0,0,0,1|1,0,0]=3 4296 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 34a_100000736561_100000210206 [0,1,0,0,0,1|2,0,0]=4 4297 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 7a_100000736561_100000210206 [0,1,0,0,0,1|2,0,0]=4 4298 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 34a_100000211776_100000210206 [0,1,0,0,0,1|2,0,0]=4 4299 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 7a_100000211776_100000210206 [0,1,0,0,0,1|2,0,0]=4 4300 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100000210206_100011217332 [0,1,0,0,0,1|2,0,0]=4 4301 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100011217332_100000210206 [0,1,0,0,0,1|2,0,0]=4 4302 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_100012349684 [0,1,0,0,0,1|1,0,0]=3 4303 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_100012349684 [0,1,0,0,0,1|1,0,0]=3 4304 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100011935181 [0,1,0,0,0,1|1,0,0]=3 4305 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C 34a_100000210522_100000210206 [0,1,0,0,0,1|2,0,0]=4 4306 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 34a_100000749699_100000210206 [0,1,0,0,0,1|2,0,0]=4 4307 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 7a_100000749699_100000210206 [0,1,0,0,0,1|2,0,0]=4 4308 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100000210206_100011263221 [0,1,0,0,0,1|2,0,0]=4 4309 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100011263221_100000210206 [0,1,0,0,0,1|2,0,0]=4 4310 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011217900 [0,1,0,0,0,1|1,0,0]=3 4311 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011217900 [0,1,0,0,0,1|1,0,0]=3 4312 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011217368 [0,1,0,0,0,1|1,0,0]=3 4313 B12R1.233 Cc1ccc(c(c1)F)NC(C)C 34a_100000211023_100000210206 [0,1,0,0,0,1|2,0,0]=4 4314 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 34a_100011216688_100000210206 [0,1,0,0,0,1|2,0,0]=4 4315 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 7a_100011216688_100000210206 [0,1,0,0,0,1|2,0,0]=4 4316 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100000210206_100011216119 [0,1,0,0,0,1|2,0,0]=4 4317 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100011216119_100000210206 [0,1,0,0,0,1|2,0,0]=4 4318 B12R1.233 Cc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010150104 [0,1,0,0,0,1|1,0,0]=3 4319 B12R1.233 Cc1ccc(c(c1)I)NC(C)C 34a_100011356834_100000210206 [0,1,0,0,0,1|2,0,0]=4 4320 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 34a_100000765521_100000210206 [0,1,0,0,0,1|2,0,0]=4 4321 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 7a_100000765521_100000210206 [0,1,0,0,0,1|2,0,0]=4 4322 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 34a_100011215204_100000210206 [0,1,0,0,0,1|2,0,0]=4 4323 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 7a_100011215204_100000210206 [0,1,0,0,0,1|2,0,0]=4 4324 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100000210206_100011216686 [0,1,0,0,0,1|2,0,0]=4 4325 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100011216686_100000210206 [0,1,0,0,0,1|2,0,0]=4 4326 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [0,1,0,0,0,1|2,0,0]=4 4327 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [0,1,0,0,0,1|2,0,0]=4 4328 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [0,1,0,0,0,1|2,0,0]=4 4329 B12R1.233 Cc1ccc(c(n1)Br)CN(C)C 2230a_100102631434_200010064658 [0,1,0,0,0,1|2,0,0]=4 4330 B12R1.233 Cc1ccc(c(n1)Br)CN(C)C 269982a_100102631434_200010064658 [0,1,0,0,0,1|2,0,0]=4 4331 B12R1.233 Cc1ccc(c(n1)C)CN(C)C 270004a_100102631434_100011794427 [0,1,0,0,0,1|2,0,0]=4 4332 B12R1.233 Cc1cnc(c(c1)C)CN(C)C 2230a_100102631434_100016990036 [0,1,0,0,0,1|2,0,0]=4 4333 B12R1.233 Cc1cnc(c(c1)C)CN(C)C 269982a_100102631434_100016990036 [0,1,0,0,0,1|2,0,0]=4 4334 B12R1.233 Cc1cnc(c(c1)F)CN(C)C 270004a_100102631434_100009845184 [0,1,0,0,0,1|2,0,0]=4 4335 B12R1.233 Cc1nc(ccc1SC(C)C)O 62a_100000210206_100000691680 [0,1,0,0,0,1|2,0,0]=4 4336 B12R1.233 Cc1nc(ccc1SC(C)C)O 62a_100000691680_100000210206 [0,1,0,0,0,1|2,0,0]=4 4337 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,1,0,0,0,1|2,0,0]=4 4338 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,1,0,0,0,1|2,0,0]=4 4339 B12R1.5 C=Cc1ccc(cc1)C(C)CC 271570a_100011290941_100011221364 [0,2,0,0,0,0|2,0,0]=4 4340 B12R1.5 C=Cc1ccc(cc1)C(C)NC 2230a_200012023546_200000210301 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.5 C=Cc1ccc(cc1)C(C)NC 271570a_100011290941_100000231103 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.5 C=Cc1ccc(cc1)C(C)NC 34a_200012023546_200000210301 [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 2230a_200012023546_200025704644 [0,2,0,0,0,0|2,0,0]=4 4344 B12R1.5 C=Cc1ccc(cc1)C(C)N[13CH3] 34a_200012023546_200025704644 [0,2,0,0,0,0|2,0,0]=4 4345 B12R1.5 C=Cc1ccc(cc1)C(C)OC 271570a_100011290941_100010254937 [0,2,0,0,0,0|2,0,0]=4 4346 B12R1.5 CC(=NO)c1ccc(cc1)O[13CH3] 34a_100000164205_200025704644 [0,2,0,0,0,0|2,0,0]=4 4347 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [0,2,0,0,0,0|1,0,0]=3 4348 B12R1.5 CC(O[13CH3])c1ccc(cc1)CN 34a_200000048501_200025704644 [0,2,0,0,0,0|2,0,0]=4 4349 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,2,0,0,0,0|2,0,0]=4 4350 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,2,0,0,0,0|2,0,0]=4 4351 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,2,0,0,0,0|2,0,0]=4 4352 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,2,0,0,0,0|2,0,0]=4 4353 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,2,0,0,0,0|2,0,0]=4 4354 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,2,0,0,0,0|2,0,0]=4 4355 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 4357 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [0,2,0,0,0,0|2,0,0]=4 4358 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 4359 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 4360 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [0,2,0,0,0,0|2,0,0]=4 4361 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [0,2,0,0,0,0|1,0,0]=3 4362 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [0,2,0,0,0,0|1,0,0]=3 4363 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [0,2,0,0,0,0|1,0,0]=3 4364 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [0,2,0,0,0,0|1,0,0]=3 4365 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [0,2,0,0,0,0|1,1,0]=4 4366 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [0,2,0,0,0,0|1,1,0]=4 4367 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [0,2,0,0,0,0|1,1,0]=4 4368 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [0,2,0,0,0,0|1,1,0]=4 4369 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [0,2,0,0,0,0|2,0,0]=4 4370 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [0,2,0,0,0,0|2,0,0]=4 4371 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000218877_200000210301 [0,2,0,0,0,0|1,0,0]=3 4372 B12R1.5 CCN(C)c1ccc(cc1)C#N 269982a_100000739737_100000204670 [0,2,0,0,0,0|1,0,0]=3 4373 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000218877_200000210301 [0,2,0,0,0,0|1,0,0]=3 4374 B12R1.5 CCN(C)c1ccc(cc1)C#N 34a_100000739737_100000210202 [0,2,0,0,0,0|1,0,0]=3 4375 B12R1.5 CCN(C)c1ccc(cc1)C#N 7a_100000218877_200000210301 [0,2,0,0,0,0|1,0,0]=3 4376 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [0,2,0,0,0,0|0,0,0]=2 4377 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [0,2,0,0,0,0|0,0,0]=2 4378 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [0,2,0,0,0,0|0,0,0]=2 4379 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 269982a_100000218877_200025704644 [0,2,0,0,0,0|1,0,0]=3 4380 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 34a_100000218877_200025704644 [0,2,0,0,0,0|1,0,0]=3 4381 B12R1.5 CCN([13CH3])c1ccc(cc1)C#N 7a_100000218877_200025704644 [0,2,0,0,0,0|1,0,0]=3 4382 B12R1.5 CCc1ccc(cc1)C(C)NC 2230a_100015186439_200000210301 [0,2,0,0,0,0|2,0,0]=4 4383 B12R1.5 CCc1ccc(cc1)C(C)NC 269862a_106832991636_100000211630 [0,2,0,0,0,0|2,0,0]=4 4384 B12R1.5 CCc1ccc(cc1)C(C)NC 34a_100015186439_200000210301 [0,2,0,0,0,0|2,0,0]=4 4385 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 2230a_100015186439_200025704644 [0,2,0,0,0,0|2,0,0]=4 4386 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 34a_100015186439_200025704644 [0,2,0,0,0,0|2,0,0]=4 4387 B12R1.5 CCc1ccc(cc1)C(C)OC 34a_100011232672_200000210301 [0,2,0,0,0,0|2,0,0]=4 4388 B12R1.5 CCc1ccc(cc1)C(C)OC 7a_100011232672_200000210301 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 34a_100011232672_200025704644 [0,2,0,0,0,0|2,0,0]=4 4390 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 7a_100011232672_200025704644 [0,2,0,0,0,0|2,0,0]=4 4391 B12R1.5 CN(CF)c1ccc(cc1)C#N 269982a_100000739737_100015361967 [0,2,0,0,0,0|1,0,0]=3 4392 B12R1.5 CN(CF)c1ccc(cc1)C#N 34a_100000739737_100015361967 [0,2,0,0,0,0|1,0,0]=3 4393 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [0,2,0,0,0,0|2,0,0]=4 4395 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [0,2,0,0,0,0|2,0,0]=4 4396 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 4397 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 4398 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [0,2,0,0,0,0|2,0,0]=4 4399 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [0,2,0,0,0,0|2,0,0]=4 4400 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [0,2,0,0,0,0|2,0,0]=4 4401 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [0,2,0,0,0,0|2,0,0]=4 4402 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [0,2,0,0,0,0|2,0,0]=4 4403 B12R1.5 CNC(C)c1ccc(cc1)C#N 269862a_106832991636_100000182420 [0,2,0,0,0,0|2,0,0]=4 4404 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,2,0,0,0,0|1,0,0]=3 4405 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,2,0,0,0,0|1,0,0]=3 4406 B12R1.5 CNC(C)c1ccc(cc1)SC 2230a_100000738722_200000210301 [0,2,0,0,0,0|1,1,0]=4 4407 B12R1.5 CNC(C)c1ccc(cc1)SC 269862a_106832991636_100000185071 [0,2,0,0,0,0|1,1,0]=4 4408 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_100000231103_200000210301 [0,2,0,0,0,0|1,1,0]=4 4409 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_200000210301_100000231103 [0,2,0,0,0,0|1,1,0]=4 4410 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_100000231103_200025704644 [0,2,0,0,0,0|1,1,0]=4 4411 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000231103 [0,2,0,0,0,0|1,1,0]=4 4412 B12R1.5 CNC(C)c1ccc(nc1)OC 269862a_106832991636_100011934396 [0,2,0,0,0,0|2,0,0]=4 4413 B12R1.5 CN[C@H](C)c1ccc(cc1)C#N 2230a_100016991473_200000210301 [0,2,0,0,0,0|2,0,0]=4 4414 B12R1.5 CN[C@H](C)c1ccc(cc1)C#N 34a_100016991473_200000210301 [0,2,0,0,0,0|2,0,0]=4 4415 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,2,0,0,0,0|1,0,0]=3 4416 B12R1.5 CNc1ccc(cc1)C(C)NC 269862a_106832991636_100011806243 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.5 COC(C)c1ccc(cc1)CN 34a_200000048501_200000210301 [0,2,0,0,0,0|2,0,0]=4 4422 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4423 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4424 B12R1.5 COC(C)c1ccc(cc1)SC 62a_100010254937_200000210301 [0,2,0,0,0,0|1,1,0]=4 4425 B12R1.5 COC(C)c1ccc(cc1)SC 62a_200000210301_100010254937 [0,2,0,0,0,0|1,1,0]=4 4426 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_100010254937_200025704644 [0,2,0,0,0,0|1,1,0]=4 4427 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100010254937 [0,2,0,0,0,0|1,1,0]=4 4428 B12R1.5 CO[C@@H](C)c1ccc(cc1)C#N 34a_100011852132_200000210301 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.5 CO[C@@H](C)c1ccc(cc1)C#N 7a_100011852132_200000210301 [0,2,0,0,0,0|2,0,0]=4 4430 B12R1.5 COc1ccc(cc1)C(=NO)C 34a_100000164205_200000210301 [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [0,2,0,0,0,0|1,0,0]=3 4437 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [0,2,0,0,0,0|1,0,0]=3 4438 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4439 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [0,2,0,0,0,0|1,0,0]=3 4440 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4441 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [0,2,0,0,0,0|1,0,0]=3 4442 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [0,2,0,0,0,0|1,0,0]=3 4443 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.5 COc1ccc(cc1)N(C)CF 269982a_100000220023_100015361967 [0,2,0,0,0,0|0,0,0]=2 4445 B12R1.5 COc1ccc(cc1)N(C)CF 34a_100000220023_100015361967 [0,2,0,0,0,0|0,0,0]=2 4446 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,2,0,0,0,0|1,0,0]=3 4447 B12R1.5 CSc1ccc(cc1)C(C)N[13CH3] 2230a_100000738722_200025704644 [0,2,0,0,0,0|1,1,0]=4 4448 B12R1.5 C[C@@H](N[13CH3])c1ccc(cc1)C#N 2230a_100016991473_200025704644 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.5 C[C@@H](N[13CH3])c1ccc(cc1)C#N 34a_100016991473_200025704644 [0,2,0,0,0,0|2,0,0]=4 4450 B12R1.5 C[C@H](O[13CH3])c1ccc(cc1)C#N 34a_100011852132_200025704644 [0,2,0,0,0,0|2,0,0]=4 4451 B12R1.5 C[C@H](O[13CH3])c1ccc(cc1)C#N 7a_100011852132_200025704644 [0,2,0,0,0,0|2,0,0]=4 4452 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,2,0,0,0,0|2,0,0]=4 4453 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,2,0,0,0,0|2,0,0]=4 4454 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,2,0,0,0,0|2,0,0]=4 4455 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 4456 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,2,0,0,0,0|2,0,0]=4 4457 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [0,2,0,0,0,0|2,0,0]=4 4458 B12R1.6 C=Cc1ccc(cc1)C(C)(C)C 271570a_100011290941_100011215385 [0,2,0,0,0,0|2,0,0]=4 4459 B12R1.6 C=Cc1ccc(cc1)C(C)(C)N 271570a_100011290941_100000739617 [0,2,0,0,0,0|2,0,0]=4 4460 B12R1.6 C=Cc1ccc(cc1)C(C)(C)O 271570a_100011290941_100000753367 [0,2,0,0,0,0|2,0,0]=4 4461 B12R1.6 C=Cc1ccc(cc1)[Si](C)(C)C 271570a_100011290941_100009813420 [0,2,0,0,0,0|2,0,0]=4 4462 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 2230a_100000210346_200025704644 [0,2,0,0,0,0|2,0,0]=4 4463 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 34a_100000210346_200025704644 [0,2,0,0,0,0|2,0,0]=4 4464 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 7a_100000210346_200025704644 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 34a_100000185729_200025704644 [0,2,0,0,0,0|1,0,0]=3 4466 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 7a_100000185729_200025704644 [0,2,0,0,0,0|1,0,0]=3 4467 B12R1.6 CC(C)(C)c1ccc(cc1)S[13CH3] 62a_100011215385_200025704644 [0,2,0,0,0,0|1,1,0]=4 4468 B12R1.6 CC(C)(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011215385 [0,2,0,0,0,0|1,1,0]=4 4469 B12R1.6 CC(C)(N)c1ccc(cc1)S[13CH3] 62a_100000739617_200025704644 [0,2,0,0,0,0|1,1,0]=4 4470 B12R1.6 CC(C)(N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000739617 [0,2,0,0,0,0|1,1,0]=4 4471 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 34a_100000695648_200025704644 [0,2,0,0,0,0|1,0,0]=3 4472 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 7a_100000695648_200025704644 [0,2,0,0,0,0|1,0,0]=3 4473 B12R1.6 CC(C)(O)c1ccc(cc1)S[13CH3] 62a_100000753367_200025704644 [0,2,0,0,0,0|1,1,0]=4 4474 B12R1.6 CC(C)(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753367 [0,2,0,0,0,0|1,1,0]=4 4475 B12R1.6 CNc1ccc(cc1)C(C)(C)C 2230a_100000210346_200000210301 [0,2,0,0,0,0|2,0,0]=4 4476 B12R1.6 CNc1ccc(cc1)C(C)(C)C 34a_100000210346_200000210301 [0,2,0,0,0,0|2,0,0]=4 4477 B12R1.6 CNc1ccc(cc1)C(C)(C)C 7a_100000210346_200000210301 [0,2,0,0,0,0|2,0,0]=4 4478 B12R1.6 CNc1ccc(cc1)[Si](C)(C)C 7a_100009954384_200000210301 [0,2,0,0,0,0|2,0,0]=4 4479 B12R1.6 COc1ccc(cc1)C(C)(C)C 34a_100000185729_200000210301 [0,2,0,0,0,0|1,0,0]=3 4480 B12R1.6 COc1ccc(cc1)C(C)(C)C 7a_100000185729_200000210301 [0,2,0,0,0,0|1,0,0]=3 4481 B12R1.6 COc1ccc(cc1)C(C)(C)O 34a_100000695648_200000210301 [0,2,0,0,0,0|1,0,0]=3 4482 B12R1.6 COc1ccc(cc1)C(C)(C)O 7a_100000695648_200000210301 [0,2,0,0,0,0|1,0,0]=3 4483 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 34a_100000230201_200000210301 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 7a_100000230201_200000210301 [0,2,0,0,0,0|2,0,0]=4 4485 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 34a_100000230201_200025704644 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 7a_100000230201_200025704644 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.6 CSc1ccc(cc1)C(C)(C)C 62a_100011215385_200000210301 [0,2,0,0,0,0|1,1,0]=4 4488 B12R1.6 CSc1ccc(cc1)C(C)(C)C 62a_200000210301_100011215385 [0,2,0,0,0,0|1,1,0]=4 4489 B12R1.6 CSc1ccc(cc1)C(C)(C)N 62a_100000739617_200000210301 [0,2,0,0,0,0|1,1,0]=4 4490 B12R1.6 CSc1ccc(cc1)C(C)(C)N 62a_200000210301_100000739617 [0,2,0,0,0,0|1,1,0]=4 4491 B12R1.6 CSc1ccc(cc1)C(C)(C)O 62a_100000753367_200000210301 [0,2,0,0,0,0|1,1,0]=4 4492 B12R1.6 CSc1ccc(cc1)C(C)(C)O 62a_200000210301_100000753367 [0,2,0,0,0,0|1,1,0]=4 4493 B12R1.6 CSc1ccc(cc1)[Si](C)(C)C 62a_100009813420_200000210301 [0,2,0,0,0,0|1,1,0]=4 4494 B12R1.6 CSc1ccc(cc1)[Si](C)(C)C 62a_200000210301_100009813420 [0,2,0,0,0,0|1,1,0]=4 4495 B12R1.6 C[Si](C)(C)c1ccc(cc1)N[13CH3] 7a_100009954384_200025704644 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.6 C[Si](C)(C)c1ccc(cc1)S[13CH3] 62a_100009813420_200025704644 [0,2,0,0,0,0|1,1,0]=4 4497 B12R1.6 C[Si](C)(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100009813420 [0,2,0,0,0,0|1,1,0]=4 4498 B12R1.48 C=C(C)c1ccc(c(c1)Br)CO 271570a_100000694244_100010240206 [0,2,0,0,0,0|1,0,1]=4 4499 B12R1.48 C=C(C)c1ccc(c(c1)Br)OC 271570a_100000694244_100011249507 [0,2,0,0,0,0|1,0,1]=4 4500 B12R1.48 C=C(C)c1ccc(c(c1)C)CO 271570a_100000694244_100000748258 [0,2,0,0,0,0|1,0,1]=4 4501 B12R1.48 C=C(C)c1ccc(c(c1)C)OC 271570a_100000694244_100011219705 [0,2,0,0,0,0|1,0,1]=4 4502 B12R1.48 C=C(C)c1ccc(c(c1)Cl)OC 271570a_100000694244_100012355395 [0,2,0,0,0,0|1,0,1]=4 4503 B12R1.48 C=C(C)c1ccc(c(c1)F)CO 271570a_100000694244_100011191541 [0,2,0,0,0,0|1,0,1]=4 4504 B12R1.48 C=C(C)c1ccc(c(c1)F)OC 271570a_100000694244_100000185480 [0,2,0,0,0,0|1,0,1]=4 4505 B12R1.48 C=C(C)c1ccc(c(c1)N)CO 271570a_100000694244_100000718831 [0,2,0,0,0,0|1,0,1]=4 4506 B12R1.48 C=C(C)c1ccc(c(c1)N)OC 271570a_100000694244_100000743470 [0,2,0,0,0,0|1,0,1]=4 4507 B12R1.48 C=C(C)c1ccc(c(c1)O)CO 271570a_100000694244_100000071718 [0,2,0,0,0,0|1,0,1]=4 4508 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,2,0,0,0,0|1,0,1]=4 4509 B12R1.48 C=Cc1ccc(cc1Br)C(C)C 271570a_100011290941_200010212211 [0,2,0,0,0,0|2,0,0]=4 4510 B12R1.48 C=Cc1ccc(cc1C)N(C)C 271570a_100011290941_100011934168 [0,2,0,0,0,0|1,0,0]=3 4511 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [0,2,0,0,0,0|2,0,0]=4 4512 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [0,2,0,0,0,0|2,0,0]=4 4513 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [0,2,0,0,0,0|2,0,0]=4 4516 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [0,2,0,0,0,0|2,0,0]=4 4517 B12R1.48 CC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200000210301 [0,2,0,0,0,0|2,0,0]=4 4518 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [0,2,0,0,0,0|2,0,0]=4 4519 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [0,2,0,0,0,0|2,0,0]=4 4520 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [0,2,0,0,0,0|2,0,0]=4 4521 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [0,2,0,0,0,0|2,0,0]=4 4522 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 2230a_100011218581_200025704644 [0,2,0,0,0,0|2,0,0]=4 4523 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 34a_100011218581_200025704644 [0,2,0,0,0,0|2,0,0]=4 4524 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 7a_100011218581_200025704644 [0,2,0,0,0,0|2,0,0]=4 4525 B12R1.48 CC(C)c1ccc(c(c1)Br)S[13CH3] 62a_200010212211_200025704644 [0,2,0,0,0,0|1,1,0]=4 4526 B12R1.48 CC(C)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_200010212211 [0,2,0,0,0,0|1,1,0]=4 4527 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 34a_100012182850_200025704644 [0,2,0,0,0,0|1,0,0]=3 4528 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 7a_100012182850_200025704644 [0,2,0,0,0,0|1,0,0]=3 4529 B12R1.48 CC(C)c1ccc(c(c1)I)N[13CH3] 34a_100012355998_200025704644 [0,2,0,0,0,0|2,0,0]=4 4530 B12R1.48 CC(C)c1ccc(c(c1)I)N[13CH3] 7a_100012355998_200025704644 [0,2,0,0,0,0|2,0,0]=4 4531 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 34a_200000187366_200025704644 [0,2,0,0,0,0|1,0,0]=3 4532 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 7a_200000187366_200025704644 [0,2,0,0,0,0|1,0,0]=3 4533 B12R1.48 CC(C)c1ccc(c(c1)O)C=O 271570a_203496583355_100010158967 [0,2,0,0,0,0|1,0,1]=4 4534 B12R1.48 CN(C)c1ccc(c(c1)Br)C#N 27a_100102631434_100012349582 [0,2,0,0,0,0|1,0,0]=3 4535 B12R1.48 CN(C)c1ccc(c(c1)Br)N[13CH3] 34a_200013039233_200025704644 [0,2,0,0,0,0|1,0,0]=3 4536 B12R1.48 CN(C)c1ccc(c(c1)F)C#N 27a_100102631434_100000037869 [0,2,0,0,0,0|1,0,0]=3 4537 B12R1.48 CN(C)c1ccc(c(n1)F)C=O 27a_100102631434_100010064369 [0,2,0,0,0,0|1,0,1]=4 4538 B12R1.48 CN(C)c1ccc(c(n1)F)CO 27a_100102631434_100010065253 [0,2,0,0,0,0|1,0,0]=3 4539 B12R1.48 CN(C)c1ccc(c(n1)N)C#N 27a_100102631434_100000719313 [0,2,0,0,0,0|2,0,0]=4 4540 B12R1.48 CN(C)c1ncc(c(n1)N)CO 27a_100102631434_200009965464 [0,2,0,0,0,0|2,0,0]=4 4541 B12R1.48 CN(N)c1ccc(c(c1)O)C#N 271570a_203496583355_200010713610 [0,2,0,0,0,0|2,0,0]=4 4542 B12R1.48 CNc1ccc(cc1Br)C(C)C 2230a_100011218581_200000210301 [0,2,0,0,0,0|2,0,0]=4 4543 B12R1.48 CNc1ccc(cc1Br)C(C)C 34a_100011218581_200000210301 [0,2,0,0,0,0|2,0,0]=4 4544 B12R1.48 CNc1ccc(cc1Br)C(C)C 7a_100011218581_200000210301 [0,2,0,0,0,0|2,0,0]=4 4545 B12R1.48 CNc1ccc(cc1Br)N(C)C 34a_200013039233_200000210301 [0,2,0,0,0,0|1,0,0]=3 4546 B12R1.48 CNc1ccc(cc1C)N(C)C 34a_100000246174_200000210301 [0,2,0,0,0,0|1,0,0]=3 4547 B12R1.48 CNc1ccc(cc1I)C(C)C 34a_100012355998_200000210301 [0,2,0,0,0,0|2,0,0]=4 4548 B12R1.48 CNc1ccc(cc1I)C(C)C 7a_100012355998_200000210301 [0,2,0,0,0,0|2,0,0]=4 4549 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [0,2,0,0,0,0|2,0,0]=4 4550 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [0,2,0,0,0,0|2,0,0]=4 4551 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [0,2,0,0,0,0|2,0,0]=4 4552 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [0,2,0,0,0,0|2,0,0]=4 4553 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [0,2,0,0,0,0|2,0,0]=4 4554 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [0,2,0,0,0,0|2,0,0]=4 4555 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [0,2,0,0,0,0|2,0,0]=4 4556 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [0,2,0,0,0,0|2,0,0]=4 4557 B12R1.48 COc1ccc(cc1C)C(C)C 34a_200012180908_200000210301 [0,2,0,0,0,0|1,0,0]=3 4558 B12R1.48 COc1ccc(cc1C)C(C)C 7a_200012180908_200000210301 [0,2,0,0,0,0|1,0,0]=3 4559 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [0,2,0,0,0,0|2,0,0]=4 4560 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [0,2,0,0,0,0|2,0,0]=4 4561 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [0,2,0,0,0,0|2,0,0]=4 4563 B12R1.48 COc1ccc(cc1Cl)C(C)C 34a_100012182850_200000210301 [0,2,0,0,0,0|1,0,0]=3 4564 B12R1.48 COc1ccc(cc1Cl)C(C)C 7a_100012182850_200000210301 [0,2,0,0,0,0|1,0,0]=3 4565 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [0,2,0,0,0,0|2,0,0]=4 4566 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [0,2,0,0,0,0|2,0,0]=4 4567 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [0,2,0,0,0,0|2,0,0]=4 4568 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [0,2,0,0,0,0|2,0,0]=4 4569 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [0,2,0,0,0,0|2,0,0]=4 4570 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [0,2,0,0,0,0|2,0,0]=4 4571 B12R1.48 COc1ccc(cc1I)N(C)C 269982a_114948341033_200000210301 [0,2,0,0,0,0|0,0,0]=2 4572 B12R1.48 COc1ccc(cc1I)N(C)C 34a_114948341033_200000210301 [0,2,0,0,0,0|0,0,0]=2 4573 B12R1.48 COc1ccc(cc1I)N(C)C 38a_114948341033_200000210301 [0,2,0,0,0,0|0,0,0]=2 4574 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 269982a_114948341033_200025704644 [0,2,0,0,0,0|0,0,0]=2 4575 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 34a_114948341033_200025704644 [0,2,0,0,0,0|0,0,0]=2 4576 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 38a_114948341033_200025704644 [0,2,0,0,0,0|0,0,0]=2 4577 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [0,2,0,0,0,0|2,0,0]=4 4578 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.48 COc1ccc(cc1N)C(C)C 34a_200000187366_200000210301 [0,2,0,0,0,0|1,0,0]=3 4580 B12R1.48 COc1ccc(cc1N)C(C)C 7a_200000187366_200000210301 [0,2,0,0,0,0|1,0,0]=3 4581 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,2,0,0,0,0|2,0,0]=4 4583 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,2,0,0,0,0|2,0,0]=4 4584 B12R1.48 COc1ccc(cc1O)C(C)O 271570a_203496583355_100000246541 [0,2,0,0,0,0|2,0,0]=4 4585 B12R1.48 COc1ccc(nc1F)N(C)C 27a_100102631434_100010138636 [0,2,0,0,0,0|1,0,0]=3 4586 B12R1.48 COc1cnc(nc1C)N(C)C 27a_100102631434_100010382893 [0,2,0,0,0,0|2,0,0]=4 4587 B12R1.48 CSc1ccc(cc1Br)C(C)C 62a_200000210301_200010212211 [0,2,0,0,0,0|1,1,0]=4 4588 B12R1.48 CSc1ccc(cc1Br)C(C)C 62a_200010212211_200000210301 [0,2,0,0,0,0|1,1,0]=4 4589 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_100011934168_200000210301 [0,2,0,0,0,0|0,1,0]=3 4590 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_200000210301_100011934168 [0,2,0,0,0,0|0,1,0]=3 4591 B12R1.48 Cc1cc(ccc1N[13CH3])N(C)C 34a_100000246174_200025704644 [0,2,0,0,0,0|1,0,0]=3 4592 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 34a_200012180908_200025704644 [0,2,0,0,0,0|1,0,0]=3 4593 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 7a_200012180908_200025704644 [0,2,0,0,0,0|1,0,0]=3 4594 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_100011934168_200025704644 [0,2,0,0,0,0|0,1,0]=3 4595 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_200025704644_100011934168 [0,2,0,0,0,0|0,1,0]=3 4596 B12R1.48 Cc1cc(ncc1C#N)N(C)C 27a_100102631434_100012183107 [0,2,0,0,0,0|2,0,0]=4 4597 B12R1.48 Cc1nc(ccc1C#N)N(C)C 27a_100102631434_100000756285 [0,2,0,0,0,0|2,0,0]=4 4598 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200025704644 [0,2,0,0,0,0|2,0,0]=4 4599 B12R1.113 C=C(C)c1ccc(cc1)CCO 271570a_100000694244_100000766406 [0,2,0,0,0,0|1,0,1]=4 4600 B12R1.113 C=C(C)c1ccc(cc1)COC 271570a_100000694244_100011493685 [0,2,0,0,0,0|1,0,1]=4 4601 B12R1.113 C=C(C)c1ccc(cc1)OCC 271570a_100000694244_100000169946 [0,2,0,0,0,0|1,0,1]=4 4602 B12R1.113 C=C(C)c1ccc(cc1)OCC 34a_100009880102_100000210202 [0,2,0,0,0,0|1,0,1]=4 4603 B12R1.113 C=C(C)c1ccc(cc1)OCC 7a_100009880102_100000210202 [0,2,0,0,0,0|1,0,1]=4 4604 B12R1.113 C=C(C)c1ccc(cc1)OCF 34a_100009880102_100015361967 [0,2,0,0,0,0|1,0,1]=4 4605 B12R1.113 C=C(C)c1ccc(cc1)OCF 7a_100009880102_100015361967 [0,2,0,0,0,0|1,0,1]=4 4606 B12R1.113 C=C=Cc1ccc(cc1)C(C)C 271570a_100015277604_100000750031 [0,2,0,0,0,0|2,0,0]=4 4607 B12R1.113 C=C=Cc1ccc(cc1)N(C)C 271570a_100015277604_100000210421 [0,2,0,0,0,0|1,0,0]=3 4608 B12R1.113 C=C=Cc1ccc(cn1)N(C)C 271570a_100015277604_100009992925 [0,2,0,0,0,0|2,0,0]=4 4609 B12R1.113 C=C=Cc1ccc(nc1)N(C)C 271570a_100015277604_100011465347 [0,2,0,0,0,0|2,0,0]=4 4610 B12R1.113 CC(=O)c1ccc(cc1)CCO 1458a_100000078963_200000210301 [0,2,0,0,0,0|2,0,0]=4 4611 B12R1.113 CC(=O)c1ccc(cc1)CO[13CH3] 7a_100000082505_200025704644 [0,2,0,0,0,0|2,0,0]=4 4612 B12R1.113 CC(=O)c1ccc(cc1)OCF 34a_100000185113_100015361967 [0,2,0,0,0,0|2,0,0]=4 4613 B12R1.113 CC(=O)c1ccc(cc1)OCF 7a_100000185113_100015361967 [0,2,0,0,0,0|2,0,0]=4 4614 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 2230a_100000174979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 34a_100000174979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4616 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 34a_100000181325_200025704644 [0,2,0,0,0,0|1,0,0]=3 4617 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 7a_100000181325_200025704644 [0,2,0,0,0,0|1,0,0]=3 4618 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_100000181262_200025704644 [0,2,0,0,0,0|1,1,0]=4 4619 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000181262 [0,2,0,0,0,0|1,1,0]=4 4620 B12R1.113 CC(C)c1ccc(cc1)NCF 34a_100000210773_100015361967 [0,2,0,0,0,0|2,0,0]=4 4621 B12R1.113 CC(C)c1ccc(cc1)NCF 7a_100000210773_100015361967 [0,2,0,0,0,0|2,0,0]=4 4622 B12R1.113 CC(C)c1ccc(cc1)OCF 34a_100000181308_100015361967 [0,2,0,0,0,0|1,0,0]=3 4623 B12R1.113 CC(C)c1ccc(cc1)OCF 7a_100000181308_100015361967 [0,2,0,0,0,0|1,0,0]=3 4624 B12R1.113 CC(C)c1ccc(cc1)SCF 62a_100000750031_100015361967 [0,2,0,0,0,0|1,1,0]=4 4625 B12R1.113 CC(C)c1ccc(cc1)SCF 62a_100015361967_100000750031 [0,2,0,0,0,0|1,1,0]=4 4626 B12R1.113 CC(O)c1ccc(cc1)OCF 34a_100000754508_100015361967 [0,2,0,0,0,0|2,0,0]=4 4627 B12R1.113 CC(O)c1ccc(cc1)OCF 7a_100000754508_100015361967 [0,2,0,0,0,0|2,0,0]=4 4628 B12R1.113 CC=Cc1ccc(cc1)C(C)C 271570a_100016259895_100000750031 [0,2,0,0,0,0|2,0,0]=4 4629 B12R1.113 CC=Cc1ccc(cc1)N(C)C 271570a_100016259895_100000210421 [0,2,0,0,0,0|1,0,0]=3 4630 B12R1.113 CC=Cc1ccc(cn1)N(C)C 271570a_100016259895_100009992925 [0,2,0,0,0,0|2,0,0]=4 4631 B12R1.113 CC=Cc1ccc(nc1)N(C)C 271570a_100016259895_100011465347 [0,2,0,0,0,0|2,0,0]=4 4632 B12R1.113 CCNc1ccc(cc1)C(C)C 2230a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 4633 B12R1.113 CCNc1ccc(cc1)C(C)C 34a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 4634 B12R1.113 CCNc1ccc(cc1)C(C)C 7a_100000210773_100000210202 [0,2,0,0,0,0|2,0,0]=4 4635 B12R1.113 CCNc1ccc(cc1)N(C)C 34a_100016997997_100000210202 [0,2,0,0,0,0|1,0,0]=3 4636 B12R1.113 CCOc1ccc(cc1)C(=O)C 1458a_100000181891_200000210301 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.113 CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210202 [0,2,0,0,0,0|2,0,0]=4 4638 B12R1.113 CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210202 [0,2,0,0,0,0|2,0,0]=4 4639 B12R1.113 CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000181891_200025704644 [0,2,0,0,0,0|2,0,0]=4 4640 B12R1.113 CCOc1ccc(cc1)C(C)C 34a_100000181308_100000210202 [0,2,0,0,0,0|1,0,0]=3 4641 B12R1.113 CCOc1ccc(cc1)C(C)C 7a_100000181308_100000210202 [0,2,0,0,0,0|1,0,0]=3 4642 B12R1.113 CCOc1ccc(cc1)C(C)O 34a_100000754508_100000210202 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.113 CCOc1ccc(cc1)C(C)O 7a_100000754508_100000210202 [0,2,0,0,0,0|2,0,0]=4 4644 B12R1.113 CCOc1ccc(cc1)N(C)C 2230a_100025784348_200000210301 [0,2,0,0,0,0|0,0,0]=2 4645 B12R1.113 CCOc1ccc(cc1)N(C)C 269982a_100025784348_200000210301 [0,2,0,0,0,0|0,0,0]=2 4646 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100000718910_100000210202 [0,2,0,0,0,0|0,0,0]=2 4647 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100025784348_200000210301 [0,2,0,0,0,0|0,0,0]=2 4648 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 2230a_100025784348_200025704644 [0,2,0,0,0,0|0,0,0]=2 4649 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 269982a_100025784348_200025704644 [0,2,0,0,0,0|0,0,0]=2 4650 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 34a_100025784348_200025704644 [0,2,0,0,0,0|0,0,0]=2 4651 B12R1.113 CCOc1ccc(cc1)S(=O)C 34a_200000064373_100000210202 [0,2,0,0,0,0|2,0,0]=4 4652 B12R1.113 CCOc1ccc(cc1)S(=O)C 7a_200000064373_100000210202 [0,2,0,0,0,0|2,0,0]=4 4653 B12R1.113 CCOc1ccc(cc1)[C@H](C)N 34a_100161106496_100000210202 [0,2,0,0,0,0|2,0,0]=4 4654 B12R1.113 CCOc1ccc(cc1)[S+](C)C 34a_100010188728_100000210202 [0,2,0,0,0,0|1,0,0]=3 4655 B12R1.113 CCOc1ccc(cc1)[S+](C)C 7a_100010188728_100000210202 [0,2,0,0,0,0|1,0,0]=3 4656 B12R1.113 CCOc1ccc(nn1)N(C)C 27a_100102631434_100000757289 [0,2,0,0,0,0|2,0,0]=4 4657 B12R1.113 CCOc1cnc(nc1)N(C)C 27a_100102631434_100000099823 [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000210202_100000750031 [0,2,0,0,0,0|1,1,0]=4 4659 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000750031_100000210202 [0,2,0,0,0,0|1,1,0]=4 4660 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210202_100000210421 [0,2,0,0,0,0|0,1,0]=3 4661 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210421_100000210202 [0,2,0,0,0,0|0,1,0]=3 4662 B12R1.113 CCSc1ccc(cn1)N(C)C 62a_100000210202_100009992925 [0,2,0,0,0,0|1,1,0]=4 4663 B12R1.113 CCSc1ccc(cn1)N(C)C 62a_100009992925_100000210202 [0,2,0,0,0,0|1,1,0]=4 4664 B12R1.113 CCSc1ccc(nc1)N(C)C 62a_100000210202_100011465347 [0,2,0,0,0,0|1,1,0]=4 4665 B12R1.113 CCSc1ccc(nc1)N(C)C 62a_100011465347_100000210202 [0,2,0,0,0,0|1,1,0]=4 4666 B12R1.113 CN(C)c1ccc(cc1)CO[13CH3] 34a_100000238745_200025704644 [0,2,0,0,0,0|0,0,0]=2 4667 B12R1.113 CN(C)c1ccc(cc1)NCF 34a_100016997997_100015361967 [0,2,0,0,0,0|1,0,0]=3 4668 B12R1.113 CN(C)c1ccc(cc1)OCF 34a_100000718910_100015361967 [0,2,0,0,0,0|0,0,0]=2 4669 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100000210421_100015361967 [0,2,0,0,0,0|0,1,0]=3 4670 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100015361967_100000210421 [0,2,0,0,0,0|0,1,0]=3 4671 B12R1.113 CN(C)c1ccc(cn1)CN[13CH3] 2230a_100000738136_200025704644 [0,2,0,0,0,0|2,0,0]=4 4672 B12R1.113 CN(C)c1ccc(cn1)SCF 62a_100011465347_100015361967 [0,2,0,0,0,0|1,1,0]=4 4673 B12R1.113 CN(C)c1ccc(cn1)SCF 62a_100015361967_100011465347 [0,2,0,0,0,0|1,1,0]=4 4674 B12R1.113 CN(C)c1ccc(nc1)SCF 62a_100009992925_100015361967 [0,2,0,0,0,0|1,1,0]=4 4675 B12R1.113 CN(C)c1ccc(nc1)SCF 62a_100015361967_100009992925 [0,2,0,0,0,0|1,1,0]=4 4676 B12R1.113 CNCc1ccc(cc1)C(C)C 207a_100102657272_100000210693 [0,2,0,0,0,0|2,0,0]=4 4677 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_100000174979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4678 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_106832991635_100000181262 [0,2,0,0,0,0|2,0,0]=4 4679 B12R1.113 CNCc1ccc(cc1)C(C)C 26a_100102657272_100000181308 [0,2,0,0,0,0|2,0,0]=4 4680 B12R1.113 CNCc1ccc(cc1)C(C)C 270004a_106832991635_100000210693 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100000174979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100102657272_100000181262 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.113 CNCc1ccc(cc1)C(C)C 7a_106832991635_100000181262 [0,2,0,0,0,0|2,0,0]=4 4684 B12R1.113 CNCc1ccc(cc1)N(C)C 207a_100102657272_100000185837 [0,2,0,0,0,0|1,0,0]=3 4685 B12R1.113 CNCc1ccc(cc1)N(C)C 270004a_106832991635_100000185837 [0,2,0,0,0,0|1,0,0]=3 4686 B12R1.113 CNCc1ccc(cc1)[S+](C)C 26a_100102657272_100010188728 [0,2,0,0,0,0|2,0,0]=4 4687 B12R1.113 CNCc1ccc(nc1)N(C)C 207a_100102657272_100000693196 [0,2,0,0,0,0|2,0,0]=4 4688 B12R1.113 CNCc1ccc(nc1)N(C)C 2230a_100000738136_200000210301 [0,2,0,0,0,0|2,0,0]=4 4689 B12R1.113 CNCc1ccc(nc1)N(C)C 270004a_106832991635_100000693196 [0,2,0,0,0,0|2,0,0]=4 4690 B12R1.113 COCc1ccc(cc1)C(=O)C 1458a_100000189608_200000210301 [0,2,0,0,0,0|2,0,0]=4 4691 B12R1.113 COCc1ccc(cc1)C(=O)C 34a_100138415774_100000756337 [0,2,0,0,0,0|2,0,0]=4 4692 B12R1.113 COCc1ccc(cc1)C(=O)C 7a_100000082505_200000210301 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.113 COCc1ccc(cc1)C(=O)[13CH3] 1458a_100000189608_200025704644 [0,2,0,0,0,0|2,0,0]=4 4694 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100000181325_200000210301 [0,2,0,0,0,0|1,0,0]=3 4695 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100138415774_100000181262 [0,2,0,0,0,0|1,0,0]=3 4696 B12R1.113 COCc1ccc(cc1)C(C)C 7a_100000181325_200000210301 [0,2,0,0,0,0|1,0,0]=3 4697 B12R1.113 COCc1ccc(cc1)N(C)C 34a_100000238745_200000210301 [0,2,0,0,0,0|0,0,0]=2 4698 B12R1.113 CS(=O)c1ccc(cc1)OCF 34a_200000064373_100015361967 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.113 CS(=O)c1ccc(cc1)OCF 7a_200000064373_100015361967 [0,2,0,0,0,0|2,0,0]=4 4700 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_100000181262_200000210301 [0,2,0,0,0,0|1,1,0]=4 4701 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_200000210301_100000181262 [0,2,0,0,0,0|1,1,0]=4 4702 B12R1.113 C[C@H](N)c1ccc(cc1)OCF 34a_100161106496_100015361967 [0,2,0,0,0,0|2,0,0]=4 4703 B12R1.113 C[S+](C)c1ccc(cc1)OCF 34a_100010188728_100015361967 [0,2,0,0,0,0|1,0,0]=3 4704 B12R1.113 C[S+](C)c1ccc(cc1)OCF 7a_100010188728_100015361967 [0,2,0,0,0,0|1,0,0]=3 4705 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CCO 1458a_100000078963_200025704644 [0,2,0,0,0,0|2,0,0]=4 4706 B12R1.256 C=C(C)c1ccc(cc1)B(O)O 271570a_100000694244_100000754493 [0,2,0,0,0,0|1,0,1]=4 4707 B12R1.256 C=C(C)c1ccc(cc1)C(C)C 271570a_100000694244_100000750031 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.256 C=C(C)c1ccc(cc1)C(C)O 271570a_100000694244_100000745893 [0,2,0,0,0,0|1,0,1]=4 4709 B12R1.256 C=C(C)c1ccc(cc1)N(C)C 271570a_100000694244_100000210421 [0,2,0,0,0,0|1,0,0]=3 4710 B12R1.256 C=C(C)c1ccc(cn1)N(C)C 271570a_100000694244_100009992925 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.256 C=C(C)c1ccc(nc1)N(C)C 271570a_100000694244_100011465347 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.256 CC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_200000210301 [0,2,0,0,0,0|1,0,1]=4 4713 B12R1.256 CC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_200000210301 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.256 CC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_200000210301 [0,2,0,0,0,0|0,0,1]=3 4715 B12R1.256 CC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000690552 [0,2,0,0,0,0|1,0,1]=4 4716 B12R1.256 CC(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210772_200025704644 [0,2,0,0,0,0|1,0,1]=4 4717 B12R1.256 CC(C)c1ccc(cc1)N(C)C 2230a_100000688768_200000210301 [0,2,0,0,0,0|1,0,0]=3 4718 B12R1.256 CC(C)c1ccc(cc1)N(C)C 269982a_100000688768_200000210301 [0,2,0,0,0,0|1,0,0]=3 4719 B12R1.256 CC(C)c1ccc(cc1)N(C)C 34a_100000688768_200000210301 [0,2,0,0,0,0|1,0,0]=3 4720 B12R1.256 CC(C)c1ccc(cc1)N(C)C 38a_100000688768_200000210301 [0,2,0,0,0,0|1,0,0]=3 4721 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 2230a_100000688768_200025704644 [0,2,0,0,0,0|1,0,0]=3 4722 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 269982a_100000688768_200025704644 [0,2,0,0,0,0|1,0,0]=3 4723 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 34a_100000688768_200025704644 [0,2,0,0,0,0|1,0,0]=3 4724 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 38a_100000688768_200025704644 [0,2,0,0,0,0|1,0,0]=3 4725 B12R1.256 CC(O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000076921_200025704644 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.256 CN(C)c1ccc(cc1)C(=O)N 27a_100102631434_100000162191 [0,2,0,0,0,0|0,0,1]=3 4727 B12R1.256 CN(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210873_200025704644 [0,2,0,0,0,0|0,0,1]=3 4728 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200000210301 [0,2,0,0,0,0|0,0,1]=3 4729 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200000210301 [0,2,0,0,0,0|0,0,1]=3 4730 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200000210301 [0,2,0,0,0,0|0,0,1]=3 4731 B12R1.256 CN(C)c1ccc(cn1)C(=O)N 27a_100102631434_100000162237 [0,2,0,0,0,0|1,0,1]=4 4732 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200025704644 [0,2,0,0,0,0|0,0,1]=3 4733 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200025704644 [0,2,0,0,0,0|0,0,1]=3 4734 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200025704644 [0,2,0,0,0,0|0,0,1]=3 4735 B12R1.452 C=C(C)c1ccc(cc1Br)OC 271570a_100000694244_100012349170 [0,2,0,0,0,0|1,0,1]=4 4736 B12R1.452 C=C(C)c1ccc(cc1C)CO 271570a_100000694244_100000718852 [0,2,0,0,0,0|1,0,1]=4 4737 B12R1.452 C=C(C)c1ccc(cc1C)OC 271570a_100000694244_100000759875 [0,2,0,0,0,0|1,0,1]=4 4738 B12R1.452 C=C(C)c1ccc(cc1Cl)CO 271570a_100000694244_100000718186 [0,2,0,0,0,0|1,0,1]=4 4739 B12R1.452 C=C(C)c1ccc(cc1F)CO 271570a_100000694244_100011533735 [0,2,0,0,0,0|1,0,1]=4 4740 B12R1.452 C=C(C)c1ccc(cc1F)OC 271570a_100000694244_100000753793 [0,2,0,0,0,0|1,0,1]=4 4741 B12R1.452 C=C(C)c1ccc(cc1N)CO 271570a_100000694244_100012347568 [0,2,0,0,0,0|1,0,1]=4 4742 B12R1.452 C=C(C)c1ccc(cc1N)OC 271570a_100000694244_100000748021 [0,2,0,0,0,0|1,0,1]=4 4743 B12R1.452 C=C(C)c1ccc(cc1O)CO 271570a_100000694244_100000049605 [0,2,0,0,0,0|1,0,1]=4 4744 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [0,2,0,0,0,0|1,0,1]=4 4745 B12R1.452 C=Cc1ccc(c(c1)N)N(C)C 271570a_100011290941_100000737018 [0,2,0,0,0,0|1,0,0]=3 4746 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.452 CC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200000210301 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.452 CC(=O)c1ccc(cc1F)CO 1458a_100011934814_200000210301 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.452 CN(C)c1ccc(cc1Cl)N[13CH3] 34a_100000742791_200025704644 [0,2,0,0,0,0|1,0,0]=3 4757 B12R1.452 CN(C)c1ccc(cc1F)N[13CH3] 34a_100011248830_200025704644 [0,2,0,0,0,0|1,0,0]=3 4758 B12R1.452 CN(C)c1ccc(cc1I)C#N 269982a_200020994358_200000210301 [0,2,0,0,0,0|1,0,0]=3 4759 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_100000737018_200025704644 [0,2,0,0,0,0|0,1,0]=3 4760 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_200025704644_100000737018 [0,2,0,0,0,0|0,1,0]=3 4761 B12R1.452 CN(C)c1ccc(cc1O)C=O 271570a_203496583355_200011298039 [0,2,0,0,0,0|0,0,1]=3 4762 B12R1.452 CN(C)c1ncc(cc1F)C#N 27a_100102631434_100000097480 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.452 CN([13CH3])c1ccc(cc1I)C#N 269982a_200020994358_200025704644 [0,2,0,0,0,0|1,0,0]=3 4764 B12R1.452 CNc1ccc(c(c1)C)C(C)C 2230a_100000005830_200000210301 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.452 CNc1ccc(c(c1)C)C(C)C 34a_100000005830_200000210301 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.452 CNc1ccc(c(c1)C)C(C)C 7a_100000005830_200000210301 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.452 CNc1ccc(c(c1)C)N(C)C 34a_100000738307_200000210301 [0,2,0,0,0,0|1,0,0]=3 4768 B12R1.452 CNc1ccc(c(c1)Cl)N(C)C 34a_100000742791_200000210301 [0,2,0,0,0,0|1,0,0]=3 4769 B12R1.452 CNc1ccc(c(c1)F)N(C)C 34a_100011248830_200000210301 [0,2,0,0,0,0|1,0,0]=3 4770 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [0,2,0,0,0,0|2,0,0]=4 4771 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [0,2,0,0,0,0|2,0,0]=4 4772 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [0,2,0,0,0,0|2,0,0]=4 4775 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.452 COc1ccc(c(c1)C)C(C)C 34a_100000210824_200000210301 [0,2,0,0,0,0|1,0,0]=3 4779 B12R1.452 COc1ccc(c(c1)C)C(C)C 7a_100000210824_200000210301 [0,2,0,0,0,0|1,0,0]=3 4780 B12R1.452 COc1ccc(c(c1)C)N(C)C 2230a_103496583619_200000210301 [0,2,0,0,0,0|0,0,0]=2 4781 B12R1.452 COc1ccc(c(c1)C)N(C)C 269982a_103496583619_200000210301 [0,2,0,0,0,0|0,0,0]=2 4782 B12R1.452 COc1ccc(c(c1)C)N(C)C 34a_103496583619_200000210301 [0,2,0,0,0,0|0,0,0]=2 4783 B12R1.452 COc1ccc(c(c1)C)N(C)C 38a_103496583619_200000210301 [0,2,0,0,0,0|0,0,0]=2 4784 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 2230a_103496583619_200025704644 [0,2,0,0,0,0|0,0,0]=2 4785 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 269982a_103496583619_200025704644 [0,2,0,0,0,0|0,0,0]=2 4786 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 34a_103496583619_200025704644 [0,2,0,0,0,0|0,0,0]=2 4787 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 38a_103496583619_200025704644 [0,2,0,0,0,0|0,0,0]=2 4788 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [0,2,0,0,0,0|2,0,0]=4 4789 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [0,2,0,0,0,0|2,0,0]=4 4792 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [0,2,0,0,0,0|2,0,0]=4 4793 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [0,2,0,0,0,0|2,0,0]=4 4794 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [0,2,0,0,0,0|2,0,0]=4 4797 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [0,2,0,0,0,0|2,0,0]=4 4798 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [0,2,0,0,0,0|2,0,0]=4 4800 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.452 COc1ccc(c(c1)O)C(C)O 271570a_203496583355_100000697252 [0,2,0,0,0,0|2,0,0]=4 4802 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_100000737018_200000210301 [0,2,0,0,0,0|0,1,0]=3 4803 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_200000210301_100000737018 [0,2,0,0,0,0|0,1,0]=3 4804 B12R1.452 CSc1cnc(c(c1)C)N(C)C 27a_100102631434_203440288091 [0,2,0,0,0,0|1,1,0]=4 4805 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 2230a_100000005830_200025704644 [0,2,0,0,0,0|2,0,0]=4 4806 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 34a_100000005830_200025704644 [0,2,0,0,0,0|2,0,0]=4 4807 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 7a_100000005830_200025704644 [0,2,0,0,0,0|2,0,0]=4 4808 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 34a_100000210824_200025704644 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 7a_100000210824_200025704644 [0,2,0,0,0,0|1,0,0]=3 4810 B12R1.452 Cc1cc(ccc1N(C)C)N[13CH3] 34a_100000738307_200025704644 [0,2,0,0,0,0|1,0,0]=3 4811 B12R1.452 Cc1cc(cnc1N(C)C)C#N 27a_100102631434_100000719225 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200025704644 [0,2,0,0,0,0|2,0,0]=4 4813 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)CO 1458a_100011934814_200025704644 [0,2,0,0,0,0|2,0,0]=4 4814 B12R1.9 CC(C)(C#N)c1ccc(cc1)O 271570a_203496583355_100000740055 [0,2,0,0,0,0|1,0,0]=3 4815 B12R1.9 CC(C)(C#N)c1ccc(cn1)O 271570a_203496583355_100012353963 [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.9 CC(C)(C=O)c1ccc(cc1)O 271570a_203496583355_100010228009 [0,2,0,0,0,0|1,0,0]=3 4817 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)Br 2230a_100000739617_200025704644 [0,2,0,0,0,0|2,0,0]=4 4818 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)Cl 2230a_100000750703_200025704644 [0,2,0,0,0,0|2,0,0]=4 4819 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)F 2230a_100015193028_200025704644 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.9 CC(C)(N[13CH3])c1ccc(cc1)F 34a_100015193028_200025704644 [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Br 34a_100000753367_200025704644 [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Br 7a_100000753367_200025704644 [0,2,0,0,0,0|2,0,0]=4 4823 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Cl 34a_100000750429_200025704644 [0,2,0,0,0,0|2,0,0]=4 4824 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Cl 7a_100000750429_200025704644 [0,2,0,0,0,0|2,0,0]=4 4825 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)F 34a_100011219992_200025704644 [0,2,0,0,0,0|2,0,0]=4 4826 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)F 7a_100011219992_200025704644 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.9 CCC(F)(F)c1ccc(cc1)O 271570a_203496583355_100010208532 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.9 CNC(C)(C)c1ccc(cc1)Br 2230a_100000739617_200000210301 [0,2,0,0,0,0|2,0,0]=4 4830 B12R1.9 CNC(C)(C)c1ccc(cc1)C 2230a_200011345931_200000210301 [0,2,0,0,0,0|2,0,0]=4 4831 B12R1.9 CNC(C)(C)c1ccc(cc1)C 34a_200011345931_200000210301 [0,2,0,0,0,0|2,0,0]=4 4832 B12R1.9 CNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_200000210301 [0,2,0,0,0,0|2,0,0]=4 4833 B12R1.9 CNC(C)(C)c1ccc(cc1)F 2230a_100015193028_200000210301 [0,2,0,0,0,0|2,0,0]=4 4834 B12R1.9 CNC(C)(C)c1ccc(cc1)F 34a_100015193028_200000210301 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,2,0,0,0,0|2,0,0]=4 4838 B12R1.9 COC(C)(C)c1ccc(cc1)Br 34a_100000753367_200000210301 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.9 COC(C)(C)c1ccc(cc1)Br 7a_100000753367_200000210301 [0,2,0,0,0,0|2,0,0]=4 4840 B12R1.9 COC(C)(C)c1ccc(cc1)C 34a_200011345916_200000210301 [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.9 COC(C)(C)c1ccc(cc1)C 7a_200011345916_200000210301 [0,2,0,0,0,0|2,0,0]=4 4842 B12R1.9 COC(C)(C)c1ccc(cc1)Cl 34a_100000750429_200000210301 [0,2,0,0,0,0|2,0,0]=4 4843 B12R1.9 COC(C)(C)c1ccc(cc1)Cl 7a_100000750429_200000210301 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.9 COC(C)(C)c1ccc(cc1)F 34a_100011219992_200000210301 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.9 COC(C)(C)c1ccc(cc1)F 7a_100011219992_200000210301 [0,2,0,0,0,0|2,0,0]=4 4846 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 2230a_200011345931_200025704644 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 34a_200011345931_200025704644 [0,2,0,0,0,0|2,0,0]=4 4849 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 34a_200011345916_200025704644 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 7a_200011345916_200025704644 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.23 CC(C)(C)c1ccc(c(c1)Br)O 271570a_203496583355_100010212221 [0,2,0,0,0,0|1,0,0]=3 4852 B12R1.23 CC(C)(C)c1ccc(c(c1)N)O 271570a_203496583355_100010244637 [0,2,0,0,0,0|1,0,0]=3 4853 B12R1.23 CC(C)(C)c1ccc(c(c1)O)Br 271570a_203496583355_100015717115 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.23 CC(C)(C)c1ccc(c(c1)O)F 271570a_203496583355_100010244540 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.23 CC(C)(C)c1ccc(c(c1)O)N 271570a_203496583355_100012338886 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.23 CC(C)(C)c1ccc(c(c1)O)O 271570a_203496583355_100010201833 [0,2,0,0,0,0|1,0,0]=3 4857 B12R1.23 CC(C)(C)c1ccc(c(c1)O)O 271570a_203496583355_100012359415 [0,2,0,0,0,0|1,0,0]=3 4858 B12R1.23 CS(=O)(=O)c1ccc(c(c1)F)O 271570a_203496583355_100010234714 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.23 CS(=O)(=O)c1ccc(c(c1)N)O 271570a_203496583355_200015322649 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)C 271570a_203496583355_200010713620 [0,2,0,0,0,0|2,0,0]=4 4861 B12R1.126 CC(C)(C)c1ccc(cc1O)N 271570a_203496583355_100010219255 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.126 CS(=O)(=O)c1ccc(cc1F)O 271570a_203496583355_100010245844 [0,2,0,0,0,0|2,0,0]=4 4863 B12R1.126 Cc1cc(ccc1S(=O)(=O)C)O 271570a_203496583355_100010713630 [0,2,0,0,0,0|2,0,0]=4 4864 B12R1.56 C=C(C)c1ccc(c(c1)C#N)O 271570a_100000694244_100000687585 [0,2,0,0,0,0|1,0,1]=4 4865 B12R1.56 C=C(C)c1ccc(c(c1)C=O)O 271570a_100000694244_100000186750 [0,2,0,0,0,0|1,0,1]=4 4866 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,2,0,0,0,0|1,0,1]=4 4867 B12R1.56 C=C(C)c1ccc(c(c1)CN)O 271570a_100000694244_100000730032 [0,2,0,0,0,0|1,0,1]=4 4868 B12R1.56 C=C(C)c1ccc(c(c1)CO)O 271570a_100000694244_100000184703 [0,2,0,0,0,0|1,0,1]=4 4869 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,2,0,0,0,0|1,0,1]=4 4870 B12R1.56 C=Cc1cc(ccc1N)C(C)C 271570a_100011290941_100011218581 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.56 C=Cc1cc(ccc1N)N(C)C 271570a_100011290941_200013039233 [0,2,0,0,0,0|1,0,0]=3 4872 B12R1.56 C=Cc1cc(ccc1O)C(=O)C 271570a_100011290941_100011772453 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 34a_200000187366_200025704644 [0,2,0,0,0,0|1,0,0]=3 4877 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 7a_200000187366_200025704644 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_100011218581_200025704644 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100011218581 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.56 CN(C)c1cc(c(cn1)F)C#N 27a_100102631434_100000709737 [0,2,0,0,0,0|2,0,0]=4 4881 B12R1.56 CN(C)c1ccc(c(c1)S[13CH3])N 62a_200013039233_200025704644 [0,2,0,0,0,0|1,0,0]=3 4882 B12R1.56 CN(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_200013039233 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.56 CN(C)c1ccc(c(n1)C#N)F 27a_100102631434_100000722900 [0,2,0,0,0,0|2,0,0]=4 4884 B12R1.56 CN(C)c1cnc(c(c1)C#N)F 27a_100102631434_100010136711 [0,2,0,0,0,0|2,0,0]=4 4885 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4886 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4887 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [0,2,0,0,0,0|2,0,0]=4 4888 B12R1.56 CNc1cc(ccc1C)N(C)C 34a_100015186894_200000210301 [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.56 CNc1cc(ccc1O)C(C)C 34a_200000187366_200000210301 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.56 CNc1cc(ccc1O)C(C)C 7a_200000187366_200000210301 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [0,2,0,0,0,0|2,0,0]=4 4892 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [0,2,0,0,0,0|2,0,0]=4 4893 B12R1.56 COc1cc(ccc1F)N(C)C 2230a_200012002703_200000210301 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.56 COc1cc(ccc1F)N(C)C 269982a_200012002703_200000210301 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.56 COc1cc(ccc1F)N(C)C 34a_200012002703_200000210301 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.56 COc1cc(ccc1F)N(C)C 38a_200012002703_200000210301 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 2230a_200012002703_200025704644 [0,2,0,0,0,0|1,0,0]=3 4898 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 269982a_200012002703_200025704644 [0,2,0,0,0,0|1,0,0]=3 4899 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 34a_200012002703_200025704644 [0,2,0,0,0,0|1,0,0]=3 4900 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 38a_200012002703_200025704644 [0,2,0,0,0,0|1,0,0]=3 4901 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,2,0,0,0,0|2,0,0]=4 4902 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,2,0,0,0,0|2,0,0]=4 4903 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,2,0,0,0,0|2,0,0]=4 4904 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,2,0,0,0,0|1,0,0]=3 4905 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_100011218581_200000210301 [0,2,0,0,0,0|2,0,0]=4 4906 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_200000210301_100011218581 [0,2,0,0,0,0|2,0,0]=4 4907 B12R1.56 CSc1cc(ccc1N)N(C)C 62a_200000210301_200013039233 [0,2,0,0,0,0|1,0,0]=3 4908 B12R1.56 CSc1cc(ccc1N)N(C)C 62a_200013039233_200000210301 [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,2,0,0,0,0|2,0,0]=4 4910 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4911 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.56 Cc1ccc(cc1N[13CH3])N(C)C 34a_100015186894_200025704644 [0,2,0,0,0,0|1,0,0]=3 4914 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.56 Cc1ccc(nc1C#N)N(C)C 27a_100102631434_100009885930 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [0,2,0,0,0,0|2,0,0]=4 4918 B12R1.232 C=C(C)c1cc(c(cc1C)O)C 271570a_100000694244_100000698207 [0,2,0,0,0,0|1,0,1]=4 4919 B12R1.232 C=C(C)c1cc(c(cc1C)O)F 271570a_100000694244_100012355673 [0,2,0,0,0,0|1,0,1]=4 4920 B12R1.232 C=C(C)c1cc(c(cc1C)O)N 271570a_100000694244_200010235796 [0,2,0,0,0,0|1,0,1]=4 4921 B12R1.232 C=C(C)c1cc(c(cc1Cl)O)N 271570a_100000694244_100011011175 [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.232 C=C(C)c1cc(c(cc1F)O)F 271570a_100000694244_100011830439 [0,2,0,0,0,0|1,0,1]=4 4923 B12R1.232 C=C(C)c1cc(c(cc1F)O)N 271570a_100000694244_100012359894 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.232 CC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200000210301 [0,2,0,0,0,0|2,0,0]=4 4925 B12R1.232 CC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100012024335 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.232 Cc1cc(c(nc1F)N(C)C)N 27a_100102631434_100010134903 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200025704644 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000743459_200025704644 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000743459_200025704644 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 2230a_100000756309_200025704644 [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 34a_100000756309_200025704644 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Br)F 34a_100011191524_200025704644 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Br)F 7a_100011191524_200025704644 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000742046_200025704644 [0,2,0,0,0,0|2,0,0]=4 4939 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Cl)Cl 7a_100000742046_200025704644 [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)Cl 34a_100011944057_200025704644 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)Cl 7a_100011944057_200025704644 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)F 34a_100000246517_200025704644 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)F 7a_100000246517_200025704644 [0,2,0,0,0,0|2,0,0]=4 4944 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,2,0,0,0,0|2,0,0]=4 4947 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,2,0,0,0,0|2,0,0]=4 4948 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 2230a_100000707694_100000210202 [0,2,0,0,0,0|1,0,0]=3 4952 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 269982a_100000707694_100000204670 [0,2,0,0,0,0|1,0,0]=3 4953 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 34a_100000707694_100000210202 [0,2,0,0,0,0|1,0,0]=3 4954 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 38a_100000707694_100000204670 [0,2,0,0,0,0|1,0,0]=3 4955 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100015183089_200000210301 [0,2,0,0,0,0|1,0,0]=3 4956 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100102888905_100000210202 [0,2,0,0,0,0|1,0,0]=3 4957 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100015183089_200000210301 [0,2,0,0,0,0|1,0,0]=3 4958 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100102888905_100000204670 [0,2,0,0,0,0|1,0,0]=3 4959 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100015183089_200000210301 [0,2,0,0,0,0|1,0,0]=3 4960 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100102888905_100000210202 [0,2,0,0,0,0|1,0,0]=3 4961 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 7a_100015183089_200000210301 [0,2,0,0,0,0|1,0,0]=3 4962 B12R1.367 CCN(C)c1ccc(c(c1)C)C 2230a_106256033975_200000210301 [0,2,0,0,0,0|1,0,0]=3 4963 B12R1.367 CCN(C)c1ccc(c(c1)C)C 269982a_106256033975_200000210301 [0,2,0,0,0,0|1,0,0]=3 4964 B12R1.367 CCN(C)c1ccc(c(c1)C)C 34a_106256033975_200000210301 [0,2,0,0,0,0|1,0,0]=3 4965 B12R1.367 CCN(C)c1ccc(c(c1)C)C 7a_106256033975_200000210301 [0,2,0,0,0,0|1,0,0]=3 4966 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 2230a_114849113799_100000210202 [0,2,0,0,0,0|1,0,0]=3 4967 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 269982a_114849113799_100000204670 [0,2,0,0,0,0|1,0,0]=3 4968 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 34a_114849113799_100000210202 [0,2,0,0,0,0|1,0,0]=3 4969 B12R1.367 CCN(C)c1ccc(c(c1)C)F 2230a_100011756966_100000210202 [0,2,0,0,0,0|1,0,0]=3 4970 B12R1.367 CCN(C)c1ccc(c(c1)C)F 269982a_100011756966_100000204670 [0,2,0,0,0,0|1,0,0]=3 4971 B12R1.367 CCN(C)c1ccc(c(c1)C)F 34a_100011756966_100000210202 [0,2,0,0,0,0|1,0,0]=3 4972 B12R1.367 CCN(C)c1ccc(c(c1)C)F 38a_100011756966_100000204670 [0,2,0,0,0,0|1,0,0]=3 4973 B12R1.367 CCN(C)c1ccc(c(c1)C)F 7a_100011756966_100000210202 [0,2,0,0,0,0|1,0,0]=3 4974 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 2230a_100000220120_100000210202 [0,2,0,0,0,0|1,0,0]=3 4975 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 269982a_100000220120_100000204670 [0,2,0,0,0,0|1,0,0]=3 4976 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 34a_100000220120_100000210202 [0,2,0,0,0,0|1,0,0]=3 4977 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 38a_100000220120_100000204670 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_100000210202 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_100000204670 [0,2,0,0,0,0|1,0,0]=3 4980 B12R1.367 CCN(C)c1ccc(c(c1)Cl)Cl 34a_100000219944_100000210202 [0,2,0,0,0,0|1,0,0]=3 4981 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 2230a_100000697440_100000210202 [0,2,0,0,0,0|1,0,0]=3 4982 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 269982a_100000697440_100000204670 [0,2,0,0,0,0|1,0,0]=3 4983 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 34a_100000697440_100000210202 [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 38a_100000697440_100000204670 [0,2,0,0,0,0|1,0,0]=3 4985 B12R1.367 CCN(C)c1ccc(c(c1)Cl)F 7a_100000697440_100000210202 [0,2,0,0,0,0|1,0,0]=3 4986 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 2230a_100012285320_100000210202 [0,2,0,0,0,0|1,0,0]=3 4987 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 269982a_100012285320_100000204670 [0,2,0,0,0,0|1,0,0]=3 4988 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 34a_100012285320_100000210202 [0,2,0,0,0,0|1,0,0]=3 4989 B12R1.367 CCN(C)c1ccc(c(c1)F)Br 7a_100012285320_100000210202 [0,2,0,0,0,0|1,0,0]=3 4990 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100015205639_200000210301 [0,2,0,0,0,0|1,0,0]=3 4991 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100160572069_100000210202 [0,2,0,0,0,0|1,0,0]=3 4992 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100015205639_200000210301 [0,2,0,0,0,0|1,0,0]=3 4993 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100160572069_100000204670 [0,2,0,0,0,0|1,0,0]=3 4994 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100015205639_200000210301 [0,2,0,0,0,0|1,0,0]=3 4995 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100160572069_100000210202 [0,2,0,0,0,0|1,0,0]=3 4996 B12R1.367 CCN(C)c1ccc(c(c1)F)C 38a_100160572069_100000204670 [0,2,0,0,0,0|1,0,0]=3 4997 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100015205639_200000210301 [0,2,0,0,0,0|1,0,0]=3 4998 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100160572069_100000210202 [0,2,0,0,0,0|1,0,0]=3 4999 B12R1.367 CCN(C)c1ccc(c(c1)F)F 2230a_100000221014_100000210202 [0,2,0,0,0,0|1,0,0]=3 5000 B12R1.367 CCN(C)c1ccc(c(c1)F)F 2230a_100000221022_200000210301 [0,2,0,0,0,0|1,0,0]=3 5001 B12R1.367 CCN(C)c1ccc(c(c1)F)F 269982a_100000221014_100000204670 [0,2,0,0,0,0|1,0,0]=3 5002 B12R1.367 CCN(C)c1ccc(c(c1)F)F 269982a_100000221022_200000210301 [0,2,0,0,0,0|1,0,0]=3 5003 B12R1.367 CCN(C)c1ccc(c(c1)F)F 34a_100000221014_100000210202 [0,2,0,0,0,0|1,0,0]=3 5004 B12R1.367 CCN(C)c1ccc(c(c1)F)F 34a_100000221022_200000210301 [0,2,0,0,0,0|1,0,0]=3 5005 B12R1.367 CCN(C)c1ccc(c(c1)F)F 38a_100000221014_100000204670 [0,2,0,0,0,0|1,0,0]=3 5006 B12R1.367 CCN(C)c1ccc(c(c1)F)F 7a_100000221014_100000210202 [0,2,0,0,0,0|1,0,0]=3 5007 B12R1.367 CCN(C)c1ccc(c(c1)F)F 7a_100000221022_200000210301 [0,2,0,0,0,0|1,0,0]=3 5008 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 2230a_100015183089_200025704644 [0,2,0,0,0,0|1,0,0]=3 5009 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 269982a_100015183089_200025704644 [0,2,0,0,0,0|1,0,0]=3 5010 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 34a_100015183089_200025704644 [0,2,0,0,0,0|1,0,0]=3 5011 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 7a_100015183089_200025704644 [0,2,0,0,0,0|1,0,0]=3 5012 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 2230a_106256033975_200025704644 [0,2,0,0,0,0|1,0,0]=3 5013 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 269982a_106256033975_200025704644 [0,2,0,0,0,0|1,0,0]=3 5014 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 34a_106256033975_200025704644 [0,2,0,0,0,0|1,0,0]=3 5015 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 7a_106256033975_200025704644 [0,2,0,0,0,0|1,0,0]=3 5016 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 2230a_100015205639_200025704644 [0,2,0,0,0,0|1,0,0]=3 5017 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 269982a_100015205639_200025704644 [0,2,0,0,0,0|1,0,0]=3 5018 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 34a_100015205639_200025704644 [0,2,0,0,0,0|1,0,0]=3 5019 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 7a_100015205639_200025704644 [0,2,0,0,0,0|1,0,0]=3 5020 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 2230a_100000221022_200025704644 [0,2,0,0,0,0|1,0,0]=3 5021 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 269982a_100000221022_200025704644 [0,2,0,0,0,0|1,0,0]=3 5022 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 34a_100000221022_200025704644 [0,2,0,0,0,0|1,0,0]=3 5023 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)F 7a_100000221022_200025704644 [0,2,0,0,0,0|1,0,0]=3 5024 B12R1.367 CN(CF)c1ccc(c(c1)Cl)Cl 269982a_100000219944_100015361967 [0,2,0,0,0,0|1,0,0]=3 5025 B12R1.367 CN(CF)c1ccc(c(c1)Cl)Cl 34a_100000219944_100015361967 [0,2,0,0,0,0|1,0,0]=3 5026 B12R1.367 CN(CF)c1ccc(c(c1)Cl)F 269982a_100000697440_100015361967 [0,2,0,0,0,0|1,0,0]=3 5027 B12R1.367 CN(CF)c1ccc(c(c1)Cl)F 34a_100000697440_100015361967 [0,2,0,0,0,0|1,0,0]=3 5028 B12R1.367 CN(CF)c1ccc(c(c1)Cl)F 38a_100000697440_100015361967 [0,2,0,0,0,0|1,0,0]=3 5029 B12R1.367 CN(CF)c1ccc(c(c1)Cl)F 7a_100000697440_100015361967 [0,2,0,0,0,0|1,0,0]=3 5030 B12R1.367 CN(CF)c1ccc(c(c1)F)Br 269982a_100012285320_100015361967 [0,2,0,0,0,0|1,0,0]=3 5031 B12R1.367 CN(CF)c1ccc(c(c1)F)Br 34a_100012285320_100015361967 [0,2,0,0,0,0|1,0,0]=3 5032 B12R1.367 CN(CF)c1ccc(c(c1)F)Br 7a_100012285320_100015361967 [0,2,0,0,0,0|1,0,0]=3 5033 B12R1.367 CN(CF)c1ccc(c(c1)F)F 269982a_100000221014_100015361967 [0,2,0,0,0,0|1,0,0]=3 5034 B12R1.367 CN(CF)c1ccc(c(c1)F)F 34a_100000221014_100015361967 [0,2,0,0,0,0|1,0,0]=3 5035 B12R1.367 CN(CF)c1ccc(c(c1)F)F 38a_100000221014_100015361967 [0,2,0,0,0,0|1,0,0]=3 5036 B12R1.367 CN(CF)c1ccc(c(c1)F)F 7a_100000221014_100015361967 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,2,0,0,0,0|2,0,0]=4 5038 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,2,0,0,0,0|2,0,0]=4 5039 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,2,0,0,0,0|2,0,0]=4 5040 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,2,0,0,0,0|2,0,0]=4 5041 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,2,0,0,0,0|2,0,0]=4 5042 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,2,0,0,0,0|2,0,0]=4 5043 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,2,0,0,0,0|2,0,0]=4 5044 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,2,0,0,0,0|2,0,0]=4 5045 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,2,0,0,0,0|2,0,0]=4 5046 B12R1.367 CNC(C)c1ccc(c(c1)Br)Br 269862a_106832991636_100009814466 [0,2,0,0,0,0|2,0,0]=4 5047 B12R1.367 CNC(C)c1ccc(c(c1)Br)C 269862a_106832991636_100011934287 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.367 CNC(C)c1ccc(c(c1)Br)Cl 269862a_106832991636_100012356427 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.367 CNC(C)c1ccc(c(c1)Br)F 269862a_106832991636_100000239719 [0,2,0,0,0,0|2,0,0]=4 5050 B12R1.367 CNC(C)c1ccc(c(c1)Br)I 269862a_106832991636_100010146554 [0,2,0,0,0,0|2,0,0]=4 5051 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [0,2,0,0,0,0|1,0,0]=3 5052 B12R1.367 CNC(C)c1ccc(c(c1)C)Br 269862a_106832991636_100000697869 [0,2,0,0,0,0|2,0,0]=4 5053 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [0,2,0,0,0,0|2,0,0]=4 5054 B12R1.367 CNC(C)c1ccc(c(c1)C)Cl 269862a_106832991636_100011216000 [0,2,0,0,0,0|2,0,0]=4 5055 B12R1.367 CNC(C)c1ccc(c(c1)C)F 2230a_100000705826_200000210301 [0,2,0,0,0,0|2,0,0]=4 5056 B12R1.367 CNC(C)c1ccc(c(c1)C)F 269862a_106832991636_100000754758 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.367 CNC(C)c1ccc(c(c1)C)F 34a_100000705826_200000210301 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,2,0,0,0,0|1,0,0]=3 5059 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Br 269862a_106832991636_100012353846 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 2230a_100012005020_200000210301 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 269862a_106832991636_100012002458 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 34a_100012005020_200000210301 [0,2,0,0,0,0|2,0,0]=4 5063 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_200000210301 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 269862a_106832991636_100000210641 [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_200000210301 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.367 CNC(C)c1ccc(c(c1)Cl)F 269862a_106832991636_100000737303 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [0,2,0,0,0,0|1,0,0]=3 5068 B12R1.367 CNC(C)c1ccc(c(c1)F)Br 269862a_106832991636_100000690002 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.367 CNC(C)c1ccc(c(c1)F)C 269862a_106832991636_100000767010 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.367 CNC(C)c1ccc(c(c1)F)Cl 269862a_106832991636_100000693814 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.367 CNC(C)c1ccc(c(c1)F)F 2230a_100000756309_200000210301 [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.367 CNC(C)c1ccc(c(c1)F)F 269862a_106832991636_100000184692 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.367 CNC(C)c1ccc(c(c1)F)F 34a_100000756309_200000210301 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [0,2,0,0,0,0|1,0,0]=3 5075 B12R1.367 CNC(C)c1ccc(c(c1)I)Br 269862a_106832991636_100010146556 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 2230a_100000753309_200000210301 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 34a_100000753309_200000210301 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 2230a_100134618348_200000210301 [0,2,0,0,0,0|2,0,0]=4 5081 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 34a_100134618348_200000210301 [0,2,0,0,0,0|2,0,0]=4 5082 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 2230a_100011997884_200000210301 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 34a_100011997884_200000210301 [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 2230a_100016987892_200000210301 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 34a_100016987892_200000210301 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_200000210301 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_200000210301 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,2,0,0,0,0|2,0,0]=4 5091 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.367 COC(C)c1ccc(c(c1)Br)F 34a_100011191524_200000210301 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.367 COC(C)c1ccc(c(c1)Br)F 7a_100011191524_200000210301 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.367 COC(C)c1ccc(c(c1)Cl)Cl 34a_100000742046_200000210301 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.367 COC(C)c1ccc(c(c1)Cl)Cl 7a_100000742046_200000210301 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.367 COC(C)c1ccc(c(c1)F)Cl 34a_100011944057_200000210301 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.367 COC(C)c1ccc(c(c1)F)Cl 7a_100011944057_200000210301 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.367 COC(C)c1ccc(c(c1)F)F 34a_100000246517_200000210301 [0,2,0,0,0,0|2,0,0]=4 5104 B12R1.367 COC(C)c1ccc(c(c1)F)F 7a_100000246517_200000210301 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 2230a_100016987892_200025704644 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 34a_100016987892_200025704644 [0,2,0,0,0,0|2,0,0]=4 5107 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 2230a_100016987903_200025704644 [0,2,0,0,0,0|2,0,0]=4 5108 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 34a_100016987903_200025704644 [0,2,0,0,0,0|2,0,0]=4 5109 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 2230a_100000753309_200025704644 [0,2,0,0,0,0|2,0,0]=4 5110 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 34a_100000753309_200025704644 [0,2,0,0,0,0|2,0,0]=4 5111 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 2230a_100134618348_200025704644 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 34a_100134618348_200025704644 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.367 Cc1cc(ccc1Br)N(C)CF 269982a_100102888905_100015361967 [0,2,0,0,0,0|1,0,0]=3 5114 B12R1.367 Cc1cc(ccc1Br)N(C)CF 34a_100102888905_100015361967 [0,2,0,0,0,0|1,0,0]=3 5115 B12R1.367 Cc1cc(ccc1Cl)N(C)CF 269982a_114849113799_100015361967 [0,2,0,0,0,0|1,0,0]=3 5116 B12R1.367 Cc1cc(ccc1Cl)N(C)CF 34a_114849113799_100015361967 [0,2,0,0,0,0|1,0,0]=3 5117 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 2230a_100000705826_200025704644 [0,2,0,0,0,0|2,0,0]=4 5118 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 34a_100000705826_200025704644 [0,2,0,0,0,0|2,0,0]=4 5119 B12R1.367 Cc1cc(ccc1F)N(C)CF 269982a_100011756966_100015361967 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.367 Cc1cc(ccc1F)N(C)CF 34a_100011756966_100015361967 [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.367 Cc1cc(ccc1F)N(C)CF 38a_100011756966_100015361967 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.367 Cc1cc(ccc1F)N(C)CF 7a_100011756966_100015361967 [0,2,0,0,0,0|1,0,0]=3 5123 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,2,0,0,0,0|2,0,0]=4 5124 B12R1.367 Cc1ccc(cc1Br)N(C)CF 269982a_100000707694_100015361967 [0,2,0,0,0,0|1,0,0]=3 5125 B12R1.367 Cc1ccc(cc1Br)N(C)CF 34a_100000707694_100015361967 [0,2,0,0,0,0|1,0,0]=3 5126 B12R1.367 Cc1ccc(cc1Br)N(C)CF 38a_100000707694_100015361967 [0,2,0,0,0,0|1,0,0]=3 5127 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 2230a_100012005020_200025704644 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 34a_100012005020_200025704644 [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 269982a_100000220120_100015361967 [0,2,0,0,0,0|1,0,0]=3 5132 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 34a_100000220120_100015361967 [0,2,0,0,0,0|1,0,0]=3 5133 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 38a_100000220120_100015361967 [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.367 Cc1ccc(cc1F)N(C)CF 269982a_100160572069_100015361967 [0,2,0,0,0,0|1,0,0]=3 5135 B12R1.367 Cc1ccc(cc1F)N(C)CF 34a_100160572069_100015361967 [0,2,0,0,0,0|1,0,0]=3 5136 B12R1.367 Cc1ccc(cc1F)N(C)CF 38a_100160572069_100015361967 [0,2,0,0,0,0|1,0,0]=3 5137 B12R1.367 Cc1ccc(cc1F)N(C)CF 7a_100160572069_100015361967 [0,2,0,0,0,0|1,0,0]=3 5138 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 2230a_100011997884_200025704644 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 34a_100011997884_200025704644 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.893 C=C(C)c1ccc(c(c1C)C)O 271570a_100000694244_100012353674 [0,2,0,0,0,0|1,0,1]=4 5147 B12R1.893 C=C(C)c1ccc(c(c1C)N)O 271570a_100000694244_100013039247 [0,2,0,0,0,0|1,0,1]=4 5148 B12R1.893 C=C(C)c1ccc(c(c1F)C)O 271570a_100000694244_100010390934 [0,2,0,0,0,0|1,0,1]=4 5149 B12R1.893 C=C(C)c1ccc(c(c1F)F)O 271570a_100000694244_100011830415 [0,2,0,0,0,0|1,0,1]=4 5150 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,2,0,0,0,0|2,0,0]=4 5151 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,2,0,0,0,0|2,0,0]=4 5152 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,2,0,0,0,0|2,0,0]=4 5153 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,2,0,0,0,0|2,0,0]=4 5154 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,2,0,0,0,0|2,0,0]=4 5155 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,2,0,0,0,0|2,0,0]=4 5156 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,2,0,0,0,0|2,0,0]=4 5157 B12R1.1005 C=C(C)c1cc(c(c(c1)Br)O)C 271570a_100000694244_100010982682 [0,2,0,0,0,0|1,0,1]=4 5158 B12R1.1005 C=C(C)c1cc(c(c(c1)C)O)C 271570a_100000694244_100000187306 [0,2,0,0,0,0|1,0,1]=4 5159 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)C 271570a_100000694244_200015900153 [0,2,0,0,0,0|1,0,1]=4 5160 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)Cl 271570a_100000694244_100012339652 [0,2,0,0,0,0|1,0,1]=4 5161 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)F 271570a_100000694244_100011216917 [0,2,0,0,0,0|1,0,1]=4 5162 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)N 271570a_100000694244_100011217383 [0,2,0,0,0,0|1,0,1]=4 5163 B12R1.1005 C=C(C)c1cc(c(c(c1)N)O)C 271570a_100000694244_100011825904 [0,2,0,0,0,0|1,0,1]=4 5164 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200000210301 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200000210301 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.1005 CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_200000210301 [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200000210301 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200000210301 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200000210301 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_100010371124 [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.1005 CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200000210301 [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.1005 CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000210301 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.1005 Cc1cc(cc(c1O)C)C(=O)[13CH3] 1458a_100011219978_200025704644 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.1005 Cc1cc(cc(c1O)C)N(C)C 271570a_203496583355_100011935182 [0,2,0,0,0,0|0,0,0]=2 5175 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200025704644 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200025704644 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200025704644 [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200025704644 [0,2,0,0,0,0|2,0,0]=4 5179 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200025704644 [0,2,0,0,0,0|2,0,0]=4 5180 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200025704644 [0,2,0,0,0,0|2,0,0]=4 5181 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200025704644 [0,2,0,0,0,0|2,0,0]=4 5182 B12R1.12 CCC(NC)c1ccc(cc1)Br 269862a_106832991636_100000211647 [0,2,0,0,0,0|2,0,0]=4 5183 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [0,2,0,0,0,0|2,0,0]=4 5184 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [0,2,0,0,0,0|2,0,0]=4 5185 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [0,2,0,0,0,0|2,0,0]=4 5186 B12R1.12 CCC(NC)c1ccc(cc1)Cl 269862a_106832991636_100000210983 [0,2,0,0,0,0|2,0,0]=4 5187 B12R1.12 CCC(NC)c1ccc(cc1)F 2230a_100011191751_200000210301 [0,2,0,0,0,0|2,0,0]=4 5188 B12R1.12 CCC(NC)c1ccc(cc1)F 269862a_106832991636_100000211089 [0,2,0,0,0,0|2,0,0]=4 5189 B12R1.12 CCC(NC)c1ccc(cc1)F 34a_100011191751_200000210301 [0,2,0,0,0,0|2,0,0]=4 5190 B12R1.12 CCC(NC)c1ccc(cc1)I 269862a_106832991636_100000763097 [0,2,0,0,0,0|2,0,0]=4 5191 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [0,2,0,0,0,0|1,0,0]=3 5192 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [0,2,0,0,0,0|1,0,0]=3 5193 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [0,2,0,0,0,0|2,0,0]=4 5194 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [0,2,0,0,0,0|2,0,0]=4 5195 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 2230a_100011191751_200025704644 [0,2,0,0,0,0|2,0,0]=4 5196 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 34a_100011191751_200025704644 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [0,2,0,0,0,0|1,0,0]=3 5198 B12R1.12 CCC(OC)c1ccc(cc1)Br 34a_100000246506_200000210301 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.12 CCC(OC)c1ccc(cc1)Br 7a_100000246506_200000210301 [0,2,0,0,0,0|2,0,0]=4 5200 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [0,2,0,0,0,0|2,0,0]=4 5202 B12R1.12 CCC(OC)c1ccc(cc1)Cl 34a_100000246471_200000210301 [0,2,0,0,0,0|2,0,0]=4 5203 B12R1.12 CCC(OC)c1ccc(cc1)Cl 7a_100000246471_200000210301 [0,2,0,0,0,0|2,0,0]=4 5204 B12R1.12 CCC(OC)c1ccc(cc1)F 34a_100000246474_200000210301 [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.12 CCC(OC)c1ccc(cc1)F 7a_100000246474_200000210301 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 34a_100000246506_200025704644 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 7a_100000246506_200025704644 [0,2,0,0,0,0|2,0,0]=4 5208 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 34a_100000246471_200025704644 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 7a_100000246471_200025704644 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 34a_100000246474_200025704644 [0,2,0,0,0,0|2,0,0]=4 5213 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 7a_100000246474_200025704644 [0,2,0,0,0,0|2,0,0]=4 5214 B12R1.12 CCN(CC)c1ccc(cc1)Br 2230a_100000219632_100000210202 [0,2,0,0,0,0|1,0,0]=3 5215 B12R1.12 CCN(CC)c1ccc(cc1)Br 269982a_100000219632_100000204670 [0,2,0,0,0,0|1,0,0]=3 5216 B12R1.12 CCN(CC)c1ccc(cc1)Br 34a_100000219632_100000210202 [0,2,0,0,0,0|1,0,0]=3 5217 B12R1.12 CCN(CC)c1ccc(cc1)C 2230a_100000219985_100000210202 [0,2,0,0,0,0|1,0,0]=3 5218 B12R1.12 CCN(CC)c1ccc(cc1)C 269982a_100000219985_100000204670 [0,2,0,0,0,0|1,0,0]=3 5219 B12R1.12 CCN(CC)c1ccc(cc1)C 34a_100000219985_100000210202 [0,2,0,0,0,0|1,0,0]=3 5220 B12R1.12 CCN(CC)c1ccc(cc1)Cl 2230a_100000220165_100000210202 [0,2,0,0,0,0|1,0,0]=3 5221 B12R1.12 CCN(CC)c1ccc(cc1)Cl 269982a_100000220165_100000204670 [0,2,0,0,0,0|1,0,0]=3 5222 B12R1.12 CCN(CC)c1ccc(cc1)Cl 34a_100000220165_100000210202 [0,2,0,0,0,0|1,0,0]=3 5223 B12R1.12 CCN(CC)c1ccc(cc1)F 2230a_100102640331_100000210202 [0,2,0,0,0,0|1,0,0]=3 5224 B12R1.12 CCN(CC)c1ccc(cc1)F 269982a_100102640331_100000204670 [0,2,0,0,0,0|1,0,0]=3 5225 B12R1.12 CCN(CC)c1ccc(cc1)F 34a_100102640331_100000210202 [0,2,0,0,0,0|1,0,0]=3 5226 B12R1.12 CCN(CC)c1ccc(cc1)O 2230a_100011337800_100000210202 [0,2,0,0,0,0|0,0,0]=2 5227 B12R1.12 CCN(CC)c1ccc(cc1)O 269982a_100011337800_100000204670 [0,2,0,0,0,0|0,0,0]=2 5228 B12R1.12 CCN(CC)c1ccc(cc1)O 271570a_203496583355_100011216415 [0,2,0,0,0,0|0,0,0]=2 5229 B12R1.12 CCN(CC)c1ccc(cc1)O 34a_100011337800_100000210202 [0,2,0,0,0,0|0,0,0]=2 5230 B12R1.12 CCN(CC)c1ccc(cn1)Br 27a_100000724800_100000686858 [0,2,0,0,0,0|2,0,0]=4 5231 B12R1.12 CCN(CC)c1ccc(cn1)O 271570a_203496583355_100011465332 [0,2,0,0,0,0|1,0,0]=3 5232 B12R1.12 CCN(CC)c1ncc(cn1)O 271570a_203496583355_200011939172 [0,2,0,0,0,0|2,0,0]=4 5233 B12R1.12 CCN(CF)c1ccc(cc1)Br 269982a_100000219632_100015361967 [0,2,0,0,0,0|1,0,0]=3 5234 B12R1.12 CCN(CF)c1ccc(cc1)Br 34a_100000219632_100015361967 [0,2,0,0,0,0|1,0,0]=3 5235 B12R1.12 CCN(CF)c1ccc(cc1)C 269982a_100000219985_100015361967 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.12 CCN(CF)c1ccc(cc1)C 34a_100000219985_100015361967 [0,2,0,0,0,0|1,0,0]=3 5237 B12R1.12 CCN(CF)c1ccc(cc1)Cl 269982a_100000220165_100015361967 [0,2,0,0,0,0|1,0,0]=3 5238 B12R1.12 CCN(CF)c1ccc(cc1)Cl 34a_100000220165_100015361967 [0,2,0,0,0,0|1,0,0]=3 5239 B12R1.12 CCN(CF)c1ccc(cc1)F 269982a_100102640331_100015361967 [0,2,0,0,0,0|1,0,0]=3 5240 B12R1.12 CCN(CF)c1ccc(cc1)F 34a_100102640331_100015361967 [0,2,0,0,0,0|1,0,0]=3 5241 B12R1.12 CCN(CF)c1ccc(cc1)O 269982a_100011337800_100015361967 [0,2,0,0,0,0|0,0,0]=2 5242 B12R1.12 CCN(CF)c1ccc(cc1)O 34a_100011337800_100015361967 [0,2,0,0,0,0|0,0,0]=2 5243 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 2230a_100025736560_200000210301 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 34a_100025736560_200000210301 [0,2,0,0,0,0|2,0,0]=4 5245 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 2230a_100015186824_200000210301 [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 34a_100015186824_200000210301 [0,2,0,0,0,0|2,0,0]=4 5247 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100025736560_200025704644 [0,2,0,0,0,0|2,0,0]=4 5248 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 34a_100025736560_200025704644 [0,2,0,0,0,0|2,0,0]=4 5249 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015186824_200025704644 [0,2,0,0,0,0|2,0,0]=4 5250 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 34a_100015186824_200025704644 [0,2,0,0,0,0|2,0,0]=4 5251 B12R1.12 CNC(CO)c1ccc(cc1)Br 2230a_100000734186_200000210301 [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.12 CNC(CO)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,2,0,0,0,0|2,0,0]=4 5253 B12R1.12 CNC(CO)c1ccc(cc1)F 2230a_100000705410_200000210301 [0,2,0,0,0,0|2,0,0]=4 5254 B12R1.12 CNC(CO)c1ccc(cc1)F 34a_100000705410_200000210301 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_200000210301 [0,2,0,0,0,0|2,0,0]=4 5256 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_200000210301 [0,2,0,0,0,0|2,0,0]=4 5257 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200000210301 [0,2,0,0,0,0|2,0,0]=4 5258 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,2,0,0,0,0|2,0,0]=4 5259 B12R1.12 COC(CCl)c1ccc(cc1)Cl 34a_200011996143_200000210301 [0,2,0,0,0,0|2,0,0]=4 5260 B12R1.12 COC(CCl)c1ccc(cc1)Cl 7a_200011996143_200000210301 [0,2,0,0,0,0|2,0,0]=4 5261 B12R1.12 COC(CN)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,2,0,0,0,0|2,0,0]=4 5262 B12R1.12 COC(CN)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,2,0,0,0,0|2,0,0]=4 5263 B12R1.12 COC(OC)c1ccc(cc1)O 271570a_203496583355_100009813454 [0,2,0,0,0,0|1,0,0]=3 5264 B12R1.12 COC(OC)c1ccc(cn1)O 271570a_203496583355_100010270258 [0,2,0,0,0,0|2,0,0]=4 5265 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200000210301 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200000210301 [0,2,0,0,0,0|2,0,0]=4 5267 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 2230a_100009818840_200025704644 [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 34a_100009818840_200025704644 [0,2,0,0,0,0|2,0,0]=4 5269 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 2230a_100000734186_200025704644 [0,2,0,0,0,0|2,0,0]=4 5270 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,2,0,0,0,0|2,0,0]=4 5271 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 2230a_100000705410_200025704644 [0,2,0,0,0,0|2,0,0]=4 5272 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 34a_100000705410_200025704644 [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200025704644 [0,2,0,0,0,0|2,0,0]=4 5274 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,2,0,0,0,0|2,0,0]=4 5275 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 34a_200011996143_200025704644 [0,2,0,0,0,0|2,0,0]=4 5276 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 7a_200011996143_200025704644 [0,2,0,0,0,0|2,0,0]=4 5277 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,2,0,0,0,0|2,0,0]=4 5278 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,2,0,0,0,0|2,0,0]=4 5279 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200025704644 [0,2,0,0,0,0|2,0,0]=4 5280 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200025704644 [0,2,0,0,0,0|2,0,0]=4 5281 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.16 C#CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000038162 [0,2,0,0,0,0|1,0,0]=3 5283 B12R1.16 C#CCN(C)c1ccc(cc1)Br 34a_100000219623_100000184674 [0,2,0,0,0,0|1,0,0]=3 5284 B12R1.16 C#CCN(C)c1ccc(cc1)C 2230a_100000219977_100000038162 [0,2,0,0,0,0|1,0,0]=3 5285 B12R1.16 C#CCN(C)c1ccc(cc1)C 34a_100000219977_100000184674 [0,2,0,0,0,0|1,0,0]=3 5286 B12R1.16 C#CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000038162 [0,2,0,0,0,0|1,0,0]=3 5287 B12R1.16 C#CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000184674 [0,2,0,0,0,0|1,0,0]=3 5288 B12R1.16 C#CCN(C)c1ccc(cc1)F 2230a_100000219829_100000038162 [0,2,0,0,0,0|1,0,0]=3 5289 B12R1.16 C#CCN(C)c1ccc(cc1)F 34a_100000219829_100000184674 [0,2,0,0,0,0|1,0,0]=3 5290 B12R1.16 C#CCN(C)c1ccc(cc1)I 2230a_100000743151_100000038162 [0,2,0,0,0,0|1,0,0]=3 5291 B12R1.16 C#CCN(C)c1ccc(cc1)I 34a_100000743151_100000184674 [0,2,0,0,0,0|1,0,0]=3 5292 B12R1.16 C#CCN(C)c1ccc(cc1)O 34a_100000182112_100000184674 [0,2,0,0,0,0|0,0,0]=2 5293 B12R1.16 C#CCN(C)c1ccc(cn1)Br 27a_100000225692_100000686858 [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.16 C=CCC(O)c1ccc(cc1)O 271570a_203496583355_100011466436 [0,2,0,0,0,0|2,0,0]=4 5296 B12R1.16 C=CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210623 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.16 C=CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000210623 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.16 C=CCN(C)c1ccc(cc1)Br 34a_100000219623_100015514636 [0,2,0,0,0,0|1,0,0]=3 5299 B12R1.16 C=CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210623 [0,2,0,0,0,0|1,0,0]=3 5300 B12R1.16 C=CCN(C)c1ccc(cc1)C 269982a_100000219977_100000210623 [0,2,0,0,0,0|1,0,0]=3 5301 B12R1.16 C=CCN(C)c1ccc(cc1)C 34a_100000219977_100015514636 [0,2,0,0,0,0|1,0,0]=3 5302 B12R1.16 C=CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210623 [0,2,0,0,0,0|1,0,0]=3 5303 B12R1.16 C=CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210623 [0,2,0,0,0,0|1,0,0]=3 5304 B12R1.16 C=CCN(C)c1ccc(cc1)Cl 34a_100020629279_100015514636 [0,2,0,0,0,0|1,0,0]=3 5305 B12R1.16 C=CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210623 [0,2,0,0,0,0|1,0,0]=3 5306 B12R1.16 C=CCN(C)c1ccc(cc1)F 269982a_100000219829_100000210623 [0,2,0,0,0,0|1,0,0]=3 5307 B12R1.16 C=CCN(C)c1ccc(cc1)F 34a_100000219829_100015514636 [0,2,0,0,0,0|1,0,0]=3 5308 B12R1.16 C=CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210623 [0,2,0,0,0,0|1,0,0]=3 5309 B12R1.16 C=CCN(C)c1ccc(cc1)I 269982a_100000743151_100000210623 [0,2,0,0,0,0|1,0,0]=3 5310 B12R1.16 C=CCN(C)c1ccc(cc1)I 34a_100000743151_100015514636 [0,2,0,0,0,0|1,0,0]=3 5311 B12R1.16 C=CCN(C)c1ccc(cc1)O 269982a_100000182112_100000210623 [0,2,0,0,0,0|0,0,0]=2 5312 B12R1.16 C=CCN(C)c1ccc(cc1)O 34a_100000182112_100015514636 [0,2,0,0,0,0|0,0,0]=2 5313 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [0,2,0,0,0,0|1,0,0]=3 5315 B12R1.16 CC(OCF)c1ccc(cc1)Br 34a_100000745893_100015361967 [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.16 CC(OCF)c1ccc(cc1)Br 7a_100000745893_100015361967 [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.16 CC(OCF)c1ccc(cc1)F 34a_100000181323_100015361967 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.16 CC(OCF)c1ccc(cc1)F 7a_100000181323_100015361967 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.16 CC(OCF)c1ccc(cc1)N 34a_100011216399_100015361967 [0,2,0,0,0,0|2,0,0]=4 5320 B12R1.16 CC(SCF)c1ccc(cc1)Br 62a_100000755118_100015361967 [0,2,0,0,0,0|2,0,0]=4 5321 B12R1.16 CC(SCF)c1ccc(cc1)Br 62a_100015361967_100000755118 [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.16 CC(SCF)c1ccc(cc1)Cl 62a_100000684792_100015361967 [0,2,0,0,0,0|2,0,0]=4 5323 B12R1.16 CC(SCF)c1ccc(cc1)Cl 62a_100015361967_100000684792 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.16 CC(SCF)c1ccc(cc1)F 62a_100000743420_100015361967 [0,2,0,0,0,0|2,0,0]=4 5325 B12R1.16 CC(SCF)c1ccc(cc1)F 62a_100015361967_100000743420 [0,2,0,0,0,0|2,0,0]=4 5326 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.16 CCCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210303 [0,2,0,0,0,0|1,0,0]=3 5330 B12R1.16 CCCN(C)c1ccc(cc1)Br 269982a_100000219623_100000210303 [0,2,0,0,0,0|1,0,0]=3 5331 B12R1.16 CCCN(C)c1ccc(cc1)Br 34a_100000219623_100000210303 [0,2,0,0,0,0|1,0,0]=3 5332 B12R1.16 CCCN(C)c1ccc(cc1)C 2230a_100000219977_100000210303 [0,2,0,0,0,0|1,0,0]=3 5333 B12R1.16 CCCN(C)c1ccc(cc1)C 269982a_100000219977_100000210303 [0,2,0,0,0,0|1,0,0]=3 5334 B12R1.16 CCCN(C)c1ccc(cc1)C 34a_100000219977_100000210303 [0,2,0,0,0,0|1,0,0]=3 5335 B12R1.16 CCCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210303 [0,2,0,0,0,0|1,0,0]=3 5336 B12R1.16 CCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210303 [0,2,0,0,0,0|1,0,0]=3 5337 B12R1.16 CCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210303 [0,2,0,0,0,0|1,0,0]=3 5338 B12R1.16 CCCN(C)c1ccc(cc1)F 2230a_100000219829_100000210303 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.16 CCCN(C)c1ccc(cc1)F 269982a_100000219829_100000210303 [0,2,0,0,0,0|1,0,0]=3 5340 B12R1.16 CCCN(C)c1ccc(cc1)F 34a_100000219829_100000210303 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.16 CCCN(C)c1ccc(cc1)I 2230a_100000743151_100000210303 [0,2,0,0,0,0|1,0,0]=3 5342 B12R1.16 CCCN(C)c1ccc(cc1)I 269982a_100000743151_100000210303 [0,2,0,0,0,0|1,0,0]=3 5343 B12R1.16 CCCN(C)c1ccc(cc1)I 34a_100000743151_100000210303 [0,2,0,0,0,0|1,0,0]=3 5344 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [0,2,0,0,0,0|0,0,0]=2 5345 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [0,2,0,0,0,0|0,0,0]=2 5346 B12R1.16 CCCN(C)c1ccc(cn1)Br 27a_100000747261_100000686858 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [0,2,0,0,0,0|2,0,0]=4 5352 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,2,0,0,0,0|2,0,0]=4 5354 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [0,2,0,0,0,0|2,0,0]=4 5357 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [0,2,0,0,0,0|2,0,0]=4 5358 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [0,2,0,0,0,0|2,0,0]=4 5359 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [0,2,0,0,0,0|2,0,0]=4 5360 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [0,2,0,0,0,0|2,0,0]=4 5361 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [0,2,0,0,0,0|2,0,0]=4 5362 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [0,2,0,0,0,0|1,0,0]=3 5363 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [0,2,0,0,0,0|2,0,0]=4 5364 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [0,2,0,0,0,0|2,0,0]=4 5377 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [0,2,0,0,0,0|2,0,0]=4 5378 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [0,2,0,0,0,0|2,0,0]=4 5379 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,2,0,0,0,0|2,0,0]=4 5380 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000210202_100000755118 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000755118_100000210202 [0,2,0,0,0,0|2,0,0]=4 5383 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [0,2,0,0,0,0|2,0,0]=4 5384 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [0,2,0,0,0,0|2,0,0]=4 5385 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000210202_100000684792 [0,2,0,0,0,0|2,0,0]=4 5386 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210202 [0,2,0,0,0,0|2,0,0]=4 5387 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000210202_100000743420 [0,2,0,0,0,0|2,0,0]=4 5388 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000743420_100000210202 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.16 CN(CC#N)c1ccc(cc1)Br 2230a_100000219623_100011215382 [0,2,0,0,0,0|1,0,0]=3 5390 B12R1.16 CN(CC#N)c1ccc(cc1)Br 269982a_100000219623_100011214920 [0,2,0,0,0,0|1,0,0]=3 5391 B12R1.16 CN(CC#N)c1ccc(cc1)Cl 2230a_100020629279_100011215382 [0,2,0,0,0,0|1,0,0]=3 5392 B12R1.16 CN(CC#N)c1ccc(cc1)Cl 269982a_100020629279_100011214920 [0,2,0,0,0,0|1,0,0]=3 5393 B12R1.16 CN(CC#N)c1ccc(cc1)F 2230a_100000219829_100011215382 [0,2,0,0,0,0|1,0,0]=3 5394 B12R1.16 CN(CC#N)c1ccc(cc1)F 2230a_100011199736_200000210301 [0,2,0,0,0,0|1,0,0]=3 5395 B12R1.16 CN(CC#N)c1ccc(cc1)F 269982a_100000219829_100011214920 [0,2,0,0,0,0|1,0,0]=3 5396 B12R1.16 CN(CC#N)c1ccc(cc1)F 34a_100011199736_200000210301 [0,2,0,0,0,0|1,0,0]=3 5397 B12R1.16 CN(CC#N)c1ccc(cc1)I 2230a_100000743151_100011215382 [0,2,0,0,0,0|1,0,0]=3 5398 B12R1.16 CN(CC#N)c1ccc(cc1)I 269982a_100000743151_100011214920 [0,2,0,0,0,0|1,0,0]=3 5399 B12R1.16 CN(CC#N)c1ccc(cc1)O 269982a_100000182112_100011214920 [0,2,0,0,0,0|0,0,0]=2 5400 B12R1.16 CN(CC=O)c1ccc(cc1)Br 2230a_100000219623_200015260668 [0,2,0,0,0,0|1,0,0]=3 5401 B12R1.16 CN(CC=O)c1ccc(cc1)Br 269982a_100000219623_200015260668 [0,2,0,0,0,0|1,0,0]=3 5402 B12R1.16 CN(CC=O)c1ccc(cc1)Br 34a_100000219623_200009817547 [0,2,0,0,0,0|1,0,0]=3 5403 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 2230a_100020629279_200015260668 [0,2,0,0,0,0|1,0,0]=3 5404 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 269982a_100020629279_200015260668 [0,2,0,0,0,0|1,0,0]=3 5405 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 34a_100020629279_200009817547 [0,2,0,0,0,0|1,0,0]=3 5406 B12R1.16 CN(CC=O)c1ccc(cc1)F 2230a_100000219829_200015260668 [0,2,0,0,0,0|1,0,0]=3 5407 B12R1.16 CN(CC=O)c1ccc(cc1)F 269982a_100000219829_200015260668 [0,2,0,0,0,0|1,0,0]=3 5408 B12R1.16 CN(CC=O)c1ccc(cc1)F 34a_100000219829_200009817547 [0,2,0,0,0,0|1,0,0]=3 5409 B12R1.16 CN(CC=O)c1ccc(cc1)I 2230a_100000743151_200015260668 [0,2,0,0,0,0|1,0,0]=3 5410 B12R1.16 CN(CC=O)c1ccc(cc1)I 269982a_100000743151_200015260668 [0,2,0,0,0,0|1,0,0]=3 5411 B12R1.16 CN(CC=O)c1ccc(cc1)I 34a_100000743151_200009817547 [0,2,0,0,0,0|1,0,0]=3 5412 B12R1.16 CN(CC=O)c1ccc(cc1)O 269982a_100000182112_200015260668 [0,2,0,0,0,0|0,0,0]=2 5413 B12R1.16 CN(CC=O)c1ccc(cc1)O 34a_100000182112_200009817547 [0,2,0,0,0,0|0,0,0]=2 5414 B12R1.16 CN(CCF)c1ccc(cc1)Br 2230a_100000219623_100011217306 [0,2,0,0,0,0|1,0,0]=3 5415 B12R1.16 CN(CCF)c1ccc(cc1)Br 269982a_100000219623_100011217306 [0,2,0,0,0,0|1,0,0]=3 5416 B12R1.16 CN(CCF)c1ccc(cc1)Br 34a_100000219623_100011217306 [0,2,0,0,0,0|1,0,0]=3 5417 B12R1.16 CN(CCF)c1ccc(cc1)Cl 2230a_100020629279_100011217306 [0,2,0,0,0,0|1,0,0]=3 5418 B12R1.16 CN(CCF)c1ccc(cc1)Cl 269982a_100020629279_100011217306 [0,2,0,0,0,0|1,0,0]=3 5419 B12R1.16 CN(CCF)c1ccc(cc1)Cl 34a_100020629279_100011217306 [0,2,0,0,0,0|1,0,0]=3 5420 B12R1.16 CN(CCF)c1ccc(cc1)F 2230a_100000219829_100011217306 [0,2,0,0,0,0|1,0,0]=3 5421 B12R1.16 CN(CCF)c1ccc(cc1)F 269982a_100000219829_100011217306 [0,2,0,0,0,0|1,0,0]=3 5422 B12R1.16 CN(CCF)c1ccc(cc1)F 34a_100000219829_100011217306 [0,2,0,0,0,0|1,0,0]=3 5423 B12R1.16 CN(CCF)c1ccc(cc1)I 2230a_100000743151_100011217306 [0,2,0,0,0,0|1,0,0]=3 5424 B12R1.16 CN(CCF)c1ccc(cc1)I 269982a_100000743151_100011217306 [0,2,0,0,0,0|1,0,0]=3 5425 B12R1.16 CN(CCF)c1ccc(cc1)I 34a_100000743151_100011217306 [0,2,0,0,0,0|1,0,0]=3 5426 B12R1.16 CN(CCF)c1ccc(cc1)O 269982a_100000182112_100011217306 [0,2,0,0,0,0|0,0,0]=2 5427 B12R1.16 CN(CCF)c1ccc(cc1)O 34a_100000182112_100011217306 [0,2,0,0,0,0|0,0,0]=2 5428 B12R1.16 CN(CCO)c1ccc(cc1)Br 2230a_100000219623_100000211926 [0,2,0,0,0,0|1,0,0]=3 5429 B12R1.16 CN(CCO)c1ccc(cc1)Br 269982a_100000219623_100000211926 [0,2,0,0,0,0|1,0,0]=3 5430 B12R1.16 CN(CCO)c1ccc(cc1)Br 34a_100000219623_100000211926 [0,2,0,0,0,0|1,0,0]=3 5431 B12R1.16 CN(CCO)c1ccc(cc1)Cl 2230a_100020629279_100000211926 [0,2,0,0,0,0|1,0,0]=3 5432 B12R1.16 CN(CCO)c1ccc(cc1)Cl 269982a_100020629279_100000211926 [0,2,0,0,0,0|1,0,0]=3 5433 B12R1.16 CN(CCO)c1ccc(cc1)Cl 34a_100020629279_100000211926 [0,2,0,0,0,0|1,0,0]=3 5434 B12R1.16 CN(CCO)c1ccc(cc1)F 2230a_100000219829_100000211926 [0,2,0,0,0,0|1,0,0]=3 5435 B12R1.16 CN(CCO)c1ccc(cc1)F 269982a_100000219829_100000211926 [0,2,0,0,0,0|1,0,0]=3 5436 B12R1.16 CN(CCO)c1ccc(cc1)F 34a_100000219829_100000211926 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.16 CN(CCO)c1ccc(cc1)I 2230a_100000743151_100000211926 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.16 CN(CCO)c1ccc(cc1)I 269982a_100000743151_100000211926 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.16 CN(CCO)c1ccc(cc1)I 34a_100000743151_100000211926 [0,2,0,0,0,0|1,0,0]=3 5440 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [0,2,0,0,0,0|0,0,0]=2 5441 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [0,2,0,0,0,0|0,0,0]=2 5442 B12R1.16 CN(CCO)c1ccc(cn1)Br 27a_100000210263_100000686858 [0,2,0,0,0,0|2,0,0]=4 5443 B12R1.16 CN(CCO)c1ccc(nn1)O 271570a_203496583355_100000215310 [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,2,0,0,0,0|2,0,0]=4 5445 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [0,2,0,0,0,0|1,0,0]=3 5447 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [0,2,0,0,0,0|2,0,0]=4 5448 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,2,0,0,0,0|2,0,0]=4 5450 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,2,0,0,0,0|2,0,0]=4 5451 B12R1.16 COCN(C)c1ccc(cc1)Br 2230a_100000219623_100000766300 [0,2,0,0,0,0|1,0,0]=3 5452 B12R1.16 COCN(C)c1ccc(cc1)Br 269982a_100000219623_100000766300 [0,2,0,0,0,0|1,0,0]=3 5453 B12R1.16 COCN(C)c1ccc(cc1)C 2230a_100000219977_100000766300 [0,2,0,0,0,0|1,0,0]=3 5454 B12R1.16 COCN(C)c1ccc(cc1)C 269982a_100000219977_100000766300 [0,2,0,0,0,0|1,0,0]=3 5455 B12R1.16 COCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000766300 [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.16 COCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000766300 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.16 COCN(C)c1ccc(cc1)F 2230a_100000219829_100000766300 [0,2,0,0,0,0|1,0,0]=3 5458 B12R1.16 COCN(C)c1ccc(cc1)F 269982a_100000219829_100000766300 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.16 COCN(C)c1ccc(cc1)I 2230a_100000743151_100000766300 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.16 COCN(C)c1ccc(cc1)I 269982a_100000743151_100000766300 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [0,2,0,0,0,0|0,0,0]=2 5462 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,2,0,0,0,0|2,0,0]=4 5463 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,2,0,0,0,0|2,0,0]=4 5464 B12R1.16 CSCN(C)c1ccc(cc1)Br 2230a_100000219623_100011218213 [0,2,0,0,0,0|1,0,0]=3 5465 B12R1.16 CSCN(C)c1ccc(cc1)Br 269982a_100000219623_100011218213 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.16 CSCN(C)c1ccc(cc1)Br 34a_100000219623_100011218213 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.16 CSCN(C)c1ccc(cc1)C 2230a_100000219977_100011218213 [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.16 CSCN(C)c1ccc(cc1)C 269982a_100000219977_100011218213 [0,2,0,0,0,0|1,0,0]=3 5469 B12R1.16 CSCN(C)c1ccc(cc1)C 34a_100000219977_100011218213 [0,2,0,0,0,0|1,0,0]=3 5470 B12R1.16 CSCN(C)c1ccc(cc1)Cl 2230a_100020629279_100011218213 [0,2,0,0,0,0|1,0,0]=3 5471 B12R1.16 CSCN(C)c1ccc(cc1)Cl 269982a_100020629279_100011218213 [0,2,0,0,0,0|1,0,0]=3 5472 B12R1.16 CSCN(C)c1ccc(cc1)Cl 34a_100020629279_100011218213 [0,2,0,0,0,0|1,0,0]=3 5473 B12R1.16 CSCN(C)c1ccc(cc1)F 2230a_100000219829_100011218213 [0,2,0,0,0,0|1,0,0]=3 5474 B12R1.16 CSCN(C)c1ccc(cc1)F 269982a_100000219829_100011218213 [0,2,0,0,0,0|1,0,0]=3 5475 B12R1.16 CSCN(C)c1ccc(cc1)F 34a_100000219829_100011218213 [0,2,0,0,0,0|1,0,0]=3 5476 B12R1.16 CSCN(C)c1ccc(cc1)I 2230a_100000743151_100011218213 [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.16 CSCN(C)c1ccc(cc1)I 269982a_100000743151_100011218213 [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.16 CSCN(C)c1ccc(cc1)I 34a_100000743151_100011218213 [0,2,0,0,0,0|1,0,0]=3 5479 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [0,2,0,0,0,0|0,0,0]=2 5480 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [0,2,0,0,0,0|0,0,0]=2 5481 B12R1.16 C[C@@H](NCF)c1ccc(cc1)Cl 34a_100015205461_100015361967 [0,2,0,0,0,0|2,0,0]=4 5482 B12R1.16 C[C@H](NCF)c1ccc(cc1)F 34a_100025705893_100015361967 [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 34a_100011852131_100015361967 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 7a_100011852131_100015361967 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100011261388_100015361967 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100015361967_100011261388 [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.16 Cc1ccc(cc1)N(C)CC#N 2230a_100000219977_100011215382 [0,2,0,0,0,0|1,0,0]=3 5488 B12R1.16 Cc1ccc(cc1)N(C)CC#N 269982a_100000219977_100011214920 [0,2,0,0,0,0|1,0,0]=3 5489 B12R1.16 Cc1ccc(cc1)N(C)CC=O 2230a_100000219977_200015260668 [0,2,0,0,0,0|1,0,0]=3 5490 B12R1.16 Cc1ccc(cc1)N(C)CC=O 269982a_100000219977_200015260668 [0,2,0,0,0,0|1,0,0]=3 5491 B12R1.16 Cc1ccc(cc1)N(C)CC=O 34a_100000219977_200009817547 [0,2,0,0,0,0|1,0,0]=3 5492 B12R1.16 Cc1ccc(cc1)N(C)CCF 2230a_100000219977_100011217306 [0,2,0,0,0,0|1,0,0]=3 5493 B12R1.16 Cc1ccc(cc1)N(C)CCF 269982a_100000219977_100011217306 [0,2,0,0,0,0|1,0,0]=3 5494 B12R1.16 Cc1ccc(cc1)N(C)CCF 34a_100000219977_100011217306 [0,2,0,0,0,0|1,0,0]=3 5495 B12R1.16 Cc1ccc(cc1)N(C)CCO 2230a_100000219977_100000211926 [0,2,0,0,0,0|1,0,0]=3 5496 B12R1.16 Cc1ccc(cc1)N(C)CCO 269982a_100000219977_100000211926 [0,2,0,0,0,0|1,0,0]=3 5497 B12R1.16 Cc1ccc(cc1)N(C)CCO 34a_100000219977_100000211926 [0,2,0,0,0,0|1,0,0]=3 5498 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCF 34a_100016988085_100015361967 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,2,0,0,0,0|2,0,0]=4 5501 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,2,0,0,0,0|2,0,0]=4 5502 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,2,0,0,0,0|2,0,0]=4 5503 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [0,2,0,0,0,0|2,0,0]=4 5504 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,2,0,0,0,0|2,0,0]=4 5505 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,2,0,0,0,0|2,0,0]=4 5506 B12R1.16 [13CH3]N(CC#N)c1ccc(cc1)F 2230a_100011199736_200025704644 [0,2,0,0,0,0|1,0,0]=3 5507 B12R1.16 [13CH3]N(CC#N)c1ccc(cc1)F 34a_100011199736_200025704644 [0,2,0,0,0,0|1,0,0]=3 5508 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [0,2,0,0,0,0|2,0,0]=4 5509 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 2230a_100000179772_200025704644 [0,2,0,0,0,0|2,0,0]=4 5512 B12R1.1703 CC(N[13CH3])c1ccc(cc1Cl)Cl 34a_100000179772_200025704644 [0,2,0,0,0,0|2,0,0]=4 5513 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 2230a_100000730447_200025704644 [0,2,0,0,0,0|2,0,0]=4 5514 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)Br 34a_100000730447_200025704644 [0,2,0,0,0,0|2,0,0]=4 5515 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 2230a_100000181410_200025704644 [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.1703 CC(N[13CH3])c1ccc(cc1F)F 34a_100000181410_200025704644 [0,2,0,0,0,0|2,0,0]=4 5517 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 34a_100000743050_200025704644 [0,2,0,0,0,0|2,0,0]=4 5518 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 7a_100000743050_200025704644 [0,2,0,0,0,0|2,0,0]=4 5519 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 34a_200011245020_200025704644 [0,2,0,0,0,0|2,0,0]=4 5520 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 7a_200011245020_200025704644 [0,2,0,0,0,0|2,0,0]=4 5521 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 34a_200011805215_200025704644 [0,2,0,0,0,0|2,0,0]=4 5522 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 7a_200011805215_200025704644 [0,2,0,0,0,0|2,0,0]=4 5523 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 34a_200000246518_200025704644 [0,2,0,0,0,0|2,0,0]=4 5524 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 7a_200000246518_200025704644 [0,2,0,0,0,0|2,0,0]=4 5525 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|2,0,0]=4 5529 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|2,0,0]=4 5530 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|2,0,0]=4 5532 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 269982a_200000221195_100000204670 [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.1703 CCN(C)c1ccc(cc1Br)Br 34a_200000221195_100000210202 [0,2,0,0,0,0|1,0,0]=3 5534 B12R1.1703 CCN(C)c1ccc(cc1Br)C 2230a_100000221369_100000210202 [0,2,0,0,0,0|1,0,0]=3 5535 B12R1.1703 CCN(C)c1ccc(cc1Br)C 269982a_100000221369_100000204670 [0,2,0,0,0,0|1,0,0]=3 5536 B12R1.1703 CCN(C)c1ccc(cc1Br)C 34a_100000221369_100000210202 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 269982a_100020633009_100000204670 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.1703 CCN(C)c1ccc(cc1Br)Cl 34a_100020633009_100000210202 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.1703 CCN(C)c1ccc(cc1Br)F 269982a_100011246292_100000204670 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.1703 CCN(C)c1ccc(cc1Br)F 34a_100011246292_100000210202 [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.1703 CCN(C)c1ccc(cc1C)Br 2230a_100000221803_100000210202 [0,2,0,0,0,0|1,0,0]=3 5542 B12R1.1703 CCN(C)c1ccc(cc1C)Br 269982a_100000221803_100000204670 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.1703 CCN(C)c1ccc(cc1C)Br 34a_100000221803_100000210202 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 2230a_114849113698_100000210202 [0,2,0,0,0,0|1,0,0]=3 5545 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 269982a_114849113698_100000204670 [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 34a_114849113698_100000210202 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.1703 CCN(C)c1ccc(cc1C)Cl 38a_114849113698_100000204670 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.1703 CCN(C)c1ccc(cc1C)F 2230a_100000221679_200000210301 [0,2,0,0,0,0|1,0,0]=3 5549 B12R1.1703 CCN(C)c1ccc(cc1C)F 269982a_100000221679_200000210301 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.1703 CCN(C)c1ccc(cc1C)F 34a_100000221679_200000210301 [0,2,0,0,0,0|1,0,0]=3 5551 B12R1.1703 CCN(C)c1ccc(cc1C)F 7a_100000221679_200000210301 [0,2,0,0,0,0|1,0,0]=3 5552 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [0,2,0,0,0,0|0,0,0]=2 5553 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [0,2,0,0,0,0|0,0,0]=2 5554 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 269982a_100000221650_100000204670 [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.1703 CCN(C)c1ccc(cc1Cl)Br 34a_100000221650_100000210202 [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_100160557746_200000210301 [0,2,0,0,0,0|1,0,0]=3 5557 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_100000204670 [0,2,0,0,0,0|1,0,0]=3 5558 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_100160557746_200000210301 [0,2,0,0,0,0|1,0,0]=3 5559 B12R1.1703 CCN(C)c1ccc(cc1Cl)Cl 34a_114849113696_100000210202 [0,2,0,0,0,0|1,0,0]=3 5560 B12R1.1703 CCN(C)c1ccc(cc1F)Br 2230a_100000743884_100000210202 [0,2,0,0,0,0|1,0,0]=3 5561 B12R1.1703 CCN(C)c1ccc(cc1F)Br 269982a_100000743884_100000204670 [0,2,0,0,0,0|1,0,0]=3 5562 B12R1.1703 CCN(C)c1ccc(cc1F)Br 34a_100000743884_100000210202 [0,2,0,0,0,0|1,0,0]=3 5563 B12R1.1703 CCN(C)c1ccc(cc1F)F 2230a_100020633734_100000210202 [0,2,0,0,0,0|1,0,0]=3 5564 B12R1.1703 CCN(C)c1ccc(cc1F)F 269982a_100020633734_100000204670 [0,2,0,0,0,0|1,0,0]=3 5565 B12R1.1703 CCN(C)c1ccc(cc1F)F 34a_100020633734_100000210202 [0,2,0,0,0,0|1,0,0]=3 5566 B12R1.1703 CCN(C)c1ccc(cc1F)F 38a_100020633734_100000204670 [0,2,0,0,0,0|1,0,0]=3 5567 B12R1.1703 CCN(C)c1ccc(cc1F)I 269982a_114948340911_100000204670 [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.1703 CCN(C)c1ccc(cc1F)I 34a_114948340911_100000210202 [0,2,0,0,0,0|1,0,0]=3 5569 B12R1.1703 CCN(C)c1ccc(cc1F)I 38a_114948340911_100000204670 [0,2,0,0,0,0|1,0,0]=3 5570 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 2230a_100000221679_200025704644 [0,2,0,0,0,0|1,0,0]=3 5571 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 269982a_100000221679_200025704644 [0,2,0,0,0,0|1,0,0]=3 5572 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 34a_100000221679_200025704644 [0,2,0,0,0,0|1,0,0]=3 5573 B12R1.1703 CCN([13CH3])c1ccc(cc1C)F 7a_100000221679_200025704644 [0,2,0,0,0,0|1,0,0]=3 5574 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 269982a_100160557746_200025704644 [0,2,0,0,0,0|1,0,0]=3 5575 B12R1.1703 CCN([13CH3])c1ccc(cc1Cl)Cl 34a_100160557746_200025704644 [0,2,0,0,0,0|1,0,0]=3 5576 B12R1.1703 CN(CF)c1ccc(cc1Br)Br 269982a_200000221195_100015361967 [0,2,0,0,0,0|1,0,0]=3 5577 B12R1.1703 CN(CF)c1ccc(cc1Br)Br 34a_200000221195_100015361967 [0,2,0,0,0,0|1,0,0]=3 5578 B12R1.1703 CN(CF)c1ccc(cc1Br)Cl 269982a_100020633009_100015361967 [0,2,0,0,0,0|1,0,0]=3 5579 B12R1.1703 CN(CF)c1ccc(cc1Br)Cl 34a_100020633009_100015361967 [0,2,0,0,0,0|1,0,0]=3 5580 B12R1.1703 CN(CF)c1ccc(cc1Br)F 269982a_100011246292_100015361967 [0,2,0,0,0,0|1,0,0]=3 5581 B12R1.1703 CN(CF)c1ccc(cc1Br)F 34a_100011246292_100015361967 [0,2,0,0,0,0|1,0,0]=3 5582 B12R1.1703 CN(CF)c1ccc(cc1Cl)Br 269982a_100000221650_100015361967 [0,2,0,0,0,0|1,0,0]=3 5583 B12R1.1703 CN(CF)c1ccc(cc1Cl)Br 34a_100000221650_100015361967 [0,2,0,0,0,0|1,0,0]=3 5584 B12R1.1703 CN(CF)c1ccc(cc1Cl)Cl 269982a_114849113696_100015361967 [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.1703 CN(CF)c1ccc(cc1Cl)Cl 34a_114849113696_100015361967 [0,2,0,0,0,0|1,0,0]=3 5586 B12R1.1703 CN(CF)c1ccc(cc1F)Br 269982a_100000743884_100015361967 [0,2,0,0,0,0|1,0,0]=3 5587 B12R1.1703 CN(CF)c1ccc(cc1F)Br 34a_100000743884_100015361967 [0,2,0,0,0,0|1,0,0]=3 5588 B12R1.1703 CN(CF)c1ccc(cc1F)F 269982a_100020633734_100015361967 [0,2,0,0,0,0|1,0,0]=3 5589 B12R1.1703 CN(CF)c1ccc(cc1F)F 34a_100020633734_100015361967 [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.1703 CN(CF)c1ccc(cc1F)F 38a_100020633734_100015361967 [0,2,0,0,0,0|1,0,0]=3 5591 B12R1.1703 CN(CF)c1ccc(cc1F)I 269982a_114948340911_100015361967 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.1703 CN(CF)c1ccc(cc1F)I 34a_114948340911_100015361967 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.1703 CN(CF)c1ccc(cc1F)I 38a_114948340911_100015361967 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 5595 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,2,0,0,0,0|2,0,0]=4 5602 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,2,0,0,0,0|2,0,0]=4 5603 B12R1.1703 CNC(C)c1ccc(cc1Br)Br 269862a_106832991636_100000183147 [0,2,0,0,0,0|2,0,0]=4 5604 B12R1.1703 CNC(C)c1ccc(cc1Br)C 269862a_106832991636_100012353930 [0,2,0,0,0,0|2,0,0]=4 5605 B12R1.1703 CNC(C)c1ccc(cc1Br)Cl 269862a_106832991636_100011934292 [0,2,0,0,0,0|2,0,0]=4 5606 B12R1.1703 CNC(C)c1ccc(cc1Br)F 269862a_106832991636_100000686192 [0,2,0,0,0,0|2,0,0]=4 5607 B12R1.1703 CNC(C)c1ccc(cc1C)Br 269862a_106832991636_100012360112 [0,2,0,0,0,0|2,0,0]=4 5608 B12R1.1703 CNC(C)c1ccc(cc1C)C 269862a_106832991636_100000211561 [0,2,0,0,0,0|2,0,0]=4 5609 B12R1.1703 CNC(C)c1ccc(cc1C)Cl 269862a_106832991636_100011998434 [0,2,0,0,0,0|2,0,0]=4 5610 B12R1.1703 CNC(C)c1ccc(cc1C)F 269862a_106832991636_100000753884 [0,2,0,0,0,0|2,0,0]=4 5611 B12R1.1703 CNC(C)c1ccc(cc1Cl)Br 269862a_106832991636_100000693907 [0,2,0,0,0,0|2,0,0]=4 5612 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_200000210301 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 269862a_106832991636_100000210972 [0,2,0,0,0,0|2,0,0]=4 5614 B12R1.1703 CNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_200000210301 [0,2,0,0,0,0|2,0,0]=4 5615 B12R1.1703 CNC(C)c1ccc(cc1Cl)F 269862a_106832991636_100000214953 [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.1703 CNC(C)c1ccc(cc1F)Br 2230a_100000730447_200000210301 [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.1703 CNC(C)c1ccc(cc1F)Br 269862a_106832991636_100000690205 [0,2,0,0,0,0|2,0,0]=4 5618 B12R1.1703 CNC(C)c1ccc(cc1F)Br 34a_100000730447_200000210301 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.1703 CNC(C)c1ccc(cc1F)C 269862a_106832991636_100011216410 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.1703 CNC(C)c1ccc(cc1F)Cl 269862a_106832991636_100011805184 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.1703 CNC(C)c1ccc(cc1F)F 2230a_100000181410_200000210301 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.1703 CNC(C)c1ccc(cc1F)F 269862a_106832991636_100000185200 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.1703 CNC(C)c1ccc(cc1F)F 34a_100000181410_200000210301 [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.1703 CNC(C)c1ccc(cc1O)Br 269862a_106832991636_100000188348 [0,2,0,0,0,0|2,0,0]=4 5625 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.1703 CNC(C)c1ccc(cc1O)Cl 269862a_106832991636_100000061402 [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.1703 CNC(C)c1ccc(cc1O)F 269862a_106832991636_100011215782 [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 2230a_100000745882_200000210301 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 34a_100000745882_200000210301 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_200000210301 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_200000210301 [0,2,0,0,0,0|2,0,0]=4 5632 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 2230a_100025704064_200000210301 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.1703 CN[C@H](C)c1ccc(cc1Br)F 34a_100025704064_200000210301 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 2230a_100015196781_200000210301 [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.1703 CN[C@H](C)c1ccc(cc1Cl)F 34a_100015196781_200000210301 [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,2,0,0,0,0|2,0,0]=4 5641 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|2,0,0]=4 5643 B12R1.1703 COC(C)c1ccc(cc1C)C 34a_100000246504_200000210301 [0,2,0,0,0,0|2,0,0]=4 5644 B12R1.1703 COC(C)c1ccc(cc1C)C 7a_100000246504_200000210301 [0,2,0,0,0,0|2,0,0]=4 5645 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 34a_100000743050_200000210301 [0,2,0,0,0,0|2,0,0]=4 5646 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 7a_100000743050_200000210301 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.1703 COC(C)c1ccc(cc1Cl)F 34a_200011245020_200000210301 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.1703 COC(C)c1ccc(cc1Cl)F 7a_200011245020_200000210301 [0,2,0,0,0,0|2,0,0]=4 5649 B12R1.1703 COC(C)c1ccc(cc1F)Cl 34a_200011805215_200000210301 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.1703 COC(C)c1ccc(cc1F)Cl 7a_200011805215_200000210301 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.1703 COC(C)c1ccc(cc1F)F 34a_200000246518_200000210301 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.1703 COC(C)c1ccc(cc1F)F 7a_200000246518_200000210301 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 2230a_100025704064_200025704644 [0,2,0,0,0,0|2,0,0]=4 5654 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Br)F 34a_100025704064_200025704644 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 2230a_100015196781_200025704644 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.1703 C[C@@H](N[13CH3])c1ccc(cc1Cl)F 34a_100015196781_200025704644 [0,2,0,0,0,0|2,0,0]=4 5657 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,2,0,0,0,0|2,0,0]=4 5658 B12R1.1703 Cc1cc(ccc1N(C)CF)Br 269982a_100000221803_100015361967 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.1703 Cc1cc(ccc1N(C)CF)Br 34a_100000221803_100015361967 [0,2,0,0,0,0|1,0,0]=3 5660 B12R1.1703 Cc1cc(ccc1N(C)CF)Cl 269982a_114849113698_100015361967 [0,2,0,0,0,0|1,0,0]=3 5661 B12R1.1703 Cc1cc(ccc1N(C)CF)Cl 34a_114849113698_100015361967 [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.1703 Cc1cc(ccc1N(C)CF)Cl 38a_114849113698_100015361967 [0,2,0,0,0,0|1,0,0]=3 5663 B12R1.1703 Cc1cc(ccc1N(C)CF)O 269982a_100161107805_100015361967 [0,2,0,0,0,0|0,0,0]=2 5664 B12R1.1703 Cc1cc(ccc1N(C)CF)O 34a_100161107805_100015361967 [0,2,0,0,0,0|0,0,0]=2 5665 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 2230a_100020633667_200025704644 [0,2,0,0,0,0|2,0,0]=4 5666 B12R1.1703 Cc1cc(ccc1[C@H](C)N[13CH3])Cl 34a_100020633667_200025704644 [0,2,0,0,0,0|2,0,0]=4 5667 B12R1.1703 Cc1cc(ccc1[C@H](N)CO)O 271570a_203496583355_100138412551 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.1703 Cc1ccc(c(c1)Br)N(C)CF 269982a_100000221369_100015361967 [0,2,0,0,0,0|1,0,0]=3 5669 B12R1.1703 Cc1ccc(c(c1)Br)N(C)CF 34a_100000221369_100015361967 [0,2,0,0,0,0|1,0,0]=3 5670 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 34a_100000246504_200025704644 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 7a_100000246504_200025704644 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 2230a_100000745882_200025704644 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 34a_100000745882_200025704644 [0,2,0,0,0,0|2,0,0]=4 5674 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,2,0,0,0,0|2,0,0]=4 5675 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,2,0,0,0,0|2,0,0]=4 5676 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,2,0,0,0,0|2,0,0]=4 5677 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|2,0,0]=4 5678 B12R1.57 C=C(C)c1ccc(cc1C#N)O 271570a_100000694244_100009818209 [0,2,0,0,0,0|1,0,1]=4 5679 B12R1.57 C=C(C)c1ccc(cc1C=O)O 271570a_100000694244_100000690577 [0,2,0,0,0,0|1,0,1]=4 5680 B12R1.57 C=C(C)c1ccc(cc1CO)O 271570a_100000694244_100012351483 [0,2,0,0,0,0|1,0,1]=4 5681 B12R1.57 C=C(C)c1ccc(cc1OC)O 271570a_100000694244_100011827694 [0,2,0,0,0,0|1,0,1]=4 5682 B12R1.57 C=Cc1cc(ccc1C(=O)C)O 271570a_100011290941_100012340537 [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.57 C=Cc1cc(ccc1N(C)C)C 271570a_100011290941_100012353700 [0,2,0,0,0,0|1,0,0]=3 5684 B12R1.57 C=Cc1cc(ccc1N(C)C)F 271570a_100011290941_100012349029 [0,2,0,0,0,0|1,0,0]=3 5685 B12R1.57 C=Cc1cc(ccc1N(C)C)N 271570a_100011290941_100011534197 [0,2,0,0,0,0|1,0,0]=3 5686 B12R1.57 C=Cc1cc(cnc1N(C)C)N 271570a_100011290941_200012353320 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])O 62a_100012340537_200025704644 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.57 CC(C)c1ccc(cc1N[13CH3])F 2230a_100012283353_200025704644 [0,2,0,0,0,0|2,0,0]=4 5689 B12R1.57 CC(C)c1ccc(cc1N[13CH3])F 34a_100012283353_200025704644 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.57 CC(C)c1ccc(cc1N[13CH3])F 7a_100012283353_200025704644 [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.57 CN(C)c1ccc(cc1C#N)Br 2230a_100013037436_200000210301 [0,2,0,0,0,0|1,0,0]=3 5692 B12R1.57 CN(C)c1ccc(cc1C#N)Br 269982a_100013037436_200000210301 [0,2,0,0,0,0|1,0,0]=3 5693 B12R1.57 CN(C)c1ccc(cc1C#N)Br 27a_100102631434_100011219714 [0,2,0,0,0,0|1,0,0]=3 5694 B12R1.57 CN(C)c1ccc(cc1C#N)Br 7a_100013037436_200000210301 [0,2,0,0,0,0|1,0,0]=3 5695 B12R1.57 CN(C)c1ccc(cc1C=O)O 271570a_203496583355_100012753127 [0,2,0,0,0,0|0,0,0]=2 5696 B12R1.57 CN(C)c1ccc(cc1S[13CH3])F 62a_100012349029_200025704644 [0,2,0,0,0,0|1,0,0]=3 5697 B12R1.57 CN(C)c1ccc(cc1S[13CH3])F 62a_200025704644_100012349029 [0,2,0,0,0,0|1,0,0]=3 5698 B12R1.57 CN(C)c1ccc(cc1S[13CH3])N 62a_100011534197_200025704644 [0,2,0,0,0,0|1,0,0]=3 5699 B12R1.57 CN(C)c1ccc(cc1S[13CH3])N 62a_200025704644_100011534197 [0,2,0,0,0,0|1,0,0]=3 5700 B12R1.57 CN(C)c1ncc(cc1C#N)Br 27a_100102631434_100014921297 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.57 CN(C)c1ncc(cc1C#N)F 27a_100102631434_100009880867 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.57 CN(C)c1ncc(cc1S[13CH3])N 62a_200012353320_200025704644 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.57 CN(C)c1ncc(cc1S[13CH3])N 62a_200025704644_200012353320 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.57 CN([13CH3])c1ccc(cc1C#N)Br 2230a_100013037436_200025704644 [0,2,0,0,0,0|1,0,0]=3 5705 B12R1.57 CN([13CH3])c1ccc(cc1C#N)Br 269982a_100013037436_200025704644 [0,2,0,0,0,0|1,0,0]=3 5706 B12R1.57 CN([13CH3])c1ccc(cc1C#N)Br 7a_100013037436_200025704644 [0,2,0,0,0,0|1,0,0]=3 5707 B12R1.57 CNc1cc(ccc1C(C)C)F 2230a_100012283353_200000210301 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.57 CNc1cc(ccc1C(C)C)F 34a_100012283353_200000210301 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.57 CNc1cc(ccc1C(C)C)F 7a_100012283353_200000210301 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.57 COc1cc(ccc1C(=O)C)O 271570a_203496583355_100000709911 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.57 COc1cc(ccc1C(C)C)C 34a_100000185798_200000210301 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.57 COc1cc(ccc1C(C)C)C 7a_100000185798_200000210301 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.57 COc1cc(ccc1N(C)C)Cl 2230a_100000061351_200000210301 [0,2,0,0,0,0|1,0,0]=3 5714 B12R1.57 COc1cc(ccc1N(C)C)Cl 269982a_100000061351_200000210301 [0,2,0,0,0,0|1,0,0]=3 5715 B12R1.57 COc1cc(ccc1N(C)C)Cl 34a_100000061351_200000210301 [0,2,0,0,0,0|1,0,0]=3 5716 B12R1.57 COc1cc(ccc1N(C)C)F 2230a_100020633920_200000210301 [0,2,0,0,0,0|1,0,0]=3 5717 B12R1.57 COc1cc(ccc1N(C)C)F 269982a_100020633920_200000210301 [0,2,0,0,0,0|1,0,0]=3 5718 B12R1.57 COc1cc(ccc1N(C)C)F 34a_100020633920_200000210301 [0,2,0,0,0,0|1,0,0]=3 5719 B12R1.57 COc1cc(ccc1N(C)C)F 38a_100020633920_200000210301 [0,2,0,0,0,0|1,0,0]=3 5720 B12R1.57 COc1cc(ccc1N(C)[13CH3])Cl 2230a_100000061351_200025704644 [0,2,0,0,0,0|1,0,0]=3 5721 B12R1.57 COc1cc(ccc1N(C)[13CH3])Cl 269982a_100000061351_200025704644 [0,2,0,0,0,0|1,0,0]=3 5722 B12R1.57 COc1cc(ccc1N(C)[13CH3])Cl 34a_100000061351_200025704644 [0,2,0,0,0,0|1,0,0]=3 5723 B12R1.57 COc1cc(ccc1N(C)[13CH3])F 2230a_100020633920_200025704644 [0,2,0,0,0,0|1,0,0]=3 5724 B12R1.57 COc1cc(ccc1N(C)[13CH3])F 269982a_100020633920_200025704644 [0,2,0,0,0,0|1,0,0]=3 5725 B12R1.57 COc1cc(ccc1N(C)[13CH3])F 34a_100020633920_200025704644 [0,2,0,0,0,0|1,0,0]=3 5726 B12R1.57 COc1cc(ccc1N(C)[13CH3])F 38a_100020633920_200025704644 [0,2,0,0,0,0|1,0,0]=3 5727 B12R1.57 CSc1cc(ccc1C(=O)C)O 62a_100012340537_200000210301 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.57 CSc1cc(ccc1N(C)C)C 62a_100012353700_200000210301 [0,2,0,0,0,0|1,0,0]=3 5729 B12R1.57 CSc1cc(ccc1N(C)C)C 62a_200000210301_100012353700 [0,2,0,0,0,0|1,0,0]=3 5730 B12R1.57 CSc1cc(ccc1N(C)C)F 62a_100012349029_200000210301 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.57 CSc1cc(ccc1N(C)C)F 62a_200000210301_100012349029 [0,2,0,0,0,0|1,0,0]=3 5732 B12R1.57 CSc1cc(ccc1N(C)C)N 62a_100011534197_200000210301 [0,2,0,0,0,0|1,0,0]=3 5733 B12R1.57 CSc1cc(ccc1N(C)C)N 62a_200000210301_100011534197 [0,2,0,0,0,0|1,0,0]=3 5734 B12R1.57 CSc1cc(cnc1N(C)C)C 27a_100102631434_100010884634 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.57 CSc1cc(cnc1N(C)C)N 62a_200000210301_200012353320 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.57 CSc1cc(cnc1N(C)C)N 62a_200012353320_200000210301 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 34a_100000185798_200025704644 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 7a_100000185798_200025704644 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.57 Cc1ccc(c(c1)S[13CH3])N(C)C 62a_100012353700_200025704644 [0,2,0,0,0,0|1,0,0]=3 5740 B12R1.57 Cc1ccc(c(c1)S[13CH3])N(C)C 62a_200025704644_100012353700 [0,2,0,0,0,0|1,0,0]=3 5741 B12R1.57 Cc1cnc(c(c1)C#N)N(C)C 27a_100102631434_100012662280 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.1000 C=C(C)c1c(cc(cc1C)O)C 271570a_100000694244_100000243743 [0,2,0,0,0,0|1,0,1]=4 5743 B12R1.1000 C=C(C)c1c(cc(cc1F)O)F 271570a_100000694244_100010219129 [0,2,0,0,0,0|1,0,1]=4 5744 B12R1.1000 C=C(C)c1c(cc(cc1O)O)O 271570a_100000694244_200010341185 [0,2,0,0,0,0|1,0,1]=4 5745 B12R1.1000 CC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_200000210301 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.1000 CC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200000210301 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200000210301 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100012706838 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.1000 CC(=O)c1c(cc(cc1F)O)O 271570a_203496583355_100010734142 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.1000 CC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_200000210301 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.1000 CC(O)c1c(cc(cc1F)O)F 271570a_203496583355_100013396598 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 2230a_200011806176_200000210301 [0,2,0,0,0,0|1,0,0]=3 5753 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 269982a_200011806176_200000210301 [0,2,0,0,0,0|1,0,0]=3 5754 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 34a_200011806176_200000210301 [0,2,0,0,0,0|1,0,0]=3 5755 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 2230a_200011806176_200025704644 [0,2,0,0,0,0|1,0,0]=3 5756 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 269982a_200011806176_200025704644 [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 34a_200011806176_200025704644 [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)O 1458a_100000066486_200025704644 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])O)O 1458a_200000061528_200025704644 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.1000 Cc1nc([nH]c(=O)c1N(C)C)O 27a_100102631434_100000187651 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200025704644 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200025704644 [0,2,0,0,0,0|2,0,0]=4 5763 B10R2.31 Oc1ccc2c(c1)CC2 271570a_203496583355_100009818592 [1,0,0,1,0,0|1,0,0]=3 5764 B10R2.6 c1cc(ccn1)C2CC2 271570a_100011220607_100000035832 [1,0,0,1,0,0|2,0,0]=4 5765 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|1,0,0]=3 5766 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [1,0,0,1,0,0|2,0,0]=4 5767 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [1,0,0,1,0,0|2,0,0]=4 5768 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [0,0,0,1,0,1|2,0,0]=4 5769 B12R2.294 Brc1ccc(cc1)NC2CC2 34a_100000210018_100000211595 [0,0,0,1,0,1|2,0,0]=4 5770 B12R2.294 Brc1ccc(cc1)OC2CC2 34a_100000185759_100000211595 [0,0,0,1,0,1|2,0,0]=4 5771 B12R2.294 Brc1ccc(cc1)SC2CC2 62a_100000752885_100000211595 [0,0,0,1,0,1|2,0,0]=4 5772 B12R2.294 Cc1ccc(cc1)NC2CC2 34a_100000124888_100000211595 [0,0,0,1,0,1|2,0,0]=4 5773 B12R2.294 Cc1ccc(cc1)OC2CC2 34a_100000210336_100000211595 [0,0,0,1,0,1|2,0,0]=4 5774 B12R2.294 Cc1ccc(cc1)SC2CC2 62a_100000186775_100000211595 [0,0,0,1,0,1|2,0,0]=4 5775 B12R2.294 Clc1ccc(cc1)NC2CC2 34a_100000210052_100000211595 [0,0,0,1,0,1|2,0,0]=4 5776 B12R2.294 Clc1ccc(cc1)OC2CC2 34a_100000210216_100000211595 [0,0,0,1,0,1|2,0,0]=4 5777 B12R2.294 Clc1ccc(cc1)SC2CC2 62a_100000755918_100000211595 [0,0,0,1,0,1|2,0,0]=4 5778 B12R2.294 Fc1ccc(cc1)NC2CC2 34a_100000185862_100000211595 [0,0,0,1,0,1|2,0,0]=4 5779 B12R2.294 Fc1ccc(cc1)OC2CC2 34a_100000210339_100000211595 [0,0,0,1,0,1|2,0,0]=4 5780 B12R2.294 Fc1ccc(cc1)SC2CC2 62a_100000211213_100000211595 [0,0,0,1,0,1|2,0,0]=4 5781 B12R2.294 Ic1ccc(cc1)NC2CC2 34a_100000185761_100000211595 [0,0,0,1,0,1|2,0,0]=4 5782 B12R2.294 Ic1ccc(cc1)OC2CC2 34a_100000212066_100000211595 [0,0,0,1,0,1|2,0,0]=4 5783 B12R2.294 Nc1ccc(cc1)OC2CC2 34a_100000185829_100000211595 [0,0,0,1,0,1|2,0,0]=4 5784 B12R2.294 Nc1ccc(cc1)SC2CC2 62a_100000185761_100000211595 [0,0,0,1,0,1|2,0,0]=4 5785 B12R2.294 Oc1ccc(cc1)NC2CC2 34a_100000185829_100000211595 [0,0,0,1,0,1|1,0,0]=3 5786 B12R2.294 Oc1ccc(cc1)OC2CC2 271570a_203496583355_100000704264 [0,0,0,1,0,1|1,0,0]=3 5787 B12R2.294 Oc1ccc(nc1)NC2CC2 271570a_203496583355_100011242975 [0,0,0,1,0,1|2,0,0]=4 5788 B12R2.294 Oc1ccc(nc1)SC2CC2 62a_100000685995_100000211595 [0,0,0,1,0,1|2,0,0]=4 5789 B12R2.606 CN1Cc2ccc(cc2C1)Br 2230a_100000702344_200000210301 [0,0,0,1,0,1|1,0,0]=3 5790 B12R2.606 CN1Cc2ccc(cc2C1)Br 269982a_100000702344_200000210301 [0,0,0,1,0,1|1,0,0]=3 5791 B12R2.606 CN1Cc2ccc(cc2C1)Br 34a_100000702344_200000210301 [0,0,0,1,0,1|1,0,0]=3 5792 B12R2.606 CN1Cc2ccc(cc2C1)Cl 2230a_100015205306_200000210301 [0,0,0,1,0,1|1,0,0]=3 5793 B12R2.606 CN1Cc2ccc(cc2C1)Cl 269982a_100015205306_200000210301 [0,0,0,1,0,1|1,0,0]=3 5794 B12R2.606 CN1Cc2ccc(cc2C1)Cl 34a_100015205306_200000210301 [0,0,0,1,0,1|1,0,0]=3 5795 B12R2.606 CN1Cc2ccc(cc2C1)F 2230a_100000766377_200000210301 [0,0,0,1,0,1|1,0,0]=3 5796 B12R2.606 CN1Cc2ccc(cc2C1)F 269982a_100000766377_200000210301 [0,0,0,1,0,1|1,0,0]=3 5797 B12R2.606 CN1Cc2ccc(cc2C1)F 34a_100000766377_200000210301 [0,0,0,1,0,1|1,0,0]=3 5798 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,0,0,1,0,1|0,0,0]=2 5799 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,0,0,1,0,1|0,0,0]=2 5800 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,0,0,1,0,1|0,0,0]=2 5801 B12R2.606 CN1Cc2ccc(nc2C1)Cl 2230a_100016995040_200000210301 [0,0,0,1,0,1|2,0,0]=4 5802 B12R2.606 CN1Cc2ccc(nc2C1)Cl 269982a_100016995040_200000210301 [0,0,0,1,0,1|2,0,0]=4 5803 B12R2.606 CN1Cc2cnc(cc2C1)Cl 2230a_100020645637_200000210301 [0,0,0,1,0,1|2,0,0]=4 5804 B12R2.606 CN1Cc2cnc(cc2C1)Cl 269982a_100020645637_200000210301 [0,0,0,1,0,1|2,0,0]=4 5805 B12R2.606 CN1Cc2cnc(cc2C1)Cl 34a_100020645637_200000210301 [0,0,0,1,0,1|2,0,0]=4 5806 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,0,0,1,0,1|1,0,1]=4 5807 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,0,0,1,0,1|1,0,1]=4 5808 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,0,0,1,0,1|2,0,0]=4 5809 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,0,0,1,0,1|2,0,0]=4 5810 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,0,0,1,0,1|2,0,0]=4 5811 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,0,0,1,0,1|2,0,0]=4 5812 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,0,0,1,0,1|2,0,0]=4 5813 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,0,0,1,0,1|2,0,0]=4 5814 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [0,0,0,1,0,1|0,0,1]=3 5815 B12R2.606 Cn1cc2cc(cnc2n1)O 271570a_203496583355_100010114929 [0,0,0,1,0,1|1,0,1]=4 5816 B12R2.606 Cn1cc2cc(ncc2n1)O 271570a_203496583355_100020640495 [0,0,0,1,0,1|1,0,1]=4 5817 B12R2.606 Cn1cc2ccc(cc2n1)O 271570a_203496583355_100009817169 [0,0,0,1,0,1|1,0,0]=3 5818 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [0,0,0,1,0,1|2,0,0]=4 5819 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,0,0,1,0,1|2,0,0]=4 5820 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,0,0,1,0,1|2,0,0]=4 5821 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [0,0,0,1,0,1|2,0,0]=4 5822 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 2230a_100000702344_200025704644 [0,0,0,1,0,1|1,0,0]=3 5823 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 269982a_100000702344_200025704644 [0,0,0,1,0,1|1,0,0]=3 5824 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 34a_100000702344_200025704644 [0,0,0,1,0,1|1,0,0]=3 5825 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 2230a_100015205306_200025704644 [0,0,0,1,0,1|1,0,0]=3 5826 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 269982a_100015205306_200025704644 [0,0,0,1,0,1|1,0,0]=3 5827 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 34a_100015205306_200025704644 [0,0,0,1,0,1|1,0,0]=3 5828 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 2230a_100000766377_200025704644 [0,0,0,1,0,1|1,0,0]=3 5829 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 269982a_100000766377_200025704644 [0,0,0,1,0,1|1,0,0]=3 5830 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 34a_100000766377_200025704644 [0,0,0,1,0,1|1,0,0]=3 5831 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,0,0,1,0,1|0,0,0]=2 5832 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,0,0,1,0,1|0,0,0]=2 5833 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,0,0,1,0,1|0,0,0]=2 5834 B12R2.606 [13CH3]N1Cc2ccc(nc2C1)Cl 2230a_100016995040_200025704644 [0,0,0,1,0,1|2,0,0]=4 5835 B12R2.606 [13CH3]N1Cc2ccc(nc2C1)Cl 269982a_100016995040_200025704644 [0,0,0,1,0,1|2,0,0]=4 5836 B12R2.606 [13CH3]N1Cc2cnc(cc2C1)Cl 2230a_100020645637_200025704644 [0,0,0,1,0,1|2,0,0]=4 5837 B12R2.606 [13CH3]N1Cc2cnc(cc2C1)Cl 269982a_100020645637_200025704644 [0,0,0,1,0,1|2,0,0]=4 5838 B12R2.606 [13CH3]N1Cc2cnc(cc2C1)Cl 34a_100020645637_200025704644 [0,0,0,1,0,1|2,0,0]=4 5839 B12R2.9 C=Cc1ccc(cc1)C2CC2 271570a_100011290941_100009820665 [0,1,0,1,0,0|2,0,0]=4 5840 B12R2.9 CCc1ccc(cc1)C2CC2 271570a_100011220607_100011215824 [0,1,0,1,0,0|2,0,0]=4 5841 B12R2.9 CNc1ccc(cc1)C2CC2 271570a_100011220607_100000219623 [0,1,0,1,0,0|2,0,0]=4 5842 B12R2.9 CNc1ccc(cc1)C2CC2 34a_100016991203_200000210301 [0,1,0,1,0,0|2,0,0]=4 5843 B12R2.9 COc1ccc(cc1)C2CC2 271570a_100011220607_100000171711 [0,1,0,1,0,0|1,0,0]=3 5844 B12R2.9 COc1ccc(cc1)C2CC2 34a_100011997980_200000210301 [0,1,0,1,0,0|1,0,0]=3 5845 B12R2.9 COc1ccc(cc1)C2CC2 7a_100011997980_200000210301 [0,1,0,1,0,0|1,0,0]=3 5846 B12R2.9 COc1ccc(cn1)C2CC2 271570a_100011220607_100000047065 [0,1,0,1,0,0|2,0,0]=4 5847 B12R2.9 COc1ccc(nc1)C2CC2 271570a_100011220607_100000755202 [0,1,0,1,0,0|2,0,0]=4 5848 B12R2.9 CSc1ccc(cc1)C2CC2 271570a_100011220607_100011263217 [0,1,0,1,0,0|1,1,0]=4 5849 B12R2.9 CSc1ccc(cc1)C2CC2 62a_200000210301_100009820665 [0,1,0,1,0,0|1,1,0]=4 5850 B12R2.9 FCc1ccc(cc1)C2CC2 271570a_100011220607_100010268989 [0,1,0,1,0,0|2,0,0]=4 5851 B12R2.9 N#Cc1ccc(cc1)C2CC2 271570a_100011220607_100000179745 [0,1,0,1,0,0|2,0,0]=4 5852 B12R2.9 NCc1ccc(cc1)C2CC2 271570a_100011220607_100016989417 [0,1,0,1,0,0|2,0,0]=4 5853 B12R2.9 NNc1ccc(cc1)C2CC2 271570a_100011220607_100016988836 [0,1,0,1,0,0|2,0,0]=4 5854 B12R2.9 O=Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186029 [0,1,0,1,0,0|1,0,1]=4 5855 B12R2.9 OCc1ccc(cc1)C2CC2 271570a_100011220607_100000690907 [0,1,0,1,0,0|1,0,0]=3 5856 B12R2.9 OCc1ccc(cn1)C2CC2 271570a_100011220607_100000754261 [0,1,0,1,0,0|2,0,0]=4 5857 B12R2.9 OCc1ccc(nc1)C2CC2 271570a_100011220607_100009816760 [0,1,0,1,0,0|2,0,0]=4 5858 B12R2.9 [13CH3]Nc1ccc(cc1)C2CC2 34a_100016991203_200025704644 [0,1,0,1,0,0|2,0,0]=4 5859 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 34a_100011997980_200025704644 [0,1,0,1,0,0|1,0,0]=3 5860 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 7a_100011997980_200025704644 [0,1,0,1,0,0|1,0,0]=3 5861 B12R2.9 [13CH3]Sc1ccc(cc1)C2CC2 62a_200025704644_100009820665 [0,1,0,1,0,0|1,1,0]=4 5862 B12R2.290 NC1(CC1)c2ccc(cc2)O 271570a_203496583355_100000742681 [0,1,0,1,0,0|1,0,0]=3 5863 B12R2.291 Brc1ccc(cc1Br)C2CC2 271570a_100011220607_100012356285 [0,1,0,1,0,0|2,0,0]=4 5864 B12R2.291 Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100009813585 [0,1,0,1,0,0|2,0,0]=4 5865 B12R2.291 Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100000049509 [0,1,0,1,0,0|2,0,0]=4 5866 B12R2.291 Cc1cc(ccc1F)C2CC2 271570a_100011220607_100011218330 [0,1,0,1,0,0|2,0,0]=4 5867 B12R2.291 Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000211769 [0,1,0,1,0,0|2,0,0]=4 5868 B12R2.291 Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186361 [0,1,0,1,0,0|1,0,0]=3 5869 B12R2.291 Cc1cc(cnc1O)C2CC2 271570a_100011220607_100000685391 [0,1,0,1,0,0|2,0,0]=4 5870 B12R2.291 Cc1cc(ncc1O)C2CC2 271570a_100011220607_100000692680 [0,1,0,1,0,0|2,0,0]=4 5871 B12R2.291 Cc1ccc(cc1Br)C2CC2 271570a_100011220607_100011847877 [0,1,0,1,0,0|2,0,0]=4 5872 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [0,1,0,1,0,0|2,0,0]=4 5873 B12R2.291 Cc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011216363 [0,1,0,1,0,0|2,0,0]=4 5874 B12R2.291 Cc1ccc(cc1F)C2CC2 271570a_100011220607_100000720648 [0,1,0,1,0,0|2,0,0]=4 5875 B12R2.291 Cc1ccc(cc1N)C2CC2 271570a_100011220607_100000761890 [0,1,0,1,0,0|2,0,0]=4 5876 B12R2.291 Cc1ccc(cc1O)C2CC2 271570a_100011220607_100000766334 [0,1,0,1,0,0|2,0,0]=4 5877 B12R2.291 Cc1nc(ccc1O)C2CC2 271570a_100011220607_100010233687 [0,1,0,1,0,0|2,0,0]=4 5878 B12R2.291 Clc1cc(ccc1Br)C2CC2 271570a_100011220607_100012047281 [0,1,0,1,0,0|2,0,0]=4 5879 B12R2.291 Clc1ccc(cc1Br)C2CC2 271570a_100011220607_100012353702 [0,1,0,1,0,0|2,0,0]=4 5880 B12R2.291 Clc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011214914 [0,1,0,1,0,0|2,0,0]=4 5881 B12R2.291 Fc1cc(ccc1Br)C2CC2 271570a_100011220607_100000685389 [0,1,0,1,0,0|2,0,0]=4 5882 B12R2.291 Fc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011216805 [0,1,0,1,0,0|2,0,0]=4 5883 B12R2.291 Fc1ccc(cc1Br)C2CC2 271570a_100011220607_100012047266 [0,1,0,1,0,0|2,0,0]=4 5884 B12R2.291 Fc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011215976 [0,1,0,1,0,0|2,0,0]=4 5885 B12R2.291 Fc1ccc(cc1F)C2CC2 271570a_100011220607_100000750028 [0,1,0,1,0,0|2,0,0]=4 5886 B12R2.291 Nc1cc(ccc1Br)C2CC2 271570a_100011220607_100000750456 [0,1,0,1,0,0|2,0,0]=4 5887 B12R2.291 Nc1cc(ccc1Cl)C2CC2 271570a_100011220607_200000761891 [0,1,0,1,0,0|2,0,0]=4 5888 B12R2.291 Nc1cc(ccc1F)C2CC2 271570a_100011220607_100000740924 [0,1,0,1,0,0|2,0,0]=4 5889 B12R2.291 Nc1cc(ccc1O)C2CC2 271570a_100011220607_100000752626 [0,1,0,1,0,0|1,0,0]=3 5890 B12R2.291 Nc1cc(cnc1O)C2CC2 271570a_100011220607_100000743729 [0,1,0,1,0,0|2,0,0]=4 5891 B12R2.291 Nc1cc(ncc1O)C2CC2 271570a_100011220607_100009819941 [0,1,0,1,0,0|2,0,0]=4 5892 B12R2.291 Nc1ccc(cc1Br)C2CC2 271570a_100011220607_100000750455 [0,1,0,1,0,0|2,0,0]=4 5893 B12R2.291 Nc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011218065 [0,1,0,1,0,0|2,0,0]=4 5894 B12R2.291 Nc1ccc(cc1F)C2CC2 271570a_100011220607_100011215594 [0,1,0,1,0,0|2,0,0]=4 5895 B12R2.291 Nc1ccc(cc1N)C2CC2 271570a_100011220607_100000741789 [0,1,0,1,0,0|2,0,0]=4 5896 B12R2.291 Nc1ccc(cc1O)C2CC2 271570a_100011220607_100000739049 [0,1,0,1,0,0|2,0,0]=4 5897 B12R2.291 Nc1nc(ccc1O)C2CC2 271570a_100011220607_100000685527 [0,1,0,1,0,0|2,0,0]=4 5898 B12R2.291 Oc1cc(ccc1Br)C2CC2 271570a_100011220607_100012356990 [0,1,0,1,0,0|2,0,0]=4 5899 B12R2.291 Oc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356854 [0,1,0,1,0,0|2,0,0]=4 5900 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_100011220607_100000686035 [0,1,0,1,0,0|2,0,0]=4 5901 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_203496583355_100010281199 [0,1,0,1,0,0|2,0,0]=4 5902 B12R2.291 Oc1ccc(cc1Br)C2CC2 271570a_100011220607_100012361655 [0,1,0,1,0,0|1,0,0]=3 5903 B12R2.291 Oc1ccc(cc1Cl)C2CC2 271570a_100011220607_100012360047 [0,1,0,1,0,0|1,0,0]=3 5904 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_100011220607_100000185481 [0,1,0,1,0,0|1,0,0]=3 5905 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_203496583355_100010281179 [0,1,0,1,0,0|1,0,0]=3 5906 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_100011220607_100009813601 [0,1,0,1,0,0|1,0,0]=3 5907 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_203496583355_100135415898 [0,1,0,1,0,0|1,0,0]=3 5908 B12R2.291 Oc1ccc(nc1Br)C2CC2 271570a_100011220607_100000725334 [0,1,0,1,0,0|2,0,0]=4 5909 B12R2.291 Oc1ccc(nc1Cl)C2CC2 271570a_100011220607_100000721234 [0,1,0,1,0,0|2,0,0]=4 5910 B12R2.291 Oc1ccc(nc1F)C2CC2 271570a_100011220607_100009819667 [0,1,0,1,0,0|2,0,0]=4 5911 B12R2.291 Oc1ncc(cc1Cl)C2CC2 271570a_100011220607_100010238531 [0,1,0,1,0,0|2,0,0]=4 5912 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [0,1,0,1,0,0|0,0,0]=2 5913 B12R2.612 CN1CCc2c1ncc(c2)O 271570a_203496583355_200010383199 [0,1,0,1,0,0|1,0,0]=3 5914 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,1,0,0|1,0,1]=4 5915 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,1,0,0|1,0,1]=4 5916 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,1,0,1,0,0|2,0,0]=4 5917 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,1,0,1,0,0|2,0,0]=4 5918 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [0,1,0,1,0,0|0,0,1]=3 5919 B12R2.612 Cn1ccc2c1ncc(c2)O 271570a_203496583355_100010191616 [0,1,0,1,0,0|1,0,1]=4 5920 B12R2.612 Cn1cnc2c1ccc(c2)O 271570a_203496583355_100000718706 [0,1,0,1,0,0|0,0,1]=3 5921 B12R2.612 Cn1cnc2c1ccc(n2)O 271570a_203496583355_100010385288 [0,1,0,1,0,0|1,0,1]=4 5922 B12R2.612 Cn1cnc2c1cnc(c2)O 271570a_203496583355_200010979150 [0,1,0,1,0,0|1,0,1]=4 5923 B12R2.612 Cn1cnc2c1ncc(c2)O 271570a_203496583355_100010197353 [0,1,0,1,0,0|1,0,1]=4 5924 B12R2.612 Cn1ncc2c1ccc(c2)O 271570a_203496583355_100009817176 [0,1,0,1,0,0|0,0,1]=3 5925 B12R2.612 Cn1ncc2c1cnc(c2)O 271570a_203496583355_100010370742 [0,1,0,1,0,0|1,0,1]=4 5926 B12R2.612 Cn1ncc2c1ncc(c2)O 271570a_203496583355_100011554430 [0,1,0,1,0,0|1,0,1]=4 5927 B12R2.612 Cn1nnc2c1ccc(c2)O 271570a_203496583355_100000724718 [0,1,0,1,0,0|1,0,0]=3 5928 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [0,1,0,1,0,0|2,0,0]=4 5929 B12R2.612 NC1COc2c1ccc(c2)O 271570a_203496583355_100020628175 [0,1,0,1,0,0|2,0,0]=4 5930 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,1,0,0|2,0,0]=4 5931 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,1,0,0|2,0,0]=4 5932 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,1,0,0|2,0,0]=4 5933 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,1,0,0|2,0,0]=4 5934 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,1,0,1,0,0|2,0,0]=4 5935 B12R2.2302 Brc1ccc(nc1)N2CCC2 27a_100000754969_100000686858 [0,1,0,1,0,0|2,0,0]=4 5936 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [0,1,0,1,0,0|1,0,0]=3 5937 B12R2.2302 Oc1ccc(cc1)C2COC2 271570a_203496583355_100010732642 [0,1,0,1,0,0|1,0,0]=3 5938 B12R2.2302 Oc1cnc(nc1)N2CCC2 271570a_203496583355_100011940482 [0,1,0,1,0,0|2,0,0]=4 5939 B12R2.1317 Brc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011484698 [0,1,0,1,0,0|2,0,0]=4 5940 B12R2.1317 Cc1cc(ccc1C2CC2)Br 271570a_100011220607_100000701812 [0,1,0,1,0,0|2,0,0]=4 5941 B12R2.1317 Cc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011219607 [0,1,0,1,0,0|2,0,0]=4 5942 B12R2.1317 Cc1cc(ccc1C2CC2)F 271570a_100011220607_100011205405 [0,1,0,1,0,0|2,0,0]=4 5943 B12R2.1317 Cc1cc(ccc1C2CC2)N 271570a_100011220607_100000210723 [0,1,0,1,0,0|2,0,0]=4 5944 B12R2.1317 Cc1cc(ccc1C2CC2)O 271570a_100011220607_100000729255 [0,1,0,1,0,0|1,0,0]=3 5945 B12R2.1317 Cc1cc(cnc1C2CC2)O 271570a_100011220607_100012000486 [0,1,0,1,0,0|2,0,0]=4 5946 B12R2.1317 Cc1cc(ncc1C2CC2)O 271570a_100011220607_100010114363 [0,1,0,1,0,0|2,0,0]=4 5947 B12R2.1317 Cc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100009813563 [0,1,0,1,0,0|2,0,0]=4 5948 B12R2.1317 Cc1ccc(c(c1)C)C2CC2 271570a_100011220607_100011217332 [0,1,0,1,0,0|2,0,0]=4 5949 B12R2.1317 Cc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100011263221 [0,1,0,1,0,0|2,0,0]=4 5950 B12R2.1317 Cc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011216119 [0,1,0,1,0,0|2,0,0]=4 5951 B12R2.1317 Cc1ccc(c(c1)N)C2CC2 271570a_100011220607_100011216686 [0,1,0,1,0,0|2,0,0]=4 5952 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|2,0,0]=4 5953 B12R2.1317 Cc1nc(ccc1C2CC2)O 271570a_100011220607_100000691680 [0,1,0,1,0,0|2,0,0]=4 5954 B12R2.1317 Clc1cc(ccc1C2CC2)Br 271570a_100011220607_100011216062 [0,1,0,1,0,0|2,0,0]=4 5955 B12R2.1317 Clc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011219703 [0,1,0,1,0,0|2,0,0]=4 5956 B12R2.1317 Clc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000699841 [0,1,0,1,0,0|2,0,0]=4 5957 B12R2.1317 Fc1cc(ccc1C2CC2)Br 271570a_100011220607_100009814013 [0,1,0,1,0,0|2,0,0]=4 5958 B12R2.1317 Fc1cc(ccc1C2CC2)Cl 271570a_100011220607_100011216042 [0,1,0,1,0,0|2,0,0]=4 5959 B12R2.1317 Fc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011217111 [0,1,0,1,0,0|2,0,0]=4 5960 B12R2.1317 Fc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000733362 [0,1,0,1,0,0|2,0,0]=4 5961 B12R2.1317 Fc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000750030 [0,1,0,1,0,0|2,0,0]=4 5962 B12R2.1317 Nc1cc(ccc1C2CC2)Br 271570a_100011220607_100000743836 [0,1,0,1,0,0|2,0,0]=4 5963 B12R2.1317 Nc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000761886 [0,1,0,1,0,0|2,0,0]=4 5964 B12R2.1317 Nc1cc(ccc1C2CC2)F 271570a_100011220607_100011218093 [0,1,0,1,0,0|2,0,0]=4 5965 B12R2.1317 Nc1cc(ccc1C2CC2)O 271570a_100011220607_100011999798 [0,1,0,1,0,0|1,0,0]=3 5966 B12R2.1317 Nc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000750458 [0,1,0,1,0,0|2,0,0]=4 5967 B12R2.1317 Nc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000761885 [0,1,0,1,0,0|2,0,0]=4 5968 B12R2.1317 Nc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011356925 [0,1,0,1,0,0|2,0,0]=4 5969 B12R2.1317 Nc1ccc(c(c1)N)C2CC2 271570a_100011220607_200012175722 [0,1,0,1,0,0|2,0,0]=4 5970 B12R2.1317 Oc1cc(ccc1C2CC2)Br 271570a_100011220607_100012344904 [0,1,0,1,0,0|2,0,0]=4 5971 B12R2.1317 Oc1cc(ccc1C2CC2)Cl 271570a_100011220607_100000050036 [0,1,0,1,0,0|2,0,0]=4 5972 B12R2.1317 Oc1cc(ccc1C2CC2)F 271570a_100011220607_100000690578 [0,1,0,1,0,0|2,0,0]=4 5973 B12R2.1317 Oc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100000701344 [0,1,0,1,0,0|1,0,0]=3 5974 B12R2.1317 Oc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100000047559 [0,1,0,1,0,0|1,0,0]=3 5975 B12R2.1317 Oc1ccc(c(c1)F)C2CC2 271570a_100011220607_100000755031 [0,1,0,1,0,0|1,0,0]=3 5976 B12R2.1317 Oc1ccc(c(c1)O)C2CC2 271570a_100011220607_100009813921 [0,1,0,1,0,0|1,0,0]=3 5977 B12R2.1317 Oc1ccc(c(n1)F)C2CC2 271570a_100011220607_100009879308 [0,1,0,1,0,0|2,0,0]=4 5978 B12R2.1317 Oc1cnc(c(c1)F)C2CC2 271570a_100011220607_100000063512 [0,1,0,1,0,0|2,0,0]=4 5979 B8R1.1 CCc1cc(cs1)O 271570a_203496583355_100009846239 [1,0,0,0,1,0|2,0,0]=4 5980 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,0,0,0,1,0|2,0,0]=4 5981 B8R1.1 CSc1cc(cs1)O 271570a_203496583355_200010256830 [1,0,0,0,1,0|2,0,0]=4 5982 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,0,0,0,1|1,0,0]=3 5983 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,0,0,0,0,1|2,0,0]=4 5984 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,0,0,0,1|2,0,0]=4 5985 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,0,0,0,0,1|2,0,0]=4 5986 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,1|2,0,0]=4 5987 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,1|2,0,0]=4 5988 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,1|2,0,0]=4 5989 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,1|2,0,0]=4 5990 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,1|2,0,0]=4 5991 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,0,0,0,0,1|1,0,0]=3 5992 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,1|1,0,0]=3 5993 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,1|1,0,0]=3 5994 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [1,0,0,0,0,1|2,0,0]=4 5995 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [1,0,0,0,0,1|2,0,0]=4 5996 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [1,0,0,0,0,1|2,0,0]=4 5997 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,0,0,0,0,1|1,0,0]=3 5998 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,0,0,0,0,1|1,0,0]=3 5999 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [1,0,0,0,0,1|2,0,0]=4 6000 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [1,0,0,0,0,1|2,0,0]=4 6001 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [1,0,0,0,0,1|2,0,0]=4 6002 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [1,0,0,0,0,1|2,0,0]=4 6003 B10R1.18 CC(C)Sc1ccncc1 62a_100000210206_100000728582 [1,0,0,0,0,1|2,0,0]=4 6004 B10R1.18 CC(C)Sc1ccncc1 62a_100000728582_100000210206 [1,0,0,0,0,1|2,0,0]=4 6005 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,0,0,0,0,1|0,0,0]=2 6006 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,0,0,0,0,1|0,0,0]=2 6007 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,0,0,0,0,1|0,0,0]=2 6008 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,0,0,0,0,1|0,0,0]=2 6009 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,0,0,0,0,1|0,0,0]=2 6010 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [1,0,0,0,0,1|1,0,0]=3 6011 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [1,0,0,0,0,1|1,0,0]=3 6012 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [1,0,0,0,0,1|1,0,0]=3 6013 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [1,0,0,0,0,1|1,0,0]=3 6014 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [1,0,0,0,0,1|1,0,0]=3 6015 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [1,0,0,0,0,1|1,0,0]=3 6016 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [1,0,0,0,0,1|1,0,0]=3 6017 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [1,0,0,0,0,1|1,0,0]=3 6018 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [1,0,0,0,0,1|1,0,0]=3 6019 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [1,0,0,0,0,1|1,0,0]=3 6020 B10R1.18 CN(C)Cc1cccnn1 2230a_100102631434_100016990269 [1,0,0,0,0,1|2,0,0]=4 6021 B10R1.18 CN(C)Cc1ccncc1 2230a_100000187231_200000210301 [1,0,0,0,0,1|1,0,0]=3 6022 B10R1.18 CN(C)Cc1ccncc1 2230a_100102631434_100015193705 [1,0,0,0,0,1|1,0,0]=3 6023 B10R1.18 CN(C)Cc1ccncc1 269982a_100000187231_200000210301 [1,0,0,0,0,1|1,0,0]=3 6024 B10R1.18 CN(C)Cc1ccncc1 269982a_100102631434_100015193705 [1,0,0,0,0,1|1,0,0]=3 6025 B10R1.18 CN(C)Cc1ccnnc1 270004a_100102631434_100011934578 [1,0,0,0,0,1|2,0,0]=4 6026 B10R1.18 CN(C)Cc1cnccn1 2230a_100011269079_200000210301 [1,0,0,0,0,1|2,0,0]=4 6027 B10R1.18 CN(C)Cc1cnccn1 2230a_100102631434_100016995436 [1,0,0,0,0,1|2,0,0]=4 6028 B10R1.18 CN(C)Cc1cnccn1 269982a_100011269079_200000210301 [1,0,0,0,0,1|2,0,0]=4 6029 B10R1.18 CN(C)Cc1cnccn1 269982a_100102631434_100016995436 [1,0,0,0,0,1|2,0,0]=4 6030 B10R1.18 CN(C)Cc1cnccn1 270004a_100102631434_100000749867 [1,0,0,0,0,1|2,0,0]=4 6031 B10R1.18 CN(C)Cc1cncnc1 2230a_100102631434_100015196519 [1,0,0,0,0,1|2,0,0]=4 6032 B10R1.18 CN(C)Cc1cncnc1 269982a_100102631434_100016991940 [1,0,0,0,0,1|2,0,0]=4 6033 B10R1.18 CN(C)Cc1cncnc1 270004a_100102631434_100000749868 [1,0,0,0,0,1|2,0,0]=4 6034 B10R1.18 CN(C)Cc1ncccn1 2230a_100025716638_200000210301 [1,0,0,0,0,1|2,0,0]=4 6035 B10R1.18 CN(C)Cc1ncccn1 2230a_100102631434_100000703007 [1,0,0,0,0,1|2,0,0]=4 6036 B10R1.18 CN(C)Cc1ncccn1 269982a_100025716638_200000210301 [1,0,0,0,0,1|2,0,0]=4 6037 B10R1.18 CN(C)Cc1ncccn1 269982a_100102631434_100000703007 [1,0,0,0,0,1|2,0,0]=4 6038 B10R1.18 CN(C)Cc1ncccn1 270004a_100102631434_100011532527 [1,0,0,0,0,1|2,0,0]=4 6039 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,0,0,0,0,1|0,0,0]=2 6040 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,0,0,0,0,1|0,0,0]=2 6041 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [1,0,0,0,0,1|1,0,0]=3 6042 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [1,0,0,0,0,1|1,0,0]=3 6043 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [1,0,0,0,0,1|1,0,0]=3 6044 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [1,0,0,0,0,1|1,0,0]=3 6045 B10R1.18 CN([13CH3])Cc1ccncc1 2230a_100000187231_200025704644 [1,0,0,0,0,1|1,0,0]=3 6046 B10R1.18 CN([13CH3])Cc1ccncc1 269982a_100000187231_200025704644 [1,0,0,0,0,1|1,0,0]=3 6047 B10R1.18 CN([13CH3])Cc1cnccn1 2230a_100011269079_200025704644 [1,0,0,0,0,1|2,0,0]=4 6048 B10R1.18 CN([13CH3])Cc1cnccn1 269982a_100011269079_200025704644 [1,0,0,0,0,1|2,0,0]=4 6049 B10R1.18 CN([13CH3])Cc1ncccn1 2230a_100025716638_200025704644 [1,0,0,0,0,1|2,0,0]=4 6050 B10R1.18 CN([13CH3])Cc1ncccn1 269982a_100025716638_200025704644 [1,0,0,0,0,1|2,0,0]=4 6051 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [0,0,0,0,0,2|1,0,1]=4 6052 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [0,0,0,0,0,2|1,0,1]=4 6053 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [0,0,0,0,0,2|2,0,0]=4 6054 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [0,0,0,0,0,2|2,0,0]=4 6055 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [0,0,0,0,0,2|2,0,0]=4 6056 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [0,0,0,0,0,2|2,0,0]=4 6057 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [0,0,0,0,0,2|2,0,0]=4 6058 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [0,0,0,0,0,2|2,0,0]=4 6059 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [0,0,0,0,0,2|2,0,0]=4 6060 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [0,0,0,0,0,2|2,0,0]=4 6061 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [0,0,0,0,0,2|2,0,0]=4 6062 B12R1.21 CC(C)C=Cc1ccc(cc1)Br 271570a_100016257149_100000752885 [0,0,0,0,0,2|2,0,0]=4 6063 B12R1.21 CC(C)C=Cc1ccc(cc1)Cl 271570a_100016257149_100000755918 [0,0,0,0,0,2|2,0,0]=4 6064 B12R1.21 CC(C)C=Cc1ccc(cc1)F 271570a_100016257149_100000211213 [0,0,0,0,0,2|2,0,0]=4 6065 B12R1.21 CC(C)C=Cc1ccc(cc1)N 271570a_100016257149_100000185761 [0,0,0,0,0,2|2,0,0]=4 6066 B12R1.21 CC(C)C=Cc1ccc(cc1)O 271570a_100016257149_100000185759 [0,0,0,0,0,2|1,0,0]=3 6067 B12R1.21 CC(C)C=Cc1ccc(cn1)O 271570a_100016257149_100000685995 [0,0,0,0,0,2|2,0,0]=4 6068 B12R1.21 CC(C)CNc1ccc(cc1)Br 2230a_100000210018_100000210760 [0,0,0,0,0,2|2,0,0]=4 6069 B12R1.21 CC(C)CNc1ccc(cc1)Br 34a_100000210018_100000210624 [0,0,0,0,0,2|2,0,0]=4 6070 B12R1.21 CC(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000210760 [0,0,0,0,0,2|2,0,0]=4 6071 B12R1.21 CC(C)CNc1ccc(cc1)Cl 34a_100000210052_100000210624 [0,0,0,0,0,2|2,0,0]=4 6072 B12R1.21 CC(C)CNc1ccc(cc1)F 34a_100000185862_100000210624 [0,0,0,0,0,2|2,0,0]=4 6073 B12R1.21 CC(C)CNc1ccc(cc1)I 34a_100000185761_100000210624 [0,0,0,0,0,2|2,0,0]=4 6074 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [0,0,0,0,0,2|1,0,0]=3 6075 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [0,0,0,0,0,2|1,0,0]=3 6076 B12R1.21 CC(C)COc1ccc(cc1)Br 34a_100000185759_100000210624 [0,0,0,0,0,2|2,0,0]=4 6077 B12R1.21 CC(C)COc1ccc(cc1)Br 7a_100000185759_100000210760 [0,0,0,0,0,2|2,0,0]=4 6078 B12R1.21 CC(C)COc1ccc(cc1)Cl 34a_100000210216_100000210624 [0,0,0,0,0,2|2,0,0]=4 6079 B12R1.21 CC(C)COc1ccc(cc1)Cl 7a_100000210216_100000210760 [0,0,0,0,0,2|2,0,0]=4 6080 B12R1.21 CC(C)COc1ccc(cc1)F 34a_100000210339_100000210624 [0,0,0,0,0,2|2,0,0]=4 6081 B12R1.21 CC(C)COc1ccc(cc1)I 34a_100000212066_100000210624 [0,0,0,0,0,2|2,0,0]=4 6082 B12R1.21 CC(C)COc1ccc(cc1)I 7a_100000212066_100000210760 [0,0,0,0,0,2|2,0,0]=4 6083 B12R1.21 CC(C)COc1ccc(cc1)N 34a_100000185829_100000210624 [0,0,0,0,0,2|2,0,0]=4 6084 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [0,0,0,0,0,2|1,0,0]=3 6085 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000210624_100000752885 [0,0,0,0,0,2|2,0,0]=4 6086 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000752885_100000210760 [0,0,0,0,0,2|2,0,0]=4 6087 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000210624_100000755918 [0,0,0,0,0,2|2,0,0]=4 6088 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000755918_100000210760 [0,0,0,0,0,2|2,0,0]=4 6089 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000210624_100000211213 [0,0,0,0,0,2|2,0,0]=4 6090 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000211213_100000210760 [0,0,0,0,0,2|2,0,0]=4 6091 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000185761_100000210760 [0,0,0,0,0,2|2,0,0]=4 6092 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000210624_100000185761 [0,0,0,0,0,2|2,0,0]=4 6093 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [0,0,0,0,0,2|1,0,0]=3 6094 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000210624_100000744096 [0,0,0,0,0,2|2,0,0]=4 6095 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000685995_100000210760 [0,0,0,0,0,2|2,0,0]=4 6096 B12R1.21 CC(C)NCc1ccc(cc1)Br 207a_100138425928_100000186029 [0,0,0,0,0,2|2,0,0]=4 6097 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100000174875_100000210206 [0,0,0,0,0,2|2,0,0]=4 6098 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100138425928_100011217064 [0,0,0,0,0,2|2,0,0]=4 6099 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100000174875_100000210206 [0,0,0,0,0,2|2,0,0]=4 6100 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100138425928_100000189115 [0,0,0,0,0,2|2,0,0]=4 6101 B12R1.21 CC(C)NCc1ccc(cc1)Cl 207a_100138425928_100000189385 [0,0,0,0,0,2|2,0,0]=4 6102 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000210206 [0,0,0,0,0,2|2,0,0]=4 6103 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100138425928_100000694040 [0,0,0,0,0,2|2,0,0]=4 6104 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210206 [0,0,0,0,0,2|2,0,0]=4 6105 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100138425928_100000694040 [0,0,0,0,0,2|2,0,0]=4 6106 B12R1.21 CC(C)NCc1ccc(cc1)F 207a_100138425928_100000210084 [0,0,0,0,0,2|2,0,0]=4 6107 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100000174882_100000210206 [0,0,0,0,0,2|2,0,0]=4 6108 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100138425928_100000198546 [0,0,0,0,0,2|2,0,0]=4 6109 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100000174882_100000210206 [0,0,0,0,0,2|2,0,0]=4 6110 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100138425928_100000198546 [0,0,0,0,0,2|2,0,0]=4 6111 B12R1.21 CC(C)NCc1ccc(cc1)I 207a_100138425928_100000188517 [0,0,0,0,0,2|2,0,0]=4 6112 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100016989417_100000210206 [0,0,0,0,0,2|2,0,0]=4 6113 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100138425928_100000189116 [0,0,0,0,0,2|2,0,0]=4 6114 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100016989417_100000210206 [0,0,0,0,0,2|2,0,0]=4 6115 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100138425928_100000189116 [0,0,0,0,0,2|2,0,0]=4 6116 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [0,0,0,0,0,2|1,0,0]=3 6117 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [0,0,0,0,0,2|1,0,0]=3 6118 B12R1.21 CC(C)NCc1ccc(nc1)O 207a_100138425928_100011361521 [0,0,0,0,0,2|2,0,0]=4 6119 B12R1.21 CC(C)NCc1ccc(nc1)O 2230a_100000757128_100000210206 [0,0,0,0,0,2|2,0,0]=4 6120 B12R1.21 CC(C)NCc1ccc(nc1)O 271570a_203496583355_100016992178 [0,0,0,0,0,2|2,0,0]=4 6121 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000212225_100000189115 [0,0,0,0,0,2|2,0,0]=4 6122 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000695286_100000210206 [0,0,0,0,0,2|2,0,0]=4 6123 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210206 [0,0,0,0,0,2|2,0,0]=4 6124 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000212225_100000694040 [0,0,0,0,0,2|2,0,0]=4 6125 B12R1.21 CC(C)OCc1ccc(cc1)Cl 7a_100000211118_100000210206 [0,0,0,0,0,2|2,0,0]=4 6126 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000210977_100000210206 [0,0,0,0,0,2|2,0,0]=4 6127 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000212225_100000198546 [0,0,0,0,0,2|2,0,0]=4 6128 B12R1.21 CC(C)OCc1ccc(cc1)F 7a_100000210977_100000210206 [0,0,0,0,0,2|2,0,0]=4 6129 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000212225_100000189116 [0,0,0,0,0,2|2,0,0]=4 6130 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000690907_100000210206 [0,0,0,0,0,2|2,0,0]=4 6131 B12R1.21 CC(C)OCc1ccc(cc1)I 7a_100000690907_100000210206 [0,0,0,0,0,2|2,0,0]=4 6132 B12R1.21 CC(C)OCc1ccc(cc1)N 34a_100011215238_100000210206 [0,0,0,0,0,2|2,0,0]=4 6133 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [0,0,0,0,0,2|1,0,0]=3 6134 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000189115_100000210206 [0,0,0,0,0,2|2,0,0]=4 6135 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000210206_100000189115 [0,0,0,0,0,2|2,0,0]=4 6136 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000187161_100000210206 [0,0,0,0,0,2|2,0,0]=4 6137 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000210206_100000187161 [0,0,0,0,0,2|2,0,0]=4 6138 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000198546_100000210206 [0,0,0,0,0,2|2,0,0]=4 6139 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000210206_100000187164 [0,0,0,0,0,2|2,0,0]=4 6140 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000189116_100000210206 [0,0,0,0,0,2|2,0,0]=4 6141 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000210206_100000189116 [0,0,0,0,0,2|2,0,0]=4 6142 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [0,0,0,0,0,2|1,0,0]=3 6143 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [0,0,0,0,0,2|2,0,0]=4 6144 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [0,0,0,0,0,2|2,0,0]=4 6145 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [0,0,0,0,0,2|2,0,0]=4 6146 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100000752880_200000210301 [0,0,0,0,0,2|1,0,0]=3 6147 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100102631434_100011740612 [0,0,0,0,0,2|1,0,0]=3 6148 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100000752880_200000210301 [0,0,0,0,0,2|1,0,0]=3 6149 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100102631434_100011740612 [0,0,0,0,0,2|1,0,0]=3 6150 B12R1.21 CN(C)CCc1ccc(cc1)Br 34a_100000752880_200000210301 [0,0,0,0,0,2|1,0,0]=3 6151 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100000698262_200000210301 [0,0,0,0,0,2|1,0,0]=3 6152 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100102631434_100011713675 [0,0,0,0,0,2|1,0,0]=3 6153 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100000698262_200000210301 [0,0,0,0,0,2|1,0,0]=3 6154 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100102631434_100011713675 [0,0,0,0,0,2|1,0,0]=3 6155 B12R1.21 CN(C)CCc1ccc(cc1)Cl 34a_100000698262_200000210301 [0,0,0,0,0,2|1,0,0]=3 6156 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102631434_100011217392 [0,0,0,0,0,2|1,0,0]=3 6157 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102946585_200000210301 [0,0,0,0,0,2|1,0,0]=3 6158 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102631434_100011217392 [0,0,0,0,0,2|1,0,0]=3 6159 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102946585_200000210301 [0,0,0,0,0,2|1,0,0]=3 6160 B12R1.21 CN(C)CCc1ccc(cc1)F 34a_100102946585_200000210301 [0,0,0,0,0,2|1,0,0]=3 6161 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [0,0,0,0,0,2|0,0,0]=2 6162 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [0,0,0,0,0,2|0,0,0]=2 6163 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [0,0,0,0,0,2|0,0,0]=2 6164 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [0,0,0,0,0,2|0,0,0]=2 6165 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [0,0,0,0,0,2|0,0,0]=2 6166 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 2230a_100000752880_200025704644 [0,0,0,0,0,2|1,0,0]=3 6167 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 269982a_100000752880_200025704644 [0,0,0,0,0,2|1,0,0]=3 6168 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 34a_100000752880_200025704644 [0,0,0,0,0,2|1,0,0]=3 6169 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 2230a_100000698262_200025704644 [0,0,0,0,0,2|1,0,0]=3 6170 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 269982a_100000698262_200025704644 [0,0,0,0,0,2|1,0,0]=3 6171 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 34a_100000698262_200025704644 [0,0,0,0,0,2|1,0,0]=3 6172 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 2230a_100102946585_200025704644 [0,0,0,0,0,2|1,0,0]=3 6173 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 269982a_100102946585_200025704644 [0,0,0,0,0,2|1,0,0]=3 6174 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 34a_100102946585_200025704644 [0,0,0,0,0,2|1,0,0]=3 6175 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [0,0,0,0,0,2|0,0,0]=2 6176 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [0,0,0,0,0,2|0,0,0]=2 6177 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [0,0,0,0,0,2|0,0,0]=2 6178 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [0,0,0,0,0,2|2,0,0]=4 6179 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [0,0,0,0,0,2|2,0,0]=4 6180 B12R1.21 Cc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000186775 [0,0,0,0,0,2|2,0,0]=4 6181 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [0,0,0,0,0,2|1,0,0]=3 6182 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [0,0,0,0,0,2|1,0,0]=3 6183 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [0,0,0,0,0,2|2,0,0]=4 6184 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [0,0,0,0,0,2|2,0,0]=4 6185 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [0,0,0,0,0,2|2,0,0]=4 6186 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [0,0,0,0,0,2|2,0,0]=4 6187 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [0,0,0,0,0,2|2,0,0]=4 6188 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [0,0,0,0,0,2|2,0,0]=4 6189 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [0,0,0,0,0,2|2,0,0]=4 6190 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [0,0,0,0,0,2|2,0,0]=4 6191 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [0,0,0,0,0,2|2,0,0]=4 6192 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [0,0,0,0,0,2|2,0,0]=4 6193 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [0,0,0,0,0,2|2,0,0]=4 6194 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [0,0,0,0,0,2|2,0,0]=4 6195 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [0,0,0,0,0,2|2,0,0]=4 6196 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [0,0,0,0,0,2|2,0,0]=4 6197 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [0,0,0,0,0,2|2,0,0]=4 6198 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [0,0,0,0,0,2|2,0,0]=4 6199 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [0,0,0,0,0,2|2,0,0]=4