0 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.22 CC(O[13CH3])c1ccc(cn1)Br 34a_100012353650_200025704644 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.22 CC(O[13CH3])c1ccc(cn1)Br 7a_100012353650_200025704644 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.22 CC(O[13CH3])c1ccc(nc1)Br 34a_200010274204_200025704644 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.22 CC(O[13CH3])c1ccc(nc1)Br 7a_200010274204_200025704644 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.22 CC(O[13CH3])c1ccc(nc1)Cl 34a_200012017543_200025704644 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.22 CC(O[13CH3])c1ccc(nc1)Cl 7a_200012017543_200025704644 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,0,0,0,0,0|2,1,1]=4 13 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,0,0,0,0,0|2,1,1]=4 14 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,0,0,0,0,0|2,1,1]=4 15 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,0,0,0,0,0|2,1,1]=4 16 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,0,0,0,0,0|2,1,1]=4 17 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,0,0,0,0,0|2,1,1]=4 18 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,0,0,0,0,0|2,0,0]=2 23 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,0,0,0,0,0|1,0,0]=1 24 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,0,0,0,0,0|1,0,0]=1 25 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.22 CCC(=O)c1ncc(cn1)O 271570a_203496583355_200010116844 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,0,0,0,0,0|1,0,2]=3 29 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 46 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,0,0,0,0,0|4,0,0]=4 47 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,0,0,0,0,0|4,0,0]=4 48 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,0,0,0,0,0|4,0,0]=4 50 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 62 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 67 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 68 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 70 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 74 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 75 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 76 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,0,0,0,0,0|2,0,1]=3 77 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,0,0,0,0,0|2,0,0]=2 84 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,0,0,0,0,0|2,0,0]=2 85 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,0,0,0,0,0|2,0,0]=2 86 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,0,0,0,0,0|2,0,0]=2 91 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,0,0,0,0,0|2,0,0]=2 92 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,0,0,0,0,0|2,0,0]=2 93 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,0,0,0,0,0|2,0,0]=2 94 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,0,0,0,0,0|2,0,0]=2 95 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,0,0,0,0,0|2,0,0]=2 96 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,0,0,0,0,0|2,0,0]=2 97 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,0,0,0,0,0|2,0,0]=2 98 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,0,0,0,0,0|2,0,0]=2 99 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,0,0,0,0,0|1,0,0]=1 100 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,0,0,0,0,0|1,0,0]=1 101 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,0,0,0,0,0|1,0,0]=1 102 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.22 CNC(=O)c1ncc(cn1)O 271570a_203496583355_200010127873 [0,0,0,0,0,0|3,0,0]=3 105 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,0,0,0,0,0|3,0,1]=4 106 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,0,0,0,0,0|3,0,1]=4 107 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,0,0,0,0,0|3,0,1]=4 108 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,0,0,0,0,0|3,0,1]=4 109 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,0,0,0,0,0|3,0,1]=4 110 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,0,0,0,0,0|3,0,1]=4 111 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,0,0,0,0,0|3,0,1]=4 112 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,0,0,0,0,0|3,0,1]=4 113 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,0,0,0,0,0|3,0,1]=4 114 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,0,0,0,0,0|3,0,1]=4 115 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,0,0,0,0,0|3,0,1]=4 116 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,0,0,0,0,0|3,0,1]=4 117 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,0,0,0,0,0|3,0,1]=4 118 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,0,0,0,0,0|3,0,1]=4 119 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,0,0,0,0,0|3,0,1]=4 120 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,0,0,0,0,0|2,0,1]=3 121 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,0,0,0,0,0|3,0,1]=4 122 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,0,0,0,0,0|3,0,1]=4 123 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,0,0,0,0,0|3,0,1]=4 124 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,0,0,0,0,0|2,0,1]=3 125 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,0,0,0,0,0|3,0,1]=4 126 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,0,0,0,0,0|3,0,1]=4 127 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,0,0,0,0,0|3,0,1]=4 128 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,0,0,0,0,0|3,0,1]=4 129 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,0,0,0,0,0|3,0,1]=4 130 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,0,0,0,0,0|0,0,0]=0 131 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,0,0,0,0,0|1,0,0]=1 132 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,0,0,0,0,0|1,0,0]=1 133 B11R1.22 COC(=O)c1ccc(nn1)O 271570a_203496583355_100009816182 [0,0,0,0,0,0|2,0,0]=2 134 B11R1.22 COC(=O)c1cnc(cn1)O 271570a_203496583355_100010219404 [0,0,0,0,0,0|2,0,0]=2 135 B11R1.22 COC(=O)c1cnc(nc1)O 271570a_203496583355_100000729365 [0,0,0,0,0,0|2,0,0]=2 136 B11R1.22 COC(=O)c1ncc(cn1)O 271570a_203496583355_100000690087 [0,0,0,0,0,0|2,0,0]=2 137 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,0,0,0,0,0|2,0,1]=3 138 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,0,0,0,0,0|2,0,1]=3 139 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,0,0,0,0,0|2,0,1]=3 140 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,0,0,0,0,0|2,0,1]=3 141 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,0,0,0,0,0|2,0,1]=3 142 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,0,0,0,0,0|2,0,1]=3 143 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,0,0,0,0,0|2,0,1]=3 144 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,0,0,0,0,0|2,0,1]=3 145 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,0,0,0,0,0|1,0,1]=2 146 B11R1.22 COC(C)c1ccc(cn1)Br 34a_100012353650_200000210301 [0,0,0,0,0,0|3,0,1]=4 147 B11R1.22 COC(C)c1ccc(cn1)Br 7a_100012353650_200000210301 [0,0,0,0,0,0|3,0,1]=4 148 B11R1.22 COC(C)c1ccc(nc1)Br 34a_200010274204_200000210301 [0,0,0,0,0,0|3,0,1]=4 149 B11R1.22 COC(C)c1ccc(nc1)Br 7a_200010274204_200000210301 [0,0,0,0,0,0|3,0,1]=4 150 B11R1.22 COC(C)c1ccc(nc1)C 34a_200011815720_200000210301 [0,0,0,0,0,0|3,0,1]=4 151 B11R1.22 COC(C)c1ccc(nc1)C 7a_200011815720_200000210301 [0,0,0,0,0,0|3,0,1]=4 152 B11R1.22 COC(C)c1ccc(nc1)Cl 34a_200012017543_200000210301 [0,0,0,0,0,0|3,0,1]=4 153 B11R1.22 COC(C)c1ccc(nc1)Cl 7a_200012017543_200000210301 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,0,0,0,0,0|2,0,1]=3 155 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,0,0,0,0,0|2,0,1]=3 156 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,0,0,0,0,0|2,0,1]=3 157 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,0,0,0,0,0|2,0,1]=3 158 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,0,0,0,0,0|2,1,1]=4 159 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,0,0,0,0,0|2,1,1]=4 160 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,0,0,0,0,0|2,1,1]=4 161 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,0,0,0,0,0|2,1,1]=4 162 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,0,0,0,0,0|2,1,1]=4 163 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,0,0,0,0,0|2,1,1]=4 164 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,0,0,0,0,0|2,1,1]=4 165 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,0,0,0,0,0|2,1,1]=4 166 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,0,0,0,0,0|3,0,1]=4 168 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,0,0,0,0,0|3,0,1]=4 169 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,0,0,0,0,0|3,0,1]=4 170 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,0,0,0,0,0|3,0,1]=4 171 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,0,0,0,0,0|3,0,1]=4 172 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,0,0,0,0,0|2,0,1]=3 173 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,0,0,0,0,0|2,0,1]=3 174 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,0,0,0,0,0|2,0,1]=3 175 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,0,0,0,0,0|3,0,0]=3 176 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,0,0,0,0,0|2,1,1]=4 177 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,0,0,0,0,0|2,1,1]=4 178 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,0,0,0,0,0|3,0,1]=4 179 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,0,0,0,0,0|3,0,1]=4 180 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,0,0,0,0,0|2,0,1]=3 181 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,0,0,0,0,0|2,0,1]=3 182 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 34a_200011815720_200025704644 [0,0,0,0,0,0|3,0,1]=4 183 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 7a_200011815720_200025704644 [0,0,0,0,0,0|3,0,1]=4 184 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,0,0,0,0,0|2,0,0]=2 185 B11R1.22 N#CC(N)c1ccc(cc1)O 271570a_203496583355_106722365845 [0,0,0,0,0,0|3,0,1]=4 186 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [0,0,0,0,0,0|3,0,1]=4 187 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,0,0,0,0,0|2,0,0]=2 188 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [0,0,0,0,0,0|2,0,2]=4 189 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,0,0,0,0,0|2,0,0]=2 190 B11R1.22 NNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781063 [0,0,0,0,0,0|3,0,0]=3 191 B11R1.22 NNC(=O)c1ccc(nc1)O 271570a_203496583355_100000189807 [0,0,0,0,0,0|3,0,0]=3 192 B11R1.22 NNC(=O)c1cnc(cn1)O 271570a_203496583355_200012021860 [0,0,0,0,0,0|4,0,0]=4 193 B11R1.22 NNC(=O)c1ncc(cn1)O 271570a_203496583355_100009996755 [0,0,0,0,0,0|4,0,0]=4 194 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,0,0,0,0,0|3,0,0]=3 195 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,0,0,0,0,0|3,0,0]=3 196 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,0,0,0,0,0|3,0,0]=3 197 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,0,0,0,0,0|3,0,0]=3 198 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,0,0,0,0,0|2,0,0]=2 199 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,0,0,0,0,0|2,0,0]=2 200 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,0,0,0,0,0|2,0,0]=2 201 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,0,0,0,0,0|2,0,2]=4 202 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,0,0,0,0,0|2,0,1]=3 203 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,0,0,0,0,0|2,0,1]=3 204 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,0,0,0,0,0|2,0,1]=3 205 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,0,0,0,0,0|2,0,1]=3 206 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,0,0,0,0,0|1,0,0]=2 207 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,0,0,0,0,0|2,0,1]=4 208 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,0,0,0,0,0|2,0,1]=4 209 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,0,0,0,0,0|2,0,1]=4 211 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,0,0,0,0,0|2,0,1]=4 212 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,0,0,0,0,0|1,0,1]=3 213 B10R1.1 C=C=Cc1ccc(cn1)O 271570a_100015277604_100000685995 [1,0,0,0,0,0|2,0,1]=4 214 B10R1.1 CC=Cc1cc[n+](cc1)[O-] 271570a_100016259895_100000039755 [1,0,0,0,0,0|2,0,1]=4 215 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [1,0,0,0,0,0|2,0,1]=4 216 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,0,0,0,0,0|2,0,0]=3 217 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,0,0,0,0,0|2,0,0]=3 218 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,0,0,0,0,0|2,0,0]=3 219 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,0,0,0,0,0|2,0,0]=3 220 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,0,0,0,0,0|2,0,0]=3 221 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,0,0,0,0,0|1,0,0]=2 222 B10R1.1 CC=Cc1ccc(cn1)Br 271570a_100016259895_100000686858 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.1 CC=Cc1ccc(cn1)Cl 271570a_100016259895_100011356976 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.1 CC=Cc1ccc(cn1)F 271570a_100016259895_100000744514 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.1 CC=Cc1ccc(cn1)N 271570a_100016259895_100000744251 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [1,0,0,0,0,0|2,0,0]=3 228 B10R1.1 CC=Cc1ccc(nc1)Br 271570a_100016259895_100009814638 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.1 CC=Cc1ccc(nc1)Cl 271570a_100016259895_100000034144 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.1 CC=Cc1ccc(nc1)F 271570a_100016259895_100000748661 [1,0,0,0,0,0|3,0,0]=4 232 B10R1.1 CC=Cc1ccc(nc1)N 271570a_100016259895_100000187370 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.1 CC=Cc1ncc(cn1)O 271570a_100016259895_100000730009 [1,0,0,0,0,0|3,0,0]=4 234 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,0,0,0,0,0|1,0,1]=3 235 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,0,0,0,0,0|3,0,0]=4 238 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,0,0,0,0,0|3,0,0]=4 239 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,0,0,0,0,0|3,0,0]=4 242 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,0,0,0,0,0|2,0,0]=3 243 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,0,0,0,0,0|2,0,0]=3 244 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [1,0,0,0,0,0|3,0,0]=4 245 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,0,0,0,0,0|3,0,0]=4 246 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,0,0,0,0,0|3,0,0]=4 248 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,0,0,0,0,0|3,0,0]=4 253 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,0,0,0,0,0|3,0,0]=4 254 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,0,0,0,0,0|2,0,0]=3 256 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [1,0,0,0,0,0|3,0,0]=4 258 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,0,0,0,0,0|3,0,0]=4 268 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,0,0,0,0,0|2,0,0]=3 269 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,0,0,0,0,0|2,0,0]=3 270 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [1,0,0,0,0,0|3,0,0]=4 271 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [1,0,0,0,0,0|3,0,0]=4 272 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [1,0,0,0,0,0|3,0,0]=4 273 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,0,0,0,0,0|2,0,1]=4 274 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,0,0,0,0,0|2,0,1]=4 275 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,0,0,0,0,0|2,0,1]=4 276 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,0,0,0,0,0|2,0,1]=4 277 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,0,0,0,0,0|2,0,1]=4 278 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,0,0,0,0,0|2,0,1]=4 279 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,0,0,0,0,0|2,0,1]=4 280 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,0,0,0,0,0|2,0,1]=4 281 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,0,0,0,0,0|2,0,1]=4 282 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,0,0,0,0,0|2,0,1]=4 283 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,0,0,0,0,0|2,0,1]=4 284 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,0,0,0,0,0|2,0,1]=4 285 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,0,0,0,0,0|2,0,1]=4 286 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,0,0,0,0,0|2,0,1]=4 287 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,0,0,0,0,0|2,0,1]=4 288 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,0,0,0,0,0|2,0,1]=4 289 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,0,0,0,0,0|2,0,1]=4 290 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,0,0,0,0,0|2,0,1]=4 291 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,0,0,0,0,0|2,0,1]=4 292 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,0,0,0,0,0|2,0,1]=4 293 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,0,0,0,0,0|2,0,1]=4 294 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,0,0,0,0,0|2,0,1]=4 295 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,0,0,0,0,0|2,0,1]=4 296 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,0,0,0,0,0|2,0,1]=4 297 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,0,0,0,0,0|2,0,1]=4 298 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,0,0,0,0,0|2,0,1]=4 299 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,0,0,0,0,0|2,0,1]=4 300 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,0,0,0,0,0|2,0,1]=4 301 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,0,0,0,0,0|2,0,1]=4 302 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,0,0,0,0,0|2,0,1]=4 303 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,0,0,0,0,0|2,0,1]=4 304 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,0,0,0,0,0|2,0,1]=4 305 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,0,0,0,0,0|2,0,1]=4 306 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,0,0,0,0,0|2,0,1]=4 307 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,0,0,0,0,0|2,0,1]=4 308 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,0,0,0,0,0|2,0,1]=4 309 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,0,0,0,0,0|1,0,1]=3 310 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,0,0,0,0,0|1,0,1]=3 311 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,0,0,0,0,0|2,0,1]=4 312 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,0,0,0,0,0|2,0,1]=4 313 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,0,0,0,0,0|2,0,1]=4 314 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [1,0,0,0,0,0|2,0,1]=4 315 B10R1.1 COCc1cc[n+](cc1)[O-] 34a_100000031831_200000210301 [1,0,0,0,0,0|1,0,2]=4 316 B10R1.1 COCc1cc[n+](cc1)[O-] 7a_100000031831_200000210301 [1,0,0,0,0,0|1,0,2]=4 317 B10R1.1 COCc1ccc(=O)[nH]c1 34a_100011999846_200000210301 [1,0,0,0,0,0|1,0,2]=4 318 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,0,0,0,0,0|1,0,1]=3 319 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,0,0,0,0,0|1,0,1]=3 320 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,0,0,0,0,0|1,0,1]=3 321 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,0,0,0,0,0|1,0,1]=3 322 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,0,0,0,0,0|1,0,1]=3 323 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,0,0,0,0,0|1,0,1]=3 324 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,0,0,0,0,0|1,0,1]=3 325 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,0,0,0,0,0|1,0,1]=3 326 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,0,0,0,0,0|1,0,1]=3 327 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,0,0,0,0,0|1,0,1]=3 328 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,0,0,0,0,0|1,0,1]=3 329 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,0,0,0,0,0|1,0,1]=3 330 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,0,0,0,0,0|1,0,1]=3 331 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,0,0,0,0,0|1,0,1]=3 332 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,0,0,0,0,0|1,0,1]=3 333 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,0,0,0,0,0|0,0,1]=2 334 B10R1.1 COCc1ccc(cn1)Br 34a_100000754261_200000210301 [1,0,0,0,0,0|2,0,1]=4 335 B10R1.1 COCc1ccc(cn1)Br 34a_100138415774_100000702658 [1,0,0,0,0,0|2,0,1]=4 336 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [1,0,0,0,0,0|2,0,1]=4 337 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [1,0,0,0,0,0|2,0,1]=4 338 B10R1.1 COCc1ccc(cn1)Cl 34a_100000703999_200000210301 [1,0,0,0,0,0|2,0,1]=4 339 B10R1.1 COCc1ccc(cn1)Cl 34a_100138415774_100012066911 [1,0,0,0,0,0|2,0,1]=4 340 B10R1.1 COCc1ccc(cn1)F 34a_100011999454_200000210301 [1,0,0,0,0,0|2,0,1]=4 341 B10R1.1 COCc1ccc(cn1)F 34a_100138415774_100000703193 [1,0,0,0,0,0|2,0,1]=4 342 B10R1.1 COCc1ccc(cn1)N 34a_100011998161_200000210301 [1,0,0,0,0,0|2,0,1]=4 343 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [1,0,0,0,0,0|2,0,1]=4 344 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [1,0,0,0,0,0|2,0,1]=4 345 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [1,0,0,0,0,0|2,0,1]=4 346 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [1,0,0,0,0,0|2,0,1]=4 347 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [1,0,0,0,0,0|2,0,1]=4 348 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [1,0,0,0,0,0|2,0,1]=4 349 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [1,0,0,0,0,0|2,0,1]=4 350 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [1,0,0,0,0,0|2,0,1]=4 351 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [1,0,0,0,0,0|2,0,1]=4 352 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [1,0,0,0,0,0|2,0,1]=4 353 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [1,0,0,0,0,0|2,0,1]=4 354 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,0,0,0,0,0|1,1,1]=4 355 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,0,0,0,0,0|1,1,1]=4 356 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,0,0,0,0,0|1,1,1]=4 357 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,0,0,0,0,0|1,1,1]=4 358 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,0,0,0,0,0|1,1,1]=4 359 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,0,0,0,0,0|1,1,1]=4 360 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,0,0,0,0,0|1,1,1]=4 361 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,0,0,0,0,0|1,1,1]=4 362 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,0,0,0,0,0|1,1,1]=4 363 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,0,0,0,0,0|1,1,1]=4 364 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [1,0,0,0,0,0|1,1,1]=4 365 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [1,0,0,0,0,0|2,0,1]=4 366 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,0,0,0,0,0|2,0,1]=4 367 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,0,0,0,0,0|2,0,1]=4 368 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,0,0,0,0,0|1,0,1]=3 369 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,0,0,0,0,0|1,0,1]=3 370 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,0,0,0,0,0|1,1,1]=4 371 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,0,0,0,0,0|1,1,1]=4 372 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [1,0,0,0,0,0|2,0,1]=4 373 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [1,0,0,0,0,0|2,0,1]=4 374 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,0,0,0,0,0|2,0,1]=4 375 B10R1.1 N#CNc1ccc(cc1)O 271570a_203496583355_100011685341 [1,0,0,0,0,0|3,0,0]=4 376 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,0,0,0,0,0|2,0,1]=4 377 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,0,0,0,0,0|2,0,1]=4 378 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,0,0,0,0,0|2,0,1]=4 379 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,0,0,0,0,0|2,0,1]=4 380 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,0,0,0,0,0|2,0,0]=3 381 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [1,0,0,0,0,0|3,0,0]=4 382 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,0,0,0,0,0|2,0,1]=4 384 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,0,0,0,0,0|2,0,1]=4 385 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,0,0,0,0,0|2,0,1]=4 386 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,0,0,0,0,0|2,0,1]=4 387 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,0,0,0,0,0|2,0,1]=4 388 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,0,0,0,0,0|1,0,1]=3 392 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,0,0,0,0,0|2,0,1]=4 393 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 34a_100000031831_200025704644 [1,0,0,0,0,0|1,0,2]=4 394 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 7a_100000031831_200025704644 [1,0,0,0,0,0|1,0,2]=4 395 B10R1.1 [13CH3]OCc1ccc(=O)[nH]c1 34a_100011999846_200025704644 [1,0,0,0,0,0|1,0,2]=4 396 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,0,0,0,0,0|1,0,1]=3 397 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,0,0,0,0,0|1,0,1]=3 398 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,0,0,0,0,0|1,0,1]=3 399 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,0,0,0,0,0|1,0,1]=3 400 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,0,0,0,0,0|1,0,1]=3 401 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,0,0,0,0,0|1,0,1]=3 402 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,0,0,0,0,0|1,0,1]=3 403 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,0,0,0,0,0|1,0,1]=3 404 B10R1.1 [13CH3]OCc1ccc(cn1)Br 34a_100000754261_200025704644 [1,0,0,0,0,0|2,0,1]=4 405 B10R1.1 [13CH3]OCc1ccc(cn1)Cl 34a_100000703999_200025704644 [1,0,0,0,0,0|2,0,1]=4 406 B10R1.1 [13CH3]OCc1ccc(cn1)F 34a_100011999454_200025704644 [1,0,0,0,0,0|2,0,1]=4 407 B10R1.1 [13CH3]OCc1ccc(cn1)N 34a_100011998161_200025704644 [1,0,0,0,0,0|2,0,1]=4 408 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [1,0,0,0,0,0|2,0,1]=4 409 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [1,0,0,0,0,0|2,0,1]=4 410 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [1,0,0,0,0,0|2,0,1]=4 411 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [1,0,0,0,0,0|2,0,1]=4 412 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [1,0,0,0,0,0|2,0,1]=4 413 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [1,0,0,0,0,0|2,0,1]=4 414 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,0,0,0,0,0|1,1,1]=4 415 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,0,0,0,0,0|1,1,1]=4 416 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,0,0,0,0,0|1,1,1]=4 417 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,0,0,0,0,0|1,1,1]=4 418 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,0,0,0,0,0|1,1,1]=4 419 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,0,0,0,0,0|1,1,1]=4 420 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,0,0,0,0,0|1,1,1]=4 421 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,0,0,0,0,0|1,1,1]=4 422 B10R1.1 [N-]=[N+]=Nc1ccc(cc1)O 271570a_203496583355_100000735661 [1,0,0,0,0,0|3,0,0]=4 423 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [1,0,0,0,0,0|2,0,1]=4 424 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [1,0,0,0,0,0|2,0,1]=4 425 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,0,0,0,0,0|2,0,0]=3 426 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,0,0,0,0,0|2,0,0]=3 427 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,0,0,0,0,0|2,0,0]=3 428 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,0,0,0,0,0|2,0,0]=3 429 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,0,0,0,0,0|2,0,0]=3 430 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,0,0,0,0,0|1,0,0]=2 431 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,0,0,0,0,0|1,0,0]=2 432 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [1,0,0,0,0,0|3,0,0]=4 436 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [1,0,0,0,0,0|3,0,0]=4 437 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,0,0,0,0,0|2,0,0]=3 438 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.13 C=C(C)c1ncc(cn1)O 271570a_100000694244_100000730009 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,0,0,0,0,0|1,0,0]=2 445 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,0,0,0,0,0|1,0,0]=2 446 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,0,0,0,0,0|1,0,0]=2 447 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,0,0,0,0,0|1,0,0]=2 448 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,0,0,0,0,0|1,0,0]=2 449 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,0,0,0,0,0|0,0,0]=1 450 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,0,0,0,0,0|0,0,0]=1 451 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,0,0,0,0,0|1,0,0]=2 452 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,0,0,0,0,0|1,0,0]=2 453 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [1,0,0,0,0,0|2,0,0]=3 454 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [1,0,0,0,0,0|2,0,0]=3 455 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [1,0,0,0,0,0|2,0,0]=3 456 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,0,0,0,0,0|1,0,1]=3 457 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [1,0,0,0,0,0|2,0,1]=4 458 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [1,0,0,0,0,0|2,0,1]=4 459 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [1,0,0,0,0,0|2,0,1]=4 460 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,0,0,0,0,0|0,0,2]=3 461 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [1,0,0,0,0,0|1,0,2]=4 462 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [1,0,0,0,0,0|1,0,2]=4 463 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 464 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 465 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 466 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 467 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 468 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 469 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 470 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 471 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 472 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 473 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 474 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 475 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,0,0,0,0,0|2,0,0]=3 476 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,0,0,0,0,0|2,0,0]=3 477 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,0,0,0,0,0|2,0,0]=3 478 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [1,0,0,0,0,0|3,0,0]=4 479 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [1,0,0,0,0,0|3,0,0]=4 480 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 481 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 482 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 483 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 484 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 485 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 486 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 487 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 488 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 489 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 490 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 491 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 492 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,0,0,0,0,0|2,0,0]=3 493 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,0,0,0,0,0|2,0,0]=3 494 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,0,0,0,0,0|1,0,0]=2 495 B10R1.13 CS(=O)c1ncc(cn1)O 271570a_203496583355_100010117237 [1,0,0,0,0,0|3,0,0]=4 496 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,0,0,0,0,0|1,0,1]=3 497 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,0,0,0,0,0|1,0,1]=3 498 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [1,0,0,0,0,0|2,0,1]=4 499 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,0,0,0,0,0|1,0,0]=2 500 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 501 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 502 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 503 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 504 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 505 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 506 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,0,0,0,0,0|1,0,0]=2 507 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,0,0,0,0,0|2,0,0]=3 508 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.13 NC(=O)c1ccc(nn1)O 271570a_203496583355_100000761398 [1,0,0,0,0,0|3,0,0]=4 510 B10R1.13 NC(=O)c1cnc(cn1)O 271570a_203496583355_100000738300 [1,0,0,0,0,0|3,0,0]=4 511 B10R1.13 NC(=O)c1ncc(cn1)O 271570a_203496583355_100009996756 [1,0,0,0,0,0|3,0,0]=4 512 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [1,0,0,0,0,0|1,0,1]=3 513 B10R1.13 OB(O)c1ccc(cn1)O 271570a_203496583355_200010198023 [1,0,0,0,0,0|2,0,1]=4 514 B10R1.13 OB(O)c1ccc(nc1)O 271570a_203496583355_100000688115 [1,0,0,0,0,0|2,0,1]=4 515 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [1,0,0,0,0,0|2,0,1]=4 516 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,0,0,0,0,0|1,0,0]=2 517 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,0,0,0,0,0|1,0,0]=2 518 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,0,0,0,0,0|1,0,0]=2 519 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,0,0,0,0,0|1,0,0]=2 520 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,0,0,0,0,0|0,0,0]=1 521 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,0,0,0,0,0|1,1,1]=4 522 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,0,0,0,0,0|1,1,1]=4 523 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,0,0,0,0,0|1,0,0]=2 524 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 525 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 526 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,0,0,0,0,0|3,0,0]=4 527 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 528 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 529 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 531 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 532 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 533 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,0,0,0,0,0|1,0,0]=2 534 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,0,0,0,0,0|1,0,0]=2 535 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,0,0,0,0,0|1,0,0]=2 536 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,0,0,0,0,0|1,0,0]=2 537 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,0,0,0,0,0|2,0,1]=4 538 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,0,0,0,0,0|2,0,1]=4 539 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,0,0,0,0,0|2,0,1]=4 540 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,0,0,0,0,0|2,0,1]=4 541 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,0,0,0,0,0|2,0,1]=4 542 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,0,0,0,0,0|1,0,1]=3 543 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,0,0,0,0,0|1,0,1]=3 544 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,0,0,0,0,0|1,0,1]=3 545 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,0,0,0,0,0|1,1,1]=4 546 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,0,0,0,0,0|1,1,1]=4 547 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,0,0,0,0,0|2,0,1]=4 548 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,0,0,0,0,0|1,0,1]=3 549 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,0,0,0,0,0|1,0,1]=3 550 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,0,0,0,0,0|2,0,0]=3 551 B12R1.5 C#Cc1ccc(cc1)C(=O)CC 1458a_100011217615_100000210202 [0,1,0,0,0,0|2,0,0]=3 552 B12R1.5 C#Cc1ccc(cc1)C(=O)CF 1458a_100011217615_100015361967 [0,1,0,0,0,0|3,0,0]=4 553 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 11a_106832991635_100011217615 [0,1,0,0,0,0|2,0,0]=3 554 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100011217615 [0,1,0,0,0,0|2,0,0]=3 555 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100011217615 [0,1,0,0,0,0|2,0,0]=3 556 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 527a_100102657272_100011217615 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.5 C=Cc1ccc(cc1)C(=O)C#N 271570a_100011290941_100009994572 [0,1,0,0,0,0|3,0,0]=4 558 B12R1.5 C=Cc1ccc(cc1)C(=O)C=O 271570a_100011290941_100000725942 [0,1,0,0,0,0|3,0,0]=4 559 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 1458a_100000687532_100000210202 [0,1,0,0,0,0|2,0,0]=3 560 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 271570a_100011290941_100000211647 [0,1,0,0,0,0|2,0,0]=3 561 B12R1.5 C=Cc1ccc(cc1)C(=O)CF 1458a_100000687532_100015361967 [0,1,0,0,0,0|3,0,0]=4 562 B12R1.5 C=Cc1ccc(cc1)C(=O)CN 271570a_100011290941_100000017248 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.5 C=Cc1ccc(cc1)C(=O)CO 271570a_100011290941_100011219529 [0,1,0,0,0,0|3,0,0]=4 564 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 11a_106832991635_100000687532 [0,1,0,0,0,0|2,0,0]=3 565 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100000687532 [0,1,0,0,0,0|2,0,0]=3 566 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100000687532 [0,1,0,0,0,0|2,0,0]=3 567 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 271570a_100011290941_100000155074 [0,1,0,0,0,0|2,0,0]=3 568 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 527a_100102657272_100000687532 [0,1,0,0,0,0|2,0,0]=3 569 B12R1.5 C=Cc1ccc(cc1)C(=O)NN 271570a_100011290941_100000183614 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.5 C=Cc1ccc(cc1)C(=O)OC 271570a_100011290941_100000150774 [0,1,0,0,0,0|1,0,0]=2 571 B12R1.5 C=Cc1ccc(cc1)C(C)OC 271570a_100011290941_100010254937 [0,1,0,0,0,0|2,0,1]=4 572 B12R1.5 C=Cc1ccc(cn1)C(=O)NC 271570a_100011290941_100000159860 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.5 C=Cc1ccc(cn1)C(=O)OC 271570a_100011290941_100000733799 [0,1,0,0,0,0|2,0,0]=3 574 B12R1.5 C=Cc1ccc(nc1)C(=O)CC 271570a_100011290941_100012351654 [0,1,0,0,0,0|3,0,0]=4 575 B12R1.5 C=Cc1ccc(nc1)C(=O)NC 271570a_100011290941_100011781262 [0,1,0,0,0,0|3,0,0]=4 576 B12R1.5 C=Cc1ccc(nc1)C(=O)OC 271570a_100011290941_100000690920 [0,1,0,0,0,0|2,0,0]=3 577 B12R1.5 C=Cc1ccc(nn1)C(=O)OC 271570a_100011290941_100009816182 [0,1,0,0,0,0|3,0,0]=4 578 B12R1.5 C=Cc1cnc(cn1)C(=O)OC 271570a_100011290941_100010219404 [0,1,0,0,0,0|3,0,0]=4 579 B12R1.5 C=Cc1cnc(nc1)C(=O)OC 271570a_100011290941_100000690087 [0,1,0,0,0,0|3,0,0]=4 580 B12R1.5 C=Cc1ncc(cn1)C(=O)OC 271570a_100011290941_100000729365 [0,1,0,0,0,0|3,0,0]=4 581 B12R1.5 CC(=NO)c1ccc(cc1)O[13CH3] 34a_100000164205_200025704644 [0,1,0,0,0,0|3,0,0]=4 582 B12R1.5 CC(O[13CH3])c1ccc(cc1)CN 34a_200000048501_200025704644 [0,1,0,0,0,0|2,0,1]=4 583 B12R1.5 CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210202 [0,1,0,0,0,0|2,0,0]=3 584 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [0,1,0,0,0,0|2,0,0]=3 585 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,1,0,0,0,0|1,0,0]=2 586 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,1,0,0,0,0|1,0,0]=2 587 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,1,0,0,0,0|1,0,0]=2 588 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,1,0,0,0,0|1,0,0]=2 589 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,1,0,0,0,0|1,0,0]=2 590 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,1,0,0,0,0|1,0,0]=2 591 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [0,1,0,0,0,0|1,1,0]=3 592 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [0,1,0,0,0,0|1,1,0]=3 593 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [0,1,0,0,0,0|1,1,0]=3 594 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [0,1,0,0,0,0|1,1,0]=3 595 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [0,1,0,0,0,0|1,1,0]=3 596 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_100012351654_200000210301 [0,1,0,0,0,0|2,1,0]=4 597 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_200000210301_100012351654 [0,1,0,0,0,0|2,1,0]=4 598 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_100012351654_200025704644 [0,1,0,0,0,0|2,1,0]=4 599 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100012351654 [0,1,0,0,0,0|2,1,0]=4 600 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [0,1,0,0,0,0|2,0,1]=4 601 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [0,1,0,0,0,0|2,0,1]=4 602 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [0,1,0,0,0,0|2,0,1]=4 603 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [0,1,0,0,0,0|2,0,1]=4 604 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [0,1,0,0,0,0|2,0,1]=4 605 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [0,1,0,0,0,0|2,0,1]=4 606 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [0,1,0,0,0,0|3,0,0]=4 608 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.5 CCc1ccc(cc1)C(=O)CF 1458a_100000211226_100015361967 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.5 CCc1ccc(cc1)C(=O)NC 11a_106832991635_100000211226 [0,1,0,0,0,0|2,0,0]=3 611 B12R1.5 CCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000211226 [0,1,0,0,0,0|2,0,0]=3 612 B12R1.5 CCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000211226 [0,1,0,0,0,0|2,0,0]=3 613 B12R1.5 CCc1ccc(cc1)C(=O)NC 527a_100102657272_100000211226 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.5 CCc1ccc(cc1)C(C)OC 34a_100011232672_200000210301 [0,1,0,0,0,0|2,0,1]=4 615 B12R1.5 CCc1ccc(cc1)C(C)OC 7a_100011232672_200000210301 [0,1,0,0,0,0|2,0,1]=4 616 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 34a_100011232672_200025704644 [0,1,0,0,0,0|2,0,1]=4 617 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 7a_100011232672_200025704644 [0,1,0,0,0,0|2,0,1]=4 618 B12R1.5 CNC(=O)c1ccc(cc1)C#N 11a_106832991635_100000210717 [0,1,0,0,0,0|2,0,0]=3 619 B12R1.5 CNC(=O)c1ccc(cc1)C#N 1626a_100102657272_100000210717 [0,1,0,0,0,0|2,0,0]=3 620 B12R1.5 CNC(=O)c1ccc(cc1)C#N 240690a_100102657272_100000210717 [0,1,0,0,0,0|2,0,0]=3 621 B12R1.5 CNC(=O)c1ccc(cc1)C#N 527a_100102657272_100000210717 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [0,1,0,0,0,0|1,0,0]=2 623 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [0,1,0,0,0,0|1,0,0]=2 624 B12R1.5 CNC(=O)c1ccc(cc1)NC 2230a_100000184841_200000210301 [0,1,0,0,0,0|2,0,0]=3 625 B12R1.5 CNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155074 [0,1,0,0,0,0|2,0,0]=3 626 B12R1.5 CNC(=O)c1ccc(cc1)NC 34a_100000184841_200000210301 [0,1,0,0,0,0|2,0,0]=3 627 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000184841_200025704644 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 34a_100000184841_200025704644 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [0,1,0,0,0,0|1,0,0]=2 630 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [0,1,0,0,0,0|1,0,0]=2 631 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [0,1,0,0,0,0|1,0,0]=2 632 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [0,1,0,0,0,0|1,0,0]=2 633 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [0,1,0,0,0,0|1,0,0]=2 634 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [0,1,0,0,0,0|1,0,0]=2 635 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [0,1,0,0,0,0|1,0,0]=2 636 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [0,1,0,0,0,0|1,0,0]=2 637 B12R1.5 CNC(=O)c1ccc(cc1)SC 11a_106832991635_100000189692 [0,1,0,0,0,0|1,1,0]=3 638 B12R1.5 CNC(=O)c1ccc(cc1)SC 1626a_100102657272_100000189692 [0,1,0,0,0,0|1,1,0]=3 639 B12R1.5 CNC(=O)c1ccc(cc1)SC 240690a_100102657272_100000189692 [0,1,0,0,0,0|1,1,0]=3 640 B12R1.5 CNC(=O)c1ccc(cc1)SC 527a_100102657272_100000189692 [0,1,0,0,0,0|1,1,0]=3 641 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_100000155074_200000210301 [0,1,0,0,0,0|1,1,0]=3 642 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155074 [0,1,0,0,0,0|1,1,0]=3 643 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155074_200025704644 [0,1,0,0,0,0|1,1,0]=3 644 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155074 [0,1,0,0,0,0|1,1,0]=3 645 B12R1.5 CNC(=O)c1ccc(cn1)NC 27a_100102657272_100011781262 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.5 CNC(=O)c1ccc(cn1)OC 34a_100009861314_200000210301 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.5 CNC(=O)c1ccc(cn1)OC 7a_100009861314_200000210301 [0,1,0,0,0,0|2,0,0]=3 648 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 34a_100009861314_200025704644 [0,1,0,0,0,0|2,0,0]=3 649 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 7a_100009861314_200025704644 [0,1,0,0,0,0|2,0,0]=3 650 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_100011781262_200000210301 [0,1,0,0,0,0|2,1,0]=4 651 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_200000210301_100011781262 [0,1,0,0,0,0|2,1,0]=4 652 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_100011781262_200025704644 [0,1,0,0,0,0|2,1,0]=4 653 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100011781262 [0,1,0,0,0,0|2,1,0]=4 654 B12R1.5 CNC(=O)c1ccc(nc1)NC 27a_100102657272_100000159860 [0,1,0,0,0,0|3,0,0]=4 655 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_100000159860_200000210301 [0,1,0,0,0,0|2,1,0]=4 656 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_200000210301_100000159860 [0,1,0,0,0,0|2,1,0]=4 657 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_100000159860_200025704644 [0,1,0,0,0,0|2,1,0]=4 658 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000159860 [0,1,0,0,0,0|2,1,0]=4 659 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,1,0,0,0,0|2,0,1]=4 660 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,1,0,0,0,0|2,0,1]=4 661 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,1,0,0,0,0|2,0,1]=4 662 B12R1.5 CNc1ccc(cc1)C(=O)NN 27a_100102657272_100000183614 [0,1,0,0,0,0|3,0,0]=4 663 B12R1.5 CNc1ccc(cn1)C(=O)OC 27a_100102657272_100000733799 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.5 CNc1ccc(nn1)C(=O)OC 27a_100102657272_100000738951 [0,1,0,0,0,0|3,0,0]=4 665 B12R1.5 CNc1cnc(cn1)C(=O)OC 27a_100102657272_100010219404 [0,1,0,0,0,0|3,0,0]=4 666 B12R1.5 CNc1ncc(cn1)C(=O)OC 27a_100102657272_100000729365 [0,1,0,0,0,0|3,0,0]=4 667 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [0,1,0,0,0,0|0,0,0]=1 668 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [0,1,0,0,0,0|0,0,0]=1 669 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [0,1,0,0,0,0|0,0,0]=1 670 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [0,1,0,0,0,0|0,0,0]=1 671 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [0,1,0,0,0,0|0,1,0]=2 672 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [0,1,0,0,0,0|0,1,0]=2 673 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [0,1,0,0,0,0|0,1,0]=2 674 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [0,1,0,0,0,0|0,1,0]=2 675 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [0,1,0,0,0,0|1,0,0]=2 676 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [0,1,0,0,0,0|1,0,0]=2 677 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [0,1,0,0,0,0|1,0,0]=2 678 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [0,1,0,0,0,0|1,0,0]=2 679 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_100102712061_200000210301 [0,1,0,0,0,0|1,1,0]=3 680 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_200000210301_100102712061 [0,1,0,0,0,0|1,1,0]=3 681 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_100102712061_200025704644 [0,1,0,0,0,0|1,1,0]=3 682 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100102712061 [0,1,0,0,0,0|1,1,0]=3 683 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_100000733799_200000210301 [0,1,0,0,0,0|1,1,0]=3 684 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_200000210301_100000733799 [0,1,0,0,0,0|1,1,0]=3 685 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_100000733799_200025704644 [0,1,0,0,0,0|1,1,0]=3 686 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000733799 [0,1,0,0,0,0|1,1,0]=3 687 B12R1.5 COC(=O)c1ccc(nn1)SC 62a_100000738951_200000210301 [0,1,0,0,0,0|2,1,0]=4 688 B12R1.5 COC(=O)c1ccc(nn1)SC 62a_200000210301_100000738951 [0,1,0,0,0,0|2,1,0]=4 689 B12R1.5 COC(=O)c1ccc(nn1)S[13CH3] 62a_100000738951_200025704644 [0,1,0,0,0,0|2,1,0]=4 690 B12R1.5 COC(=O)c1ccc(nn1)S[13CH3] 62a_200025704644_100000738951 [0,1,0,0,0,0|2,1,0]=4 691 B12R1.5 COC(=O)c1cnc(cn1)SC 62a_100010219404_200000210301 [0,1,0,0,0,0|2,1,0]=4 692 B12R1.5 COC(=O)c1cnc(cn1)SC 62a_200000210301_100010219404 [0,1,0,0,0,0|2,1,0]=4 693 B12R1.5 COC(=O)c1cnc(cn1)S[13CH3] 62a_100010219404_200025704644 [0,1,0,0,0,0|2,1,0]=4 694 B12R1.5 COC(=O)c1cnc(cn1)S[13CH3] 62a_200025704644_100010219404 [0,1,0,0,0,0|2,1,0]=4 695 B12R1.5 COC(=O)c1cnc(nc1)SC 62a_100000729365_200000210301 [0,1,0,0,0,0|2,1,0]=4 696 B12R1.5 COC(=O)c1cnc(nc1)SC 62a_200000210301_100000729365 [0,1,0,0,0,0|2,1,0]=4 697 B12R1.5 COC(=O)c1cnc(nc1)S[13CH3] 62a_100000729365_200025704644 [0,1,0,0,0,0|2,1,0]=4 698 B12R1.5 COC(=O)c1cnc(nc1)S[13CH3] 62a_200025704644_100000729365 [0,1,0,0,0,0|2,1,0]=4 699 B12R1.5 COC(=O)c1ncc(cn1)SC 62a_100000690087_200000210301 [0,1,0,0,0,0|2,1,0]=4 700 B12R1.5 COC(=O)c1ncc(cn1)SC 62a_200000210301_100000690087 [0,1,0,0,0,0|2,1,0]=4 701 B12R1.5 COC(=O)c1ncc(cn1)S[13CH3] 62a_100000690087_200025704644 [0,1,0,0,0,0|2,1,0]=4 702 B12R1.5 COC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100000690087 [0,1,0,0,0,0|2,1,0]=4 703 B12R1.5 COC(C)c1ccc(cc1)CN 34a_200000048501_200000210301 [0,1,0,0,0,0|2,0,1]=4 704 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [0,1,0,0,0,0|1,0,1]=3 705 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [0,1,0,0,0,0|1,0,1]=3 706 B12R1.5 COC(C)c1ccc(cc1)SC 62a_100010254937_200000210301 [0,1,0,0,0,0|1,1,1]=4 707 B12R1.5 COC(C)c1ccc(cc1)SC 62a_200000210301_100010254937 [0,1,0,0,0,0|1,1,1]=4 708 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_100010254937_200025704644 [0,1,0,0,0,0|1,1,1]=4 709 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100010254937 [0,1,0,0,0,0|1,1,1]=4 710 B12R1.5 CO[C@@H](C)c1ccc(cc1)C#N 34a_100011852132_200000210301 [0,1,0,0,0,0|2,0,1]=4 711 B12R1.5 CO[C@@H](C)c1ccc(cc1)C#N 7a_100011852132_200000210301 [0,1,0,0,0,0|2,0,1]=4 712 B12R1.5 COc1ccc(cc1)C(=NO)C 34a_100000164205_200000210301 [0,1,0,0,0,0|3,0,0]=4 713 B12R1.5 COc1ccc(cc1)C(=NO)N 34a_100000231063_200000210301 [0,1,0,0,0,0|3,0,0]=4 714 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,1,0,0,0,0|2,0,0]=3 715 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,1,0,0,0,0|2,0,0]=3 716 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,1,0,0,0,0|2,0,0]=3 717 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,1,0,0,0,0|2,0,0]=3 718 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,1,0,0,0,0|2,0,0]=3 719 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [0,1,0,0,0,0|2,0,0]=3 720 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [0,1,0,0,0,0|1,0,1]=3 721 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [0,1,0,0,0,0|1,0,1]=3 722 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [0,1,0,0,0,0|1,0,1]=3 723 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [0,1,0,0,0,0|1,0,1]=3 724 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [0,1,0,0,0,0|1,0,1]=3 725 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [0,1,0,0,0,0|1,0,1]=3 726 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,1,0,0,0,0|2,0,1]=4 727 B12R1.5 CSc1ccc(cc1)C(=O)C#N 62a_200000210301_100009994572 [0,1,0,0,0,0|2,1,0]=4 728 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000210301 [0,1,0,0,0,0|2,1,0]=4 729 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_200000210301_100000725942 [0,1,0,0,0,0|2,1,0]=4 730 B12R1.5 CSc1ccc(cc1)C(=O)CF 1458a_100000189692_100015361967 [0,1,0,0,0,0|2,1,0]=4 731 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_100000017248_200000210301 [0,1,0,0,0,0|2,1,0]=4 732 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_200000210301_100000017248 [0,1,0,0,0,0|2,1,0]=4 733 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_100011219529_200000210301 [0,1,0,0,0,0|2,1,0]=4 734 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_200000210301_100011219529 [0,1,0,0,0,0|2,1,0]=4 735 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_100000183614_200000210301 [0,1,0,0,0,0|2,1,0]=4 736 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_200000210301_100000183614 [0,1,0,0,0,0|2,1,0]=4 737 B12R1.5 C[C@H](O[13CH3])c1ccc(cc1)C#N 34a_100011852132_200025704644 [0,1,0,0,0,0|2,0,1]=4 738 B12R1.5 C[C@H](O[13CH3])c1ccc(cc1)C#N 7a_100011852132_200025704644 [0,1,0,0,0,0|2,0,1]=4 739 B12R1.5 N#Cc1ccc(cc1)C(=O)CF 1458a_100000210717_100015361967 [0,1,0,0,0,0|3,0,0]=4 740 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,1,0,0,0,0|2,0,0]=3 741 B12R1.5 [13CH3]Oc1ccc(cc1)C(=NO)N 34a_100000231063_200025704644 [0,1,0,0,0,0|3,0,0]=4 742 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,1,0,0,0,0|2,0,0]=3 743 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,1,0,0,0,0|2,0,0]=3 744 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,1,0,0,0,0|2,0,0]=3 745 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,1,0,0,0,0|2,0,0]=3 746 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [0,1,0,0,0,0|2,0,0]=3 747 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C#N 62a_200025704644_100009994572 [0,1,0,0,0,0|2,1,0]=4 748 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200025704644 [0,1,0,0,0,0|2,1,0]=4 749 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_200025704644_100000725942 [0,1,0,0,0,0|2,1,0]=4 750 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_100000017248_200025704644 [0,1,0,0,0,0|2,1,0]=4 751 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_200025704644_100000017248 [0,1,0,0,0,0|2,1,0]=4 752 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_100011219529_200025704644 [0,1,0,0,0,0|2,1,0]=4 753 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_200025704644_100011219529 [0,1,0,0,0,0|2,1,0]=4 754 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_100000183614_200025704644 [0,1,0,0,0,0|2,1,0]=4 755 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_200025704644_100000183614 [0,1,0,0,0,0|2,1,0]=4 756 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Br 34a_100000753367_200025704644 [0,1,0,0,0,0|2,0,1]=4 757 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Br 7a_100000753367_200025704644 [0,1,0,0,0,0|2,0,1]=4 758 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Cl 34a_100000750429_200025704644 [0,1,0,0,0,0|2,0,1]=4 759 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)Cl 7a_100000750429_200025704644 [0,1,0,0,0,0|2,0,1]=4 760 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)F 34a_100011219992_200025704644 [0,1,0,0,0,0|2,0,1]=4 761 B12R1.9 CC(C)(O[13CH3])c1ccc(cc1)F 7a_100011219992_200025704644 [0,1,0,0,0,0|2,0,1]=4 762 B12R1.9 CCC(F)(F)c1ccc(cc1)O 271570a_203496583355_100010208532 [0,1,0,0,0,0|2,0,1]=4 763 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,1,0,0,0,0|2,0,0]=3 764 B12R1.9 CCS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814650 [0,1,0,0,0,0|3,0,0]=4 765 B12R1.9 CCS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100010142209 [0,1,0,0,0,0|3,0,0]=4 766 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 270084a_100102657272_100000182491 [0,1,0,0,0,0|3,0,0]=4 767 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 274078a_100102657272_100000182491 [0,1,0,0,0,0|3,0,0]=4 768 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 40a_100102657272_100010306709 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 270084a_100102657272_100000211267 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 274078a_100102657272_100000211267 [0,1,0,0,0,0|3,0,0]=4 771 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 40a_100102657272_100000039673 [0,1,0,0,0,0|3,0,0]=4 772 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100102657272_100000209962 [0,1,0,0,0,0|3,0,0]=4 773 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100102657272_100000209962 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 40a_100102657272_100000077732 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 270084a_100102657272_100000184267 [0,1,0,0,0,0|3,0,0]=4 776 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 274078a_100102657272_100000184267 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 40a_100102657272_100000081159 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 270084a_100102657272_100011205396 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 274078a_100102657272_100011205396 [0,1,0,0,0,0|3,0,0]=4 780 B12R1.9 CNS(=O)(=O)c1ccc(cc1)N 40a_100102657272_100000054796 [0,1,0,0,0,0|3,0,0]=4 781 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,1,0,0,0,0|2,0,0]=3 782 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,1,0,0,0,0|2,0,0]=3 783 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,1,0,0,0,0|2,0,0]=3 784 B12R1.9 COC(C)(C)c1ccc(cc1)Br 34a_100000753367_200000210301 [0,1,0,0,0,0|2,0,1]=4 785 B12R1.9 COC(C)(C)c1ccc(cc1)Br 7a_100000753367_200000210301 [0,1,0,0,0,0|2,0,1]=4 786 B12R1.9 COC(C)(C)c1ccc(cc1)C 34a_200011345916_200000210301 [0,1,0,0,0,0|2,0,1]=4 787 B12R1.9 COC(C)(C)c1ccc(cc1)C 7a_200011345916_200000210301 [0,1,0,0,0,0|2,0,1]=4 788 B12R1.9 COC(C)(C)c1ccc(cc1)Cl 34a_100000750429_200000210301 [0,1,0,0,0,0|2,0,1]=4 789 B12R1.9 COC(C)(C)c1ccc(cc1)Cl 7a_100000750429_200000210301 [0,1,0,0,0,0|2,0,1]=4 790 B12R1.9 COC(C)(C)c1ccc(cc1)F 34a_100011219992_200000210301 [0,1,0,0,0,0|2,0,1]=4 791 B12R1.9 COC(C)(C)c1ccc(cc1)F 7a_100011219992_200000210301 [0,1,0,0,0,0|2,0,1]=4 792 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,1,0,0,0,0|1,0,0]=2 793 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 34a_200011345916_200025704644 [0,1,0,0,0,0|2,0,1]=4 794 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 7a_200011345916_200025704644 [0,1,0,0,0,0|2,0,1]=4 795 B12R1.9 NNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000183514 [0,1,0,0,0,0|3,0,0]=4 796 B12R1.12 C#CC(OC)c1ccc(cc1)Cl 34a_100011470666_200000210301 [0,1,0,0,0,0|2,0,1]=4 797 B12R1.12 C#CC(OC)c1ccc(cc1)Cl 7a_100011470666_200000210301 [0,1,0,0,0,0|2,0,1]=4 798 B12R1.12 C#CC(O[13CH3])c1ccc(cc1)Cl 34a_100011470666_200025704644 [0,1,0,0,0,0|2,0,1]=4 799 B12R1.12 C#CC(O[13CH3])c1ccc(cc1)Cl 7a_100011470666_200025704644 [0,1,0,0,0,0|2,0,1]=4 800 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [0,1,0,0,0,0|2,0,1]=4 801 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [0,1,0,0,0,0|2,0,1]=4 802 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [0,1,0,0,0,0|2,0,1]=4 803 B12R1.12 CCC(OC)c1ccc(cc1)Br 34a_100000246506_200000210301 [0,1,0,0,0,0|2,0,1]=4 804 B12R1.12 CCC(OC)c1ccc(cc1)Br 7a_100000246506_200000210301 [0,1,0,0,0,0|2,0,1]=4 805 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [0,1,0,0,0,0|2,0,1]=4 806 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [0,1,0,0,0,0|2,0,1]=4 807 B12R1.12 CCC(OC)c1ccc(cc1)Cl 34a_100000246471_200000210301 [0,1,0,0,0,0|2,0,1]=4 808 B12R1.12 CCC(OC)c1ccc(cc1)Cl 7a_100000246471_200000210301 [0,1,0,0,0,0|2,0,1]=4 809 B12R1.12 CCC(OC)c1ccc(cc1)F 34a_100000246474_200000210301 [0,1,0,0,0,0|2,0,1]=4 810 B12R1.12 CCC(OC)c1ccc(cc1)F 7a_100000246474_200000210301 [0,1,0,0,0,0|2,0,1]=4 811 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 34a_100000246506_200025704644 [0,1,0,0,0,0|2,0,1]=4 812 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 7a_100000246506_200025704644 [0,1,0,0,0,0|2,0,1]=4 813 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [0,1,0,0,0,0|2,0,1]=4 814 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [0,1,0,0,0,0|2,0,1]=4 815 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 34a_100000246471_200025704644 [0,1,0,0,0,0|2,0,1]=4 816 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 7a_100000246471_200025704644 [0,1,0,0,0,0|2,0,1]=4 817 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 34a_100000246474_200025704644 [0,1,0,0,0,0|2,0,1]=4 818 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 7a_100000246474_200025704644 [0,1,0,0,0,0|2,0,1]=4 819 B12R1.12 CCN(CC)c1ccc(cc1)O 2230a_100011337800_100000210202 [0,1,0,0,0,0|3,0,0]=4 820 B12R1.12 CCN(CC)c1ccc(cc1)O 269982a_100011337800_100000204670 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.12 CCN(CC)c1ccc(cc1)O 271570a_203496583355_100011216415 [0,1,0,0,0,0|3,0,0]=4 822 B12R1.12 CCN(CC)c1ccc(cc1)O 34a_100011337800_100000210202 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.12 CCN(CF)c1ccc(cc1)O 269982a_100011337800_100015361967 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.12 CCN(CF)c1ccc(cc1)O 34a_100011337800_100015361967 [0,1,0,0,0,0|3,0,0]=4 825 B12R1.12 COC(CCl)c1ccc(cc1)Cl 34a_200011996143_200000210301 [0,1,0,0,0,0|2,0,1]=4 826 B12R1.12 COC(CCl)c1ccc(cc1)Cl 7a_200011996143_200000210301 [0,1,0,0,0,0|2,0,1]=4 827 B12R1.12 COC(CN)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,1,0,0,0,0|2,0,1]=4 828 B12R1.12 COC(CN)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,1,0,0,0,0|2,0,1]=4 829 B12R1.12 COC(OC)c1ccc(cc1)O 271570a_203496583355_100009813454 [0,1,0,0,0,0|0,0,2]=3 830 B12R1.12 COC(OC)c1ccc(cn1)O 271570a_203496583355_100010270258 [0,1,0,0,0,0|1,0,2]=4 831 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 34a_200009814964_200000210301 [0,1,0,0,0,0|2,0,1]=4 832 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 7a_200009814964_200000210301 [0,1,0,0,0,0|2,0,1]=4 833 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200000210301 [0,1,0,0,0,0|2,0,1]=4 834 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200000210301 [0,1,0,0,0,0|2,0,1]=4 835 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 34a_200009814964_200025704644 [0,1,0,0,0,0|2,0,1]=4 836 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 7a_200009814964_200025704644 [0,1,0,0,0,0|2,0,1]=4 837 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 34a_200011996143_200025704644 [0,1,0,0,0,0|2,0,1]=4 838 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 7a_200011996143_200025704644 [0,1,0,0,0,0|2,0,1]=4 839 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,1,0,0,0,0|2,0,1]=4 840 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,1,0,0,0,0|2,0,1]=4 841 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200025704644 [0,1,0,0,0,0|2,0,1]=4 842 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200025704644 [0,1,0,0,0,0|2,0,1]=4 843 B12R1.16 C#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000184674 [0,1,0,0,0,0|2,0,1]=4 844 B12R1.16 C#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000184674 [0,1,0,0,0,0|2,0,1]=4 845 B12R1.16 C#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000184674 [0,1,0,0,0,0|2,0,1]=4 846 B12R1.16 C#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000184674 [0,1,0,0,0,0|2,0,1]=4 847 B12R1.16 C#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000184674 [0,1,0,0,0,0|2,0,1]=4 848 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,1,0,0,0,0|1,0,1]=3 849 B12R1.16 C=C(OCC)c1ccc(nn1)O 271570a_203496583355_100010989170 [0,1,0,0,0,0|3,0,0]=4 850 B12R1.16 C=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210623 [0,1,0,0,0,0|2,0,1]=4 851 B12R1.16 C=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210623 [0,1,0,0,0,0|2,0,1]=4 852 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210623 [0,1,0,0,0,0|2,0,1]=4 853 B12R1.16 C=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210623 [0,1,0,0,0,0|2,0,1]=4 854 B12R1.16 C=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210623 [0,1,0,0,0,0|2,0,1]=4 855 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,1,0,0,0,0|1,0,1]=3 856 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [0,1,0,0,0,0|1,0,0]=2 857 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [0,1,0,0,0,0|2,0,1]=4 858 B12R1.16 CC(OCF)c1ccc(cc1)Br 34a_100000745893_100015361967 [0,1,0,0,0,0|2,0,1]=4 859 B12R1.16 CC(OCF)c1ccc(cc1)Br 7a_100000745893_100015361967 [0,1,0,0,0,0|2,0,1]=4 860 B12R1.16 CC(OCF)c1ccc(cc1)F 34a_100000181323_100015361967 [0,1,0,0,0,0|2,0,1]=4 861 B12R1.16 CC(OCF)c1ccc(cc1)F 7a_100000181323_100015361967 [0,1,0,0,0,0|2,0,1]=4 862 B12R1.16 CC(OCF)c1ccc(cc1)N 34a_100011216399_100015361967 [0,1,0,0,0,0|2,0,1]=4 863 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [0,1,0,0,0,0|2,0,0]=3 864 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [0,1,0,0,0,0|2,0,0]=3 865 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [0,1,0,0,0,0|2,0,0]=3 866 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [0,1,0,0,0,0|2,0,0]=3 867 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [0,1,0,0,0,0|2,0,0]=3 868 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,1,0,0,0,0|1,0,0]=2 869 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,1,0,0,0,0|1,0,0]=2 870 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [0,1,0,0,0,0|2,0,0]=3 871 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [0,1,0,0,0,0|1,0,2]=4 872 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [0,1,0,0,0,0|3,0,0]=4 873 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [0,1,0,0,0,0|3,0,0]=4 874 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [0,1,0,0,0,0|2,0,0]=3 875 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [0,1,0,0,0,0|2,0,0]=3 876 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [0,1,0,0,0,0|2,0,0]=3 877 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [0,1,0,0,0,0|2,0,0]=3 878 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [0,1,0,0,0,0|2,0,0]=3 879 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [0,1,0,0,0,0|2,0,0]=3 880 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [0,1,0,0,0,0|2,0,0]=3 881 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [0,1,0,0,0,0|2,0,0]=3 882 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [0,1,0,0,0,0|2,0,0]=3 883 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [0,1,0,0,0,0|2,0,0]=3 884 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [0,1,0,0,0,0|2,0,0]=3 885 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [0,1,0,0,0,0|2,0,0]=3 886 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [0,1,0,0,0,0|2,0,0]=3 887 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [0,1,0,0,0,0|2,0,0]=3 888 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [0,1,0,0,0,0|2,0,0]=3 889 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,1,0,0,0,0|1,0,0]=2 890 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,1,0,0,0,0|1,0,0]=2 891 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,1,0,0,0,0|1,0,0]=2 892 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [0,1,0,0,0,0|2,0,0]=3 893 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [0,1,0,0,0,0|2,0,0]=3 894 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [0,1,0,0,0,0|2,0,1]=4 895 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,1,0,0,0,0|0,0,0]=1 896 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [0,1,0,0,0,0|1,0,0]=2 897 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [0,1,0,0,0,0|1,0,0]=2 898 B12R1.16 CCOC(=O)c1ccc(nn1)O 271570a_203496583355_100011933454 [0,1,0,0,0,0|2,0,0]=3 899 B12R1.16 CCOC(=O)c1cnc(cn1)O 271570a_203496583355_100000707868 [0,1,0,0,0,0|2,0,0]=3 900 B12R1.16 CCOC(=O)c1cnc(nc1)O 271570a_203496583355_100011935661 [0,1,0,0,0,0|2,0,0]=3 901 B12R1.16 CCOC(=O)c1ncc(cn1)O 271570a_203496583355_100010168878 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [0,1,0,0,0,0|2,0,1]=4 903 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [0,1,0,0,0,0|2,0,1]=4 904 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [0,1,0,0,0,0|2,0,1]=4 905 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,1,0,0,0,0|2,0,1]=4 906 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [0,1,0,0,0,0|2,0,1]=4 907 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [0,1,0,0,0,0|2,0,1]=4 908 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [0,1,0,0,0,0|2,0,1]=4 909 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [0,1,0,0,0,0|2,0,1]=4 910 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [0,1,0,0,0,0|2,0,1]=4 911 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [0,1,0,0,0,0|2,0,1]=4 912 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,1,0,0,0,0|2,0,1]=4 913 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,1,0,0,0,0|2,0,1]=4 914 B12R1.16 CN(CCF)c1ccc(cc1)O 269982a_100000182112_100011217306 [0,1,0,0,0,0|3,0,0]=4 915 B12R1.16 CN(CCF)c1ccc(cc1)O 34a_100000182112_100011217306 [0,1,0,0,0,0|3,0,0]=4 916 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [0,1,0,0,0,0|3,0,0]=4 917 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [0,1,0,0,0,0|3,0,0]=4 918 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [0,1,0,0,0,0|2,0,0]=3 919 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [0,1,0,0,0,0|2,0,0]=3 920 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [0,1,0,0,0,0|2,0,0]=3 921 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [0,1,0,0,0,0|2,0,0]=3 922 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [0,1,0,0,0,0|2,0,0]=3 923 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [0,1,0,0,0,0|2,0,0]=3 924 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [0,1,0,0,0,0|2,0,0]=3 925 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [0,1,0,0,0,0|2,0,0]=3 927 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,1,0,0,0,0|1,0,0]=2 928 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,1,0,0,0,0|1,0,0]=2 929 B12R1.16 CNCC(=O)c1ccc(cn1)Cl 7a_106832991635_100016989621 [0,1,0,0,0,0|3,0,0]=4 930 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [0,1,0,0,0,0|2,0,1]=4 931 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [0,1,0,0,0,0|1,0,2]=4 932 B12R1.16 CNNC(=O)c1ccc(cc1)Br 22a_100016993582_100000185839 [0,1,0,0,0,0|2,0,0]=3 933 B12R1.16 CNNC(=O)c1ccc(cc1)C 22a_100016993582_100000188618 [0,1,0,0,0,0|2,0,0]=3 934 B12R1.16 CNNC(=O)c1ccc(cc1)Cl 22a_100016993582_100000210187 [0,1,0,0,0,0|2,0,0]=3 935 B12R1.16 CNNC(=O)c1ccc(cc1)F 22a_100016993582_100000187176 [0,1,0,0,0,0|2,0,0]=3 936 B12R1.16 CNNC(=O)c1ccc(cc1)I 22a_100016993582_100000187904 [0,1,0,0,0,0|2,0,0]=3 937 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,1,0,0,0,0|1,0,0]=2 938 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [0,1,0,0,0,0|1,0,0]=2 939 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [0,1,0,0,0,0|1,0,0]=2 940 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [0,1,0,0,0,0|1,0,0]=2 941 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [0,1,0,0,0,0|1,0,0]=2 942 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,1,0,0,0,0|0,0,0]=1 943 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,1,0,0,0,0|0,0,0]=1 944 B12R1.16 COCC(N)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,1,0,0,0,0|2,0,1]=4 945 B12R1.16 COCC(N)c1ccc(cc1)F 34a_100000705410_200000210301 [0,1,0,0,0,0|2,0,1]=4 946 B12R1.16 COCC(O)c1ccc(cc1)Cl 34a_100138415774_200011996143 [0,1,0,0,0,0|1,0,2]=4 947 B12R1.16 COCN(C)c1ccc(cc1)Br 2230a_100000219623_100000766300 [0,1,0,0,0,0|3,0,0]=4 948 B12R1.16 COCN(C)c1ccc(cc1)Br 269982a_100000219623_100000766300 [0,1,0,0,0,0|3,0,0]=4 949 B12R1.16 COCN(C)c1ccc(cc1)C 2230a_100000219977_100000766300 [0,1,0,0,0,0|3,0,0]=4 950 B12R1.16 COCN(C)c1ccc(cc1)C 269982a_100000219977_100000766300 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.16 COCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000766300 [0,1,0,0,0,0|3,0,0]=4 952 B12R1.16 COCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000766300 [0,1,0,0,0,0|3,0,0]=4 953 B12R1.16 COCN(C)c1ccc(cc1)F 2230a_100000219829_100000766300 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.16 COCN(C)c1ccc(cc1)F 269982a_100000219829_100000766300 [0,1,0,0,0,0|3,0,0]=4 955 B12R1.16 COCN(C)c1ccc(cc1)I 2230a_100000743151_100000766300 [0,1,0,0,0,0|3,0,0]=4 956 B12R1.16 COCN(C)c1ccc(cc1)I 269982a_100000743151_100000766300 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [0,1,0,0,0,0|2,0,0]=3 958 B12R1.16 COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,1,0,0,0,0|2,0,1]=4 959 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [0,1,0,0,0,0|2,0,1]=4 960 B12R1.16 COC[C@H](O)c1ccc(cc1)F 34a_100138415774_100000720402 [0,1,0,0,0,0|1,0,2]=4 961 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [0,1,0,0,0,0|1,1,0]=3 962 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [0,1,0,0,0,0|1,1,0]=3 963 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [0,1,0,0,0,0|1,1,0]=3 964 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [0,1,0,0,0,0|1,1,0]=3 965 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [0,1,0,0,0,0|1,1,0]=3 966 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [0,1,0,0,0,0|1,1,0]=3 967 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [0,1,0,0,0,0|1,1,0]=3 968 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [0,1,0,0,0,0|1,1,0]=3 969 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [0,1,0,0,0,0|1,1,0]=3 970 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,1,0,0,0,0|0,1,0]=2 971 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,1,0,0,0,0|0,1,0]=2 972 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_200000210301 [0,1,0,0,0,0|2,1,0]=4 973 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_200000210301_100016989621 [0,1,0,0,0,0|2,1,0]=4 974 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_100012027583_200000210301 [0,1,0,0,0,0|2,1,0]=4 975 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_200000210301_100012027583 [0,1,0,0,0,0|2,1,0]=4 976 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_200000210301 [0,1,0,0,0,0|2,1,0]=4 977 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_200000210301_100009864725 [0,1,0,0,0,0|2,1,0]=4 978 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [0,1,0,0,0,0|2,1,0]=4 979 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [0,1,0,0,0,0|2,1,0]=4 980 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 34a_100011852131_100015361967 [0,1,0,0,0,0|2,0,1]=4 981 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 7a_100011852131_100015361967 [0,1,0,0,0,0|2,0,1]=4 982 B12R1.16 Cc1ccc(cc1)C(=O)CC#N 1458a_100000188618_100011214920 [0,1,0,0,0,0|2,0,1]=4 983 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [0,1,0,0,0,0|1,1,0]=3 986 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [0,1,0,0,0,0|1,1,0]=3 987 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,1,0,0,0,0|2,0,1]=4 988 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,1,0,0,0,0|2,0,1]=4 989 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [0,1,0,0,0,0|2,0,1]=4 990 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_100012027583_200025704644 [0,1,0,0,0,0|2,1,0]=4 991 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_200025704644_100012027583 [0,1,0,0,0,0|2,1,0]=4 992 B12R1.16 N#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011214920 [0,1,0,0,0,0|2,0,1]=4 993 B12R1.16 N#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214920 [0,1,0,0,0,0|2,0,1]=4 994 B12R1.16 N#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100011214920 [0,1,0,0,0,0|2,0,1]=4 995 B12R1.16 N#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100011214920 [0,1,0,0,0,0|2,0,1]=4 996 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,1,0,0,0,0|1,0,1]=3 997 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,1,0,0,0,0|1,0,1]=3 998 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [0,1,0,0,0,0|2,0,1]=4 999 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [0,1,0,0,0,0|2,0,0]=3 1000 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [0,1,0,0,0,0|2,0,0]=3 1001 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [0,1,0,0,0,0|2,0,0]=3 1002 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [0,1,0,0,0,0|2,0,0]=3 1003 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,1,0,0,0,0|1,0,0]=2 1004 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [0,1,0,0,0,0|2,0,0]=3 1005 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [0,1,0,0,0,0|2,0,0]=3 1006 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [0,1,0,0,0,0|2,0,0]=3 1007 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [0,1,0,0,0,0|2,0,0]=3 1008 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,1,0,0,0,0|1,0,0]=2 1009 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [0,1,0,0,0,0|1,0,2]=4 1010 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [0,1,0,0,0,0|1,0,0]=2 1011 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,1,0,0,0,0|2,0,1]=4 1012 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)F 34a_100000705410_200025704644 [0,1,0,0,0,0|2,0,1]=4 1013 B12R1.16 [13CH3]OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,1,0,0,0,0|2,0,1]=4 1014 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [0,1,0,0,0,0|1,1,0]=3 1015 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [0,1,0,0,0,0|1,1,0]=3 1016 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [0,1,0,0,0,0|1,1,0]=3 1017 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [0,1,0,0,0,0|1,1,0]=3 1018 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [0,1,0,0,0,0|1,1,0]=3 1019 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [0,1,0,0,0,0|1,1,0]=3 1020 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [0,1,0,0,0,0|1,1,0]=3 1021 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,1,0,0,0,0|0,1,0]=2 1022 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,1,0,0,0,0|0,1,0]=2 1023 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_100016989621_200025704644 [0,1,0,0,0,0|2,1,0]=4 1024 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_200025704644_100016989621 [0,1,0,0,0,0|2,1,0]=4 1025 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_100009864725_200025704644 [0,1,0,0,0,0|2,1,0]=4 1026 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_200025704644_100009864725 [0,1,0,0,0,0|2,1,0]=4 1027 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 34a_217856618577_100000210202 [0,1,0,0,0,0|2,0,1]=4 1028 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 7a_217856618577_100000210202 [0,1,0,0,0,0|2,0,1]=4 1029 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 34a_217856618577_100015361967 [0,1,0,0,0,0|2,0,1]=4 1030 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 7a_217856618577_100015361967 [0,1,0,0,0,0|2,0,1]=4 1031 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,1,0,0,0,0|3,0,0]=4 1032 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,1,0,0,0,0|3,0,0]=4 1034 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,1,0,0,0,0|2,0,0]=3 1037 B12R1.20 CC(=C(C)c1ccc(cn1)O)C 271570a_200000049429_100000685995 [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,1,0,0,0,0|2,0,1]=4 1039 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,1,0,0,0,0|1,0,2]=4 1040 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,1,0,0,0,0|3,0,0]=4 1041 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,1,0,0,0,0|3,0,0]=4 1042 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,1,0,0,0,0|3,0,0]=4 1043 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,1,0,0,0,0|2,0,1]=4 1044 B12R1.20 CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000210206 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210206 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.20 CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000210206 [0,1,0,0,0,0|2,0,0]=3 1047 B12R1.20 CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000210206 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,1,0,0,0,0|1,0,0]=2 1049 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,1,0,0,0,0|1,0,0]=2 1050 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,1,0,0,0,0|2,0,1]=4 1054 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 11a_100102631434_100000185839 [0,1,0,0,0,0|2,0,0]=3 1055 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 1626a_100102631434_100000185839 [0,1,0,0,0,0|2,0,0]=3 1056 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 240690a_100102631434_100000185839 [0,1,0,0,0,0|2,0,0]=3 1057 B12R1.20 CN(C)C(=O)c1ccc(cc1)Br 527a_100102631434_100000185839 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 11a_100102631434_100000210187 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 1626a_100102631434_100000210187 [0,1,0,0,0,0|2,0,0]=3 1060 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 240690a_100102631434_100000210187 [0,1,0,0,0,0|2,0,0]=3 1061 B12R1.20 CN(C)C(=O)c1ccc(cc1)Cl 527a_100102631434_100000210187 [0,1,0,0,0,0|2,0,0]=3 1062 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 11a_100102631434_100000187176 [0,1,0,0,0,0|2,0,0]=3 1063 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 1626a_100102631434_100000187176 [0,1,0,0,0,0|2,0,0]=3 1064 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 240690a_100102631434_100000187176 [0,1,0,0,0,0|2,0,0]=3 1065 B12R1.20 CN(C)C(=O)c1ccc(cc1)F 527a_100102631434_100000187176 [0,1,0,0,0,0|2,0,0]=3 1066 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 11a_100102631434_100000187904 [0,1,0,0,0,0|2,0,0]=3 1067 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 1626a_100102631434_100000187904 [0,1,0,0,0,0|2,0,0]=3 1068 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 240690a_100102631434_100000187904 [0,1,0,0,0,0|2,0,0]=3 1069 B12R1.20 CN(C)C(=O)c1ccc(cc1)I 527a_100102631434_100000187904 [0,1,0,0,0,0|2,0,0]=3 1070 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,1,0,0,0,0|1,0,0]=2 1071 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,1,0,0,0,0|1,0,0]=2 1072 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,1,0,0,0,0|1,0,0]=2 1073 B12R1.20 CN(C)C(=O)c1ccc(cn1)O 271570a_203496583355_200011781295 [0,1,0,0,0,0|2,0,0]=3 1074 B12R1.20 CN(C)C(=O)c1ccc(nc1)O 271570a_203496583355_100000159593 [0,1,0,0,0,0|2,0,0]=3 1075 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,1,0,0,0,0|2,0,0]=3 1076 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000188618 [0,1,0,0,0,0|2,0,0]=3 1077 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000188618 [0,1,0,0,0,0|2,0,0]=3 1078 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000188618 [0,1,0,0,0,0|2,0,0]=3 1079 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000188618 [0,1,0,0,0,0|2,0,0]=3 1080 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,1,0,0,0,0|2,0,0]=3 1081 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,1,0,0,0,0|1,0,2]=4 1082 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Br)F 34a_100011191524_200025704644 [0,1,0,0,0,0|2,0,1]=4 1083 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Br)F 7a_100011191524_200025704644 [0,1,0,0,0,0|2,0,1]=4 1084 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000742046_200025704644 [0,1,0,0,0,0|2,0,1]=4 1085 B12R1.367 CC(O[13CH3])c1ccc(c(c1)Cl)Cl 7a_100000742046_200025704644 [0,1,0,0,0,0|2,0,1]=4 1086 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)Cl 34a_100011944057_200025704644 [0,1,0,0,0,0|2,0,1]=4 1087 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)Cl 7a_100011944057_200025704644 [0,1,0,0,0,0|2,0,1]=4 1088 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)F 34a_100000246517_200025704644 [0,1,0,0,0,0|2,0,1]=4 1089 B12R1.367 CC(O[13CH3])c1ccc(c(c1)F)F 7a_100000246517_200025704644 [0,1,0,0,0,0|2,0,1]=4 1090 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210202 [0,1,0,0,0,0|2,0,0]=3 1091 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [0,1,0,0,0,0|2,0,0]=3 1092 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [0,1,0,0,0,0|2,0,0]=3 1093 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210202 [0,1,0,0,0,0|2,0,0]=3 1094 B12R1.367 CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210202 [0,1,0,0,0,0|2,0,0]=3 1095 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,1,0,0,0,0|1,0,0]=2 1096 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [0,1,0,0,0,0|2,0,0]=3 1097 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [0,1,0,0,0,0|2,0,0]=3 1098 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [0,1,0,0,0,0|2,0,0]=3 1099 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [0,1,0,0,0,0|2,0,0]=3 1100 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [0,1,0,0,0,0|2,0,0]=3 1101 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,1,0,0,0,0|1,0,0]=2 1102 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,1,0,0,0,0|1,0,0]=2 1103 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210202 [0,1,0,0,0,0|2,0,0]=3 1104 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [0,1,0,0,0,0|2,0,0]=3 1106 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210202 [0,1,0,0,0,0|2,0,0]=3 1107 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210202 [0,1,0,0,0,0|2,0,0]=3 1108 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,1,0,0,0,0|1,0,0]=2 1109 B12R1.367 CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210202 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [0,1,0,0,0,0|2,0,0]=3 1111 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.367 CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210202 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.367 CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210202 [0,1,0,0,0,0|2,0,0]=3 1114 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,1,0,0,0,0|1,0,0]=2 1115 B12R1.367 CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210202 [0,1,0,0,0,0|2,0,0]=3 1116 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [0,1,0,0,0,0|2,0,0]=3 1117 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [0,1,0,0,0,0|2,0,0]=3 1118 B12R1.367 CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210202 [0,1,0,0,0,0|2,0,0]=3 1119 B12R1.367 CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210202 [0,1,0,0,0,0|2,0,0]=3 1120 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,1,0,0,0,0|1,0,0]=2 1121 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,1,0,0,0,0|2,0,0]=3 1122 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,1,0,0,0,0|2,0,0]=3 1123 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,1,0,0,0,0|2,0,0]=3 1124 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,1,0,0,0,0|2,0,0]=3 1125 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,1,0,0,0,0|2,0,0]=3 1126 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,1,0,0,0,0|2,0,0]=3 1127 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,1,0,0,0,0|1,0,0]=2 1128 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 11a_106832991635_100012339404 [0,1,0,0,0,0|2,0,0]=3 1129 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 1626a_100102657272_100012339404 [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 240690a_100102657272_100012339404 [0,1,0,0,0,0|2,0,0]=3 1131 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 527a_100102657272_100012339404 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 11a_106832991635_100000186397 [0,1,0,0,0,0|2,0,0]=3 1133 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 1626a_100102657272_100000186397 [0,1,0,0,0,0|2,0,0]=3 1134 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 240690a_100102657272_100000186397 [0,1,0,0,0,0|2,0,0]=3 1135 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 527a_100102657272_100000186397 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 11a_106832991635_100000691181 [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100102657272_100000691181 [0,1,0,0,0,0|2,0,0]=3 1138 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100102657272_100000691181 [0,1,0,0,0,0|2,0,0]=3 1139 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 527a_100102657272_100000691181 [0,1,0,0,0,0|2,0,0]=3 1140 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 11a_106832991635_100000760357 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 1626a_100102657272_100000760357 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 240690a_100102657272_100000760357 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 527a_100102657272_100000760357 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 11a_106832991635_100000739115 [0,1,0,0,0,0|2,0,0]=3 1145 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 1626a_100102657272_100000739115 [0,1,0,0,0,0|2,0,0]=3 1146 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 240690a_100102657272_100000739115 [0,1,0,0,0,0|2,0,0]=3 1147 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 527a_100102657272_100000739115 [0,1,0,0,0,0|2,0,0]=3 1148 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,1,0,0,0,0|1,0,0]=2 1149 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 11a_106832991635_100000692631 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 1626a_100102657272_100000692631 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 240690a_100102657272_100000692631 [0,1,0,0,0,0|2,0,0]=3 1152 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 527a_100102657272_100000692631 [0,1,0,0,0,0|2,0,0]=3 1153 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [0,1,0,0,0,0|2,0,0]=3 1154 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [0,1,0,0,0,0|2,0,0]=3 1155 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [0,1,0,0,0,0|2,0,0]=3 1156 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [0,1,0,0,0,0|2,0,0]=3 1157 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [0,1,0,0,0,0|2,0,0]=3 1159 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [0,1,0,0,0,0|2,0,0]=3 1160 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [0,1,0,0,0,0|2,0,0]=3 1161 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 11a_106832991635_100000751819 [0,1,0,0,0,0|2,0,0]=3 1162 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 1626a_100102657272_100000751819 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 240690a_100102657272_100000751819 [0,1,0,0,0,0|2,0,0]=3 1164 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 527a_100102657272_100000751819 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 11a_106832991635_100000751300 [0,1,0,0,0,0|2,0,0]=3 1166 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 1626a_100102657272_100000751300 [0,1,0,0,0,0|2,0,0]=3 1167 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 240690a_100102657272_100000751300 [0,1,0,0,0,0|2,0,0]=3 1168 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 527a_100102657272_100000751300 [0,1,0,0,0,0|2,0,0]=3 1169 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,1,0,0,0,0|1,0,0]=2 1170 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,1,0,0,0,0|1,0,0]=2 1171 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 11a_106832991635_100000687082 [0,1,0,0,0,0|2,0,0]=3 1172 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100102657272_100000687082 [0,1,0,0,0,0|2,0,0]=3 1173 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100102657272_100000687082 [0,1,0,0,0,0|2,0,0]=3 1174 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 527a_100102657272_100000687082 [0,1,0,0,0,0|2,0,0]=3 1175 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 11a_106832991635_100000751740 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 1626a_100102657272_100000751740 [0,1,0,0,0,0|2,0,0]=3 1177 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 240690a_100102657272_100000751740 [0,1,0,0,0,0|2,0,0]=3 1178 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 527a_100102657272_100000751740 [0,1,0,0,0,0|2,0,0]=3 1179 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 11a_106832991635_100000210401 [0,1,0,0,0,0|2,0,0]=3 1180 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102657272_100000210401 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210401 [0,1,0,0,0,0|2,0,0]=3 1182 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100102657272_100000210401 [0,1,0,0,0,0|2,0,0]=3 1183 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 11a_106832991635_100000686462 [0,1,0,0,0,0|2,0,0]=3 1184 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 1626a_100102657272_100000686462 [0,1,0,0,0,0|2,0,0]=3 1185 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 240690a_100102657272_100000686462 [0,1,0,0,0,0|2,0,0]=3 1186 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 527a_100102657272_100000686462 [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 11a_106832991635_100000684831 [0,1,0,0,0,0|2,0,0]=3 1188 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 1626a_100102657272_100000684831 [0,1,0,0,0,0|2,0,0]=3 1189 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 240690a_100102657272_100000684831 [0,1,0,0,0,0|2,0,0]=3 1190 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 527a_100102657272_100000684831 [0,1,0,0,0,0|2,0,0]=3 1191 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,1,0,0,0,0|1,0,0]=2 1192 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,1,0,0,0,0|1,0,0]=2 1193 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 11a_106832991635_100000743946 [0,1,0,0,0,0|2,0,0]=3 1194 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 1626a_100102657272_100000743946 [0,1,0,0,0,0|2,0,0]=3 1195 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 240690a_100102657272_100000743946 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 527a_100102657272_100000743946 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 11a_106832991635_100000212313 [0,1,0,0,0,0|2,0,0]=3 1198 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 1626a_100102657272_100000212313 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 240690a_100102657272_100000212313 [0,1,0,0,0,0|2,0,0]=3 1200 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 527a_100102657272_100000212313 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 11a_106832991635_100000743183 [0,1,0,0,0,0|2,0,0]=3 1202 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 1626a_100102657272_100000743183 [0,1,0,0,0,0|2,0,0]=3 1203 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 240690a_100102657272_100000743183 [0,1,0,0,0,0|2,0,0]=3 1204 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 527a_100102657272_100000743183 [0,1,0,0,0,0|2,0,0]=3 1205 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 11a_106832991635_100000209822 [0,1,0,0,0,0|2,0,0]=3 1206 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 1626a_100102657272_100000209822 [0,1,0,0,0,0|2,0,0]=3 1207 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 240690a_100102657272_100000209822 [0,1,0,0,0,0|2,0,0]=3 1208 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 527a_100102657272_100000209822 [0,1,0,0,0,0|2,0,0]=3 1209 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 11a_106832991635_100000062624 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 1626a_100102657272_100000062624 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 240690a_100102657272_100000062624 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 527a_100102657272_100000062624 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,1,0,0,0,0|1,0,0]=2 1214 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,1,0,0,0,0|1,0,0]=2 1215 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 11a_106832991635_100012343876 [0,1,0,0,0,0|2,0,0]=3 1216 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 1626a_100102657272_100012343876 [0,1,0,0,0,0|2,0,0]=3 1217 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 240690a_100102657272_100012343876 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 527a_100102657272_100012343876 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 11a_106832991635_100000751299 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 1626a_100102657272_100000751299 [0,1,0,0,0,0|2,0,0]=3 1221 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 240690a_100102657272_100000751299 [0,1,0,0,0,0|2,0,0]=3 1222 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 527a_100102657272_100000751299 [0,1,0,0,0,0|2,0,0]=3 1223 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 11a_106832991635_100000739381 [0,1,0,0,0,0|2,0,0]=3 1224 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 1626a_100102657272_100000739381 [0,1,0,0,0,0|2,0,0]=3 1225 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 240690a_100102657272_100000739381 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 527a_100102657272_100000739381 [0,1,0,0,0,0|2,0,0]=3 1227 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 11a_106832991635_100000688015 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 1626a_100102657272_100000688015 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 240690a_100102657272_100000688015 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 527a_100102657272_100000688015 [0,1,0,0,0,0|2,0,0]=3 1231 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 11a_106832991635_100000725830 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 1626a_100102657272_100000725830 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 240690a_100102657272_100000725830 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 527a_100102657272_100000725830 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,1,0,0,0,0|1,0,0]=2 1236 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,1,0,0,0,0|1,0,0]=2 1237 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [0,1,0,0,0,0|2,0,0]=3 1238 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [0,1,0,0,0,0|2,0,0]=3 1239 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [0,1,0,0,0,0|2,0,0]=3 1240 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [0,1,0,0,0,0|2,0,0]=3 1242 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [0,1,0,0,0,0|2,0,0]=3 1243 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [0,1,0,0,0,0|2,0,0]=3 1244 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [0,1,0,0,0,0|2,0,0]=3 1246 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [0,1,0,0,0,0|2,0,0]=3 1248 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [0,1,0,0,0,0|2,0,1]=4 1249 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,1,0,0,0,0|2,0,1]=4 1250 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [0,1,0,0,0,0|2,0,1]=4 1251 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [0,1,0,0,0,0|2,0,1]=4 1252 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [0,1,0,0,0,0|2,0,0]=3 1253 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [0,1,0,0,0,0|1,0,0]=2 1254 B12R1.367 COC(=O)c1cc(c(cn1)O)N 271570a_203496583355_100016001589 [0,1,0,0,0,0|1,0,0]=2 1255 B12R1.367 COC(=O)c1cc(c(nn1)O)C 271570a_203496583355_100102422153 [0,1,0,0,0,0|2,0,0]=3 1256 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,1,0,0,0,0|0,0,0]=1 1257 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,1,0,0,0,0|0,0,0]=1 1258 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,1,0,0,0,0|0,0,0]=1 1259 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,1,0,0,0,0|0,0,0]=1 1260 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,1,0,0,0,0|0,0,0]=1 1261 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [0,1,0,0,0,0|1,0,0]=2 1262 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [0,1,0,0,0,0|1,0,0]=2 1263 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [0,1,0,0,0,0|1,0,0]=2 1264 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [0,1,0,0,0,0|1,0,0]=2 1265 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [0,1,0,0,0,0|1,0,0]=2 1266 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,1,0,0,0,0|0,0,0]=1 1267 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,1,0,0,0,0|0,0,0]=1 1268 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [0,1,0,0,0,0|1,0,0]=2 1269 B12R1.367 COC(=O)c1ccc(c(n1)F)O 271570a_203496583355_100010189630 [0,1,0,0,0,0|1,0,0]=2 1270 B12R1.367 COC(=O)c1ccc(c(n1)N)O 271570a_203496583355_100010187631 [0,1,0,0,0,0|1,0,0]=2 1271 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.367 COC(=O)c1ccc(c(n1)O)F 271570a_203496583355_100010189626 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [0,1,0,0,0,0|1,0,0]=2 1274 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [0,1,0,0,0,0|1,0,0]=2 1275 B12R1.367 COC(=O)c1cnc(c(c1)Br)O 271570a_203496583355_100010114297 [0,1,0,0,0,0|1,0,0]=2 1276 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [0,1,0,0,0,0|1,0,0]=2 1277 B12R1.367 COC(=O)c1cnc(c(c1)F)O 271570a_203496583355_100010189625 [0,1,0,0,0,0|1,0,0]=2 1278 B12R1.367 COC(=O)c1cnc(c(c1)N)O 271570a_203496583355_100000079130 [0,1,0,0,0,0|1,0,0]=2 1279 B12R1.367 COC(=O)c1cnc(c(c1)O)Cl 271570a_203496583355_100010188758 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.367 COC(=O)c1cnc(c(c1)O)F 271570a_203496583355_100000117919 [0,1,0,0,0,0|2,0,0]=3 1281 B12R1.367 COC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816800 [0,1,0,0,0,0|2,0,0]=3 1282 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [0,1,0,0,0,0|1,0,0]=2 1283 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [0,1,0,0,0,0|1,0,0]=2 1284 B12R1.367 COC(=O)c1cnc(c(n1)C)O 271570a_203496583355_100000109192 [0,1,0,0,0,0|2,0,0]=3 1285 B12R1.367 COC(=O)c1cnc(c(n1)O)C 271570a_203496583355_200010778766 [0,1,0,0,0,0|3,0,0]=4 1286 B12R1.367 COC(=O)c1cnc(c(n1)O)F 271570a_203496583355_100010896985 [0,1,0,0,0,0|3,0,0]=4 1287 B12R1.367 COC(=O)c1coc(=O)c(c1)O 271570a_203496583355_100009812866 [0,1,0,0,0,0|1,0,1]=3 1288 B12R1.367 COC(C)c1ccc(c(c1)Br)F 34a_100011191524_200000210301 [0,1,0,0,0,0|2,0,1]=4 1289 B12R1.367 COC(C)c1ccc(c(c1)Br)F 7a_100011191524_200000210301 [0,1,0,0,0,0|2,0,1]=4 1290 B12R1.367 COC(C)c1ccc(c(c1)Cl)Cl 34a_100000742046_200000210301 [0,1,0,0,0,0|2,0,1]=4 1291 B12R1.367 COC(C)c1ccc(c(c1)Cl)Cl 7a_100000742046_200000210301 [0,1,0,0,0,0|2,0,1]=4 1292 B12R1.367 COC(C)c1ccc(c(c1)F)Cl 34a_100011944057_200000210301 [0,1,0,0,0,0|2,0,1]=4 1293 B12R1.367 COC(C)c1ccc(c(c1)F)Cl 7a_100011944057_200000210301 [0,1,0,0,0,0|2,0,1]=4 1294 B12R1.367 COC(C)c1ccc(c(c1)F)F 34a_100000246517_200000210301 [0,1,0,0,0,0|2,0,1]=4 1295 B12R1.367 COC(C)c1ccc(c(c1)F)F 7a_100000246517_200000210301 [0,1,0,0,0,0|2,0,1]=4 1296 B12R1.367 Cc1cc(ccc1Br)C(=O)CF 1458a_100000692631_100015361967 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.367 Cc1cc(ccc1Cl)C(=O)CF 1458a_100000686306_100015361967 [0,1,0,0,0,0|3,0,0]=4 1298 B12R1.367 Cc1cc(ccc1F)C(=O)CF 1458a_100000751819_100015361967 [0,1,0,0,0,0|3,0,0]=4 1299 B12R1.367 Cc1cc(ccc1I)C(=O)CF 1458a_100000751300_100015361967 [0,1,0,0,0,0|3,0,0]=4 1300 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,1,0,0,0,0|2,0,0]=3 1301 B12R1.367 Cc1cc(ccc1O)C(=O)NN 271570a_203496583355_100012339724 [0,1,0,0,0,0|2,0,0]=3 1302 B12R1.367 Cc1ccc(cc1Br)C(=O)CF 1458a_100000186397_100015361967 [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.367 Cc1ccc(cc1C)C(=O)CF 1458a_100000210898_100015361967 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.367 Cc1ccc(cc1Cl)C(=O)CF 1458a_100000751740_100015361967 [0,1,0,0,0,0|3,0,0]=4 1305 B12R1.367 Cc1ccc(cc1F)C(=O)CF 1458a_100000212313_100015361967 [0,1,0,0,0,0|3,0,0]=4 1306 B12R1.367 Cc1ccc(cc1I)C(=O)CF 1458a_100000751299_100015361967 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [0,1,0,0,0,0|3,0,0]=4 1308 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Br 1458a_100012339404_100015361967 [0,1,0,0,0,0|3,0,0]=4 1312 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100015361967 [0,1,0,0,0,0|3,0,0]=4 1313 B12R1.367 O=C(CF)c1ccc(c(c1)Br)F 1458a_100000760357_100015361967 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.367 O=C(CF)c1ccc(c(c1)Br)I 1458a_100000739115_100015361967 [0,1,0,0,0,0|3,0,0]=4 1315 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100015361967 [0,1,0,0,0,0|3,0,0]=4 1317 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100015361967 [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)F 1458a_100000686462_100015361967 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)I 1458a_100000684831_100015361967 [0,1,0,0,0,0|3,0,0]=4 1320 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,1,0,0,0,0|2,0,0]=3 1321 B12R1.367 O=C(CF)c1ccc(c(c1)F)Br 1458a_100000743946_100015361967 [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.367 O=C(CF)c1ccc(c(c1)F)Cl 1458a_100000743183_100015361967 [0,1,0,0,0,0|3,0,0]=4 1323 B12R1.367 O=C(CF)c1ccc(c(c1)F)F 1458a_100000209822_100015361967 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.367 O=C(CF)c1ccc(c(c1)F)I 1458a_100000062624_100015361967 [0,1,0,0,0,0|3,0,0]=4 1325 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.367 O=C(CF)c1ccc(c(c1)I)Br 1458a_100012343876_100015361967 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.367 O=C(CF)c1ccc(c(c1)I)Cl 1458a_100000739381_100015361967 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.367 O=C(CF)c1ccc(c(c1)I)F 1458a_100000688015_100015361967 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.367 O=C(CF)c1ccc(c(c1)I)I 1458a_100000725830_100015361967 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,1,0,0,0,0|2,0,0]=3 1331 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [0,1,0,0,0,0|3,0,0]=4 1333 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 34a_100000743050_200025704644 [0,1,0,0,0,0|2,0,1]=4 1337 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)Cl 7a_100000743050_200025704644 [0,1,0,0,0,0|2,0,1]=4 1338 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 34a_200011245020_200025704644 [0,1,0,0,0,0|2,0,1]=4 1339 B12R1.1703 CC(O[13CH3])c1ccc(cc1Cl)F 7a_200011245020_200025704644 [0,1,0,0,0,0|2,0,1]=4 1340 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 34a_200011805215_200025704644 [0,1,0,0,0,0|2,0,1]=4 1341 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)Cl 7a_200011805215_200025704644 [0,1,0,0,0,0|2,0,1]=4 1342 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 34a_200000246518_200025704644 [0,1,0,0,0,0|2,0,1]=4 1343 B12R1.1703 CC(O[13CH3])c1ccc(cc1F)F 7a_200000246518_200025704644 [0,1,0,0,0,0|2,0,1]=4 1344 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,1,0,0,0,0|2,0,0]=3 1345 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,1,0,0,0,0|2,0,0]=3 1348 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,1,0,0,0,0|1,0,0]=2 1350 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,1,0,0,0,0|2,0,0]=3 1352 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,1,0,0,0,0|2,0,0]=3 1354 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,1,0,0,0,0|2,0,0]=3 1355 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,1,0,0,0,0|1,0,0]=2 1356 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,1,0,0,0,0|1,0,0]=2 1357 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,1,0,0,0,0|2,0,0]=3 1358 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,1,0,0,0,0|2,0,0]=3 1359 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,1,0,0,0,0|2,0,0]=3 1360 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,1,0,0,0,0|2,0,0]=3 1361 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,1,0,0,0,0|1,0,0]=2 1363 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,1,0,0,0,0|2,0,0]=3 1366 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,1,0,0,0,0|1,0,0]=2 1369 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,1,0,0,0,0|1,0,0]=2 1370 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,1,0,0,0,0|2,0,0]=3 1371 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,1,0,0,0,0|2,0,0]=3 1373 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,1,0,0,0,0|2,0,0]=3 1374 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,1,0,0,0,0|2,0,0]=3 1375 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,1,0,0,0,0|2,0,0]=3 1376 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,1,0,0,0,0|2,0,0]=3 1378 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,1,0,0,0,0|2,0,0]=3 1379 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,1,0,0,0,0|2,0,0]=3 1380 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,1,0,0,0,0|1,0,0]=2 1381 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [0,1,0,0,0,0|3,0,0]=4 1382 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 11a_106832991635_100000762965 [0,1,0,0,0,0|2,0,0]=3 1384 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 1626a_100102657272_100000762965 [0,1,0,0,0,0|2,0,0]=3 1385 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 240690a_100102657272_100000762965 [0,1,0,0,0,0|2,0,0]=3 1386 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 527a_100102657272_100000762965 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 11a_106832991635_100000685072 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 1626a_100102657272_100000685072 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 240690a_100102657272_100000685072 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 527a_100102657272_100000685072 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [0,1,0,0,0,0|2,0,0]=3 1393 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [0,1,0,0,0,0|2,0,0]=3 1395 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 11a_106832991635_100000212304 [0,1,0,0,0,0|2,0,0]=3 1396 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1626a_100102657272_100000212304 [0,1,0,0,0,0|2,0,0]=3 1397 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 240690a_100102657272_100000212304 [0,1,0,0,0,0|2,0,0]=3 1398 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 527a_100102657272_100000212304 [0,1,0,0,0,0|2,0,0]=3 1399 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 11a_106832991635_100012360512 [0,1,0,0,0,0|2,0,0]=3 1400 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 1626a_100102657272_100012360512 [0,1,0,0,0,0|2,0,0]=3 1401 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 240690a_100102657272_100012360512 [0,1,0,0,0,0|2,0,0]=3 1402 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 527a_100102657272_100012360512 [0,1,0,0,0,0|2,0,0]=3 1403 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,1,0,0,0,0|1,0,0]=2 1404 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,1,0,0,0,0|1,0,0]=2 1405 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 11a_106832991635_100000741311 [0,1,0,0,0,0|2,0,0]=3 1406 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1626a_100102657272_100000741311 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 240690a_100102657272_100000741311 [0,1,0,0,0,0|2,0,0]=3 1408 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 527a_100102657272_100000741311 [0,1,0,0,0,0|2,0,0]=3 1409 B12R1.1703 CNC(=O)c1ccc(cc1C)C 11a_106832991635_100000211164 [0,1,0,0,0,0|2,0,0]=3 1410 B12R1.1703 CNC(=O)c1ccc(cc1C)C 1626a_100102657272_100000211164 [0,1,0,0,0,0|2,0,0]=3 1411 B12R1.1703 CNC(=O)c1ccc(cc1C)C 240690a_100102657272_100000211164 [0,1,0,0,0,0|2,0,0]=3 1412 B12R1.1703 CNC(=O)c1ccc(cc1C)C 527a_100102657272_100000211164 [0,1,0,0,0,0|2,0,0]=3 1413 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [0,1,0,0,0,0|2,0,0]=3 1414 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [0,1,0,0,0,0|2,0,0]=3 1415 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [0,1,0,0,0,0|2,0,0]=3 1416 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [0,1,0,0,0,0|2,0,0]=3 1417 B12R1.1703 CNC(=O)c1ccc(cc1C)F 11a_106832991635_100000686989 [0,1,0,0,0,0|2,0,0]=3 1418 B12R1.1703 CNC(=O)c1ccc(cc1C)F 1626a_100102657272_100000686989 [0,1,0,0,0,0|2,0,0]=3 1419 B12R1.1703 CNC(=O)c1ccc(cc1C)F 240690a_100102657272_100000686989 [0,1,0,0,0,0|2,0,0]=3 1420 B12R1.1703 CNC(=O)c1ccc(cc1C)F 527a_100102657272_100000686989 [0,1,0,0,0,0|2,0,0]=3 1421 B12R1.1703 CNC(=O)c1ccc(cc1C)I 11a_106832991635_100010189873 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.1703 CNC(=O)c1ccc(cc1C)I 1626a_100102657272_100010189873 [0,1,0,0,0,0|2,0,0]=3 1423 B12R1.1703 CNC(=O)c1ccc(cc1C)I 240690a_100102657272_100010189873 [0,1,0,0,0,0|2,0,0]=3 1424 B12R1.1703 CNC(=O)c1ccc(cc1C)I 527a_100102657272_100010189873 [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,1,0,0,0,0|1,0,0]=2 1426 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,1,0,0,0,0|1,0,0]=2 1427 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 11a_106832991635_100000741628 [0,1,0,0,0,0|2,0,0]=3 1428 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 1626a_100102657272_100000741628 [0,1,0,0,0,0|2,0,0]=3 1429 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 240690a_100102657272_100000741628 [0,1,0,0,0,0|2,0,0]=3 1430 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 527a_100102657272_100000741628 [0,1,0,0,0,0|2,0,0]=3 1431 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 11a_106832991635_100000766932 [0,1,0,0,0,0|2,0,0]=3 1432 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 1626a_100102657272_100000766932 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 240690a_100102657272_100000766932 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 527a_100102657272_100000766932 [0,1,0,0,0,0|2,0,0]=3 1435 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 11a_106832991635_100000211397 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 1626a_100102657272_100000211397 [0,1,0,0,0,0|2,0,0]=3 1441 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 240690a_100102657272_100000211397 [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 527a_100102657272_100000211397 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 11a_106832991635_100000751301 [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 1626a_100102657272_100000751301 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 240690a_100102657272_100000751301 [0,1,0,0,0,0|2,0,0]=3 1446 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 527a_100102657272_100000751301 [0,1,0,0,0,0|2,0,0]=3 1447 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,1,0,0,0,0|1,0,0]=2 1448 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,1,0,0,0,0|1,0,0]=2 1449 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 11a_106832991635_100000214689 [0,1,0,0,0,0|2,0,0]=3 1450 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1626a_100102657272_100000214689 [0,1,0,0,0,0|2,0,0]=3 1451 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 240690a_100102657272_100000214689 [0,1,0,0,0,0|2,0,0]=3 1452 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 527a_100102657272_100000214689 [0,1,0,0,0,0|2,0,0]=3 1453 B12R1.1703 CNC(=O)c1ccc(cc1F)C 11a_106832991635_100000766033 [0,1,0,0,0,0|2,0,0]=3 1454 B12R1.1703 CNC(=O)c1ccc(cc1F)C 1626a_100102657272_100000766033 [0,1,0,0,0,0|2,0,0]=3 1455 B12R1.1703 CNC(=O)c1ccc(cc1F)C 240690a_100102657272_100000766033 [0,1,0,0,0,0|2,0,0]=3 1456 B12R1.1703 CNC(=O)c1ccc(cc1F)C 527a_100102657272_100000766033 [0,1,0,0,0,0|2,0,0]=3 1457 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [0,1,0,0,0,0|2,0,0]=3 1458 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [0,1,0,0,0,0|2,0,0]=3 1459 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [0,1,0,0,0,0|2,0,0]=3 1460 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [0,1,0,0,0,0|2,0,0]=3 1461 B12R1.1703 CNC(=O)c1ccc(cc1F)F 11a_106832991635_100000211022 [0,1,0,0,0,0|2,0,0]=3 1462 B12R1.1703 CNC(=O)c1ccc(cc1F)F 1626a_100102657272_100000211022 [0,1,0,0,0,0|2,0,0]=3 1463 B12R1.1703 CNC(=O)c1ccc(cc1F)F 240690a_100102657272_100000211022 [0,1,0,0,0,0|2,0,0]=3 1464 B12R1.1703 CNC(=O)c1ccc(cc1F)F 527a_100102657272_100000211022 [0,1,0,0,0,0|2,0,0]=3 1465 B12R1.1703 CNC(=O)c1ccc(cc1F)I 11a_106832991635_100000037189 [0,1,0,0,0,0|2,0,0]=3 1466 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1626a_100102657272_100000037189 [0,1,0,0,0,0|2,0,0]=3 1467 B12R1.1703 CNC(=O)c1ccc(cc1F)I 240690a_100102657272_100000037189 [0,1,0,0,0,0|2,0,0]=3 1468 B12R1.1703 CNC(=O)c1ccc(cc1F)I 527a_100102657272_100000037189 [0,1,0,0,0,0|2,0,0]=3 1469 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,1,0,0,0,0|1,0,0]=2 1470 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,1,0,0,0,0|1,0,0]=2 1471 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,1,0,0,0,0|1,0,0]=2 1472 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 11a_106832991635_100000751167 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 1626a_100102657272_100000751167 [0,1,0,0,0,0|2,0,0]=3 1474 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 240690a_100102657272_100000751167 [0,1,0,0,0,0|2,0,0]=3 1475 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 527a_100102657272_100000751167 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.1703 CNC(=O)c1ccc(cc1I)C 11a_106832991635_100009999607 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.1703 CNC(=O)c1ccc(cc1I)C 1626a_100102657272_100009999607 [0,1,0,0,0,0|2,0,0]=3 1478 B12R1.1703 CNC(=O)c1ccc(cc1I)C 240690a_100102657272_100009999607 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.1703 CNC(=O)c1ccc(cc1I)C 527a_100102657272_100009999607 [0,1,0,0,0,0|2,0,0]=3 1480 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [0,1,0,0,0,0|2,0,0]=3 1481 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [0,1,0,0,0,0|2,0,0]=3 1482 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [0,1,0,0,0,0|2,0,0]=3 1483 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [0,1,0,0,0,0|2,0,0]=3 1484 B12R1.1703 CNC(=O)c1ccc(cc1I)F 11a_106832991635_100000739341 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.1703 CNC(=O)c1ccc(cc1I)F 1626a_100102657272_100000739341 [0,1,0,0,0,0|2,0,0]=3 1486 B12R1.1703 CNC(=O)c1ccc(cc1I)F 240690a_100102657272_100000739341 [0,1,0,0,0,0|2,0,0]=3 1487 B12R1.1703 CNC(=O)c1ccc(cc1I)F 527a_100102657272_100000739341 [0,1,0,0,0,0|2,0,0]=3 1488 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [0,1,0,0,0,0|2,0,0]=3 1489 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [0,1,0,0,0,0|2,0,0]=3 1490 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [0,1,0,0,0,0|2,0,0]=3 1492 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [0,1,0,0,0,0|2,0,0]=3 1493 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [0,1,0,0,0,0|2,0,0]=3 1494 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [0,1,0,0,0,0|2,0,0]=3 1495 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [0,1,0,0,0,0|2,0,0]=3 1496 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [0,1,0,0,0,0|2,0,0]=3 1497 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [0,1,0,0,0,0|2,0,0]=3 1498 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [0,1,0,0,0,0|2,0,0]=3 1499 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [0,1,0,0,0,0|2,0,0]=3 1500 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [0,1,0,0,0,0|2,0,0]=3 1501 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])O 271570a_203496583355_100015641791 [0,1,0,0,0,0|1,0,0]=2 1502 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,1,0,0,0,0|0,0,0]=1 1503 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,1,0,0,0,0|0,0,0]=1 1504 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,1,0,0,0,0|0,0,0]=1 1505 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,1,0,0,0,0|0,0,0]=1 1506 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,1,0,0,0,0|0,0,0]=1 1507 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [0,1,0,0,0,0|1,0,0]=2 1508 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [0,1,0,0,0,0|1,0,0]=2 1509 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [0,1,0,0,0,0|1,0,0]=2 1510 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [0,1,0,0,0,0|1,0,0]=2 1511 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [0,1,0,0,0,0|1,0,0]=2 1512 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,1,0,0,0,0|0,0,0]=1 1513 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,1,0,0,0,0|0,0,0]=1 1514 B12R1.1703 COC(=O)c1ccc(nc1C)O 271570a_203496583355_100000692007 [0,1,0,0,0,0|1,0,0]=2 1515 B12R1.1703 COC(=O)c1ccc(nc1F)O 271570a_203496583355_100010189635 [0,1,0,0,0,0|1,0,0]=2 1516 B12R1.1703 COC(=O)c1ccc(nc1N)O 271570a_203496583355_100000142702 [0,1,0,0,0,0|1,0,0]=2 1517 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [0,1,0,0,0,0|2,0,0]=3 1518 B12R1.1703 COC(=O)c1ccc(nc1O)N 271570a_203496583355_100009865240 [0,1,0,0,0,0|2,0,0]=3 1519 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [0,1,0,0,0,0|1,0,0]=2 1520 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [0,1,0,0,0,0|1,0,0]=2 1521 B12R1.1703 COC(=O)c1cnc(cc1C)O 271570a_203496583355_100009871181 [0,1,0,0,0,0|1,0,0]=2 1522 B12R1.1703 COC(=O)c1cnc(cc1N)O 271570a_203496583355_100009862510 [0,1,0,0,0,0|1,0,0]=2 1523 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [0,1,0,0,0,0|2,0,0]=3 1524 B12R1.1703 COC(=O)c1cnc(nc1N)O 271570a_203496583355_200009866963 [0,1,0,0,0,0|2,0,0]=3 1525 B12R1.1703 COC(=O)c1cnc(nc1O)N 271570a_203496583355_100010277515 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.1703 COC(=O)c1n[nH]c(=O)cc1O 271570a_203496583355_200021564684 [0,1,0,0,0,0|2,0,1]=4 1527 B12R1.1703 COC(=O)c1ncc(cc1C)O 271570a_203496583355_100010178714 [0,1,0,0,0,0|1,0,0]=2 1528 B12R1.1703 COC(=O)c1ncc(cc1F)O 271570a_203496583355_100000695675 [0,1,0,0,0,0|1,0,0]=2 1529 B12R1.1703 COC(=O)c1ncc(cc1N)O 271570a_203496583355_100010090751 [0,1,0,0,0,0|1,0,0]=2 1530 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [0,1,0,0,0,0|2,0,0]=3 1531 B12R1.1703 COC(=O)c1ncc(cc1O)F 271570a_203496583355_100010189631 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [0,1,0,0,0,0|1,0,0]=2 1533 B12R1.1703 COC(=O)c1ncc(nc1O)C 271570a_203496583355_100000099855 [0,1,0,0,0,0|3,0,0]=4 1534 B12R1.1703 COC(C)c1ccc(cc1C)C 34a_100000246504_200000210301 [0,1,0,0,0,0|2,0,1]=4 1535 B12R1.1703 COC(C)c1ccc(cc1C)C 7a_100000246504_200000210301 [0,1,0,0,0,0|2,0,1]=4 1536 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 34a_100000743050_200000210301 [0,1,0,0,0,0|2,0,1]=4 1537 B12R1.1703 COC(C)c1ccc(cc1Cl)Cl 7a_100000743050_200000210301 [0,1,0,0,0,0|2,0,1]=4 1538 B12R1.1703 COC(C)c1ccc(cc1Cl)F 34a_200011245020_200000210301 [0,1,0,0,0,0|2,0,1]=4 1539 B12R1.1703 COC(C)c1ccc(cc1Cl)F 7a_200011245020_200000210301 [0,1,0,0,0,0|2,0,1]=4 1540 B12R1.1703 COC(C)c1ccc(cc1F)Cl 34a_200011805215_200000210301 [0,1,0,0,0,0|2,0,1]=4 1541 B12R1.1703 COC(C)c1ccc(cc1F)Cl 7a_200011805215_200000210301 [0,1,0,0,0,0|2,0,1]=4 1542 B12R1.1703 COC(C)c1ccc(cc1F)F 34a_200000246518_200000210301 [0,1,0,0,0,0|2,0,1]=4 1543 B12R1.1703 COC(C)c1ccc(cc1F)F 7a_200000246518_200000210301 [0,1,0,0,0,0|2,0,1]=4 1544 B12R1.1703 Cc1cc(ccc1C(=O)CF)Br 1458a_100000741311_100015361967 [0,1,0,0,0,0|3,0,0]=4 1545 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [0,1,0,0,0,0|3,0,0]=4 1546 B12R1.1703 Cc1cc(ccc1C(=O)CF)F 1458a_100000686989_100015361967 [0,1,0,0,0,0|3,0,0]=4 1547 B12R1.1703 Cc1cc(ccc1C(=O)CF)I 1458a_100010189873_100015361967 [0,1,0,0,0,0|3,0,0]=4 1548 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,1,0,0,0,0|2,0,0]=3 1549 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)CF 1458a_100000685072_100015361967 [0,1,0,0,0,0|3,0,0]=4 1550 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CF 1458a_100000211164_100015361967 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 34a_100000246504_200025704644 [0,1,0,0,0,0|2,0,1]=4 1552 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 7a_100000246504_200025704644 [0,1,0,0,0,0|2,0,1]=4 1553 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)CF 1458a_100000766932_100015361967 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.1703 Cc1ccc(c(c1)F)C(=O)CF 1458a_100000766033_100015361967 [0,1,0,0,0,0|3,0,0]=4 1555 B12R1.1703 Cc1ccc(c(c1)I)C(=O)CF 1458a_100009999607_100015361967 [0,1,0,0,0,0|3,0,0]=4 1556 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN 271570a_203496583355_200012340525 [0,1,0,0,0,0|3,0,0]=4 1558 B12R1.1703 NNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203923 [0,1,0,0,0,0|3,0,0]=4 1559 B12R1.1703 O=C(CF)c1ccc(cc1Br)Br 1458a_100000762965_100015361967 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [0,1,0,0,0,0|3,0,0]=4 1561 B12R1.1703 O=C(CF)c1ccc(cc1Br)F 1458a_100000212304_100015361967 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.1703 O=C(CF)c1ccc(cc1Br)I 1458a_100012360512_100015361967 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Br 1458a_100000741628_100015361967 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.1703 O=C(CF)c1ccc(cc1Cl)F 1458a_100000211397_100015361967 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.1703 O=C(CF)c1ccc(cc1Cl)I 1458a_100000751301_100015361967 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,1,0,0,0,0|2,0,0]=3 1569 B12R1.1703 O=C(CF)c1ccc(cc1F)Br 1458a_100000214689_100015361967 [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [0,1,0,0,0,0|3,0,0]=4 1571 B12R1.1703 O=C(CF)c1ccc(cc1F)F 1458a_100000211022_100015361967 [0,1,0,0,0,0|3,0,0]=4 1572 B12R1.1703 O=C(CF)c1ccc(cc1F)I 1458a_100000037189_100015361967 [0,1,0,0,0,0|3,0,0]=4 1573 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.1703 O=C(CF)c1ccc(cc1I)Br 1458a_100000751167_100015361967 [0,1,0,0,0,0|3,0,0]=4 1575 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [0,1,0,0,0,0|3,0,0]=4 1576 B12R1.1703 O=C(CF)c1ccc(cc1I)F 1458a_100000739341_100015361967 [0,1,0,0,0,0|3,0,0]=4 1577 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [0,1,0,0,0,0|3,0,0]=4 1579 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [0,1,0,0,0,0|3,0,0]=4 1580 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [0,1,0,0,0,0|3,0,0]=4 1581 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,1,0,0,0,0|2,0,0]=3 1582 B12R2.290 NC1(CC1)c2ccc(cc2)O 271570a_203496583355_100000742681 [0,0,0,1,0,0|2,0,1]=4 1583 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [0,0,0,1,0,0|3,0,0]=4 1584 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,0,0,1,0,0|3,0,0]=4 1585 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,0,0,1,0,0|3,0,0]=4 1586 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,0,0,1,0,0|3,0,0]=4 1587 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,0,0,1,0,0|3,0,0]=4 1588 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [0,0,0,1,0,0|2,0,1]=4 1589 B12R2.612 Nc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100011934401 [0,0,0,1,0,0|3,0,0]=4 1590 B12R2.612 Nc1noc2c1ccc(c2)O 271570a_203496583355_100012356334 [0,0,0,1,0,0|3,0,0]=4 1591 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,0,0,1,0,0|1,0,1]=3 1592 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,0,0,1,0,0|1,0,0]=2 1593 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,0,0,1,0,0|2,0,0]=3 1594 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,0,0,1,0,0|1,0,0]=2 1595 B12R2.612 O=C1NCc2c1ccc(n2)O 271570a_203496583355_200009864240 [0,0,0,1,0,0|2,0,0]=3 1596 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,0,0,1,0,0|0,0,0]=1 1597 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,0,0,1,0,0|2,0,0]=3 1598 B12R2.612 O=c1[nH][nH]c2c1cnc(c2)O 271570a_203496583355_100016039622 [0,0,0,1,0,0|3,0,0]=4 1599 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,0,0,1,0,0|1,0,2]=4 1600 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [0,0,0,1,0,0|2,0,1]=4 1601 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [0,0,0,1,0,0|2,0,1]=4 1602 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,0,0,0,1,0|2,0,0]=3 1603 B10R1.14 CNC(=O)c1ccc(o1)O 271570a_203496583355_100000159859 [0,0,0,0,1,0|2,0,0]=3 1604 B10R1.14 CNC(=O)c1ccc(s1)O 271570a_203496583355_200000155069 [0,0,0,0,1,0|2,0,0]=3 1605 B10R1.14 CNC(=O)c1csc(n1)O 271570a_203496583355_100010260535 [0,0,0,0,1,0|3,0,0]=4 1606 B10R1.14 COC(=O)c1c[nH]c(c1)O 271570a_203496583355_100009840242 [0,0,0,0,1,0|1,0,0]=2 1607 B10R1.14 COC(=O)c1cc([nH]n1)O 271570a_203496583355_100010760819 [0,0,0,0,1,0|2,0,0]=3 1608 B10R1.14 COC(=O)c1cc(co1)O 271570a_203496583355_100009992624 [0,0,0,0,1,0|1,0,0]=2 1609 B10R1.14 COC(=O)c1cc(cs1)O 271570a_203496583355_100009815473 [0,0,0,0,1,0|1,0,0]=2 1610 B10R1.14 COC(=O)c1ccc([nH]1)O 271570a_203496583355_100000687774 [0,0,0,0,1,0|1,0,0]=2 1611 B10R1.14 COC(=O)c1ccc(o1)O 271570a_203496583355_100000148852 [0,0,0,0,1,0|1,0,0]=2 1612 B10R1.14 COC(=O)c1ccc(s1)O 271570a_203496583355_100000148107 [0,0,0,0,1,0|1,0,0]=2 1613 B10R1.14 COC(=O)c1cnc([nH]1)O 271570a_203496583355_106744473586 [0,0,0,0,1,0|2,0,0]=3 1614 B10R1.14 COC(=O)c1cnc(s1)O 271570a_203496583355_100000738003 [0,0,0,0,1,0|2,0,0]=3 1615 B10R1.14 COC(=O)c1coc(n1)O 271570a_203496583355_100010235569 [0,0,0,0,1,0|2,0,0]=3 1616 B10R1.14 COC(=O)c1csc(c1)O 271570a_203496583355_100000692058 [0,0,0,0,1,0|1,0,0]=2 1617 B10R1.14 COC(=O)c1csc(n1)O 271570a_203496583355_100009816811 [0,0,0,0,1,0|2,0,0]=3 1618 B10R1.14 COC(=O)c1nc(cs1)O 271570a_203496583355_100012360158 [0,0,0,0,1,0|2,0,0]=3 1619 B10R1.14 COC(=O)c1nc(n[nH]1)O 271570a_203496583355_100010173354 [0,0,0,0,1,0|3,0,0]=4 1620 B10R1.14 COC(=O)c1ncc(s1)O 271570a_203496583355_100010191244 [0,0,0,0,1,0|2,0,0]=3 1621 B10R1.14 NNC(=O)c1ccc(o1)O 271570a_203496583355_100000186364 [0,0,0,0,1,0|3,0,0]=4 1622 B10R1.14 NNC(=O)c1ccc(s1)O 271570a_203496583355_100000180196 [0,0,0,0,1,0|3,0,0]=4 1623 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [0,0,0,0,0,1|2,0,1]=4 1624 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [0,0,0,0,0,1|2,0,1]=4 1625 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [0,0,0,0,0,1|2,0,1]=4 1626 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [0,0,0,0,0,1|2,0,1]=4 1627 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [0,0,0,0,0,1|2,0,1]=4 1628 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [0,0,0,0,0,1|2,0,1]=4 1629 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [0,0,0,0,0,1|2,0,1]=4 1630 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [0,0,0,0,0,1|2,0,1]=4 1631 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [0,0,0,0,0,1|2,0,1]=4 1632 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [0,0,0,0,0,1|2,0,1]=4 1633 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [0,0,0,0,0,1|2,0,1]=4 1634 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [0,0,0,0,0,1|2,0,1]=4 1635 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [0,0,0,0,0,1|2,0,1]=4 1636 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [0,0,0,0,0,1|2,0,1]=4 1637 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [0,0,0,0,0,1|2,0,1]=4 1638 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [0,0,0,0,0,1|2,0,1]=4 1639 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [0,0,0,0,0,1|2,0,1]=4 1640 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [0,0,0,0,0,1|2,0,1]=4 1641 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [0,0,0,0,0,1|2,0,1]=4 1642 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [0,0,0,0,0,1|2,0,1]=4 1643 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [0,0,0,0,0,1|1,0,1]=3 1644 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [0,0,0,0,0,1|2,0,1]=4 1645 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [0,0,0,0,0,1|2,0,1]=4 1646 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,0,0,0,0,1|2,0,1]=4 1647 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,0,0,0,0,1|2,0,1]=4 1648 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [0,0,0,0,0,1|2,0,0]=3 1649 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [0,0,0,0,0,1|2,0,0]=3 1650 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [0,0,0,0,0,1|2,0,0]=3 1651 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [0,0,0,0,0,1|2,0,0]=3 1652 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [0,0,0,0,0,1|2,0,0]=3 1653 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [0,0,0,0,0,1|2,0,0]=3 1654 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [0,0,0,0,0,1|2,0,0]=3 1655 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [0,0,0,0,0,1|2,0,0]=3 1656 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [0,0,0,0,0,1|2,0,0]=3 1657 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [0,0,0,0,0,1|2,0,0]=3 1658 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,0,0,0,0,1|1,0,0]=2 1659 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100000210414_100000702658 [0,0,0,0,0,1|3,0,0]=4 1660 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210202 [0,0,0,0,0,1|3,0,0]=4 1661 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100000210414_100000691093 [0,0,0,0,0,1|3,0,0]=4 1662 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210202 [0,0,0,0,0,1|3,0,0]=4 1663 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000210414_100012066911 [0,0,0,0,0,1|3,0,0]=4 1664 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210202 [0,0,0,0,0,1|3,0,0]=4 1665 B12R1.49 CCC(=O)Cc1ccc(cn1)F 1458a_100000210414_100000703193 [0,0,0,0,0,1|3,0,0]=4 1666 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100000210414_100009831999 [0,0,0,0,0,1|3,0,0]=4 1667 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210202 [0,0,0,0,0,1|3,0,0]=4 1668 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000210414_100016987292 [0,0,0,0,0,1|3,0,0]=4 1669 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210202 [0,0,0,0,0,1|3,0,0]=4 1670 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210202 [0,0,0,0,0,1|3,0,0]=4 1671 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000210414_100000735431 [0,0,0,0,0,1|3,0,0]=4 1672 B12R1.49 CCC(=O)Cc1ccc(nc1)F 1458a_100000210414_100009820150 [0,0,0,0,0,1|3,0,0]=4 1673 B12R1.49 CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210202 [0,0,0,0,0,1|2,0,1]=4 1674 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [0,0,0,0,0,1|2,0,0]=3 1675 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [0,0,0,0,0,1|2,0,0]=3 1676 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [0,0,0,0,0,1|2,0,0]=3 1677 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [0,0,0,0,0,1|2,0,0]=3 1678 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [0,0,0,0,0,1|2,0,0]=3 1679 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [0,0,0,0,0,1|2,0,0]=3 1680 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [0,0,0,0,0,1|2,0,0]=3 1681 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [0,0,0,0,0,1|2,0,0]=3 1682 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [0,0,0,0,0,1|2,0,0]=3 1683 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [0,0,0,0,0,1|2,0,0]=3 1684 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [0,0,0,0,0,1|2,0,0]=3 1685 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [0,0,0,0,0,1|2,0,0]=3 1686 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [0,0,0,0,0,1|2,0,0]=3 1687 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [0,0,0,0,0,1|2,0,0]=3 1688 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [0,0,0,0,0,1|2,0,0]=3 1689 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [0,0,0,0,0,1|2,0,0]=3 1690 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [0,0,0,0,0,1|2,0,0]=3 1691 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [0,0,0,0,0,1|2,0,0]=3 1692 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [0,0,0,0,0,1|2,0,0]=3 1693 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [0,0,0,0,0,1|2,0,0]=3 1694 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,0,0,0,0,1|1,0,0]=2 1695 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,0,0,0,0,1|1,0,0]=2 1696 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [0,0,0,0,0,1|2,0,1]=4 1697 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [0,0,0,0,0,1|2,0,1]=4 1698 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [0,0,0,0,0,1|3,0,0]=4 1699 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [0,0,0,0,0,1|3,0,0]=4 1700 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [0,0,0,0,0,1|3,0,0]=4 1701 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [0,0,0,0,0,1|3,0,0]=4 1702 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [0,0,0,0,0,1|2,0,0]=3 1703 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [0,0,0,0,0,1|2,0,0]=3 1704 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [0,0,0,0,0,1|2,0,0]=3 1705 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [0,0,0,0,0,1|2,0,0]=3 1706 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [0,0,0,0,0,1|2,0,0]=3 1707 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [0,0,0,0,0,1|2,0,0]=3 1708 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [0,0,0,0,0,1|2,0,0]=3 1709 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [0,0,0,0,0,1|2,0,0]=3 1710 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [0,0,0,0,0,1|2,0,0]=3 1711 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [0,0,0,0,0,1|2,0,0]=3 1712 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [0,0,0,0,0,1|2,0,0]=3 1713 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [0,0,0,0,0,1|2,0,0]=3 1714 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [0,0,0,0,0,1|2,0,0]=3 1715 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [0,0,0,0,0,1|2,0,0]=3 1716 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [0,0,0,0,0,1|2,0,0]=3 1717 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [0,0,0,0,0,1|2,0,0]=3 1718 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [0,0,0,0,0,1|2,0,0]=3 1719 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,0,0,0,0,1|1,0,0]=2 1720 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,0,0,0,0,1|1,0,0]=2 1721 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,0,0,0,0,1|1,0,0]=2 1722 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,0,0,0,0,1|1,0,0]=2 1723 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 11a_106832991635_100020629044 [0,0,0,0,0,1|3,0,0]=4 1724 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 240690a_100102657272_100020629044 [0,0,0,0,0,1|3,0,0]=4 1725 B12R1.49 CNC(=O)Cc1ccc(cn1)C 11a_106832991635_100025705728 [0,0,0,0,0,1|3,0,0]=4 1726 B12R1.49 CNC(=O)Cc1ccc(cn1)C 1626a_100102657272_100025705728 [0,0,0,0,0,1|3,0,0]=4 1727 B12R1.49 CNC(=O)Cc1ccc(cn1)C 240690a_100102657272_100025705728 [0,0,0,0,0,1|3,0,0]=4 1728 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 11a_106832991635_100000728320 [0,0,0,0,0,1|3,0,0]=4 1729 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 1626a_100102657272_100000728320 [0,0,0,0,0,1|3,0,0]=4 1730 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 240690a_100102657272_100000728320 [0,0,0,0,0,1|3,0,0]=4 1731 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 527a_100102657272_100000728320 [0,0,0,0,0,1|3,0,0]=4 1732 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 11a_106832991635_100010067268 [0,0,0,0,0,1|3,0,0]=4 1733 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 240690a_100102657272_100010067268 [0,0,0,0,0,1|3,0,0]=4 1734 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 527a_100102657272_100010067268 [0,0,0,0,0,1|3,0,0]=4 1735 B12R1.49 CNC(=O)Cc1ccc(nc1)C 11a_106832991635_100000740413 [0,0,0,0,0,1|3,0,0]=4 1736 B12R1.49 CNC(=O)Cc1ccc(nc1)C 1626a_100102657272_100000740413 [0,0,0,0,0,1|3,0,0]=4 1737 B12R1.49 CNC(=O)Cc1ccc(nc1)C 240690a_100102657272_100000740413 [0,0,0,0,0,1|3,0,0]=4 1738 B12R1.49 CNC(=O)Cc1ccc(nc1)C 527a_100102657272_100000740413 [0,0,0,0,0,1|3,0,0]=4 1739 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 11a_106832991635_100000061944 [0,0,0,0,0,1|3,0,0]=4 1740 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 1626a_100102657272_100000061944 [0,0,0,0,0,1|3,0,0]=4 1741 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 240690a_100102657272_100000061944 [0,0,0,0,0,1|3,0,0]=4 1742 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 527a_100102657272_100000061944 [0,0,0,0,0,1|3,0,0]=4 1743 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 11a_106832991635_200000238563 [0,0,0,0,0,1|2,0,1]=4 1744 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 1626a_100102657272_200000238563 [0,0,0,0,0,1|2,0,1]=4 1745 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 240690a_100102657272_200000238563 [0,0,0,0,0,1|2,0,1]=4 1746 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 527a_100102657272_200000238563 [0,0,0,0,0,1|2,0,1]=4 1747 B12R1.49 CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102657272 [0,0,0,0,0,1|2,0,0]=3 1748 B12R1.49 CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100102657272 [0,0,0,0,0,1|2,0,0]=3 1749 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102657272 [0,0,0,0,0,1|2,0,0]=3 1750 B12R1.49 CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102657272 [0,0,0,0,0,1|2,0,0]=3 1751 B12R1.49 CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102657272 [0,0,0,0,0,1|2,0,0]=3 1752 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,0,0,0,0,1|1,0,0]=2 1753 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,0,0,0,0,1|2,0,1]=4 1754 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,0,0,0,0,1|2,0,1]=4 1755 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,0,0,0,0,1|2,0,1]=4 1756 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,0,0,0,0,1|0,0,0]=1 1757 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [0,0,0,0,0,1|1,0,0]=2 1758 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [0,0,0,0,0,1|1,0,0]=2 1759 B12R1.49 COC(=O)Cc1ncc(cn1)O 271570a_203496583355_100010080487 [0,0,0,0,0,1|2,0,0]=3 1760 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,0,0,0,0,1|0,0,0]=1 1761 B12R1.49 COC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000188976 [0,0,0,0,0,1|1,0,0]=2 1762 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [0,0,0,0,0,1|2,0,1]=4 1763 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [0,0,0,0,0,1|2,0,1]=4 1764 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100000752885_100009879195 [0,0,0,0,0,1|2,0,1]=4 1765 B12R1.49 COC(C)Sc1ccc(cc1)Br 62a_100009879195_100000752885 [0,0,0,0,0,1|2,0,1]=4 1766 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100000186775_100009879195 [0,0,0,0,0,1|2,0,1]=4 1767 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100009879195_100000186775 [0,0,0,0,0,1|2,0,1]=4 1768 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100000755918_100009879195 [0,0,0,0,0,1|2,0,1]=4 1769 B12R1.49 COC(C)Sc1ccc(cc1)Cl 62a_100009879195_100000755918 [0,0,0,0,0,1|2,0,1]=4 1770 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100000211213_100009879195 [0,0,0,0,0,1|2,0,1]=4 1771 B12R1.49 COC(C)Sc1ccc(cc1)F 62a_100009879195_100000211213 [0,0,0,0,0,1|2,0,1]=4 1772 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100000185761_100009879195 [0,0,0,0,0,1|2,0,1]=4 1773 B12R1.49 COC(C)Sc1ccc(cc1)N 62a_100009879195_100000185761 [0,0,0,0,0,1|2,0,1]=4 1774 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [0,0,0,0,0,1|1,0,1]=3 1775 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100000685995_100009879195 [0,0,0,0,0,1|2,0,1]=4 1776 B12R1.49 COC(C)Sc1ccc(cn1)O 62a_100009879195_100000744096 [0,0,0,0,0,1|2,0,1]=4 1777 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [0,0,0,0,0,1|3,0,0]=4 1778 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [0,0,0,0,0,1|3,0,0]=4 1779 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [0,0,0,0,0,1|3,0,0]=4 1780 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [0,0,0,0,0,1|3,0,0]=4 1781 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [0,0,0,0,0,1|3,0,0]=4 1782 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [0,0,0,0,0,1|3,0,0]=4 1783 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [0,0,0,0,0,1|3,0,0]=4 1784 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [0,0,0,0,0,1|3,0,0]=4 1785 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,0,0,0,0,1|2,0,0]=3 1786 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [0,0,0,0,0,1|3,0,0]=4 1787 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [0,0,0,0,0,1|3,0,0]=4 1788 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [0,0,0,0,0,1|3,0,0]=4 1789 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [0,0,0,0,0,1|3,0,0]=4 1790 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [0,0,0,0,0,1|3,0,0]=4 1791 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [0,0,0,0,0,1|3,0,0]=4 1792 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [0,0,0,0,0,1|3,0,0]=4 1793 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [0,0,0,0,0,1|3,0,0]=4 1794 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [0,0,0,0,0,1|3,0,0]=4 1795 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [0,0,0,0,0,1|3,0,0]=4 1796 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [0,0,0,0,0,1|3,0,0]=4 1797 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [0,0,0,0,0,1|3,0,0]=4 1798 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,0,0,0,0,1|2,0,0]=3 1799 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [2,0,0,0,0,0|1,0,1]=4 1800 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [2,0,0,0,0,0|1,0,1]=4 1801 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [2,0,0,0,0,0|1,0,1]=4 1802 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [2,0,0,0,0,0|1,0,1]=4 1803 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [2,0,0,0,0,0|1,0,1]=4 1804 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [2,0,0,0,0,0|0,0,1]=3 1805 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [2,0,0,0,0,0|1,0,1]=4 1806 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [2,0,0,0,0,0|0,0,1]=3 1807 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [2,0,0,0,0,0|1,0,1]=4 1808 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [2,0,0,0,0,0|1,0,1]=4 1809 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [2,0,0,0,0,0|2,0,0]=4 1810 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [2,0,0,0,0,0|2,0,0]=4 1811 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [2,0,0,0,0,0|2,0,0]=4 1812 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [2,0,0,0,0,0|2,0,0]=4 1813 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [2,0,0,0,0,0|2,0,0]=4 1814 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [2,0,0,0,0,0|2,0,0]=4 1815 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [2,0,0,0,0,0|2,0,0]=4 1816 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [2,0,0,0,0,0|1,0,0]=3 1817 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [2,0,0,0,0,0|1,0,0]=3 1818 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [2,0,0,0,0,0|2,0,0]=4 1819 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [2,0,0,0,0,0|2,0,0]=4 1820 B9R1.1 COc1ccc(=O)[nH]c1 34a_100000075641_200000210301 [2,0,0,0,0,0|1,0,1]=4 1821 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [2,0,0,0,0,0|1,0,0]=3 1822 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [2,0,0,0,0,0|1,0,0]=3 1823 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [2,0,0,0,0,0|1,0,0]=3 1824 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [2,0,0,0,0,0|1,0,0]=3 1825 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [2,0,0,0,0,0|1,0,0]=3 1826 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [2,0,0,0,0,0|1,0,0]=3 1827 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [2,0,0,0,0,0|1,0,0]=3 1828 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [2,0,0,0,0,0|1,0,0]=3 1829 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [2,0,0,0,0,0|1,0,0]=3 1830 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [2,0,0,0,0,0|1,0,0]=3 1831 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [2,0,0,0,0,0|0,0,0]=2 1832 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [2,0,0,0,0,0|2,0,0]=4 1833 B9R1.1 COc1ccc(cn1)Cl 34a_100011215309_200000210301 [2,0,0,0,0,0|2,0,0]=4 1834 B9R1.1 COc1ccc(cn1)F 34a_100000742473_200000210301 [2,0,0,0,0,0|2,0,0]=4 1835 B9R1.1 COc1ccc(cn1)N 34a_100000729260_200000210301 [2,0,0,0,0,0|2,0,0]=4 1836 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [2,0,0,0,0,0|1,0,0]=3 1837 B9R1.1 COc1ccc(nc1)Br 34a_100000685995_200000210301 [2,0,0,0,0,0|2,0,0]=4 1838 B9R1.1 COc1ccc(nc1)Br 7a_100000685995_200000210301 [2,0,0,0,0,0|2,0,0]=4 1839 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [2,0,0,0,0,0|2,0,0]=4 1840 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [2,0,0,0,0,0|2,0,0]=4 1841 B9R1.1 COc1ccc(nc1)Cl 34a_100000744096_200000210301 [2,0,0,0,0,0|2,0,0]=4 1842 B9R1.1 COc1ccc(nc1)Cl 7a_100000744096_200000210301 [2,0,0,0,0,0|2,0,0]=4 1843 B9R1.1 COc1ccc(nc1)F 34a_100000688820_200000210301 [2,0,0,0,0,0|2,0,0]=4 1844 B9R1.1 COc1ccc(nc1)F 7a_100000688820_200000210301 [2,0,0,0,0,0|2,0,0]=4 1845 B9R1.1 COc1ccc(nc1)I 34a_100000687607_200000210301 [2,0,0,0,0,0|2,0,0]=4 1846 B9R1.1 COc1ccc(nc1)I 7a_100000687607_200000210301 [2,0,0,0,0,0|2,0,0]=4 1847 B9R1.1 COc1ccc(nc1)N 34a_100015188713_200000210301 [2,0,0,0,0,0|2,0,0]=4 1848 B9R1.1 COc1ccc(nc1)N 7a_100015188713_200000210301 [2,0,0,0,0,0|2,0,0]=4 1849 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [2,0,0,0,0,0|1,0,0]=3 1850 B9R1.1 COc1ccc(nn1)O 271570a_203496583355_100009819040 [2,0,0,0,0,0|2,0,0]=4 1851 B9R1.1 COc1cnc(cn1)O 271570a_203496583355_100011998698 [2,0,0,0,0,0|2,0,0]=4 1852 B9R1.1 COc1cnc(nc1)O 271570a_203496583355_100000069167 [2,0,0,0,0,0|2,0,0]=4 1853 B9R1.1 COc1ncc(cn1)O 271570a_203496583355_100000686852 [2,0,0,0,0,0|2,0,0]=4 1854 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [2,0,0,0,0,0|1,1,0]=4 1855 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [2,0,0,0,0,0|1,1,0]=4 1856 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [2,0,0,0,0,0|1,1,0]=4 1857 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [2,0,0,0,0,0|1,1,0]=4 1858 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [2,0,0,0,0,0|1,1,0]=4 1859 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [2,0,0,0,0,0|1,1,0]=4 1860 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [2,0,0,0,0,0|1,1,0]=4 1861 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [2,0,0,0,0,0|1,1,0]=4 1862 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [2,0,0,0,0,0|1,1,0]=4 1863 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [2,0,0,0,0,0|1,1,0]=4 1864 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [2,0,0,0,0,0|0,1,0]=3 1865 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [2,0,0,0,0,0|0,1,0]=3 1866 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [2,0,0,0,0,0|1,1,0]=4 1867 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [2,0,0,0,0,0|1,1,0]=4 1868 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [2,0,0,0,0,0|1,1,0]=4 1869 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [2,0,0,0,0,0|1,1,0]=4 1870 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [2,0,0,0,0,0|2,0,0]=4 1871 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [2,0,0,0,0,0|1,0,0]=3 1872 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [2,0,0,0,0,0|1,0,0]=3 1873 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [2,0,0,0,0,0|1,1,0]=4 1874 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [2,0,0,0,0,0|1,1,0]=4 1875 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [2,0,0,0,0,0|2,0,0]=4 1876 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [2,0,0,0,0,0|2,0,0]=4 1877 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [2,0,0,0,0,0|2,0,0]=4 1878 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [2,0,0,0,0,0|1,0,1]=4 1879 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [2,0,0,0,0,0|1,0,1]=4 1880 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [2,0,0,0,0,0|2,0,0]=4 1881 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [2,0,0,0,0,0|0,0,0]=2 1882 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [2,0,0,0,0,0|1,0,0]=3 1883 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [2,0,0,0,0,0|1,0,0]=3 1884 B9R1.1 O=Cc1ccc(nn1)O 271570a_203496583355_100000044651 [2,0,0,0,0,0|2,0,0]=4 1885 B9R1.1 O=Cc1cnc(cn1)O 271570a_203496583355_100012001714 [2,0,0,0,0,0|2,0,0]=4 1886 B9R1.1 O=Cc1cnc(nc1)O 271570a_203496583355_100000070856 [2,0,0,0,0,0|2,0,0]=4 1887 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [2,0,0,0,0,0|0,0,1]=3 1888 B9R1.1 OCc1ccc(cn1)O 271570a_203496583355_100000754261 [2,0,0,0,0,0|1,0,1]=4 1889 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [2,0,0,0,0,0|1,0,1]=4 1890 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [2,0,0,0,0,0|1,0,1]=4 1891 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [2,0,0,0,0,0|2,0,0]=4 1892 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [2,0,0,0,0,0|2,0,0]=4 1893 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [2,0,0,0,0,0|2,0,0]=4 1894 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [2,0,0,0,0,0|2,0,0]=4 1895 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [2,0,0,0,0,0|2,0,0]=4 1896 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [2,0,0,0,0,0|2,0,0]=4 1897 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [2,0,0,0,0,0|1,0,0]=3 1898 B9R1.1 [13CH3]Oc1ccc(=O)[nH]c1 34a_100000075641_200025704644 [2,0,0,0,0,0|1,0,1]=4 1899 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [2,0,0,0,0,0|1,0,0]=3 1900 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [2,0,0,0,0,0|1,0,0]=3 1901 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [2,0,0,0,0,0|1,0,0]=3 1902 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [2,0,0,0,0,0|1,0,0]=3 1903 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [2,0,0,0,0,0|1,0,0]=3 1904 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [2,0,0,0,0,0|1,0,0]=3 1905 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [2,0,0,0,0,0|1,0,0]=3 1906 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [2,0,0,0,0,0|1,0,0]=3 1907 B9R1.1 [13CH3]Oc1ccc(cn1)Cl 34a_100011215309_200025704644 [2,0,0,0,0,0|2,0,0]=4 1908 B9R1.1 [13CH3]Oc1ccc(cn1)F 34a_100000742473_200025704644 [2,0,0,0,0,0|2,0,0]=4 1909 B9R1.1 [13CH3]Oc1ccc(cn1)N 34a_100000729260_200025704644 [2,0,0,0,0,0|2,0,0]=4 1910 B9R1.1 [13CH3]Oc1ccc(nc1)Br 34a_100000685995_200025704644 [2,0,0,0,0,0|2,0,0]=4 1911 B9R1.1 [13CH3]Oc1ccc(nc1)Br 7a_100000685995_200025704644 [2,0,0,0,0,0|2,0,0]=4 1912 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 34a_100000744096_200025704644 [2,0,0,0,0,0|2,0,0]=4 1913 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 7a_100000744096_200025704644 [2,0,0,0,0,0|2,0,0]=4 1914 B9R1.1 [13CH3]Oc1ccc(nc1)F 34a_100000688820_200025704644 [2,0,0,0,0,0|2,0,0]=4 1915 B9R1.1 [13CH3]Oc1ccc(nc1)F 7a_100000688820_200025704644 [2,0,0,0,0,0|2,0,0]=4 1916 B9R1.1 [13CH3]Oc1ccc(nc1)I 34a_100000687607_200025704644 [2,0,0,0,0,0|2,0,0]=4 1917 B9R1.1 [13CH3]Oc1ccc(nc1)I 7a_100000687607_200025704644 [2,0,0,0,0,0|2,0,0]=4 1918 B9R1.1 [13CH3]Oc1ccc(nc1)N 34a_100015188713_200025704644 [2,0,0,0,0,0|2,0,0]=4 1919 B9R1.1 [13CH3]Oc1ccc(nc1)N 7a_100015188713_200025704644 [2,0,0,0,0,0|2,0,0]=4 1920 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [2,0,0,0,0,0|1,1,0]=4 1921 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [2,0,0,0,0,0|1,1,0]=4 1922 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [2,0,0,0,0,0|1,1,0]=4 1923 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [2,0,0,0,0,0|1,1,0]=4 1924 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [2,0,0,0,0,0|1,1,0]=4 1925 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [2,0,0,0,0,0|1,1,0]=4 1926 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [2,0,0,0,0,0|1,1,0]=4 1927 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [2,0,0,0,0,0|1,1,0]=4 1928 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [2,0,0,0,0,0|0,1,0]=3 1929 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [2,0,0,0,0,0|1,1,0]=4 1930 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [2,0,0,0,0,0|1,1,0]=4 1931 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [2,0,0,0,0,0|1,0,1]=4 1932 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [2,0,0,0,0,0|1,0,0]=3 1933 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [2,0,0,0,0,0|2,0,0]=4 1934 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [2,0,0,0,0,0|2,0,0]=4 1935 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [2,0,0,0,0,0|2,0,0]=4 1936 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [2,0,0,0,0,0|2,0,0]=4 1937 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1938 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1939 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [2,0,0,0,0,0|2,0,0]=4 1940 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [2,0,0,0,0,0|2,0,0]=4 1941 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|1,0,1]=4 1942 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|1,0,1]=4 1943 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|1,0,1]=4 1944 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|1,0,1]=4 1945 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|1,0,1]=4 1946 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|1,0,1]=4 1947 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|1,0,1]=4 1948 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|0,0,1]=3 1949 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|0,0,1]=3 1950 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|0,0,1]=3 1951 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [2,0,0,0,0,0|1,0,1]=4 1952 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [2,0,0,0,0,0|1,0,1]=4 1953 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|0,1,1]=4 1954 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|0,1,1]=4 1955 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|1,0,1]=4 1956 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|1,0,1]=4 1957 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|0,0,1]=3 1958 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|0,0,1]=3 1959 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|0,1,1]=4 1960 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|0,1,1]=4 1961 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [2,0,0,0,0,0|1,0,0]=3 1962 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [2,0,0,0,0,0|2,0,0]=4 1963 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [2,0,0,0,0,0|2,0,0]=4 1964 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [2,0,0,0,0,0|2,0,0]=4 1965 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [2,0,0,0,0,0|0,0,0]=2 1966 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1967 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1968 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1969 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1970 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1971 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1972 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [2,0,0,0,0,0|0,0,0]=2 1973 B11R1.1 CCCCc1ccc(cc1)O 271570a_100020621405_100000185759 [1,1,0,0,0,0|1,0,1]=4 1974 B11R1.1 CCCCc1ccc(cc1)O 271570a_203496583355_100011215597 [1,1,0,0,0,0|1,0,1]=4 1975 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [1,1,0,0,0,0|1,0,1]=4 1976 B11R1.1 CCCOc1ccc(cc1)O 271570a_203496583355_100000169948 [1,1,0,0,0,0|1,0,1]=4 1977 B11R1.1 CCCSc1ccc(cc1)O 271570a_203496583355_200009811899 [1,1,0,0,0,0|1,0,1]=4 1978 B11R1.1 CCCSc1ccc(cc1)O 62a_100000210303_100000185759 [1,1,0,0,0,0|1,0,1]=4 1979 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [1,1,0,0,0,0|1,0,1]=4 1980 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [1,1,0,0,0,0|1,0,1]=4 1981 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [1,1,0,0,0,0|1,0,1]=4 1982 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [1,1,0,0,0,0|1,0,1]=4 1983 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [1,1,0,0,0,0|1,0,1]=4 1984 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [1,1,0,0,0,0|1,0,1]=4 1985 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [1,1,0,0,0,0|1,0,1]=4 1986 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [1,1,0,0,0,0|1,0,1]=4 1987 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [1,1,0,0,0,0|1,0,1]=4 1988 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [1,1,0,0,0,0|1,0,1]=4 1989 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [1,1,0,0,0,0|1,0,1]=4 1990 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [1,1,0,0,0,0|1,0,1]=4 1991 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [1,1,0,0,0,0|1,0,1]=4 1992 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [1,1,0,0,0,0|1,0,1]=4 1993 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [1,1,0,0,0,0|1,0,1]=4 1994 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [1,1,0,0,0,0|1,0,1]=4 1995 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [1,1,0,0,0,0|1,0,1]=4 1996 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [1,1,0,0,0,0|0,0,1]=3 1997 B11R1.1 CCOCc1ccc(nc1)O 271570a_203496583355_100011206209 [1,1,0,0,0,0|1,0,1]=4 1998 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [1,1,0,0,0,0|1,0,1]=4 1999 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [1,1,0,0,0,0|1,0,1]=4 2000 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [1,1,0,0,0,0|1,0,1]=4 2001 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [1,1,0,0,0,0|1,0,1]=4 2002 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [1,1,0,0,0,0|0,0,0]=2 2003 B11R1.1 COCCc1ccc(cc1)Br 34a_100000766406_200000210301 [1,1,0,0,0,0|1,0,1]=4 2004 B11R1.1 COCCc1ccc(cc1)Br 34a_100138415774_100011740612 [1,1,0,0,0,0|1,0,1]=4 2005 B11R1.1 COCCc1ccc(cc1)Br 7a_100000766406_200000210301 [1,1,0,0,0,0|1,0,1]=4 2006 B11R1.1 COCCc1ccc(cc1)C 34a_100000756670_200000210301 [1,1,0,0,0,0|1,0,1]=4 2007 B11R1.1 COCCc1ccc(cc1)C 34a_100138415774_100011713686 [1,1,0,0,0,0|1,0,1]=4 2008 B11R1.1 COCCc1ccc(cc1)C 7a_100000756670_200000210301 [1,1,0,0,0,0|1,0,1]=4 2009 B11R1.1 COCCc1ccc(cc1)Cl 34a_100011219627_200000210301 [1,1,0,0,0,0|1,0,1]=4 2010 B11R1.1 COCCc1ccc(cc1)Cl 34a_100138415774_100011713675 [1,1,0,0,0,0|1,0,1]=4 2011 B11R1.1 COCCc1ccc(cc1)Cl 7a_100011219627_200000210301 [1,1,0,0,0,0|1,0,1]=4 2012 B11R1.1 COCCc1ccc(cc1)F 34a_100000754732_200000210301 [1,1,0,0,0,0|1,0,1]=4 2013 B11R1.1 COCCc1ccc(cc1)F 34a_100138415774_100011217392 [1,1,0,0,0,0|1,0,1]=4 2014 B11R1.1 COCCc1ccc(cc1)F 7a_100000754732_200000210301 [1,1,0,0,0,0|1,0,1]=4 2015 B11R1.1 COCCc1ccc(cc1)I 34a_100012291149_200000210301 [1,1,0,0,0,0|1,0,1]=4 2016 B11R1.1 COCCc1ccc(cc1)I 7a_100012291149_200000210301 [1,1,0,0,0,0|1,0,1]=4 2017 B11R1.1 COCCc1ccc(cc1)N 34a_100011204434_200000210301 [1,1,0,0,0,0|1,0,1]=4 2018 B11R1.1 COCCc1ccc(cc1)O 271570a_203496583355_100000739703 [1,1,0,0,0,0|0,0,1]=3 2019 B11R1.1 COCNc1ccc(cc1)Br 2230a_100000210018_100000766300 [1,1,0,0,0,0|1,0,1]=4 2020 B11R1.1 COCNc1ccc(cc1)Cl 2230a_100000210052_100000766300 [1,1,0,0,0,0|1,0,1]=4 2021 B11R1.1 COCOc1ccc(cc1)O 271570a_203496583355_100012265687 [1,1,0,0,0,0|0,0,1]=3 2022 B11R1.1 COCOc1ccc(nc1)O 271570a_203496583355_100012568617 [1,1,0,0,0,0|1,0,1]=4 2023 B11R1.1 COCSc1ccc(cc1)Br 62a_100000752885_100000766300 [1,1,0,0,0,0|1,0,1]=4 2024 B11R1.1 COCSc1ccc(cc1)Br 62a_100000766300_100000752885 [1,1,0,0,0,0|1,0,1]=4 2025 B11R1.1 COCSc1ccc(cc1)C 62a_100000186775_100000766300 [1,1,0,0,0,0|1,0,1]=4 2026 B11R1.1 COCSc1ccc(cc1)C 62a_100000766300_100000186775 [1,1,0,0,0,0|1,0,1]=4 2027 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000755918_100000766300 [1,1,0,0,0,0|1,0,1]=4 2028 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000766300_100000755918 [1,1,0,0,0,0|1,0,1]=4 2029 B11R1.1 COCSc1ccc(cc1)F 62a_100000211213_100000766300 [1,1,0,0,0,0|1,0,1]=4 2030 B11R1.1 COCSc1ccc(cc1)F 62a_100000766300_100000211213 [1,1,0,0,0,0|1,0,1]=4 2031 B11R1.1 COCSc1ccc(cc1)N 62a_100000185761_100000766300 [1,1,0,0,0,0|1,0,1]=4 2032 B11R1.1 COCSc1ccc(cc1)N 62a_100000766300_100000185761 [1,1,0,0,0,0|1,0,1]=4 2033 B11R1.1 COCSc1ccc(cc1)O 62a_100000766300_100000185759 [1,1,0,0,0,0|0,0,1]=3 2034 B11R1.1 COCSc1ccc(cn1)O 62a_100000685995_100000766300 [1,1,0,0,0,0|1,0,1]=4 2035 B11R1.1 COCSc1ccc(cn1)O 62a_100000766300_100000744096 [1,1,0,0,0,0|1,0,1]=4 2036 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [1,1,0,0,0,0|0,1,1]=4 2037 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [1,1,0,0,0,0|0,1,1]=4 2038 B11R1.1 CSCNc1ccc(cc1)O 34a_100000185829_100011218213 [1,1,0,0,0,0|0,1,1]=4 2039 B11R1.1 CSCSc1ccc(cc1)O 62a_100011218213_100000185759 [1,1,0,0,0,0|0,1,1]=4 2040 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 34a_100000756670_200025704644 [1,1,0,0,0,0|1,0,1]=4 2041 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 7a_100000756670_200025704644 [1,1,0,0,0,0|1,0,1]=4 2042 B11R1.1 Cc1ccc(cc1)COCF 34a_100011215236_100015361967 [1,1,0,0,0,0|1,0,1]=4 2043 B11R1.1 Cc1ccc(cc1)COCF 7a_100011215236_100015361967 [1,1,0,0,0,0|1,0,1]=4 2044 B11R1.1 FCOCc1ccc(cc1)Br 34a_100000695286_100015361967 [1,1,0,0,0,0|1,0,1]=4 2045 B11R1.1 FCOCc1ccc(cc1)Cl 34a_100000211118_100015361967 [1,1,0,0,0,0|1,0,1]=4 2046 B11R1.1 FCOCc1ccc(cc1)Cl 7a_100000211118_100015361967 [1,1,0,0,0,0|1,0,1]=4 2047 B11R1.1 FCOCc1ccc(cc1)F 34a_100000210977_100015361967 [1,1,0,0,0,0|1,0,1]=4 2048 B11R1.1 FCOCc1ccc(cc1)F 7a_100000210977_100015361967 [1,1,0,0,0,0|1,0,1]=4 2049 B11R1.1 FCOCc1ccc(cc1)I 34a_100000690907_100015361967 [1,1,0,0,0,0|1,0,1]=4 2050 B11R1.1 FCOCc1ccc(cc1)I 7a_100000690907_100015361967 [1,1,0,0,0,0|1,0,1]=4 2051 B11R1.1 NCCCc1ccc(cc1)O 271570a_203496583355_100011297623 [1,1,0,0,0,0|1,0,1]=4 2052 B11R1.1 NCCOc1ccc(cc1)O 271570a_203496583355_100000746992 [1,1,0,0,0,0|2,0,0]=4 2053 B11R1.1 NCCSc1ccc(cc1)O 271570a_203496583355_100000184645 [1,1,0,0,0,0|2,0,0]=4 2054 B11R1.1 Nc1ccc(cc1)COCF 34a_100011215238_100015361967 [1,1,0,0,0,0|1,0,1]=4 2055 B11R1.1 OCC#Cc1ccc(cc1)O 271570a_203496583355_100009814260 [1,1,0,0,0,0|1,0,1]=4 2056 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [1,1,0,0,0,0|1,0,1]=4 2057 B11R1.1 OCCNc1ccc(cc1)O 34a_100000185829_100000211926 [1,1,0,0,0,0|2,0,0]=4 2058 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [1,1,0,0,0,0|2,0,0]=4 2059 B11R1.1 OCCSc1ccc(cc1)O 62a_100000211926_100000185759 [1,1,0,0,0,0|2,0,0]=4 2060 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [1,1,0,0,0,0|1,0,1]=4 2061 B11R1.1 Oc1ccc(cc1)NCCF 34a_100000185829_100011217306 [1,1,0,0,0,0|2,0,0]=4 2062 B11R1.1 Oc1ccc(cc1)OCCF 271570a_203496583355_100012347556 [1,1,0,0,0,0|2,0,0]=4 2063 B11R1.1 Oc1ccc(cc1)SCCF 62a_100011217306_100000185759 [1,1,0,0,0,0|2,0,0]=4 2064 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [1,1,0,0,0,0|1,0,1]=4 2065 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 34a_100000766406_200025704644 [1,1,0,0,0,0|1,0,1]=4 2066 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 7a_100000766406_200025704644 [1,1,0,0,0,0|1,0,1]=4 2067 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 34a_100011219627_200025704644 [1,1,0,0,0,0|1,0,1]=4 2068 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 7a_100011219627_200025704644 [1,1,0,0,0,0|1,0,1]=4 2069 B11R1.1 [13CH3]OCCc1ccc(cc1)F 34a_100000754732_200025704644 [1,1,0,0,0,0|1,0,1]=4 2070 B11R1.1 [13CH3]OCCc1ccc(cc1)F 7a_100000754732_200025704644 [1,1,0,0,0,0|1,0,1]=4 2071 B11R1.1 [13CH3]OCCc1ccc(cc1)I 34a_100012291149_200025704644 [1,1,0,0,0,0|1,0,1]=4 2072 B11R1.1 [13CH3]OCCc1ccc(cc1)I 7a_100012291149_200025704644 [1,1,0,0,0,0|1,0,1]=4 2073 B11R1.1 [13CH3]OCCc1ccc(cc1)N 34a_100011204434_200025704644 [1,1,0,0,0,0|1,0,1]=4 2074 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [1,1,0,0,0,0|0,1,1]=4 2075 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [1,1,0,0,0,0|0,1,1]=4 2076 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [1,1,0,0,0,0|2,0,0]=4 2077 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [1,1,0,0,0,0|2,0,0]=4 2078 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [1,1,0,0,0,0|2,0,0]=4 2079 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [1,1,0,0,0,0|2,0,0]=4 2080 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [1,1,0,0,0,0|2,0,0]=4 2081 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,1,0,0,0,0|1,0,0]=3 2082 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [1,1,0,0,0,0|2,0,0]=4 2083 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,1,0,0,0,0|1,0,1]=4 2084 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,1,0,0,0,0|1,0,1]=4 2085 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [1,1,0,0,0,0|2,0,0]=4 2086 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [1,1,0,0,0,0|2,0,0]=4 2087 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [1,1,0,0,0,0|2,0,0]=4 2088 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [1,1,0,0,0,0|2,0,0]=4 2089 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [1,1,0,0,0,0|2,0,0]=4 2090 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [1,1,0,0,0,0|1,0,1]=4 2091 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [1,1,0,0,0,0|2,0,0]=4 2092 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [1,1,0,0,0,0|2,0,0]=4 2093 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,1,0,0,0,0|2,0,0]=4 2094 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [1,1,0,0,0,0|2,0,0]=4 2095 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [1,1,0,0,0,0|2,0,0]=4 2096 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,1,0,0,0,0|1,0,1]=4 2097 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,1,0,0,0,0|1,0,1]=4 2098 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,1,0,0,0,0|1,0,1]=4 2099 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,1,0,0,0,0|1,0,1]=4 2100 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,1,0,0,0,0|1,0,1]=4 2101 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [1,1,0,0,0,0|2,0,0]=4 2102 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [1,1,0,0,0,0|2,0,0]=4 2103 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,1,0,0,0,0|1,0,1]=4 2104 B11R1.81 C=C=Cc1ccc(cc1Br)O 271570a_100015277604_100000701344 [1,1,0,0,0,0|1,0,1]=4 2105 B11R1.81 C=C=Cc1ccc(cc1C)O 271570a_100015277604_100000729255 [1,1,0,0,0,0|1,0,1]=4 2106 B11R1.81 C=C=Cc1ccc(cc1Cl)O 271570a_100015277604_100000047559 [1,1,0,0,0,0|1,0,1]=4 2107 B11R1.81 C=C=Cc1ccc(cc1F)O 271570a_100015277604_100000755031 [1,1,0,0,0,0|1,0,1]=4 2108 B11R1.81 C=C=Cc1ccc(cc1N)O 271570a_100015277604_100011999798 [1,1,0,0,0,0|1,0,1]=4 2109 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [1,1,0,0,0,0|1,0,1]=4 2110 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [1,1,0,0,0,0|2,0,0]=4 2111 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [1,1,0,0,0,0|2,0,0]=4 2112 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [1,1,0,0,0,0|2,0,0]=4 2113 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [1,1,0,0,0,0|2,0,0]=4 2114 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [1,1,0,0,0,0|2,0,0]=4 2115 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [1,1,0,0,0,0|1,0,0]=3 2116 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [1,1,0,0,0,0|2,0,0]=4 2117 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [1,1,0,0,0,0|2,0,0]=4 2118 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [1,1,0,0,0,0|2,0,0]=4 2119 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [1,1,0,0,0,0|2,0,0]=4 2120 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [1,1,0,0,0,0|2,0,0]=4 2121 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [1,1,0,0,0,0|1,0,0]=3 2122 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [1,1,0,0,0,0|2,0,0]=4 2123 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [1,1,0,0,0,0|2,0,0]=4 2124 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [1,1,0,0,0,0|2,0,0]=4 2125 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [1,1,0,0,0,0|2,0,0]=4 2126 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [1,1,0,0,0,0|2,0,0]=4 2127 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [1,1,0,0,0,0|1,0,0]=3 2128 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [1,1,0,0,0,0|2,0,0]=4 2129 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [1,1,0,0,0,0|2,0,0]=4 2130 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [1,1,0,0,0,0|2,0,0]=4 2131 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [1,1,0,0,0,0|2,0,0]=4 2132 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [1,1,0,0,0,0|2,0,0]=4 2133 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [1,1,0,0,0,0|1,0,0]=3 2134 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [1,1,0,0,0,0|2,0,0]=4 2135 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [1,1,0,0,0,0|2,0,0]=4 2136 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [1,1,0,0,0,0|2,0,0]=4 2137 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [1,1,0,0,0,0|2,0,0]=4 2138 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [1,1,0,0,0,0|2,0,0]=4 2139 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [1,1,0,0,0,0|1,0,0]=3 2140 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [1,1,0,0,0,0|2,0,0]=4 2141 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [1,1,0,0,0,0|2,0,0]=4 2142 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [1,1,0,0,0,0|2,0,0]=4 2143 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [1,1,0,0,0,0|2,0,0]=4 2144 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [1,1,0,0,0,0|1,0,0]=3 2145 B11R1.81 CC=Cc1ccc(nc1C)O 271570a_100016259895_100000691680 [1,1,0,0,0,0|2,0,0]=4 2146 B11R1.81 CC=Cc1ccc(nc1F)O 271570a_100016259895_100009879308 [1,1,0,0,0,0|2,0,0]=4 2147 B11R1.81 CC=Cc1cnc(cc1C)O 271570a_100016259895_100010114363 [1,1,0,0,0,0|2,0,0]=4 2148 B11R1.81 CC=Cc1ncc(cc1C)O 271570a_100016259895_100012000486 [1,1,0,0,0,0|2,0,0]=4 2149 B11R1.81 CC=Cc1ncc(cc1F)O 271570a_100016259895_100000063512 [1,1,0,0,0,0|2,0,0]=4 2150 B11R1.81 CCNc1ccc(cc1Br)O 34a_100012001276_100000210202 [1,1,0,0,0,0|2,0,0]=4 2151 B11R1.81 CCNc1ccc(cc1C)O 34a_100000756630_100000210202 [1,1,0,0,0,0|2,0,0]=4 2152 B11R1.81 CCNc1ccc(cc1Cl)O 34a_100011215599_100000210202 [1,1,0,0,0,0|2,0,0]=4 2153 B11R1.81 CCNc1ccc(cc1F)O 34a_100000759473_100000210202 [1,1,0,0,0,0|2,0,0]=4 2154 B11R1.81 CCNc1ccc(cc1I)O 34a_100010084370_100000210202 [1,1,0,0,0,0|2,0,0]=4 2155 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [1,1,0,0,0,0|2,0,0]=4 2156 B11R1.81 CCOc1ccc(cc1C)O 271570a_203496583355_100011308936 [1,1,0,0,0,0|2,0,0]=4 2157 B11R1.81 CCOc1ccc(cc1F)O 271570a_203496583355_200000171753 [1,1,0,0,0,0|2,0,0]=4 2158 B11R1.81 CCOc1ccc(cc1N)O 271570a_203496583355_100000751366 [1,1,0,0,0,0|2,0,0]=4 2159 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000210202_100000701344 [1,1,0,0,0,0|2,0,0]=4 2160 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000701344_100000210202 [1,1,0,0,0,0|2,0,0]=4 2161 B11R1.81 CCSc1ccc(cc1C)O 62a_100000210202_100000690111 [1,1,0,0,0,0|2,0,0]=4 2162 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000047559_100000210202 [1,1,0,0,0,0|2,0,0]=4 2163 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000210202_100000047559 [1,1,0,0,0,0|2,0,0]=4 2164 B11R1.81 CCSc1ccc(cc1F)O 62a_100000210202_100000755031 [1,1,0,0,0,0|2,0,0]=4 2165 B11R1.81 CCSc1ccc(cc1F)O 62a_100000755031_100000210202 [1,1,0,0,0,0|2,0,0]=4 2166 B11R1.81 CCSc1ccc(cc1N)O 62a_100000210202_100011999798 [1,1,0,0,0,0|2,0,0]=4 2167 B11R1.81 CCSc1ccc(cc1N)O 62a_100011999798_100000210202 [1,1,0,0,0,0|2,0,0]=4 2168 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [1,1,0,0,0,0|2,0,0]=4 2169 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [1,1,0,0,0,0|1,0,1]=4 2170 B11R1.81 COCc1ccc(cc1Br)Br 34a_100012357508_200000210301 [1,1,0,0,0,0|1,0,1]=4 2171 B11R1.81 COCc1ccc(cc1Br)Br 34a_100138415774_200012351560 [1,1,0,0,0,0|1,0,1]=4 2172 B11R1.81 COCc1ccc(cc1Br)Br 7a_100012357508_200000210301 [1,1,0,0,0,0|1,0,1]=4 2173 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100000707881_200000210301 [1,1,0,0,0,0|1,0,1]=4 2174 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100138415774_100000755608 [1,1,0,0,0,0|1,0,1]=4 2175 B11R1.81 COCc1ccc(cc1Br)Cl 7a_100000707881_200000210301 [1,1,0,0,0,0|1,0,1]=4 2176 B11R1.81 COCc1ccc(cc1Br)F 34a_100000744086_200000210301 [1,1,0,0,0,0|1,0,1]=4 2177 B11R1.81 COCc1ccc(cc1Br)F 34a_100138415774_100000243222 [1,1,0,0,0,0|1,0,1]=4 2178 B11R1.81 COCc1ccc(cc1Br)F 7a_100000744086_200000210301 [1,1,0,0,0,0|1,0,1]=4 2179 B11R1.81 COCc1ccc(cc1Br)I 34a_100138415774_100010146610 [1,1,0,0,0,0|1,0,1]=4 2180 B11R1.81 COCc1ccc(cc1Br)I 7a_100010240206_200000210301 [1,1,0,0,0,0|1,0,1]=4 2181 B11R1.81 COCc1ccc(cc1C)Br 34a_100000748258_200000210301 [1,1,0,0,0,0|1,0,1]=4 2182 B11R1.81 COCc1ccc(cc1C)Br 34a_100138415774_100000708836 [1,1,0,0,0,0|1,0,1]=4 2183 B11R1.81 COCc1ccc(cc1C)Br 7a_100000748258_200000210301 [1,1,0,0,0,0|1,0,1]=4 2184 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [1,1,0,0,0,0|1,0,1]=4 2185 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [1,1,0,0,0,0|1,0,1]=4 2186 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [1,1,0,0,0,0|1,0,1]=4 2187 B11R1.81 COCc1ccc(cc1C)Cl 34a_100000702939_200000210301 [1,1,0,0,0,0|1,0,1]=4 2188 B11R1.81 COCc1ccc(cc1C)Cl 34a_100138415774_100012361307 [1,1,0,0,0,0|1,0,1]=4 2189 B11R1.81 COCc1ccc(cc1C)Cl 7a_100000702939_200000210301 [1,1,0,0,0,0|1,0,1]=4 2190 B11R1.81 COCc1ccc(cc1C)F 34a_100000700136_200000210301 [1,1,0,0,0,0|1,0,1]=4 2191 B11R1.81 COCc1ccc(cc1C)F 34a_100138415774_100000700533 [1,1,0,0,0,0|1,0,1]=4 2192 B11R1.81 COCc1ccc(cc1C)F 7a_100000700136_200000210301 [1,1,0,0,0,0|1,0,1]=4 2193 B11R1.81 COCc1ccc(cc1C)N 34a_100000102464_200000210301 [1,1,0,0,0,0|1,0,1]=4 2194 B11R1.81 COCc1ccc(cc1C)N 7a_100000102464_200000210301 [1,1,0,0,0,0|1,0,1]=4 2195 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100000756401_200000210301 [1,1,0,0,0,0|1,0,1]=4 2196 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100138415774_100011740631 [1,1,0,0,0,0|1,0,1]=4 2197 B11R1.81 COCc1ccc(cc1Cl)Br 7a_100000756401_200000210301 [1,1,0,0,0,0|1,0,1]=4 2198 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [1,1,0,0,0,0|1,0,1]=4 2199 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [1,1,0,0,0,0|1,0,1]=4 2200 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [1,1,0,0,0,0|1,0,1]=4 2201 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100000215721_200000210301 [1,1,0,0,0,0|1,0,1]=4 2202 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100138415774_100000188473 [1,1,0,0,0,0|1,0,1]=4 2203 B11R1.81 COCc1ccc(cc1Cl)Cl 7a_100000215721_200000210301 [1,1,0,0,0,0|1,0,1]=4 2204 B11R1.81 COCc1ccc(cc1Cl)F 34a_100011219954_200000210301 [1,1,0,0,0,0|1,0,1]=4 2205 B11R1.81 COCc1ccc(cc1Cl)F 34a_100138415774_100011216360 [1,1,0,0,0,0|1,0,1]=4 2206 B11R1.81 COCc1ccc(cc1Cl)F 7a_100011219954_200000210301 [1,1,0,0,0,0|1,0,1]=4 2207 B11R1.81 COCc1ccc(cc1Cl)N 34a_100000689119_200000210301 [1,1,0,0,0,0|1,0,1]=4 2208 B11R1.81 COCc1ccc(cc1F)Br 34a_100011191541_200000210301 [1,1,0,0,0,0|1,0,1]=4 2209 B11R1.81 COCc1ccc(cc1F)Br 34a_100138415774_100000211606 [1,1,0,0,0,0|1,0,1]=4 2210 B11R1.81 COCc1ccc(cc1F)Br 7a_100011191541_200000210301 [1,1,0,0,0,0|1,0,1]=4 2211 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [1,1,0,0,0,0|1,0,1]=4 2212 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [1,1,0,0,0,0|1,0,1]=4 2213 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [1,1,0,0,0,0|1,0,1]=4 2214 B11R1.81 COCc1ccc(cc1F)Cl 34a_100011217562_200000210301 [1,1,0,0,0,0|1,0,1]=4 2215 B11R1.81 COCc1ccc(cc1F)Cl 34a_100138415774_100000709361 [1,1,0,0,0,0|1,0,1]=4 2216 B11R1.81 COCc1ccc(cc1F)Cl 7a_100011217562_200000210301 [1,1,0,0,0,0|1,0,1]=4 2217 B11R1.81 COCc1ccc(cc1F)F 34a_100011215441_200000210301 [1,1,0,0,0,0|1,0,1]=4 2218 B11R1.81 COCc1ccc(cc1F)F 34a_100138415774_100000748237 [1,1,0,0,0,0|1,0,1]=4 2219 B11R1.81 COCc1ccc(cc1F)F 7a_100011215441_200000210301 [1,1,0,0,0,0|1,0,1]=4 2220 B11R1.81 COCc1ccc(cc1F)I 34a_100138415774_100010244991 [1,1,0,0,0,0|1,0,1]=4 2221 B11R1.81 COCc1ccc(cc1F)I 34a_200010202041_200000210301 [1,1,0,0,0,0|1,0,1]=4 2222 B11R1.81 COCc1ccc(cc1F)I 7a_200010202041_200000210301 [1,1,0,0,0,0|1,0,1]=4 2223 B11R1.81 COCc1ccc(cc1I)Br 34a_100138415774_100010146615 [1,1,0,0,0,0|1,0,1]=4 2224 B11R1.81 COCc1ccc(cc1I)Br 7a_100010146605_200000210301 [1,1,0,0,0,0|1,0,1]=4 2225 B11R1.81 COCc1ccc(cc1I)Cl 34a_100000722340_200000210301 [1,1,0,0,0,0|1,0,1]=4 2226 B11R1.81 COCc1ccc(cc1I)Cl 34a_100138415774_100010254388 [1,1,0,0,0,0|1,0,1]=4 2227 B11R1.81 COCc1ccc(cc1I)Cl 7a_100000722340_200000210301 [1,1,0,0,0,0|1,0,1]=4 2228 B11R1.81 COCc1ccc(cc1I)F 34a_100011356828_200000210301 [1,1,0,0,0,0|1,0,1]=4 2229 B11R1.81 COCc1ccc(cc1I)F 34a_100138415774_100012354799 [1,1,0,0,0,0|1,0,1]=4 2230 B11R1.81 COCc1ccc(cc1I)F 7a_100011356828_200000210301 [1,1,0,0,0,0|1,0,1]=4 2231 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [1,1,0,0,0,0|1,0,1]=4 2232 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [1,1,0,0,0,0|1,0,1]=4 2233 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [1,1,0,0,0,0|1,0,1]=4 2234 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [1,1,0,0,0,0|1,0,1]=4 2235 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [1,1,0,0,0,0|1,0,1]=4 2236 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [1,1,0,0,0,0|1,0,1]=4 2237 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [1,1,0,0,0,0|1,0,1]=4 2238 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [1,1,0,0,0,0|0,0,1]=3 2239 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 34a_100000748258_200025704644 [1,1,0,0,0,0|1,0,1]=4 2240 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 7a_100000748258_200025704644 [1,1,0,0,0,0|1,0,1]=4 2241 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 34a_100000702939_200025704644 [1,1,0,0,0,0|1,0,1]=4 2242 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 7a_100000702939_200025704644 [1,1,0,0,0,0|1,0,1]=4 2243 B11R1.81 Cc1cc(ccc1CO[13CH3])F 34a_100000700136_200025704644 [1,1,0,0,0,0|1,0,1]=4 2244 B11R1.81 Cc1cc(ccc1CO[13CH3])F 7a_100000700136_200025704644 [1,1,0,0,0,0|1,0,1]=4 2245 B11R1.81 Cc1cc(ccc1CO[13CH3])N 34a_100000102464_200025704644 [1,1,0,0,0,0|1,0,1]=4 2246 B11R1.81 Cc1cc(ccc1CO[13CH3])N 7a_100000102464_200025704644 [1,1,0,0,0,0|1,0,1]=4 2247 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [1,1,0,0,0,0|1,0,1]=4 2248 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [1,1,0,0,0,0|1,0,1]=4 2249 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [1,1,0,0,0,0|1,0,1]=4 2250 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [1,1,0,0,0,0|1,0,1]=4 2251 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [1,1,0,0,0,0|1,0,1]=4 2252 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [1,1,0,0,0,0|1,0,1]=4 2253 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [1,1,0,0,0,0|1,0,1]=4 2254 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [1,1,0,0,0,0|1,0,1]=4 2255 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [1,1,0,0,0,0|1,0,1]=4 2256 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 34a_100012357508_200025704644 [1,1,0,0,0,0|1,0,1]=4 2257 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 7a_100012357508_200025704644 [1,1,0,0,0,0|1,0,1]=4 2258 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 34a_100000707881_200025704644 [1,1,0,0,0,0|1,0,1]=4 2259 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 7a_100000707881_200025704644 [1,1,0,0,0,0|1,0,1]=4 2260 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 34a_100000744086_200025704644 [1,1,0,0,0,0|1,0,1]=4 2261 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 7a_100000744086_200025704644 [1,1,0,0,0,0|1,0,1]=4 2262 B11R1.81 [13CH3]OCc1ccc(cc1Br)I 7a_100010240206_200025704644 [1,1,0,0,0,0|1,0,1]=4 2263 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 34a_100000756401_200025704644 [1,1,0,0,0,0|1,0,1]=4 2264 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 7a_100000756401_200025704644 [1,1,0,0,0,0|1,0,1]=4 2265 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 34a_100000215721_200025704644 [1,1,0,0,0,0|1,0,1]=4 2266 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 7a_100000215721_200025704644 [1,1,0,0,0,0|1,0,1]=4 2267 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 34a_100011219954_200025704644 [1,1,0,0,0,0|1,0,1]=4 2268 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 7a_100011219954_200025704644 [1,1,0,0,0,0|1,0,1]=4 2269 B11R1.81 [13CH3]OCc1ccc(cc1Cl)N 34a_100000689119_200025704644 [1,1,0,0,0,0|1,0,1]=4 2270 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 34a_100011191541_200025704644 [1,1,0,0,0,0|1,0,1]=4 2271 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 7a_100011191541_200025704644 [1,1,0,0,0,0|1,0,1]=4 2272 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 34a_100011217562_200025704644 [1,1,0,0,0,0|1,0,1]=4 2273 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 7a_100011217562_200025704644 [1,1,0,0,0,0|1,0,1]=4 2274 B11R1.81 [13CH3]OCc1ccc(cc1F)F 34a_100011215441_200025704644 [1,1,0,0,0,0|1,0,1]=4 2275 B11R1.81 [13CH3]OCc1ccc(cc1F)F 7a_100011215441_200025704644 [1,1,0,0,0,0|1,0,1]=4 2276 B11R1.81 [13CH3]OCc1ccc(cc1F)I 34a_200010202041_200025704644 [1,1,0,0,0,0|1,0,1]=4 2277 B11R1.81 [13CH3]OCc1ccc(cc1F)I 7a_200010202041_200025704644 [1,1,0,0,0,0|1,0,1]=4 2278 B11R1.81 [13CH3]OCc1ccc(cc1I)Br 7a_100010146605_200025704644 [1,1,0,0,0,0|1,0,1]=4 2279 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 34a_100000722340_200025704644 [1,1,0,0,0,0|1,0,1]=4 2280 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 7a_100000722340_200025704644 [1,1,0,0,0,0|1,0,1]=4 2281 B11R1.81 [13CH3]OCc1ccc(cc1I)F 34a_100011356828_200025704644 [1,1,0,0,0,0|1,0,1]=4 2282 B11R1.81 [13CH3]OCc1ccc(cc1I)F 7a_100011356828_200025704644 [1,1,0,0,0,0|1,0,1]=4 2283 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [1,1,0,0,0,0|1,0,1]=4 2284 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [1,1,0,0,0,0|1,0,1]=4 2285 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [1,1,0,0,0,0|1,0,1]=4 2286 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [1,1,0,0,0,0|1,0,1]=4 2287 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [1,1,0,0,0,0|1,0,1]=4 2288 B11R1.83 C#Cc1ccc(cc1)COC 34a_100000054647_200000210301 [1,1,0,0,0,0|1,0,1]=4 2289 B11R1.83 C#Cc1ccc(cc1)COC 34a_100138415774_100000140223 [1,1,0,0,0,0|1,0,1]=4 2290 B11R1.83 C#Cc1ccc(cc1)COC 7a_100000054647_200000210301 [1,1,0,0,0,0|1,0,1]=4 2291 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 34a_100000054647_200025704644 [1,1,0,0,0,0|1,0,1]=4 2292 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 7a_100000054647_200025704644 [1,1,0,0,0,0|1,0,1]=4 2293 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [1,1,0,0,0,0|1,1,0]=4 2294 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [1,1,0,0,0,0|1,1,0]=4 2295 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [1,1,0,0,0,0|1,1,0]=4 2296 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [1,1,0,0,0,0|1,1,0]=4 2297 B11R1.83 C=C=Cc1ccc(cc1)CO 271570a_100015277604_100000690907 [1,1,0,0,0,0|1,0,1]=4 2298 B11R1.83 C=C=Cc1ccc(cc1)OC 271570a_100015277604_100000171711 [1,1,0,0,0,0|1,0,1]=4 2299 B11R1.83 C=Cc1ccc(cc1)/C=C/C 271570a_100011290941_100016259036 [1,1,0,0,0,0|2,0,0]=4 2300 B11R1.83 C=Cc1ccc(cc1)COC 271570a_100011290941_100011493685 [1,1,0,0,0,0|1,0,1]=4 2301 B11R1.83 C=Cc1ccc(cc1)COC 34a_100000073583_200000210301 [1,1,0,0,0,0|1,0,1]=4 2302 B11R1.83 C=Cc1ccc(cc1)COC 34a_100138415774_100000034074 [1,1,0,0,0,0|1,0,1]=4 2303 B11R1.83 C=Cc1ccc(cc1)COC 7a_100000073583_200000210301 [1,1,0,0,0,0|1,0,1]=4 2304 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 34a_100000073583_200025704644 [1,1,0,0,0,0|1,0,1]=4 2305 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 7a_100000073583_200025704644 [1,1,0,0,0,0|1,0,1]=4 2306 B11R1.83 CC=Cc1ccc(cc1)C#N 271570a_100016259895_100000179745 [1,1,0,0,0,0|2,0,0]=4 2307 B11R1.83 CC=Cc1ccc(cc1)C=O 271570a_100016259895_100000186029 [1,1,0,0,0,0|1,0,1]=4 2308 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [1,1,0,0,0,0|2,0,0]=4 2309 B11R1.83 CC=Cc1ccc(cc1)CF 271570a_100016259895_100010268989 [1,1,0,0,0,0|2,0,0]=4 2310 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [1,1,0,0,0,0|2,0,0]=4 2311 B11R1.83 CC=Cc1ccc(cc1)CO 271570a_100016259895_100000690907 [1,1,0,0,0,0|1,0,0]=3 2312 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [1,1,0,0,0,0|2,0,0]=4 2313 B11R1.83 CC=Cc1ccc(cc1)NN 271570a_100016259895_100016988836 [1,1,0,0,0,0|2,0,0]=4 2314 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [1,1,0,0,0,0|1,0,0]=3 2315 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [1,1,0,0,0,0|1,1,0]=4 2316 B11R1.83 CC=Cc1ccc(cn1)CO 271570a_100016259895_100009816760 [1,1,0,0,0,0|2,0,0]=4 2317 B11R1.83 CC=Cc1ccc(cn1)OC 271570a_100016259895_100000755202 [1,1,0,0,0,0|2,0,0]=4 2318 B11R1.83 CC=Cc1ccc(nc1)CO 271570a_100016259895_100000754261 [1,1,0,0,0,0|2,0,0]=4 2319 B11R1.83 CC=Cc1ccc(nc1)OC 271570a_100016259895_100000047065 [1,1,0,0,0,0|2,0,0]=4 2320 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [1,1,0,0,0,0|1,0,1]=4 2321 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [1,1,0,0,0,0|1,0,1]=4 2322 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [1,1,0,0,0,0|1,0,1]=4 2323 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [1,1,0,0,0,0|1,0,1]=4 2324 B11R1.83 CCNc1ccc(cc1)CO 2230a_100011215238_100000210202 [1,1,0,0,0,0|2,0,0]=4 2325 B11R1.83 CCNc1ccc(cc1)CO 34a_100011215238_100000210202 [1,1,0,0,0,0|2,0,0]=4 2326 B11R1.83 CCNc1ccc(cc1)OC 34a_100000184247_100000210202 [1,1,0,0,0,0|2,0,0]=4 2327 B11R1.83 CCNc1ccc(cc1)OC 34a_100011337800_200000210301 [1,1,0,0,0,0|2,0,0]=4 2328 B11R1.83 CCNc1ccc(cc1)OC 7a_100011337800_200000210301 [1,1,0,0,0,0|2,0,0]=4 2329 B11R1.83 CCNc1ccc(cc1)O[13CH3] 34a_100011337800_200025704644 [1,1,0,0,0,0|2,0,0]=4 2330 B11R1.83 CCNc1ccc(cc1)O[13CH3] 7a_100011337800_200025704644 [1,1,0,0,0,0|2,0,0]=4 2331 B11R1.83 CCOc1ccc(cc1)CO 34a_100000211755_100000210202 [1,1,0,0,0,0|2,0,0]=4 2332 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [1,1,0,0,0,0|2,0,0]=4 2333 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [1,1,0,0,0,0|2,0,0]=4 2334 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [1,1,0,0,0,0|2,0,0]=4 2335 B11R1.83 CCSc1ccc(cc1)CO 62a_100000210202_100000690907 [1,1,0,0,0,0|2,0,0]=4 2336 B11R1.83 CCSc1ccc(cc1)CO 62a_100000690907_100000210202 [1,1,0,0,0,0|2,0,0]=4 2337 B11R1.83 CCSc1ccc(cc1)OC 62a_100000210202_100000171711 [1,1,0,0,0,0|2,0,0]=4 2338 B11R1.83 CCc1ccc(cc1)COC 34a_100000702245_200000210301 [1,1,0,0,0,0|1,0,1]=4 2339 B11R1.83 CCc1ccc(cc1)COC 34a_100138415774_100000747183 [1,1,0,0,0,0|1,0,1]=4 2340 B11R1.83 CCc1ccc(cc1)COC 7a_100000702245_200000210301 [1,1,0,0,0,0|1,0,1]=4 2341 B11R1.83 CCc1ccc(cc1)CO[13CH3] 34a_100000702245_200025704644 [1,1,0,0,0,0|1,0,1]=4 2342 B11R1.83 CCc1ccc(cc1)CO[13CH3] 7a_100000702245_200025704644 [1,1,0,0,0,0|1,0,1]=4 2343 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [1,1,0,0,0,0|1,0,1]=4 2344 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [1,1,0,0,0,0|1,0,1]=4 2345 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [1,1,0,0,0,0|1,0,1]=4 2346 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [1,1,0,0,0,0|1,0,1]=4 2347 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [1,1,0,0,0,0|1,0,1]=4 2348 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [1,1,0,0,0,0|1,0,1]=4 2349 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [1,1,0,0,0,0|1,0,1]=4 2350 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [1,1,0,0,0,0|1,0,1]=4 2351 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [1,1,0,0,0,0|1,0,1]=4 2352 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [1,1,0,0,0,0|1,0,1]=4 2353 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [1,1,0,0,0,0|1,0,1]=4 2354 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [1,1,0,0,0,0|1,0,1]=4 2355 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [1,1,0,0,0,0|1,0,1]=4 2356 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [1,1,0,0,0,0|1,0,1]=4 2357 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [1,1,0,0,0,0|1,0,1]=4 2358 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [1,1,0,0,0,0|1,0,1]=4 2359 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [1,1,0,0,0,0|1,0,1]=4 2360 B11R1.83 CNc1ccc(cc1)COC 34a_100000694113_200000210301 [1,1,0,0,0,0|1,0,1]=4 2361 B11R1.83 COCc1ccc(cc1)C#N 34a_100000238739_200000210301 [1,1,0,0,0,0|1,0,1]=4 2362 B11R1.83 COCc1ccc(cc1)C#N 34a_100138415774_100000184898 [1,1,0,0,0,0|1,0,1]=4 2363 B11R1.83 COCc1ccc(cc1)C#N 7a_100000238739_200000210301 [1,1,0,0,0,0|1,0,1]=4 2364 B11R1.83 COCc1ccc(cc1)C=O 34a_100138415774_100009816848 [1,1,0,0,0,0|0,0,2]=4 2365 B11R1.83 COCc1ccc(cc1)CBr 34a_100012353999_200000210301 [1,1,0,0,0,0|1,0,1]=4 2366 B11R1.83 COCc1ccc(cc1)CBr 7a_100012353999_200000210301 [1,1,0,0,0,0|1,0,1]=4 2367 B11R1.83 COCc1ccc(cc1)CCl 34a_100000067286_200000210301 [1,1,0,0,0,0|1,0,1]=4 2368 B11R1.83 COCc1ccc(cc1)CCl 7a_100000067286_200000210301 [1,1,0,0,0,0|1,0,1]=4 2369 B11R1.83 COCc1ccc(cc1)CN 34a_100015189231_200000210301 [1,1,0,0,0,0|1,0,1]=4 2370 B11R1.83 COCc1ccc(cc1)CO 34a_100138415774_100000067286 [1,1,0,0,0,0|0,0,1]=3 2371 B11R1.83 COCc1ccc(cc1)N[13CH3] 34a_100000694113_200025704644 [1,1,0,0,0,0|1,0,1]=4 2372 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [1,1,0,0,0,0|0,0,1]=3 2373 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [1,1,0,0,0,0|0,0,1]=3 2374 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [1,1,0,0,0,0|0,0,1]=3 2375 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [1,1,0,0,0,0|0,0,1]=3 2376 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [1,1,0,0,0,0|0,0,1]=3 2377 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [1,1,0,0,0,0|0,0,1]=3 2378 B11R1.83 COCc1ccc(cc1)SC 34a_100011215404_200000210301 [1,1,0,0,0,0|0,1,1]=4 2379 B11R1.83 COCc1ccc(cc1)SC 34a_100138415774_100000181263 [1,1,0,0,0,0|0,1,1]=4 2380 B11R1.83 COCc1ccc(cc1)SC 62a_100011493685_200000210301 [1,1,0,0,0,0|0,1,1]=4 2381 B11R1.83 COCc1ccc(cc1)SC 62a_200000210301_100011493685 [1,1,0,0,0,0|0,1,1]=4 2382 B11R1.83 COCc1ccc(cc1)SC 7a_100011215404_200000210301 [1,1,0,0,0,0|0,1,1]=4 2383 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_100011493685_200025704644 [1,1,0,0,0,0|0,1,1]=4 2384 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_200025704644_100011493685 [1,1,0,0,0,0|0,1,1]=4 2385 B11R1.83 COCc1ccc(cn1)OC 34a_100011998694_200000210301 [1,1,0,0,0,0|1,0,1]=4 2386 B11R1.83 COCc1ccc(cn1)OC 34a_100138415774_200000757186 [1,1,0,0,0,0|1,0,1]=4 2387 B11R1.83 COCc1ccc(nc1)OC 34a_100000763316_200000210301 [1,1,0,0,0,0|1,0,1]=4 2388 B11R1.83 COCc1ccc(nc1)OC 34a_100138415774_100020631284 [1,1,0,0,0,0|1,0,1]=4 2389 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [1,1,0,0,0,0|1,0,1]=4 2390 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [1,1,0,0,0,0|0,0,1]=3 2391 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [1,1,0,0,0,0|0,1,1]=4 2392 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [1,1,0,0,0,0|0,1,1]=4 2393 B11R1.83 COc1ccc(cn1)CO[13CH3] 34a_100000763316_200025704644 [1,1,0,0,0,0|1,0,1]=4 2394 B11R1.83 COc1ccc(nc1)CO[13CH3] 34a_100011998694_200025704644 [1,1,0,0,0,0|1,0,1]=4 2395 B11R1.83 CSCc1ccc(cc1)CO 62a_100000067286_200000210301 [1,1,0,0,0,0|0,1,1]=4 2396 B11R1.83 CSCc1ccc(cc1)CO 62a_200000210301_100000067286 [1,1,0,0,0,0|0,1,1]=4 2397 B11R1.83 CSc1ccc(cc1)CO[13CH3] 34a_100011215404_200025704644 [1,1,0,0,0,0|0,1,1]=4 2398 B11R1.83 CSc1ccc(cc1)CO[13CH3] 7a_100011215404_200025704644 [1,1,0,0,0,0|0,1,1]=4 2399 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [1,1,0,0,0,0|1,0,1]=4 2400 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [1,1,0,0,0,0|1,0,1]=4 2401 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 34a_100000238739_200025704644 [1,1,0,0,0,0|1,0,1]=4 2402 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 7a_100000238739_200025704644 [1,1,0,0,0,0|1,0,1]=4 2403 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 34a_100012353999_200025704644 [1,1,0,0,0,0|1,0,1]=4 2404 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 7a_100012353999_200025704644 [1,1,0,0,0,0|1,0,1]=4 2405 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 34a_100000067286_200025704644 [1,1,0,0,0,0|1,0,1]=4 2406 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 7a_100000067286_200025704644 [1,1,0,0,0,0|1,0,1]=4 2407 B11R1.83 [13CH3]OCc1ccc(cc1)CN 34a_100015189231_200025704644 [1,1,0,0,0,0|1,0,1]=4 2408 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_100000067286_200025704644 [1,1,0,0,0,0|0,1,1]=4 2409 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_200025704644_100000067286 [1,1,0,0,0,0|0,1,1]=4 2410 B11R1.192 C=C=Cc1ccc(c(c1)Br)O 271570a_100015277604_100012361655 [1,1,0,0,0,0|1,0,1]=4 2411 B11R1.192 C=C=Cc1ccc(c(c1)C)O 271570a_100015277604_100000186361 [1,1,0,0,0,0|1,0,1]=4 2412 B11R1.192 C=C=Cc1ccc(c(c1)Cl)O 271570a_100015277604_100012360047 [1,1,0,0,0,0|1,0,1]=4 2413 B11R1.192 C=C=Cc1ccc(c(c1)F)O 271570a_100015277604_100000185481 [1,1,0,0,0,0|1,0,1]=4 2414 B11R1.192 C=C=Cc1ccc(c(c1)N)O 271570a_100015277604_100000752626 [1,1,0,0,0,0|1,0,1]=4 2415 B11R1.192 C=C=Cc1ccc(c(c1)O)O 271570a_100015277604_100009813601 [1,1,0,0,0,0|1,0,1]=4 2416 B11R1.192 CC=Cc1cc(c(cn1)O)C 271570a_100016259895_100000692680 [1,1,0,0,0,0|2,0,0]=4 2417 B11R1.192 CC=Cc1cc(c(cn1)O)N 271570a_100016259895_100009819941 [1,1,0,0,0,0|2,0,0]=4 2418 B11R1.192 CC=Cc1ccc(c(c1)Br)Br 271570a_100016259895_100012356285 [1,1,0,0,0,0|2,0,0]=4 2419 B11R1.192 CC=Cc1ccc(c(c1)Br)C 271570a_100016259895_100011847877 [1,1,0,0,0,0|2,0,0]=4 2420 B11R1.192 CC=Cc1ccc(c(c1)Br)Cl 271570a_100016259895_100012353702 [1,1,0,0,0,0|2,0,0]=4 2421 B11R1.192 CC=Cc1ccc(c(c1)Br)F 271570a_100016259895_100012047266 [1,1,0,0,0,0|2,0,0]=4 2422 B11R1.192 CC=Cc1ccc(c(c1)Br)N 271570a_100016259895_100000750455 [1,1,0,0,0,0|2,0,0]=4 2423 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,1,0,0,0,0|1,0,0]=3 2424 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,1,0,0,0,0|2,0,0]=4 2425 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,1,0,0,0,0|2,0,0]=4 2426 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,1,0,0,0,0|2,0,0]=4 2427 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,1,0,0,0,0|2,0,0]=4 2428 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,1,0,0,0,0|2,0,0]=4 2429 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,1,0,0,0,0|1,0,0]=3 2430 B11R1.192 CC=Cc1ccc(c(c1)Cl)Br 271570a_100016259895_100012047281 [1,1,0,0,0,0|2,0,0]=4 2431 B11R1.192 CC=Cc1ccc(c(c1)Cl)C 271570a_100016259895_100011216363 [1,1,0,0,0,0|2,0,0]=4 2432 B11R1.192 CC=Cc1ccc(c(c1)Cl)Cl 271570a_100016259895_100011214914 [1,1,0,0,0,0|2,0,0]=4 2433 B11R1.192 CC=Cc1ccc(c(c1)Cl)F 271570a_100016259895_100011215976 [1,1,0,0,0,0|2,0,0]=4 2434 B11R1.192 CC=Cc1ccc(c(c1)Cl)N 271570a_100016259895_100011218065 [1,1,0,0,0,0|2,0,0]=4 2435 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,1,0,0,0,0|1,0,0]=3 2436 B11R1.192 CC=Cc1ccc(c(c1)F)Br 271570a_100016259895_100000685389 [1,1,0,0,0,0|2,0,0]=4 2437 B11R1.192 CC=Cc1ccc(c(c1)F)C 271570a_100016259895_100000720648 [1,1,0,0,0,0|2,0,0]=4 2438 B11R1.192 CC=Cc1ccc(c(c1)F)Cl 271570a_100016259895_100011216805 [1,1,0,0,0,0|2,0,0]=4 2439 B11R1.192 CC=Cc1ccc(c(c1)F)F 271570a_100016259895_100000750028 [1,1,0,0,0,0|2,0,0]=4 2440 B11R1.192 CC=Cc1ccc(c(c1)F)N 271570a_100016259895_100011215594 [1,1,0,0,0,0|2,0,0]=4 2441 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,1,0,0,0,0|1,0,0]=3 2442 B11R1.192 CC=Cc1ccc(c(c1)N)Br 271570a_100016259895_100000750456 [1,1,0,0,0,0|2,0,0]=4 2443 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [1,1,0,0,0,0|2,0,0]=4 2444 B11R1.192 CC=Cc1ccc(c(c1)N)Cl 271570a_100016259895_200000761891 [1,1,0,0,0,0|2,0,0]=4 2445 B11R1.192 CC=Cc1ccc(c(c1)N)F 271570a_100016259895_100000740924 [1,1,0,0,0,0|2,0,0]=4 2446 B11R1.192 CC=Cc1ccc(c(c1)N)N 271570a_100016259895_100000741789 [1,1,0,0,0,0|2,0,0]=4 2447 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,1,0,0,0,0|1,0,0]=3 2448 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,1,0,0,0,0|2,0,0]=4 2449 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,1,0,0,0,0|2,0,0]=4 2450 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,1,0,0,0,0|2,0,0]=4 2451 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,1,0,0,0,0|2,0,0]=4 2452 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,1,0,0,0,0|2,0,0]=4 2453 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,1,0,0,0,0|1,0,0]=3 2454 B11R1.192 CC=Cc1ccc(c(n1)Br)O 271570a_100016259895_100000725334 [1,1,0,0,0,0|2,0,0]=4 2455 B11R1.192 CC=Cc1ccc(c(n1)C)O 271570a_100016259895_100010233687 [1,1,0,0,0,0|2,0,0]=4 2456 B11R1.192 CC=Cc1ccc(c(n1)Cl)O 271570a_100016259895_100000721234 [1,1,0,0,0,0|2,0,0]=4 2457 B11R1.192 CC=Cc1ccc(c(n1)F)O 271570a_100016259895_100009819667 [1,1,0,0,0,0|2,0,0]=4 2458 B11R1.192 CC=Cc1ccc(c(n1)N)O 271570a_100016259895_100000685527 [1,1,0,0,0,0|2,0,0]=4 2459 B11R1.192 CC=Cc1cnc(c(c1)C)O 271570a_100016259895_100000685391 [1,1,0,0,0,0|2,0,0]=4 2460 B11R1.192 CC=Cc1cnc(c(c1)Cl)O 271570a_100016259895_100010238531 [1,1,0,0,0,0|2,0,0]=4 2461 B11R1.192 CC=Cc1cnc(c(c1)N)O 271570a_100016259895_100000743729 [1,1,0,0,0,0|2,0,0]=4 2462 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,1,0,0,0,0|1,0,1]=4 2463 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [1,1,0,0,0,0|2,0,0]=4 2464 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [1,1,0,0,0,0|2,0,0]=4 2465 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [1,1,0,0,0,0|2,0,0]=4 2466 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [1,1,0,0,0,0|2,0,0]=4 2467 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [1,1,0,0,0,0|2,0,0]=4 2468 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [1,1,0,0,0,0|2,0,0]=4 2469 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [1,1,0,0,0,0|2,0,0]=4 2470 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,1,0,0,0,0|2,0,0]=4 2471 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [1,1,0,0,0,0|2,0,0]=4 2472 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [1,1,0,0,0,0|2,0,0]=4 2473 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [1,1,0,0,0,0|2,0,0]=4 2474 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [1,1,0,0,0,0|2,0,0]=4 2475 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [1,1,0,0,0,0|2,0,0]=4 2476 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [1,1,0,0,0,0|2,0,0]=4 2477 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [1,1,0,0,0,0|2,0,0]=4 2478 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [1,1,0,0,0,0|2,0,0]=4 2479 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [1,1,0,0,0,0|2,0,0]=4 2480 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [1,1,0,0,0,0|2,0,0]=4 2481 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [1,1,0,0,0,0|2,0,0]=4 2482 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,1,0,0,0,0|2,0,0]=4 2483 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,1,0,0,0,0|1,0,1]=4 2484 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,1,0,0,0,0|1,0,1]=4 2485 B11R1.192 COCc1ccc(c(c1)Br)Br 34a_100138415774_100012353900 [1,1,0,0,0,0|1,0,1]=4 2486 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100000708995_200000210301 [1,1,0,0,0,0|1,0,1]=4 2487 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100138415774_100012232412 [1,1,0,0,0,0|1,0,1]=4 2488 B11R1.192 COCc1ccc(c(c1)Br)C 7a_100000708995_200000210301 [1,1,0,0,0,0|1,0,1]=4 2489 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100012353893_200000210301 [1,1,0,0,0,0|1,0,1]=4 2490 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100138415774_100012353894 [1,1,0,0,0,0|1,0,1]=4 2491 B11R1.192 COCc1ccc(c(c1)Br)Cl 7a_100012353893_200000210301 [1,1,0,0,0,0|1,0,1]=4 2492 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100000246287_200000210301 [1,1,0,0,0,0|1,0,1]=4 2493 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100138415774_100011206884 [1,1,0,0,0,0|1,0,1]=4 2494 B11R1.192 COCc1ccc(c(c1)Br)F 7a_100000246287_200000210301 [1,1,0,0,0,0|1,0,1]=4 2495 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [1,1,0,0,0,0|1,0,1]=4 2496 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [1,1,0,0,0,0|1,0,1]=4 2497 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [1,1,0,0,0,0|1,0,1]=4 2498 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [1,1,0,0,0,0|1,0,1]=4 2499 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [1,1,0,0,0,0|1,0,1]=4 2500 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [1,1,0,0,0,0|1,0,1]=4 2501 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [1,1,0,0,0,0|1,0,1]=4 2502 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [1,1,0,0,0,0|1,0,1]=4 2503 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [1,1,0,0,0,0|1,0,1]=4 2504 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [1,1,0,0,0,0|1,0,1]=4 2505 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [1,1,0,0,0,0|1,0,1]=4 2506 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100000709168_200000210301 [1,1,0,0,0,0|1,0,1]=4 2507 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100138415774_100012353895 [1,1,0,0,0,0|1,0,1]=4 2508 B11R1.192 COCc1ccc(c(c1)Cl)Br 7a_100000709168_200000210301 [1,1,0,0,0,0|1,0,1]=4 2509 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100011290783_200000210301 [1,1,0,0,0,0|1,0,1]=4 2510 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100138415774_100011823929 [1,1,0,0,0,0|1,0,1]=4 2511 B11R1.192 COCc1ccc(c(c1)Cl)C 7a_100011290783_200000210301 [1,1,0,0,0,0|1,0,1]=4 2512 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100000211588_200000210301 [1,1,0,0,0,0|1,0,1]=4 2513 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100138415774_100000184707 [1,1,0,0,0,0|1,0,1]=4 2514 B11R1.192 COCc1ccc(c(c1)Cl)Cl 7a_100000211588_200000210301 [1,1,0,0,0,0|1,0,1]=4 2515 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100011217911_200000210301 [1,1,0,0,0,0|1,0,1]=4 2516 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100138415774_100011934319 [1,1,0,0,0,0|1,0,1]=4 2517 B11R1.192 COCc1ccc(c(c1)Cl)F 7a_100011217911_200000210301 [1,1,0,0,0,0|1,0,1]=4 2518 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100000718186_200000210301 [1,1,0,0,0,0|1,0,1]=4 2519 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100138415774_100012349665 [1,1,0,0,0,0|1,0,1]=4 2520 B11R1.192 COCc1ccc(c(c1)Cl)I 7a_100000718186_200000210301 [1,1,0,0,0,0|1,0,1]=4 2521 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100011533735_200000210301 [1,1,0,0,0,0|1,0,1]=4 2522 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100138415774_100000767054 [1,1,0,0,0,0|1,0,1]=4 2523 B11R1.192 COCc1ccc(c(c1)F)Br 7a_100011533735_200000210301 [1,1,0,0,0,0|1,0,1]=4 2524 B11R1.192 COCc1ccc(c(c1)F)C 34a_100000702247_200000210301 [1,1,0,0,0,0|1,0,1]=4 2525 B11R1.192 COCc1ccc(c(c1)F)C 34a_100138415774_100011217369 [1,1,0,0,0,0|1,0,1]=4 2526 B11R1.192 COCc1ccc(c(c1)F)C 7a_100000702247_200000210301 [1,1,0,0,0,0|1,0,1]=4 2527 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100011218299_200000210301 [1,1,0,0,0,0|1,0,1]=4 2528 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100138415774_100011519011 [1,1,0,0,0,0|1,0,1]=4 2529 B11R1.192 COCc1ccc(c(c1)F)Cl 7a_100011218299_200000210301 [1,1,0,0,0,0|1,0,1]=4 2530 B11R1.192 COCc1ccc(c(c1)F)F 34a_100011215442_200000210301 [1,1,0,0,0,0|1,0,1]=4 2531 B11R1.192 COCc1ccc(c(c1)F)F 34a_100138415774_100000757363 [1,1,0,0,0,0|1,0,1]=4 2532 B11R1.192 COCc1ccc(c(c1)F)F 7a_100011215442_200000210301 [1,1,0,0,0,0|1,0,1]=4 2533 B11R1.192 COCc1ccc(c(c1)F)I 34a_100010149597_200000210301 [1,1,0,0,0,0|1,0,1]=4 2534 B11R1.192 COCc1ccc(c(c1)F)I 34a_100138415774_100010149604 [1,1,0,0,0,0|1,0,1]=4 2535 B11R1.192 COCc1ccc(c(c1)F)I 7a_100010149597_200000210301 [1,1,0,0,0,0|1,0,1]=4 2536 B11R1.192 COCc1ccc(c(c1)F)N 34a_100011217239_200000210301 [1,1,0,0,0,0|1,0,1]=4 2537 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [1,1,0,0,0,0|0,0,1]=3 2538 B11R1.192 COCc1ccc(c(c1)I)Br 34a_100138415774_100010146616 [1,1,0,0,0,0|1,0,1]=4 2539 B11R1.192 COCc1ccc(c(c1)I)C 34a_100000050133_200000210301 [1,1,0,0,0,0|1,0,1]=4 2540 B11R1.192 COCc1ccc(c(c1)I)C 34a_100138415774_100010206137 [1,1,0,0,0,0|1,0,1]=4 2541 B11R1.192 COCc1ccc(c(c1)I)C 7a_100000050133_200000210301 [1,1,0,0,0,0|1,0,1]=4 2542 B11R1.192 COCc1ccc(c(c1)I)F 34a_100000049585_200000210301 [1,1,0,0,0,0|1,0,1]=4 2543 B11R1.192 COCc1ccc(c(c1)I)F 34a_100138415774_100010188208 [1,1,0,0,0,0|1,0,1]=4 2544 B11R1.192 COCc1ccc(c(c1)I)F 7a_100000049585_200000210301 [1,1,0,0,0,0|1,0,1]=4 2545 B11R1.192 COCc1ccc(c(c1)N)Br 34a_100012347568_200000210301 [1,1,0,0,0,0|1,0,1]=4 2546 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [1,1,0,0,0,0|1,0,1]=4 2547 B11R1.192 COCc1ccc(c(c1)N)Cl 34a_106256033963_200000210301 [1,1,0,0,0,0|1,0,1]=4 2548 B11R1.192 COCc1ccc(c(c1)N)F 34a_102125399562_200000210301 [1,1,0,0,0,0|1,0,1]=4 2549 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [1,1,0,0,0,0|0,0,1]=3 2550 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,1,0,0,0,0|1,0,1]=4 2551 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,1,0,0,0,0|1,0,1]=4 2552 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [1,1,0,0,0,0|1,0,1]=4 2553 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [1,1,0,0,0,0|1,0,1]=4 2554 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [1,1,0,0,0,0|1,0,1]=4 2555 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [1,1,0,0,0,0|1,0,1]=4 2556 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [1,1,0,0,0,0|1,0,1]=4 2557 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 34a_100000708995_200025704644 [1,1,0,0,0,0|1,0,1]=4 2558 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 7a_100000708995_200025704644 [1,1,0,0,0,0|1,0,1]=4 2559 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [1,1,0,0,0,0|1,0,1]=4 2560 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [1,1,0,0,0,0|1,0,1]=4 2561 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 34a_100011290783_200025704644 [1,1,0,0,0,0|1,0,1]=4 2562 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 7a_100011290783_200025704644 [1,1,0,0,0,0|1,0,1]=4 2563 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 34a_100000702247_200025704644 [1,1,0,0,0,0|1,0,1]=4 2564 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 7a_100000702247_200025704644 [1,1,0,0,0,0|1,0,1]=4 2565 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 34a_100000050133_200025704644 [1,1,0,0,0,0|1,0,1]=4 2566 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 7a_100000050133_200025704644 [1,1,0,0,0,0|1,0,1]=4 2567 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [1,1,0,0,0,0|1,0,1]=4 2568 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,1,0,0,0,0|1,0,1]=4 2569 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,1,0,0,0,0|1,0,1]=4 2570 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 34a_100012353893_200025704644 [1,1,0,0,0,0|1,0,1]=4 2571 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 7a_100012353893_200025704644 [1,1,0,0,0,0|1,0,1]=4 2572 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 34a_100000246287_200025704644 [1,1,0,0,0,0|1,0,1]=4 2573 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 7a_100000246287_200025704644 [1,1,0,0,0,0|1,0,1]=4 2574 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 34a_100000709168_200025704644 [1,1,0,0,0,0|1,0,1]=4 2575 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 7a_100000709168_200025704644 [1,1,0,0,0,0|1,0,1]=4 2576 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 34a_100000211588_200025704644 [1,1,0,0,0,0|1,0,1]=4 2577 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 7a_100000211588_200025704644 [1,1,0,0,0,0|1,0,1]=4 2578 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 34a_100011217911_200025704644 [1,1,0,0,0,0|1,0,1]=4 2579 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 7a_100011217911_200025704644 [1,1,0,0,0,0|1,0,1]=4 2580 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 34a_100000718186_200025704644 [1,1,0,0,0,0|1,0,1]=4 2581 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 7a_100000718186_200025704644 [1,1,0,0,0,0|1,0,1]=4 2582 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 34a_100011533735_200025704644 [1,1,0,0,0,0|1,0,1]=4 2583 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 7a_100011533735_200025704644 [1,1,0,0,0,0|1,0,1]=4 2584 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 34a_100011218299_200025704644 [1,1,0,0,0,0|1,0,1]=4 2585 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 7a_100011218299_200025704644 [1,1,0,0,0,0|1,0,1]=4 2586 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 34a_100011215442_200025704644 [1,1,0,0,0,0|1,0,1]=4 2587 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 7a_100011215442_200025704644 [1,1,0,0,0,0|1,0,1]=4 2588 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 34a_100010149597_200025704644 [1,1,0,0,0,0|1,0,1]=4 2589 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 7a_100010149597_200025704644 [1,1,0,0,0,0|1,0,1]=4 2590 B11R1.192 [13CH3]OCc1ccc(c(c1)F)N 34a_100011217239_200025704644 [1,1,0,0,0,0|1,0,1]=4 2591 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 34a_100000049585_200025704644 [1,1,0,0,0,0|1,0,1]=4 2592 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 7a_100000049585_200025704644 [1,1,0,0,0,0|1,0,1]=4 2593 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Br 34a_100012347568_200025704644 [1,1,0,0,0,0|1,0,1]=4 2594 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Cl 34a_106256033963_200025704644 [1,1,0,0,0,0|1,0,1]=4 2595 B11R1.192 [13CH3]OCc1ccc(c(c1)N)F 34a_102125399562_200025704644 [1,1,0,0,0,0|1,0,1]=4 2596 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [1,1,0,0,0,0|1,0,0]=3 2597 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [1,1,0,0,0,0|1,0,0]=3 2598 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [1,1,0,0,0,0|2,0,0]=4 2599 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [1,1,0,0,0,0|1,0,1]=4 2600 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [1,1,0,0,0,0|2,0,0]=4 2601 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [1,1,0,0,0,0|2,0,0]=4 2602 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [1,1,0,0,0,0|2,0,0]=4 2603 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [1,1,0,0,0,0|1,0,0]=3 2604 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [1,1,0,0,0,0|2,0,0]=4 2605 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [1,1,0,0,0,0|2,0,0]=4 2606 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [1,1,0,0,0,0|1,0,0]=3 2607 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [1,1,0,0,0,0|1,0,0]=3 2608 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [1,1,0,0,0,0|1,0,0]=3 2609 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [1,1,0,0,0,0|1,0,0]=3 2610 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [1,1,0,0,0,0|1,0,0]=3 2611 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [1,1,0,0,0,0|1,1,0]=4 2612 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [1,1,0,0,0,0|1,1,0]=4 2613 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [1,1,0,0,0,0|1,1,0]=4 2614 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [1,1,0,0,0,0|1,1,0]=4 2615 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [1,1,0,0,0,0|1,1,0]=4 2616 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [1,1,0,0,0,0|2,0,0]=4 2617 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [1,1,0,0,0,0|2,0,0]=4 2618 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [1,1,0,0,0,0|2,0,0]=4 2619 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [1,1,0,0,0,0|2,0,0]=4 2620 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [1,1,0,0,0,0|2,0,0]=4 2621 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [1,1,0,0,0,0|1,0,0]=3 2622 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [1,1,0,0,0,0|1,0,0]=3 2623 B11R1.3 C=Cc1ccc(cc1)C(=O)N 271570a_100011290941_100000162191 [1,1,0,0,0,0|2,0,0]=4 2624 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [1,1,0,0,0,0|1,0,0]=3 2625 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [1,1,0,0,0,0|2,0,0]=4 2626 B11R1.3 C=Cc1ccc(cn1)C(=O)C 271570a_100011290941_100000684857 [1,1,0,0,0,0|2,0,0]=4 2627 B11R1.3 C=Cc1ccc(nc1)C(=O)C 271570a_100011290941_100000686046 [1,1,0,0,0,0|2,0,0]=4 2628 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [1,1,0,0,0,0|1,0,0]=3 2629 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [1,1,0,0,0,0|0,0,0]=2 2630 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [1,1,0,0,0,0|0,0,0]=2 2631 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [1,1,0,0,0,0|0,0,0]=2 2632 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [1,1,0,0,0,0|0,1,0]=3 2633 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [1,1,0,0,0,0|0,1,0]=3 2634 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [1,1,0,0,0,0|1,0,0]=3 2635 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [1,1,0,0,0,0|1,0,0]=3 2636 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [1,1,0,0,0,0|1,1,0]=4 2637 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [1,1,0,0,0,0|1,1,0]=4 2638 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [1,1,0,0,0,0|1,1,0]=4 2639 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [1,1,0,0,0,0|1,1,0]=4 2640 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [1,1,0,0,0,0|1,0,1]=4 2641 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [1,1,0,0,0,0|1,0,1]=4 2642 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [1,1,0,0,0,0|0,0,2]=4 2643 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [1,1,0,0,0,0|0,0,2]=4 2644 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [1,1,0,0,0,0|1,0,0]=3 2645 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [1,1,0,0,0,0|1,0,0]=3 2646 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [1,1,0,0,0,0|2,0,0]=4 2647 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [1,1,0,0,0,0|2,0,0]=4 2648 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [1,1,0,0,0,0|2,0,0]=4 2649 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [1,1,0,0,0,0|2,0,0]=4 2650 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [1,1,0,0,0,0|0,0,0]=2 2651 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [1,1,0,0,0,0|0,0,0]=2 2652 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [1,1,0,0,0,0|0,0,0]=2 2653 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [1,1,0,0,0,0|1,0,0]=3 2654 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [1,1,0,0,0,0|1,0,0]=3 2655 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [1,1,0,0,0,0|0,0,0]=2 2656 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [1,1,0,0,0,0|1,0,1]=4 2657 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [1,1,0,0,0,0|1,0,1]=4 2658 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [1,1,0,0,0,0|0,0,2]=4 2659 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [1,1,0,0,0,0|0,0,2]=4 2660 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 2661 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 2662 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 2663 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [1,1,0,0,0,0|2,0,0]=4 2664 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2665 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2666 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2667 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [1,1,0,0,0,0|1,0,0]=3 2668 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [1,1,0,0,0,0|1,0,0]=3 2669 B11R1.3 COc1ccc(cc1)[C@H](C)N 34a_100161106496_200000210301 [1,1,0,0,0,0|1,0,1]=4 2670 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [1,1,0,0,0,0|1,0,1]=4 2671 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [1,1,0,0,0,0|1,0,1]=4 2672 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [1,1,0,0,0,0|2,0,0]=4 2673 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [1,1,0,0,0,0|2,0,0]=4 2674 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [1,1,0,0,0,0|1,0,0]=3 2675 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [1,1,0,0,0,0|1,0,0]=3 2676 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [1,1,0,0,0,0|1,0,0]=3 2677 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [1,1,0,0,0,0|1,0,0]=3 2678 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [1,1,0,0,0,0|1,1,0]=4 2679 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [1,1,0,0,0,0|0,1,0]=3 2680 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [1,1,0,0,0,0|0,1,0]=3 2681 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [1,1,0,0,0,0|0,1,0]=3 2682 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [1,1,0,0,0,0|1,1,0]=4 2683 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [1,1,0,0,0,0|1,1,0]=4 2684 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [1,1,0,0,0,0|0,1,0]=3 2685 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [1,1,0,0,0,0|1,1,0]=4 2686 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [1,1,0,0,0,0|1,1,0]=4 2687 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [1,1,0,0,0,0|1,1,0]=4 2688 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [1,1,0,0,0,0|1,1,0]=4 2689 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [1,1,0,0,0,0|1,1,0]=4 2690 B11R1.3 C[C@H](N)c1ccc(cc1)O[13CH3] 34a_100161106496_200025704644 [1,1,0,0,0,0|1,0,1]=4 2691 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [1,1,0,0,0,0|2,0,0]=4 2692 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [1,1,0,0,0,0|2,0,0]=4 2693 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [1,1,0,0,0,0|1,0,0]=3 2694 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [1,1,0,0,0,0|0,0,0]=2 2695 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [1,1,0,0,0,0|2,0,0]=4 2696 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [1,1,0,0,0,0|1,0,0]=3 2697 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [1,1,0,0,0,0|1,0,0]=3 2698 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [1,1,0,0,0,0|1,0,1]=4 2699 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [1,1,0,0,0,0|1,0,1]=4 2700 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [1,1,0,0,0,0|1,1,0]=4 2701 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [1,1,0,0,0,0|1,1,0]=4 2702 B11R1.19 CC(C)(C)c1ccc(cc1)O 271570a_203496583355_100011215385 [1,1,0,0,0,0|1,0,1]=4 2703 B11R1.19 CC(C)(N)c1ccc(cc1)O 271570a_203496583355_100000739617 [1,1,0,0,0,0|1,0,1]=4 2704 B11R1.19 CC(C)(O)c1ccc(cc1)O 271570a_203496583355_100000753367 [1,1,0,0,0,0|0,0,2]=4 2705 B11R1.19 CC(F)(F)c1ccc(cc1)O 271570a_203496583355_100009817129 [1,1,0,0,0,0|1,0,1]=4 2706 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [1,1,0,0,0,0|1,0,0]=3 2707 B11R1.19 CS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814649 [1,1,0,0,0,0|2,0,0]=4 2708 B11R1.19 CS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100009816761 [1,1,0,0,0,0|2,0,0]=4 2709 B11R1.19 C[Si](C)(C)c1ccc(cc1)O 271570a_203496583355_100009813420 [1,1,0,0,0,0|1,1,0]=4 2710 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [1,1,0,0,0,0|1,0,1]=4 2711 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [1,1,0,0,0,0|2,0,0]=4 2712 B11R1.21 C=C(C)c1cc(c(cn1)O)N 271570a_100000694244_100009819941 [1,1,0,0,0,0|2,0,0]=4 2713 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [1,1,0,0,0,0|2,0,0]=4 2714 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [1,1,0,0,0,0|2,0,0]=4 2715 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [1,1,0,0,0,0|2,0,0]=4 2716 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [1,1,0,0,0,0|2,0,0]=4 2717 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [1,1,0,0,0,0|2,0,0]=4 2718 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [1,1,0,0,0,0|1,0,0]=3 2719 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [1,1,0,0,0,0|2,0,0]=4 2720 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [1,1,0,0,0,0|2,0,0]=4 2721 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [1,1,0,0,0,0|2,0,0]=4 2722 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [1,1,0,0,0,0|2,0,0]=4 2723 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [1,1,0,0,0,0|2,0,0]=4 2724 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [1,1,0,0,0,0|1,0,0]=3 2725 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [1,1,0,0,0,0|2,0,0]=4 2726 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [1,1,0,0,0,0|2,0,0]=4 2727 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [1,1,0,0,0,0|2,0,0]=4 2728 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [1,1,0,0,0,0|2,0,0]=4 2729 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [1,1,0,0,0,0|2,0,0]=4 2730 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [1,1,0,0,0,0|1,0,0]=3 2731 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [1,1,0,0,0,0|2,0,0]=4 2733 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [1,1,0,0,0,0|2,0,0]=4 2734 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [1,1,0,0,0,0|2,0,0]=4 2735 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [1,1,0,0,0,0|2,0,0]=4 2736 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [1,1,0,0,0,0|1,0,0]=3 2737 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [1,1,0,0,0,0|2,0,0]=4 2738 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [1,1,0,0,0,0|2,0,0]=4 2740 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [1,1,0,0,0,0|2,0,0]=4 2741 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [1,1,0,0,0,0|2,0,0]=4 2742 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [1,1,0,0,0,0|1,0,0]=3 2743 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,1,0,0,0,0|2,0,0]=4 2744 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,1,0,0,0,0|2,0,0]=4 2745 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,1,0,0,0,0|2,0,0]=4 2746 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,1,0,0,0,0|2,0,0]=4 2747 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,1,0,0,0,0|2,0,0]=4 2748 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,1,0,0,0,0|1,0,0]=3 2749 B11R1.21 C=C(C)c1ccc(c(n1)Br)O 271570a_100000694244_100000725334 [1,1,0,0,0,0|2,0,0]=4 2750 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [1,1,0,0,0,0|2,0,0]=4 2751 B11R1.21 C=C(C)c1ccc(c(n1)Cl)O 271570a_100000694244_100000721234 [1,1,0,0,0,0|2,0,0]=4 2752 B11R1.21 C=C(C)c1ccc(c(n1)F)O 271570a_100000694244_100009819667 [1,1,0,0,0,0|2,0,0]=4 2753 B11R1.21 C=C(C)c1ccc(c(n1)N)O 271570a_100000694244_100000685527 [1,1,0,0,0,0|2,0,0]=4 2754 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [1,1,0,0,0,0|2,0,0]=4 2755 B11R1.21 C=C(C)c1cnc(c(c1)Cl)O 271570a_100000694244_100010238531 [1,1,0,0,0,0|2,0,0]=4 2756 B11R1.21 C=C(C)c1cnc(c(c1)N)O 271570a_100000694244_100000743729 [1,1,0,0,0,0|2,0,0]=4 2757 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [1,1,0,0,0,0|1,0,0]=3 2758 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [1,1,0,0,0,0|1,0,0]=3 2759 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [1,1,0,0,0,0|1,0,0]=3 2760 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [1,1,0,0,0,0|1,0,0]=3 2761 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [1,1,0,0,0,0|1,0,0]=3 2762 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [1,1,0,0,0,0|1,0,0]=3 2763 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,1,0,0,0,0|0,0,0]=2 2764 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,1,0,0,0,0|0,0,0]=2 2765 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [1,1,0,0,0,0|1,0,0]=3 2766 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [1,1,0,0,0,0|1,0,0]=3 2767 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [1,1,0,0,0,0|1,0,0]=3 2768 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [1,1,0,0,0,0|1,0,0]=3 2769 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [1,1,0,0,0,0|1,0,0]=3 2770 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,1,0,0,0,0|0,0,0]=2 2771 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,1,0,0,0,0|0,0,0]=2 2772 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [1,1,0,0,0,0|1,0,0]=3 2773 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [1,1,0,0,0,0|1,0,0]=3 2774 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [1,1,0,0,0,0|1,0,0]=3 2775 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [1,1,0,0,0,0|1,0,0]=3 2776 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [1,1,0,0,0,0|1,0,0]=3 2777 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,1,0,0,0,0|0,0,0]=2 2778 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [1,1,0,0,0,0|1,0,0]=3 2779 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [1,1,0,0,0,0|1,0,0]=3 2780 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [1,1,0,0,0,0|1,0,0]=3 2781 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [1,1,0,0,0,0|1,0,0]=3 2782 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [1,1,0,0,0,0|1,0,0]=3 2783 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,1,0,0,0,0|0,0,0]=2 2784 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,1,0,0,0,0|0,0,0]=2 2785 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [1,1,0,0,0,0|1,0,0]=3 2786 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [1,1,0,0,0,0|1,0,0]=3 2787 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [1,1,0,0,0,0|1,0,0]=3 2788 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [1,1,0,0,0,0|1,0,0]=3 2789 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [1,1,0,0,0,0|1,0,0]=3 2790 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,1,0,0,0,0|0,0,0]=2 2791 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,1,0,0,0,0|0,0,0]=2 2792 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,1,0,0,0,0|1,0,0]=3 2793 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,1,0,0,0,0|1,0,0]=3 2794 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,1,0,0,0,0|1,0,0]=3 2795 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,1,0,0,0,0|1,0,0]=3 2796 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,1,0,0,0,0|1,0,0]=3 2797 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,1,0,0,0,0|1,0,0]=3 2798 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,1,0,0,0,0|1,0,0]=3 2799 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,1,0,0,0,0|1,0,0]=3 2800 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,1,0,0,0,0|1,0,0]=3 2801 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,1,0,0,0,0|0,0,0]=2 2802 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,1,0,0,0,0|0,0,0]=2 2803 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [1,1,0,0,0,0|1,0,0]=3 2804 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [1,1,0,0,0,0|2,0,0]=4 2805 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [1,1,0,0,0,0|1,0,1]=4 2806 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [1,1,0,0,0,0|1,0,1]=4 2807 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [1,1,0,0,0,0|1,0,0]=3 2808 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [1,1,0,0,0,0|1,0,0]=3 2809 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [1,1,0,0,0,0|1,0,0]=3 2810 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [1,1,0,0,0,0|1,0,0]=3 2811 B11R1.21 Cc1cc(ccc1O)B(O)O 271570a_203496583355_100010089846 [1,1,0,0,0,0|1,0,1]=4 2812 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,1,0,0,0,0|1,0,0]=3 2813 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,1,0,0,0,0|0,0,0]=2 2814 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [1,1,0,0,0,0|2,0,0]=4 2815 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [1,1,0,0,0,0|1,0,0]=3 2816 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [1,1,0,0,0,0|1,0,0]=3 2817 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [1,1,0,0,0,0|1,0,0]=3 2818 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [1,1,0,0,0,0|1,0,0]=3 2819 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [1,1,0,0,0,0|1,0,0]=3 2820 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,1,0,0,0,0|2,0,0]=4 2821 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,1,0,0,0,0|1,0,0]=3 2822 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,1,0,0,0,0|1,0,0]=3 2823 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,1,0,0,0,0|1,0,0]=3 2824 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,1,0,0,0,0|2,0,0]=4 2825 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,1,0,0,0,0|1,0,0]=3 2826 B11R1.21 OB(O)c1ccc(c(c1)F)O 271570a_203496583355_100009813512 [1,1,0,0,0,0|1,0,1]=4 2827 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [1,1,0,0,0,0|1,0,0]=3 2828 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [1,1,0,0,0,0|1,0,0]=3 2829 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [1,1,0,0,0,0|1,0,0]=3 2830 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [1,1,0,0,0,0|1,0,0]=3 2831 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,1,0,0,0,0|0,0,0]=2 2832 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [1,1,0,0,0,0|1,0,0]=3 2833 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [1,1,0,0,0,0|1,0,0]=3 2834 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [1,1,0,0,0,0|1,0,0]=3 2835 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [1,1,0,0,0,0|1,0,0]=3 2836 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,1,0,0,0,0|0,0,0]=2 2837 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [1,1,0,0,0,0|1,0,0]=3 2838 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [1,1,0,0,0,0|1,0,0]=3 2839 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [1,1,0,0,0,0|1,0,0]=3 2840 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [1,1,0,0,0,0|1,0,0]=3 2841 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,1,0,0,0,0|0,0,0]=2 2842 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [1,1,0,0,0,0|1,0,0]=3 2843 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [1,1,0,0,0,0|1,0,0]=3 2844 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [1,1,0,0,0,0|1,0,0]=3 2845 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [1,1,0,0,0,0|1,0,0]=3 2846 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,1,0,0,0,0|0,0,0]=2 2847 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,1,0,0,0,0|1,0,0]=3 2848 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,1,0,0,0,0|1,0,0]=3 2849 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,1,0,0,0,0|1,0,0]=3 2850 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,1,0,0,0,0|1,0,0]=3 2851 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,1,0,0,0,0|0,0,0]=2 2852 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [1,1,0,0,0,0|2,0,0]=4 2853 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [1,1,0,0,0,0|2,0,0]=4 2854 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [1,1,0,0,0,0|2,0,0]=4 2855 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [1,1,0,0,0,0|2,0,0]=4 2856 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [1,1,0,0,0,0|2,0,0]=4 2857 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [1,1,0,0,0,0|1,0,0]=3 2858 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [1,1,0,0,0,0|2,0,0]=4 2859 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [1,1,0,0,0,0|2,0,0]=4 2860 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [1,1,0,0,0,0|2,0,0]=4 2861 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [1,1,0,0,0,0|2,0,0]=4 2862 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [1,1,0,0,0,0|2,0,0]=4 2863 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [1,1,0,0,0,0|1,0,0]=3 2864 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [1,1,0,0,0,0|2,0,0]=4 2865 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [1,1,0,0,0,0|2,0,0]=4 2866 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [1,1,0,0,0,0|2,0,0]=4 2868 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [1,1,0,0,0,0|2,0,0]=4 2869 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [1,1,0,0,0,0|1,0,0]=3 2870 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [1,1,0,0,0,0|2,0,0]=4 2871 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [1,1,0,0,0,0|2,0,0]=4 2872 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [1,1,0,0,0,0|2,0,0]=4 2873 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [1,1,0,0,0,0|2,0,0]=4 2874 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [1,1,0,0,0,0|2,0,0]=4 2875 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [1,1,0,0,0,0|1,0,0]=3 2876 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [1,1,0,0,0,0|2,0,0]=4 2877 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [1,1,0,0,0,0|2,0,0]=4 2878 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [1,1,0,0,0,0|2,0,0]=4 2879 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [1,1,0,0,0,0|2,0,0]=4 2880 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [1,1,0,0,0,0|2,0,0]=4 2881 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,1,0,0,0,0|1,0,0]=3 2882 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [1,1,0,0,0,0|2,0,0]=4 2883 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [1,1,0,0,0,0|2,0,0]=4 2884 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [1,1,0,0,0,0|2,0,0]=4 2885 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [1,1,0,0,0,0|2,0,0]=4 2886 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [1,1,0,0,0,0|1,0,0]=3 2887 B11R1.166 C=C(C)c1ccc(nc1C)O 271570a_100000694244_100000691680 [1,1,0,0,0,0|2,0,0]=4 2888 B11R1.166 C=C(C)c1ccc(nc1F)O 271570a_100000694244_100009879308 [1,1,0,0,0,0|2,0,0]=4 2889 B11R1.166 C=C(C)c1cnc(cc1C)O 271570a_100000694244_100010114363 [1,1,0,0,0,0|2,0,0]=4 2890 B11R1.166 C=C(C)c1ncc(cc1C)O 271570a_100000694244_100012000486 [1,1,0,0,0,0|2,0,0]=4 2891 B11R1.166 C=C(C)c1ncc(cc1F)O 271570a_100000694244_100000063512 [1,1,0,0,0,0|2,0,0]=4 2892 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [1,1,0,0,0,0|1,0,0]=3 2893 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [1,1,0,0,0,0|1,0,0]=3 2894 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [1,1,0,0,0,0|1,0,0]=3 2895 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [1,1,0,0,0,0|1,0,0]=3 2896 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [1,1,0,0,0,0|1,0,0]=3 2897 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,1,0,0,0,0|0,0,0]=2 2898 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [1,1,0,0,0,0|1,0,0]=3 2899 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [1,1,0,0,0,0|1,0,0]=3 2900 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [1,1,0,0,0,0|1,0,0]=3 2901 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [1,1,0,0,0,0|1,0,0]=3 2902 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [1,1,0,0,0,0|1,0,0]=3 2903 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,1,0,0,0,0|0,0,0]=2 2904 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,1,0,0,0,0|0,0,0]=2 2905 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [1,1,0,0,0,0|1,0,0]=3 2906 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [1,1,0,0,0,0|1,0,0]=3 2907 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [1,1,0,0,0,0|1,0,0]=3 2908 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [1,1,0,0,0,0|1,0,0]=3 2909 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [1,1,0,0,0,0|1,0,0]=3 2910 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,1,0,0,0,0|0,0,0]=2 2911 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [1,1,0,0,0,0|1,0,0]=3 2912 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [1,1,0,0,0,0|1,0,0]=3 2913 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [1,1,0,0,0,0|1,0,0]=3 2914 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [1,1,0,0,0,0|1,0,0]=3 2915 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [1,1,0,0,0,0|1,0,0]=3 2916 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,1,0,0,0,0|0,0,0]=2 2917 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,1,0,0,0,0|0,0,0]=2 2918 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [1,1,0,0,0,0|1,0,0]=3 2919 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [1,1,0,0,0,0|1,0,0]=3 2920 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [1,1,0,0,0,0|1,0,0]=3 2921 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [1,1,0,0,0,0|1,0,0]=3 2922 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,1,0,0,0,0|0,0,0]=2 2923 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [1,1,0,0,0,0|1,0,0]=3 2924 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [1,1,0,0,0,0|1,0,0]=3 2925 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [1,1,0,0,0,0|1,0,0]=3 2926 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [1,1,0,0,0,0|1,0,0]=3 2927 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [1,1,0,0,0,0|1,0,0]=3 2928 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [1,1,0,0,0,0|1,0,0]=3 2929 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [1,1,0,0,0,0|1,0,0]=3 2930 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,1,0,0,0,0|0,0,0]=2 2931 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,1,0,0,0,0|0,0,0]=2 2932 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,1,0,0,0,0|0,0,0]=2 2933 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [1,1,0,0,0,0|1,0,0]=3 2934 B11R1.166 CC(N)c1ccc(cc1F)O 271570a_203496583355_100000730447 [1,1,0,0,0,0|1,0,1]=4 2935 B11R1.166 CN(C)c1ccc(cc1N)O 271570a_203496583355_100000737018 [1,1,0,0,0,0|2,0,0]=4 2936 B11R1.166 Cc1cc(ccc1B(O)O)O 271570a_203496583355_100010074995 [1,1,0,0,0,0|1,0,1]=4 2937 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,1,0,0,0,0|1,0,0]=3 2938 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [1,1,0,0,0,0|1,0,0]=3 2939 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [1,1,0,0,0,0|1,0,0]=3 2940 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [1,1,0,0,0,0|1,0,0]=3 2941 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [1,1,0,0,0,0|1,0,0]=3 2942 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,1,0,0,0,0|0,0,0]=2 2943 B11R1.166 Cc1cc(ccc1N(C)C)O 269982a_100161107805_200000210301 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.166 Cc1cc(ccc1N(C)C)O 34a_100161107805_200000210301 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 269982a_100161107805_200025704644 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 34a_100161107805_200025704644 [1,1,0,0,0,0|2,0,0]=4 2947 B11R1.166 Cc1cc(ncc1C(=O)N)O 271570a_203496583355_200134614278 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [1,1,0,0,0,0|1,0,0]=3 2949 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [1,1,0,0,0,0|1,0,0]=3 2950 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [1,1,0,0,0,0|1,0,0]=3 2951 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [1,1,0,0,0,0|1,0,0]=3 2952 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [1,1,0,0,0,0|1,0,0]=3 2953 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [1,1,0,0,0,0|1,0,0]=3 2954 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,1,0,0,0,0|1,0,0]=3 2955 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,1,0,0,0,0|1,0,0]=3 2956 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,1,0,0,0,0|1,0,0]=3 2957 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [1,1,0,0,0,0|2,0,0]=4 2958 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [1,1,0,0,0,0|2,0,0]=4 2959 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,1,0,0,0,0|1,0,0]=3 2960 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [1,1,0,0,0,0|2,0,0]=4 2961 B11R1.166 NC(=O)c1ncc(cc1F)O 271570a_203496583355_200010161073 [1,1,0,0,0,0|2,0,0]=4 2962 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [1,1,0,0,0,0|2,0,0]=4 2963 B11R1.166 OB(O)c1ccc(cc1F)O 271570a_203496583355_100009813958 [1,1,0,0,0,0|1,0,1]=4 2964 B11R1.166 OB(O)c1ccc(cc1O)O 271570a_203496583355_100010158982 [1,1,0,0,0,0|1,0,1]=4 2965 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [1,1,0,0,0,0|1,0,0]=3 2966 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [1,1,0,0,0,0|1,0,0]=3 2967 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [1,1,0,0,0,0|1,0,0]=3 2968 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [1,1,0,0,0,0|1,0,0]=3 2969 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,1,0,0,0,0|0,0,0]=2 2970 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [1,1,0,0,0,0|1,0,0]=3 2971 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [1,1,0,0,0,0|1,0,0]=3 2972 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [1,1,0,0,0,0|1,0,0]=3 2973 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [1,1,0,0,0,0|1,0,0]=3 2974 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,1,0,0,0,0|0,0,0]=2 2975 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [1,1,0,0,0,0|1,0,0]=3 2976 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [1,1,0,0,0,0|1,0,0]=3 2977 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [1,1,0,0,0,0|1,0,0]=3 2978 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [1,1,0,0,0,0|1,0,0]=3 2979 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,1,0,0,0,0|0,0,0]=2 2980 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [1,1,0,0,0,0|1,0,0]=3 2981 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [1,1,0,0,0,0|1,0,0]=3 2982 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [1,1,0,0,0,0|1,0,0]=3 2983 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [1,1,0,0,0,0|1,0,0]=3 2984 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [1,1,0,0,0,0|1,0,0]=3 2985 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [1,1,0,0,0,0|1,0,0]=3 2986 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [1,1,0,0,0,0|1,0,0]=3 2987 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,1,0,0,0,0|0,0,0]=2 2988 B11R1.7 CC(C)(O[13CH3])c1ccccc1 7a_100000694644_200025704644 [1,1,0,0,0,0|1,0,1]=4 2989 B11R1.7 CNS(=O)(=O)c1ccccc1 270084a_100102657272_100000210345 [1,1,0,0,0,0|2,0,0]=4 2990 B11R1.7 CNS(=O)(=O)c1ccccc1 274078a_100102657272_100000210345 [1,1,0,0,0,0|2,0,0]=4 2991 B11R1.7 CNS(=O)(=O)c1ccccc1 40a_100102657272_100000032697 [1,1,0,0,0,0|2,0,0]=4 2992 B11R1.7 COC(C)(C)c1ccccc1 7a_100000694644_200000210301 [1,1,0,0,0,0|1,0,1]=4 2993 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 2994 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 2995 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 2996 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 2997 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 2998 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 2999 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 3000 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 3001 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [1,1,0,0,0,0|1,0,1]=4 3002 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [1,1,0,0,0,0|1,0,1]=4 3003 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [1,1,0,0,0,0|1,0,1]=4 3004 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [1,1,0,0,0,0|1,0,1]=4 3005 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [1,1,0,0,0,0|1,0,1]=4 3006 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [1,1,0,0,0,0|1,0,1]=4 3007 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [1,1,0,0,0,0|1,0,1]=4 3008 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [1,1,0,0,0,0|1,0,1]=4 3009 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [1,1,0,0,0,0|1,0,1]=4 3010 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [1,1,0,0,0,0|1,0,1]=4 3011 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [1,1,0,0,0,0|1,0,1]=4 3012 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [1,1,0,0,0,0|1,0,1]=4 3013 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [1,1,0,0,0,0|1,0,1]=4 3014 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [1,1,0,0,0,0|1,0,1]=4 3015 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [1,1,0,0,0,0|1,0,1]=4 3016 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [1,1,0,0,0,0|1,0,1]=4 3017 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [1,1,0,0,0,0|1,0,1]=4 3018 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [1,1,0,0,0,0|1,0,1]=4 3019 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [1,1,0,0,0,0|1,0,0]=3 3020 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [1,1,0,0,0,0|1,0,0]=3 3021 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [1,1,0,0,0,0|1,0,0]=3 3022 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [1,1,0,0,0,0|1,0,0]=3 3023 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [1,1,0,0,0,0|1,0,1]=4 3024 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [1,1,0,0,0,0|1,0,1]=4 3025 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [1,1,0,0,0,0|1,0,1]=4 3026 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [1,1,0,0,0,0|1,0,0]=3 3027 B11R1.16 CNCC(=O)c1ccccn1 34a_100102657272_100000027445 [1,1,0,0,0,0|2,0,0]=4 3028 B11R1.16 CNCC(=O)c1ccccn1 7a_106832991635_100000027445 [1,1,0,0,0,0|2,0,0]=4 3029 B11R1.16 CNCC(=O)c1ccncc1 7a_106832991635_100015248511 [1,1,0,0,0,0|2,0,0]=4 3030 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [1,1,0,0,0,0|1,0,0]=3 3031 B11R1.16 COCC(=O)c1ccccn1 34a_100138415774_100000027445 [1,1,0,0,0,0|1,0,0]=3 3032 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [1,1,0,0,0,0|1,0,1]=4 3033 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [1,1,0,0,0,0|1,0,1]=4 3034 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [1,1,0,0,0,0|1,0,1]=4 3035 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [1,1,0,0,0,0|0,0,2]=4 3036 B11R1.16 COCN(C)c1ccccc1 2230a_100000210012_100000766300 [1,1,0,0,0,0|2,0,0]=4 3037 B11R1.16 COCN(C)c1ccccc1 269982a_100000210012_100000766300 [1,1,0,0,0,0|2,0,0]=4 3038 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [1,1,0,0,0,0|1,0,1]=4 3039 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [1,1,0,0,0,0|0,0,2]=4 3040 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [1,1,0,0,0,0|0,1,0]=3 3041 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [1,1,0,0,0,0|0,1,0]=3 3042 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [1,1,0,0,0,0|1,1,0]=4 3043 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [1,1,0,0,0,0|1,1,0]=4 3044 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [1,1,0,0,0,0|1,1,0]=4 3045 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [1,1,0,0,0,0|1,1,0]=4 3046 B11R1.16 CSCC(=O)c1ccncc1 62a_100000027454_200000210301 [1,1,0,0,0,0|1,1,0]=4 3047 B11R1.16 CSCC(=O)c1ccncc1 62a_200000210301_100000027454 [1,1,0,0,0,0|1,1,0]=4 3048 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [1,1,0,0,0,0|1,1,0]=4 3049 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [1,1,0,0,0,0|1,0,1]=4 3050 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [1,1,0,0,0,0|1,0,1]=4 3051 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [1,1,0,0,0,0|1,0,1]=4 3052 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [1,1,0,0,0,0|1,0,0]=3 3053 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [1,1,0,0,0,0|1,0,0]=3 3054 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [1,1,0,0,0,0|1,0,1]=4 3055 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [1,1,0,0,0,0|0,1,0]=3 3056 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [1,1,0,0,0,0|0,1,0]=3 3057 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [1,1,0,0,0,0|1,1,0]=4 3058 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [1,1,0,0,0,0|1,1,0]=4 3059 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [1,1,0,0,0,0|1,1,0]=4 3060 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [1,1,0,0,0,0|1,1,0]=4 3061 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_100000027454_200025704644 [1,1,0,0,0,0|1,1,0]=4 3062 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_200025704644_100000027454 [1,1,0,0,0,0|1,1,0]=4 3063 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [1,1,0,0,0,0|1,1,0]=4 3064 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [1,1,0,0,0,0|1,0,1]=4 3065 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [1,1,0,0,0,0|1,0,1]=4 3066 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [1,1,0,0,0,0|1,0,1]=4 3067 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [1,1,0,0,0,0|1,0,1]=4 3068 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [1,1,0,0,0,0|1,0,1]=4 3069 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [1,1,0,0,0,0|1,0,1]=4 3070 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [1,1,0,0,0,0|1,0,1]=4 3071 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [1,1,0,0,0,0|1,0,1]=4 3072 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [1,1,0,0,0,0|1,0,0]=3 3074 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [1,1,0,0,0,0|1,0,0]=3 3075 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [1,1,0,0,0,0|1,0,0]=3 3076 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [1,1,0,0,0,0|1,0,0]=3 3077 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [1,1,0,0,0,0|1,0,0]=3 3078 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [1,1,0,0,0,0|1,0,0]=3 3079 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [1,1,0,0,0,0|1,0,0]=3 3080 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [1,1,0,0,0,0|2,0,0]=4 3081 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [1,1,0,0,0,0|2,0,0]=4 3082 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [1,1,0,0,0,0|1,0,0]=3 3083 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 3084 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 3085 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 3086 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [1,1,0,0,0,0|1,0,0]=3 3087 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [1,1,0,0,0,0|1,0,0]=3 3088 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [1,1,0,0,0,0|1,0,0]=3 3089 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [1,1,0,0,0,0|1,0,0]=3 3090 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [1,1,0,0,0,0|1,0,0]=3 3091 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 3092 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 3093 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 3094 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [1,1,0,0,0,0|1,0,0]=3 3095 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 3096 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 3097 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 3098 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [1,1,0,0,0,0|1,0,0]=3 3099 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 3100 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 3101 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 3102 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 3103 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [1,1,0,0,0,0|1,0,0]=3 3104 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 3105 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [1,1,0,0,0,0|2,0,0]=4 3106 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [1,1,0,0,0,0|2,0,0]=4 3107 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [1,1,0,0,0,0|2,0,0]=4 3108 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [1,1,0,0,0,0|1,0,0]=3 3109 B11R1.23 COC(=O)c1cc(ncn1)O 271570a_203496583355_100000051410 [1,1,0,0,0,0|2,0,0]=4 3110 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [1,1,0,0,0,0|0,0,0]=2 3111 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [1,1,0,0,0,0|1,0,0]=3 3112 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [1,1,0,0,0,0|1,0,0]=3 3113 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [1,1,0,0,0,0|1,0,0]=3 3115 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [1,1,0,0,0,0|2,0,0]=4 3116 B11R1.23 COC(=O)c1cnnc(c1)O 271570a_203496583355_100009862058 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [1,1,0,0,0,0|1,0,1]=4 3118 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [1,1,0,0,0,0|1,0,1]=4 3119 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [1,1,0,0,0,0|1,0,1]=4 3120 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [1,1,0,0,0,0|1,0,1]=4 3121 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [1,1,0,0,0,0|1,0,1]=4 3122 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [1,1,0,0,0,0|1,0,1]=4 3123 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [1,1,0,0,0,0|1,0,1]=4 3124 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [1,1,0,0,0,0|1,0,1]=4 3125 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [1,1,0,0,0,0|1,0,1]=4 3126 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [1,1,0,0,0,0|1,0,1]=4 3127 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [1,1,0,0,0,0|1,0,1]=4 3128 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [1,1,0,0,0,0|1,0,1]=4 3129 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [1,1,0,0,0,0|1,0,1]=4 3130 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [1,1,0,0,0,0|1,0,1]=4 3131 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [1,1,0,0,0,0|1,0,1]=4 3133 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [1,1,0,0,0,0|1,0,1]=4 3134 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [1,1,0,0,0,0|2,0,0]=4 3135 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [1,1,0,0,0,0|2,0,0]=4 3138 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [1,1,0,0,0,0|2,0,0]=4 3140 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [1,1,0,0,0,0|2,0,0]=4 3141 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [1,1,0,0,0,0|2,0,0]=4 3142 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [1,1,0,0,0,0|2,0,0]=4 3143 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [1,1,0,0,0,0|2,0,0]=4 3144 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [1,1,0,0,0,0|2,0,0]=4 3145 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [1,1,0,0,0,0|2,0,0]=4 3146 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [1,1,0,0,0,0|1,0,0]=3 3147 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [1,1,0,0,0,0|1,0,0]=3 3148 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [1,1,0,0,0,0|1,0,0]=3 3149 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [1,1,0,0,0,0|1,0,0]=3 3150 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [1,1,0,0,0,0|1,0,0]=3 3151 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [1,1,0,0,0,0|1,0,1]=4 3152 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [1,1,0,0,0,0|1,0,1]=4 3153 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [1,1,0,0,0,0|1,0,1]=4 3154 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [1,1,0,0,0,0|1,0,1]=4 3155 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [1,1,0,0,0,0|1,0,1]=4 3156 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [1,1,0,0,0,0|1,0,1]=4 3157 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [1,1,0,0,0,0|1,0,1]=4 3158 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [1,1,0,0,0,0|1,0,0]=3 3159 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [1,1,0,0,0,0|1,0,0]=3 3160 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [1,1,0,0,0,0|1,0,0]=3 3161 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [1,1,0,0,0,0|1,0,0]=3 3162 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [1,1,0,0,0,0|1,0,0]=3 3163 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [1,1,0,0,0,0|1,0,0]=3 3164 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [1,1,0,0,0,0|1,0,0]=3 3165 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [1,1,0,0,0,0|1,0,0]=3 3166 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 3167 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 3168 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 3169 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [1,1,0,0,0,0|1,0,0]=3 3170 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 3171 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 3172 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 3173 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [1,1,0,0,0,0|1,0,0]=3 3174 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 3175 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 3176 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 3177 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [1,1,0,0,0,0|1,0,0]=3 3178 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 3179 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 3180 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 3181 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [1,1,0,0,0,0|1,0,0]=3 3182 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 3183 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 3184 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 3185 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [1,1,0,0,0,0|1,0,0]=3 3186 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [1,1,0,0,0,0|1,0,0]=3 3187 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [1,1,0,0,0,0|1,0,0]=3 3188 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [1,1,0,0,0,0|1,0,0]=3 3189 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [1,1,0,0,0,0|1,0,0]=3 3190 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [1,1,0,0,0,0|0,0,0]=2 3192 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [1,1,0,0,0,0|1,0,0]=3 3193 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [1,1,0,0,0,0|1,0,0]=3 3194 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [1,1,0,0,0,0|1,0,0]=3 3195 B11R1.222 COC(=O)c1cncnc1O 271570a_203496583355_100000726419 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [1,1,0,0,0,0|1,0,0]=3 3197 B11R1.222 COC(=O)c1nccnc1O 271570a_203496583355_100000688410 [1,1,0,0,0,0|2,0,0]=4 3198 B11R1.222 COC(=O)c1ncncc1O 271570a_203496583355_100012360100 [1,1,0,0,0,0|2,0,0]=4 3199 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [1,1,0,0,0,0|1,0,1]=4 3200 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [1,1,0,0,0,0|1,0,1]=4 3201 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [1,1,0,0,0,0|1,0,1]=4 3202 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [1,1,0,0,0,0|1,0,1]=4 3203 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [1,1,0,0,0,0|1,0,1]=4 3204 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [1,1,0,0,0,0|1,0,1]=4 3205 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [1,1,0,0,0,0|1,0,1]=4 3206 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [1,1,0,0,0,0|1,0,1]=4 3207 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [1,1,0,0,0,0|1,0,1]=4 3208 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [1,1,0,0,0,0|1,0,1]=4 3209 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [1,1,0,0,0,0|2,0,0]=4 3210 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [1,1,0,0,0,0|1,0,1]=4 3211 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [1,1,0,0,0,0|1,0,1]=4 3212 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [1,1,0,0,0,0|2,0,0]=4 3213 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [1,1,0,0,0,0|2,0,0]=4 3214 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [1,1,0,0,0,0|2,0,0]=4 3215 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [1,1,0,0,0,0|2,0,0]=4 3216 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [1,1,0,0,0,0|2,0,0]=4 3217 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [1,1,0,0,0,0|2,0,0]=4 3218 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [1,1,0,0,0,0|2,0,0]=4 3219 B11R1.15 CCNC(=O)c1ccc(s1)O 271570a_203496583355_200000155171 [0,1,0,0,1,0|2,0,0]=4 3220 B11R1.15 CCOC(=O)c1c[nH]c(n1)O 271570a_203496583355_100010231773 [0,1,0,0,1,0|2,0,0]=4 3221 B11R1.15 CCOC(=O)c1cc([nH]n1)O 271570a_203496583355_100010743333 [0,1,0,0,1,0|2,0,0]=4 3222 B11R1.15 CCOC(=O)c1cc(cs1)O 271570a_203496583355_100009815474 [0,1,0,0,1,0|1,0,0]=3 3223 B11R1.15 CCOC(=O)c1ccc([nH]1)O 271570a_203496583355_200000687776 [0,1,0,0,1,0|1,0,0]=3 3224 B11R1.15 CCOC(=O)c1ccc(o1)O 271570a_203496583355_200000170220 [0,1,0,0,1,0|1,0,0]=3 3225 B11R1.15 CCOC(=O)c1ccc(s1)O 271570a_203496583355_100000172375 [0,1,0,0,1,0|1,0,0]=3 3226 B11R1.15 CCOC(=O)c1cnc(o1)O 271570a_203496583355_100010205802 [0,1,0,0,1,0|2,0,0]=4 3227 B11R1.15 CCOC(=O)c1cnc(s1)O 271570a_203496583355_100009814955 [0,1,0,0,1,0|2,0,0]=4 3228 B11R1.15 CCOC(=O)c1coc(n1)O 271570a_203496583355_100011935043 [0,1,0,0,1,0|2,0,0]=4 3229 B11R1.15 CCOC(=O)c1csc(c1)O 271570a_203496583355_100011228516 [0,1,0,0,1,0|1,0,0]=3 3230 B11R1.15 CCOC(=O)c1csc(n1)O 271570a_203496583355_100009814092 [0,1,0,0,1,0|2,0,0]=4 3231 B11R1.15 CCOC(=O)c1nc(cs1)O 271570a_203496583355_200012359684 [0,1,0,0,1,0|2,0,0]=4 3232 B11R1.15 CCOC(=O)c1ncc([nH]1)O 271570a_203496583355_100010172669 [0,1,0,0,1,0|2,0,0]=4 3233 B11R1.15 CCOC(=O)c1ncc(s1)O 271570a_203496583355_100012362614 [0,1,0,0,1,0|2,0,0]=4 3234 B11R1.15 COCC(=O)c1ccc(s1)C 34a_100138415774_100011262362 [0,1,0,0,1,0|2,0,0]=4 3235 B11R1.44 C=Cc1cc(c[nH]1)C(=O)OC 271570a_100011290941_100009840242 [0,1,0,0,1,0|2,0,0]=4 3236 B11R1.44 C=Cc1cc(cs1)C(=O)OC 271570a_100011290941_100000692058 [0,1,0,0,1,0|2,0,0]=4 3237 B11R1.44 C=Cc1ccc([nH]1)C(=O)OC 271570a_100011290941_100000687774 [0,1,0,0,1,0|2,0,0]=4 3238 B11R1.44 C=Cc1ccc(o1)C(=O)OC 271570a_100011290941_100000148852 [0,1,0,0,1,0|2,0,0]=4 3239 B11R1.44 C=Cc1ccc(s1)C(=O)OC 271570a_100011290941_100000148107 [0,1,0,0,1,0|2,0,0]=4 3240 B11R1.44 C=Cc1coc(c1)C(=O)OC 271570a_100011290941_100009992624 [0,1,0,0,1,0|2,0,0]=4 3241 B11R1.44 C=Cc1csc(c1)C(=O)OC 271570a_100011290941_100009815473 [0,1,0,0,1,0|2,0,0]=4 3242 B11R1.44 COC(=O)c1c[nH]c(c1)SC 62a_100009840242_200000210301 [0,1,0,0,1,0|1,1,0]=4 3243 B11R1.44 COC(=O)c1c[nH]c(c1)SC 62a_200000210301_100009840242 [0,1,0,0,1,0|1,1,0]=4 3244 B11R1.44 COC(=O)c1c[nH]c(c1)S[13CH3] 62a_100009840242_200025704644 [0,1,0,0,1,0|1,1,0]=4 3245 B11R1.44 COC(=O)c1c[nH]c(c1)S[13CH3] 62a_200025704644_100009840242 [0,1,0,0,1,0|1,1,0]=4 3246 B11R1.44 COC(=O)c1cc(c[nH]1)SC 62a_200000210301_100000205823 [0,1,0,0,1,0|1,1,0]=4 3247 B11R1.44 COC(=O)c1cc(c[nH]1)S[13CH3] 62a_200025704644_100000205823 [0,1,0,0,1,0|1,1,0]=4 3248 B11R1.44 COC(=O)c1cc(co1)SC 62a_200000210301_100009992624 [0,1,0,0,1,0|1,1,0]=4 3249 B11R1.44 COC(=O)c1cc(co1)S[13CH3] 62a_200025704644_100009992624 [0,1,0,0,1,0|1,1,0]=4 3250 B11R1.44 COC(=O)c1cc(cs1)SC 62a_100009815473_200000210301 [0,1,0,0,1,0|1,1,0]=4 3251 B11R1.44 COC(=O)c1cc(cs1)SC 62a_200000210301_100009815473 [0,1,0,0,1,0|1,1,0]=4 3252 B11R1.44 COC(=O)c1cc(cs1)S[13CH3] 62a_100009815473_200025704644 [0,1,0,0,1,0|1,1,0]=4 3253 B11R1.44 COC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100009815473 [0,1,0,0,1,0|1,1,0]=4 3254 B11R1.44 COC(=O)c1ccc([nH]1)SC 62a_200000210301_100000687774 [0,1,0,0,1,0|1,1,0]=4 3255 B11R1.44 COC(=O)c1ccc([nH]1)S[13CH3] 62a_200025704644_100000687774 [0,1,0,0,1,0|1,1,0]=4 3256 B11R1.44 COC(=O)c1ccc(o1)SC 62a_200000210301_100000148852 [0,1,0,0,1,0|1,1,0]=4 3257 B11R1.44 COC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000148852 [0,1,0,0,1,0|1,1,0]=4 3258 B11R1.44 COC(=O)c1ccc(s1)SC 62a_100000148107_200000210301 [0,1,0,0,1,0|1,1,0]=4 3259 B11R1.44 COC(=O)c1ccc(s1)SC 62a_200000210301_100000148107 [0,1,0,0,1,0|1,1,0]=4 3260 B11R1.44 COC(=O)c1ccc(s1)S[13CH3] 62a_100000148107_200025704644 [0,1,0,0,1,0|1,1,0]=4 3261 B11R1.44 COC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_100000148107 [0,1,0,0,1,0|1,1,0]=4 3262 B11R1.44 COC(=O)c1csc(c1)SC 62a_100000692058_200000210301 [0,1,0,0,1,0|1,1,0]=4 3263 B11R1.44 COC(=O)c1csc(c1)SC 62a_200000210301_100000692058 [0,1,0,0,1,0|1,1,0]=4 3264 B11R1.44 COC(=O)c1csc(c1)S[13CH3] 62a_100000692058_200025704644 [0,1,0,0,1,0|1,1,0]=4 3265 B11R1.44 COC(=O)c1csc(c1)S[13CH3] 62a_200025704644_100000692058 [0,1,0,0,1,0|1,1,0]=4 3266 B11R1.225 COC(=O)c1cc(cn1C)O 271570a_203496583355_100000240937 [0,1,0,0,1,0|1,0,0]=3 3267 B11R1.225 COC(=O)c1cc(nn1C)O 271570a_203496583355_100014069049 [0,1,0,0,1,0|2,0,0]=4 3268 B11R1.225 COC(=O)c1cc(sc1C)O 271570a_203496583355_100010187159 [0,1,0,0,1,0|1,0,0]=3 3269 B11R1.225 COC(=O)c1cc(sc1O)C 271570a_203496583355_100009817063 [0,1,0,0,1,0|2,0,0]=4 3270 B11R1.225 COC(=O)c1nc(cn1C)O 271570a_203496583355_100010173829 [0,1,0,0,1,0|2,0,0]=4 3271 B11R1.225 COC(=O)c1nc(sc1C)O 271570a_203496583355_100000719214 [0,1,0,0,1,0|2,0,0]=4 3272 B11R1.225 COC(=O)c1oc(cc1C)O 271570a_203496583355_100000737583 [0,1,0,0,1,0|1,0,0]=3 3273 B11R1.225 COC(=O)c1sc(cc1F)O 271570a_203496583355_100010734428 [0,1,0,0,1,0|1,0,0]=3 3274 B11R1.225 COC(=O)c1sc(cc1N)O 271570a_203496583355_100010255210 [0,1,0,0,1,0|1,0,0]=3 3275 B11R1.225 COC(=O)c1sc(cc1O)C 271570a_203496583355_100009817204 [0,1,0,0,1,0|2,0,0]=4 3276 B11R1.225 COC(=O)c1sc(nc1C)O 271570a_203496583355_100010220626 [0,1,0,0,1,0|2,0,0]=4 3277 B11R1.226 COC(=O)c1cc(c(s1)O)C 271570a_203496583355_100011219469 [0,1,0,0,1,0|1,0,0]=3 3278 B11R1.226 COC(=O)c1cc(c(s1)O)N 271570a_203496583355_200010749435 [0,1,0,0,1,0|1,0,0]=3 3279 B11R1.226 COC(=O)c1cc(n(n1)C)O 271570a_203496583355_100010367948 [0,1,0,0,1,0|2,0,0]=4 3280 B11R1.314 CN(C)C(=O)c1ccc(s1)O 271570a_203496583355_200000159620 [0,1,0,0,1,0|2,0,0]=4 3281 B11R1.865 COC(=O)c1ccc(n1C)O 271570a_203496583355_100010124797 [0,1,0,0,1,0|1,0,0]=3 3282 B11R1.865 COC(=O)c1cnc(n1C)O 271570a_203496583355_100009816624 [0,1,0,0,1,0|2,0,0]=4 3283 B11R1.865 COC(=O)c1scc(c1C)O 271570a_203496583355_100010184805 [0,1,0,0,1,0|1,0,0]=3 3284 B11R1.865 COC(=O)c1scc(c1N)O 271570a_203496583355_100010201200 [0,1,0,0,1,0|1,0,0]=3 3285 B11R1.865 COC(=O)c1scc(c1O)C 271570a_203496583355_100000716566 [0,1,0,0,1,0|2,0,0]=4 3286 B11R1.865 COC(=O)c1scc(c1O)O 271570a_203496583355_100009812821 [0,1,0,0,1,0|1,0,0]=3 3287 B13R1.5 C#CC(=O)Cc1ccc(cc1)CO 1458a_100000211873_100000067286 [0,1,0,0,0,1|1,0,1]=4 3288 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000140223 [0,1,0,0,0,1|2,0,0]=4 3289 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_200009884166_100000210202 [0,1,0,0,0,1|2,0,0]=4 3290 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 11a_106832991635_200009884166 [0,1,0,0,0,1|2,0,0]=4 3291 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 1626a_100102657272_200009884166 [0,1,0,0,0,1|2,0,0]=4 3292 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 240690a_100102657272_200009884166 [0,1,0,0,0,1|2,0,0]=4 3293 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 527a_100102657272_200009884166 [0,1,0,0,0,1|2,0,0]=4 3294 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 11a_100011215031_100000210414 [0,1,0,0,0,1|2,0,0]=4 3295 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 1626a_100011215031_100000210414 [0,1,0,0,0,1|2,0,0]=4 3296 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 22a_100011215031_100000210414 [0,1,0,0,0,1|2,0,0]=4 3297 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 527a_100011215031_100000210414 [0,1,0,0,0,1|2,0,0]=4 3298 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 2430a_100011215031_100102657272 [0,1,0,0,0,1|2,0,0]=4 3299 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 512a_100011215031_100102657272 [0,1,0,0,0,1|2,0,0]=4 3300 B13R1.5 C=CC(=O)Cc1ccc(cc1)CO 1458a_100000185746_100000067286 [0,1,0,0,0,1|1,0,1]=4 3301 B13R1.5 C=CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000185746 [0,1,0,0,0,1|1,0,1]=4 3302 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000185746 [0,1,0,0,0,1|1,0,1]=4 3303 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000185746 [0,1,0,0,0,1|1,0,1]=4 3304 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 34a_100011235904_200000210301 [0,1,0,0,0,1|1,0,1]=4 3305 B13R1.5 C=CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235904_200025704644 [0,1,0,0,0,1|1,0,1]=4 3306 B13R1.5 C=Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000034074 [0,1,0,0,0,1|2,0,0]=4 3307 B13R1.5 C=Cc1ccc(cc1)CC(=O)NC 271570a_100011290941_100000155101 [0,1,0,0,0,1|2,0,0]=4 3308 B13R1.5 C=Cc1ccc(cc1)CC(=O)OC 271570a_100011290941_100000149743 [0,1,0,0,0,1|1,0,0]=3 3309 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 11a_100011218248_100000210414 [0,1,0,0,0,1|2,0,0]=4 3310 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 1626a_100011218248_100000210414 [0,1,0,0,0,1|2,0,0]=4 3311 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 22a_100011218248_100000210414 [0,1,0,0,0,1|2,0,0]=4 3312 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 527a_100011218248_100000210414 [0,1,0,0,0,1|2,0,0]=4 3313 B13R1.5 C=Cc1ccc(cc1)NC(=O)NC 2430a_100011218248_100102657272 [0,1,0,0,0,1|2,0,0]=4 3314 B13R1.5 C=Cc1ccc(cc1)NC(=O)OC 271570a_100011290941_100000181880 [0,1,0,0,0,1|1,0,0]=3 3315 B13R1.5 C=Cc1ccc(cc1)OC(=O)CC 271570a_100011290941_200009811598 [0,1,0,0,0,1|2,0,0]=4 3316 B13R1.5 C=Cc1ccc(cn1)CC(=O)OC 271570a_100011290941_100000071674 [0,1,0,0,0,1|2,0,0]=4 3317 B13R1.5 C=Cc1ccc(nc1)CC(=O)OC 271570a_100011290941_100012362609 [0,1,0,0,0,1|2,0,0]=4 3318 B13R1.5 C=Cc1ccc(nc1)NC(=O)OC 271570a_100011290941_100000188976 [0,1,0,0,0,1|2,0,0]=4 3319 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000210414_100000184898 [0,1,0,0,0,1|2,0,0]=4 3320 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210202 [0,1,0,0,0,1|2,0,0]=4 3321 B13R1.5 CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210414_100000075337 [0,1,0,0,0,1|1,0,1]=4 3322 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_100000210414_100000747183 [0,1,0,0,0,1|2,0,0]=4 3323 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210202 [0,1,0,0,0,1|2,0,0]=4 3324 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100000210414_100000067286 [0,1,0,0,0,1|1,0,0]=3 3325 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210202 [0,1,0,0,0,1|1,0,0]=3 3326 B13R1.5 CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210202 [0,1,0,0,0,1|1,0,0]=3 3327 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000210414_100000181263 [0,1,0,0,0,1|1,1,0]=4 3328 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210202 [0,1,0,0,0,1|1,1,0]=4 3329 B13R1.5 CCC(=O)Cc1ccc(cn1)OC 1458a_100000210414_200000757186 [0,1,0,0,0,1|2,0,0]=4 3330 B13R1.5 CCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000210202 [0,1,0,0,0,1|2,0,0]=4 3331 B13R1.5 CCC(=O)Cc1ccc(nc1)OC 1458a_100000210414_100020631284 [0,1,0,0,0,1|2,0,0]=4 3332 B13R1.5 CCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000210202 [0,1,0,0,0,1|2,0,0]=4 3333 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100000210414 [0,1,0,0,0,1|2,0,0]=4 3334 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100000210414 [0,1,0,0,0,1|2,0,0]=4 3335 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210414 [0,1,0,0,0,1|2,0,0]=4 3336 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210414 [0,1,0,0,0,1|2,0,0]=4 3337 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210414 [0,1,0,0,0,1|2,0,0]=4 3338 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000210414 [0,1,0,0,0,1|2,0,0]=4 3339 B13R1.5 CCC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000210414 [0,1,0,0,0,1|1,0,0]=3 3340 B13R1.5 CCC(=O)Nc1ccc(cc1)NC 34a_100000186511_200000210301 [0,1,0,0,0,1|2,0,0]=4 3341 B13R1.5 CCC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000186511_200025704644 [0,1,0,0,0,1|2,0,0]=4 3342 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210414 [0,1,0,0,0,1|1,0,0]=3 3343 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210414 [0,1,0,0,0,1|1,0,0]=3 3344 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210414 [0,1,0,0,0,1|1,0,0]=3 3345 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 34a_200000243810_200000210301 [0,1,0,0,0,1|1,0,0]=3 3346 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000210414 [0,1,0,0,0,1|1,0,0]=3 3347 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 7a_200000243810_200000210301 [0,1,0,0,0,1|1,0,0]=3 3348 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 34a_200000243810_200025704644 [0,1,0,0,0,1|1,0,0]=3 3349 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 7a_200000243810_200025704644 [0,1,0,0,0,1|1,0,0]=3 3350 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210414 [0,1,0,0,0,1|1,1,0]=4 3351 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210414 [0,1,0,0,0,1|1,1,0]=4 3352 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000210414 [0,1,0,0,0,1|1,1,0]=4 3353 B13R1.5 CCC(=O)Oc1ccc(cc1)SC 62a_200000210301_200009811598 [0,1,0,0,0,1|1,1,0]=4 3354 B13R1.5 CCC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009811598 [0,1,0,0,0,1|1,1,0]=4 3355 B13R1.5 CCc1ccc(cc1)CC(=O)NC 11a_106832991635_200000759805 [0,1,0,0,0,1|2,0,0]=4 3356 B13R1.5 CCc1ccc(cc1)CC(=O)NC 1626a_100102657272_200000759805 [0,1,0,0,0,1|2,0,0]=4 3357 B13R1.5 CCc1ccc(cc1)CC(=O)NC 240690a_100102657272_200000759805 [0,1,0,0,0,1|2,0,0]=4 3358 B13R1.5 CCc1ccc(cc1)CC(=O)NC 527a_100102657272_200000759805 [0,1,0,0,0,1|2,0,0]=4 3359 B13R1.5 CCc1ccc(cc1)NC(=O)NC 2430a_100000211069_100102657272 [0,1,0,0,0,1|2,0,0]=4 3360 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 11a_106832991635_100000748677 [0,1,0,0,0,1|2,0,0]=4 3361 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 1626a_100102657272_100000748677 [0,1,0,0,0,1|2,0,0]=4 3362 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 240690a_100102657272_100000748677 [0,1,0,0,0,1|2,0,0]=4 3363 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 527a_100102657272_100000748677 [0,1,0,0,0,1|2,0,0]=4 3364 B13R1.5 CNC(=O)Cc1ccc(cc1)CO 240690a_100102657272_100011356463 [0,1,0,0,0,1|1,0,0]=3 3365 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 2230a_100000736799_200000210301 [0,1,0,0,0,1|2,0,0]=4 3366 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 34a_100000736799_200000210301 [0,1,0,0,0,1|2,0,0]=4 3367 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 2230a_100000736799_200025704644 [0,1,0,0,0,1|2,0,0]=4 3368 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 34a_100000736799_200025704644 [0,1,0,0,0,1|2,0,0]=4 3369 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 11a_106832991635_100000210706 [0,1,0,0,0,1|1,0,0]=3 3370 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 240690a_100102657272_100000210706 [0,1,0,0,0,1|1,0,0]=3 3371 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 34a_200000020795_200000210301 [0,1,0,0,0,1|1,0,0]=3 3372 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 527a_100102657272_100000210706 [0,1,0,0,0,1|1,0,0]=3 3373 B13R1.5 CNC(=O)Cc1ccc(cc1)O[13CH3] 34a_200000020795_200025704644 [0,1,0,0,0,1|1,0,0]=3 3374 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 11a_106832991635_100000756958 [0,1,0,0,0,1|1,1,0]=4 3375 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 1626a_100102657272_100000756958 [0,1,0,0,0,1|1,1,0]=4 3376 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 240690a_100102657272_100000756958 [0,1,0,0,0,1|1,1,0]=4 3377 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 527a_100102657272_100000756958 [0,1,0,0,0,1|1,1,0]=4 3378 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_100000155101_200000210301 [0,1,0,0,0,1|1,1,0]=4 3379 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000155101 [0,1,0,0,0,1|1,1,0]=4 3380 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000155101_200025704644 [0,1,0,0,0,1|1,1,0]=4 3381 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000155101 [0,1,0,0,0,1|1,1,0]=4 3382 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 11a_106832991635_100000722272 [0,1,0,0,0,1|2,0,0]=4 3383 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 240690a_100102657272_100000722272 [0,1,0,0,0,1|2,0,0]=4 3384 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 527a_100102657272_100000722272 [0,1,0,0,0,1|2,0,0]=4 3385 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 11a_106832991635_100012001117 [0,1,0,0,0,1|2,0,0]=4 3386 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 240690a_100102657272_100012001117 [0,1,0,0,0,1|2,0,0]=4 3387 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 527a_100102657272_100012001117 [0,1,0,0,0,1|2,0,0]=4 3388 B13R1.5 CNC(=O)Nc1ccc(cc1)C#N 2430a_100000185469_100102657272 [0,1,0,0,0,1|2,0,0]=4 3389 B13R1.5 CNC(=O)Nc1ccc(cc1)CO 2430a_100011215238_100102657272 [0,1,0,0,0,1|1,0,0]=3 3390 B13R1.5 CNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100102657272 [0,1,0,0,0,1|1,0,0]=3 3391 B13R1.5 CNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100102657272 [0,1,0,0,0,1|1,1,0]=4 3392 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [0,1,0,0,0,1|0,0,0]=2 3393 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [0,1,0,0,0,1|0,0,0]=2 3394 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [0,1,0,0,0,1|0,1,0]=3 3395 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [0,1,0,0,0,1|0,1,0]=3 3396 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [0,1,0,0,0,1|0,1,0]=3 3397 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [0,1,0,0,0,1|0,1,0]=3 3398 B13R1.5 COC(=O)Cc1ccc(cn1)SC 62a_100012362609_200000210301 [0,1,0,0,0,1|1,1,0]=4 3399 B13R1.5 COC(=O)Cc1ccc(cn1)SC 62a_200000210301_100012362609 [0,1,0,0,0,1|1,1,0]=4 3400 B13R1.5 COC(=O)Cc1ccc(cn1)S[13CH3] 62a_100012362609_200025704644 [0,1,0,0,0,1|1,1,0]=4 3401 B13R1.5 COC(=O)Cc1ccc(cn1)S[13CH3] 62a_200025704644_100012362609 [0,1,0,0,0,1|1,1,0]=4 3402 B13R1.5 COC(=O)Cc1ccc(nc1)SC 62a_100000071674_200000210301 [0,1,0,0,0,1|1,1,0]=4 3403 B13R1.5 COC(=O)Cc1ccc(nc1)SC 62a_200000210301_100000071674 [0,1,0,0,0,1|1,1,0]=4 3404 B13R1.5 COC(=O)Cc1ccc(nc1)S[13CH3] 62a_100000071674_200025704644 [0,1,0,0,0,1|1,1,0]=4 3405 B13R1.5 COC(=O)Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000071674 [0,1,0,0,0,1|1,1,0]=4 3406 B13R1.5 COC(=O)Nc1ccc(cc1)OC 34a_100011235918_200000210301 [0,1,0,0,0,1|0,0,0]=2 3407 B13R1.5 COC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235918_200025704644 [0,1,0,0,0,1|0,0,0]=2 3408 B13R1.5 COC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000181880 [0,1,0,0,0,1|0,1,0]=3 3409 B13R1.5 COC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000181880 [0,1,0,0,0,1|0,1,0]=3 3410 B13R1.5 COC(=O)Nc1ccc(cn1)SC 62a_200000210301_100000188976 [0,1,0,0,0,1|1,1,0]=4 3411 B13R1.5 COC(=O)Nc1ccc(cn1)S[13CH3] 62a_200025704644_100000188976 [0,1,0,0,0,1|1,1,0]=4 3412 B13R1.5 COC(C)Sc1ccc(cc1)CO 62a_100000690907_100009879195 [0,1,0,0,0,1|1,0,1]=4 3413 B13R1.5 COC(C)Sc1ccc(cc1)CO 62a_100009879195_100000690907 [0,1,0,0,0,1|1,0,1]=4 3414 B13R1.5 COc1ccc(cc1)CC(=O)CF 1458a_100000210706_100015361967 [0,1,0,0,0,1|2,0,0]=4 3415 B13R1.5 COc1ccc(cc1)CC(=O)NN 34a_100000020777_200000210301 [0,1,0,0,0,1|2,0,0]=4 3416 B13R1.5 COc1ccc(cc1)NC(=O)CCl 34a_100000233757_200000210301 [0,1,0,0,0,1|2,0,0]=4 3417 B13R1.5 COc1ccc(cc1)NC(=O)CO 22a_100000184247_100000210174 [0,1,0,0,0,1|2,0,0]=4 3418 B13R1.5 COc1ccc(cc1)NC(=O)CO 527a_100000184247_100000210174 [0,1,0,0,0,1|2,0,0]=4 3419 B13R1.5 COc1ccc(cc1)SC(C)OC 62a_100009879195_100000171711 [0,1,0,0,0,1|1,0,1]=4 3420 B13R1.5 O=C(CF)Cc1ccc(cc1)CO 1458a_100011356463_100015361967 [0,1,0,0,0,1|2,0,0]=4 3421 B13R1.5 O=C(CO)Cc1ccc(cc1)CO 1458a_100000210174_100000067286 [0,1,0,0,0,1|2,0,0]=4 3422 B13R1.5 O=C(CO)Nc1ccc(cc1)CO 22a_100011215238_100000210174 [0,1,0,0,0,1|2,0,0]=4 3423 B13R1.5 [13CH3]Oc1ccc(cc1)CC(=O)NN 34a_100000020777_200025704644 [0,1,0,0,0,1|2,0,0]=4 3424 B13R1.5 [13CH3]Oc1ccc(cc1)NC(=O)CCl 34a_100000233757_200025704644 [0,1,0,0,0,1|2,0,0]=4 3425 B13R1.19 C#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000184674 [0,1,0,0,0,1|1,0,1]=4 3426 B13R1.19 C=CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210623 [0,1,0,0,0,1|1,0,1]=4 3427 B13R1.19 C=CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210193 [0,1,0,0,0,1|1,0,1]=4 3428 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Br 1458a_100000763181_100000189115 [0,1,0,0,0,1|2,0,0]=4 3429 B13R1.19 CC#CC(=O)Cc1ccc(cc1)C 1458a_100000763181_100000210814 [0,1,0,0,0,1|2,0,0]=4 3430 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Cl 1458a_100000763181_100000694040 [0,1,0,0,0,1|2,0,0]=4 3431 B13R1.19 CC#CC(=O)Cc1ccc(cc1)F 1458a_100000763181_100000198546 [0,1,0,0,0,1|2,0,0]=4 3432 B13R1.19 CC#CC(=O)Cc1ccc(cc1)I 1458a_100000763181_100000189116 [0,1,0,0,0,1|2,0,0]=4 3433 B13R1.19 CC#CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000763181 [0,1,0,0,0,1|2,0,0]=4 3434 B13R1.19 CC#CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000763181 [0,1,0,0,0,1|2,0,0]=4 3435 B13R1.19 CC#CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000763181 [0,1,0,0,0,1|2,0,0]=4 3436 B13R1.19 CC#CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000763181 [0,1,0,0,0,1|2,0,0]=4 3437 B13R1.19 CC#CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000763181 [0,1,0,0,0,1|2,0,0]=4 3438 B13R1.19 CC#CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000763181 [0,1,0,0,0,1|1,0,0]=3 3439 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Br 1458a_100000210699_100000189115 [0,1,0,0,0,1|2,0,0]=4 3440 B13R1.19 CC=CC(=O)Cc1ccc(cc1)C 1458a_100000210699_100000210814 [0,1,0,0,0,1|2,0,0]=4 3441 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000210699_100000694040 [0,1,0,0,0,1|2,0,0]=4 3442 B13R1.19 CC=CC(=O)Cc1ccc(cc1)F 1458a_100000210699_100000198546 [0,1,0,0,0,1|2,0,0]=4 3443 B13R1.19 CC=CC(=O)Cc1ccc(cc1)I 1458a_100000210699_100000189116 [0,1,0,0,0,1|2,0,0]=4 3444 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210699 [0,1,0,0,0,1|2,0,0]=4 3445 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210699 [0,1,0,0,0,1|2,0,0]=4 3446 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210699 [0,1,0,0,0,1|2,0,0]=4 3447 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210699 [0,1,0,0,0,1|2,0,0]=4 3448 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210699 [0,1,0,0,0,1|2,0,0]=4 3449 B13R1.19 CC=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210699 [0,1,0,0,0,1|2,0,0]=4 3450 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210699 [0,1,0,0,0,1|2,0,0]=4 3451 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210699 [0,1,0,0,0,1|2,0,0]=4 3452 B13R1.19 CC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210699 [0,1,0,0,0,1|2,0,0]=4 3453 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210699 [0,1,0,0,0,1|2,0,0]=4 3454 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210699 [0,1,0,0,0,1|2,0,0]=4 3455 B13R1.19 CC=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210699 [0,1,0,0,0,1|2,0,0]=4 3456 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210699 [0,1,0,0,0,1|2,0,0]=4 3457 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210699 [0,1,0,0,0,1|2,0,0]=4 3458 B13R1.19 CC=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210699 [0,1,0,0,0,1|2,0,0]=4 3459 B13R1.19 CC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210699 [0,1,0,0,0,1|1,0,0]=3 3460 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210303 [0,1,0,0,0,1|2,0,0]=4 3461 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000211992_100000189115 [0,1,0,0,0,1|2,0,0]=4 3462 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000211992_100000210814 [0,1,0,0,0,1|2,0,0]=4 3463 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210303 [0,1,0,0,0,1|2,0,0]=4 3464 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210303 [0,1,0,0,0,1|2,0,0]=4 3465 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211992_100000694040 [0,1,0,0,0,1|2,0,0]=4 3466 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210303 [0,1,0,0,0,1|2,0,0]=4 3467 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000211992_100000198546 [0,1,0,0,0,1|2,0,0]=4 3468 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000211992_100000189116 [0,1,0,0,0,1|2,0,0]=4 3469 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210303 [0,1,0,0,0,1|2,0,0]=4 3470 B13R1.19 CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210303 [0,1,0,0,0,1|1,0,0]=3 3471 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000211992 [0,1,0,0,0,1|2,0,0]=4 3472 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000211992 [0,1,0,0,0,1|2,0,0]=4 3473 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000211992 [0,1,0,0,0,1|2,0,0]=4 3474 B13R1.19 CCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000211992 [0,1,0,0,0,1|2,0,0]=4 3475 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211992 [0,1,0,0,0,1|2,0,0]=4 3476 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211992 [0,1,0,0,0,1|2,0,0]=4 3477 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211992 [0,1,0,0,0,1|2,0,0]=4 3478 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211992 [0,1,0,0,0,1|2,0,0]=4 3479 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000211992 [0,1,0,0,0,1|2,0,0]=4 3480 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000211992 [0,1,0,0,0,1|2,0,0]=4 3481 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211992 [0,1,0,0,0,1|2,0,0]=4 3482 B13R1.19 CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000211992 [0,1,0,0,0,1|2,0,0]=4 3483 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000211992 [0,1,0,0,0,1|2,0,0]=4 3484 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000211992 [0,1,0,0,0,1|2,0,0]=4 3485 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000211992 [0,1,0,0,0,1|2,0,0]=4 3486 B13R1.19 CCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000211992 [0,1,0,0,0,1|2,0,0]=4 3487 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000211992 [0,1,0,0,0,1|2,0,0]=4 3488 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000211992 [0,1,0,0,0,1|2,0,0]=4 3489 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000211992 [0,1,0,0,0,1|2,0,0]=4 3490 B13R1.19 CCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000211992 [0,1,0,0,0,1|2,0,0]=4 3491 B13R1.19 CCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000211992 [0,1,0,0,0,1|1,0,0]=3 3492 B13R1.19 CCCC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193317 [0,1,0,0,0,1|2,0,0]=4 3493 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 11a_100015525214_100000198978 [0,1,0,0,0,1|2,0,0]=4 3494 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 240690a_100015525214_100000198978 [0,1,0,0,0,1|2,0,0]=4 3495 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 527a_100015525214_100000198978 [0,1,0,0,0,1|2,0,0]=4 3496 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 11a_100015525214_100000212244 [0,1,0,0,0,1|2,0,0]=4 3497 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 240690a_100015525214_100000212244 [0,1,0,0,0,1|2,0,0]=4 3498 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 527a_100015525214_100000212244 [0,1,0,0,0,1|2,0,0]=4 3499 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 11a_100015525214_100000211027 [0,1,0,0,0,1|2,0,0]=4 3500 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 240690a_100015525214_100000211027 [0,1,0,0,0,1|2,0,0]=4 3501 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 527a_100015525214_100000211027 [0,1,0,0,0,1|2,0,0]=4 3502 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 11a_100015525214_100000210951 [0,1,0,0,0,1|2,0,0]=4 3503 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 240690a_100015525214_100000210951 [0,1,0,0,0,1|2,0,0]=4 3504 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 527a_100015525214_100000210951 [0,1,0,0,0,1|2,0,0]=4 3505 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 11a_100015525214_100000688869 [0,1,0,0,0,1|2,0,0]=4 3506 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 240690a_100015525214_100000688869 [0,1,0,0,0,1|2,0,0]=4 3507 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 527a_100015525214_100000688869 [0,1,0,0,0,1|2,0,0]=4 3508 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 240690a_100015525214_100000198540 [0,1,0,0,0,1|1,0,0]=3 3509 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 527a_100015525214_100000198540 [0,1,0,0,0,1|1,0,0]=3 3510 B13R1.19 CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100015525214 [0,1,0,0,0,1|2,0,0]=4 3511 B13R1.19 CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100015525214 [0,1,0,0,0,1|2,0,0]=4 3512 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100015525214 [0,1,0,0,0,1|2,0,0]=4 3513 B13R1.19 CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100015525214 [0,1,0,0,0,1|2,0,0]=4 3514 B13R1.19 CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100015525214 [0,1,0,0,0,1|2,0,0]=4 3515 B13R1.19 CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100015525214 [0,1,0,0,0,1|1,0,0]=3 3516 B13R1.19 CCOC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000170549 [0,1,0,0,0,1|0,0,0]=2 3517 B13R1.19 CCOC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012359163 [0,1,0,0,0,1|1,0,0]=3 3518 B13R1.19 CCOC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071673 [0,1,0,0,0,1|1,0,0]=3 3519 B13R1.19 CCOC(=O)Cc1ncc(cn1)O 271570a_203496583355_100010214908 [0,1,0,0,0,1|2,0,0]=4 3520 B13R1.19 CCOC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000158341 [0,1,0,0,0,1|0,0,0]=2 3521 B13R1.19 CCOC(C)Oc1ccc(cc1)O 271570a_203496583355_100009812852 [0,1,0,0,0,1|1,0,1]=4 3522 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_200000210301 [0,1,0,0,0,1|2,0,0]=4 3523 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 2230a_106832991635_100000183692 [0,1,0,0,0,1|2,0,0]=4 3524 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 34a_100102657272_100000183692 [0,1,0,0,0,1|2,0,0]=4 3525 B13R1.19 CNCC(=O)Nc1ccc(cc1)Br 7a_106832991635_100000183692 [0,1,0,0,0,1|2,0,0]=4 3526 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 2230a_106832991635_100000182914 [0,1,0,0,0,1|2,0,0]=4 3527 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 34a_100102657272_100000182914 [0,1,0,0,0,1|2,0,0]=4 3528 B13R1.19 CNCC(=O)Nc1ccc(cc1)C 7a_106832991635_100000182914 [0,1,0,0,0,1|2,0,0]=4 3529 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 2230a_106832991635_100000182960 [0,1,0,0,0,1|2,0,0]=4 3530 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 34a_100102657272_100000182960 [0,1,0,0,0,1|2,0,0]=4 3531 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl 7a_106832991635_100000182960 [0,1,0,0,0,1|2,0,0]=4 3532 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_200000210301 [0,1,0,0,0,1|2,0,0]=4 3533 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 2230a_106832991635_100000181725 [0,1,0,0,0,1|2,0,0]=4 3534 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 34a_100025683178_200000210301 [0,1,0,0,0,1|2,0,0]=4 3535 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 34a_100102657272_100000181725 [0,1,0,0,0,1|2,0,0]=4 3536 B13R1.19 CNCC(=O)Nc1ccc(cc1)F 7a_106832991635_100000181725 [0,1,0,0,0,1|2,0,0]=4 3537 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 2230a_106832991635_100000183000 [0,1,0,0,0,1|2,0,0]=4 3538 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 34a_100102657272_100000183000 [0,1,0,0,0,1|2,0,0]=4 3539 B13R1.19 CNCC(=O)Nc1ccc(cc1)I 7a_106832991635_100000183000 [0,1,0,0,0,1|2,0,0]=4 3540 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 2230a_106832991635_100000233757 [0,1,0,0,0,1|1,0,0]=3 3541 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 34a_100102657272_100000233757 [0,1,0,0,0,1|1,0,0]=3 3542 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 7a_106832991635_100000233757 [0,1,0,0,0,1|1,0,0]=3 3543 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 2230a_106832991635_200010760497 [0,1,0,0,0,1|2,0,0]=4 3544 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 34a_100102657272_200010760497 [0,1,0,0,0,1|2,0,0]=4 3545 B13R1.19 CNCC(=O)Oc1ccc(cc1)Br 7a_106832991635_200010760497 [0,1,0,0,0,1|2,0,0]=4 3546 B13R1.19 CNNC(=O)Cc1ccc(cc1)Br 22a_100016993582_100000198978 [0,1,0,0,0,1|2,0,0]=4 3547 B13R1.19 CNNC(=O)Cc1ccc(cc1)C 22a_100016993582_100000212244 [0,1,0,0,0,1|2,0,0]=4 3548 B13R1.19 CNNC(=O)Cc1ccc(cc1)Cl 22a_100016993582_100000211027 [0,1,0,0,0,1|2,0,0]=4 3549 B13R1.19 CNNC(=O)Cc1ccc(cc1)F 22a_100016993582_100000210951 [0,1,0,0,0,1|2,0,0]=4 3550 B13R1.19 CNNC(=O)Cc1ccc(cc1)I 22a_100016993582_100000688869 [0,1,0,0,0,1|2,0,0]=4 3551 B13R1.19 CNNC(=O)Cc1ccc(cc1)O 22a_100016993582_100000198540 [0,1,0,0,0,1|1,0,0]=3 3552 B13R1.19 COCC(=O)Cc1ccc(cc1)Br 1458a_100000210968_100000189115 [0,1,0,0,0,1|1,0,0]=3 3553 B13R1.19 COCC(=O)Cc1ccc(cc1)C 1458a_100000210968_100000210814 [0,1,0,0,0,1|1,0,0]=3 3554 B13R1.19 COCC(=O)Cc1ccc(cc1)Cl 1458a_100000210968_100000694040 [0,1,0,0,0,1|1,0,0]=3 3555 B13R1.19 COCC(=O)Cc1ccc(cc1)F 1458a_100000210968_100000198546 [0,1,0,0,0,1|1,0,0]=3 3556 B13R1.19 COCC(=O)Cc1ccc(cc1)I 1458a_100000210968_100000189116 [0,1,0,0,0,1|1,0,0]=3 3557 B13R1.19 COCC(=O)Cc1ccc(cn1)Br 1458a_100000210968_100000702658 [0,1,0,0,0,1|2,0,0]=4 3558 B13R1.19 COCC(=O)Cc1ccc(cn1)C 1458a_100000210968_100000691093 [0,1,0,0,0,1|2,0,0]=4 3559 B13R1.19 COCC(=O)Cc1ccc(cn1)Cl 1458a_100000210968_100012066911 [0,1,0,0,0,1|2,0,0]=4 3560 B13R1.19 COCC(=O)Cc1ccc(cn1)F 1458a_100000210968_100000703193 [0,1,0,0,0,1|2,0,0]=4 3561 B13R1.19 COCC(=O)Cc1ccc(nc1)Br 1458a_100000210968_100009831999 [0,1,0,0,0,1|2,0,0]=4 3562 B13R1.19 COCC(=O)Cc1ccc(nc1)C 1458a_100000210968_100016987292 [0,1,0,0,0,1|2,0,0]=4 3563 B13R1.19 COCC(=O)Cc1ccc(nc1)Cl 1458a_100000210968_100000735431 [0,1,0,0,0,1|2,0,0]=4 3564 B13R1.19 COCC(=O)Cc1ccc(nc1)F 1458a_100000210968_100009820150 [0,1,0,0,0,1|2,0,0]=4 3565 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210968 [0,1,0,0,0,1|1,0,0]=3 3566 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210968 [0,1,0,0,0,1|1,0,0]=3 3567 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210968 [0,1,0,0,0,1|1,0,0]=3 3568 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000183692 [0,1,0,0,0,1|1,0,0]=3 3569 B13R1.19 COCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210968 [0,1,0,0,0,1|1,0,0]=3 3570 B13R1.19 COCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210968 [0,1,0,0,0,1|1,0,0]=3 3571 B13R1.19 COCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210968 [0,1,0,0,0,1|1,0,0]=3 3572 B13R1.19 COCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210968 [0,1,0,0,0,1|1,0,0]=3 3573 B13R1.19 COCC(=O)Nc1ccc(cc1)C 34a_100138415774_100000182914 [0,1,0,0,0,1|1,0,0]=3 3574 B13R1.19 COCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210968 [0,1,0,0,0,1|1,0,0]=3 3575 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210968 [0,1,0,0,0,1|1,0,0]=3 3576 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210968 [0,1,0,0,0,1|1,0,0]=3 3577 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210968 [0,1,0,0,0,1|1,0,0]=3 3578 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 34a_100138415774_100000182960 [0,1,0,0,0,1|1,0,0]=3 3579 B13R1.19 COCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210968 [0,1,0,0,0,1|1,0,0]=3 3580 B13R1.19 COCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210968 [0,1,0,0,0,1|1,0,0]=3 3581 B13R1.19 COCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210968 [0,1,0,0,0,1|1,0,0]=3 3582 B13R1.19 COCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210968 [0,1,0,0,0,1|1,0,0]=3 3583 B13R1.19 COCC(=O)Nc1ccc(cc1)F 34a_100138415774_100000181725 [0,1,0,0,0,1|1,0,0]=3 3584 B13R1.19 COCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210968 [0,1,0,0,0,1|1,0,0]=3 3585 B13R1.19 COCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210968 [0,1,0,0,0,1|1,0,0]=3 3586 B13R1.19 COCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210968 [0,1,0,0,0,1|1,0,0]=3 3587 B13R1.19 COCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210968 [0,1,0,0,0,1|1,0,0]=3 3588 B13R1.19 COCC(=O)Nc1ccc(cc1)I 34a_100138415774_100000183000 [0,1,0,0,0,1|1,0,0]=3 3589 B13R1.19 COCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210968 [0,1,0,0,0,1|1,0,0]=3 3590 B13R1.19 COCC(=O)Nc1ccc(cc1)N 34a_100011269904_200000210301 [0,1,0,0,0,1|1,0,0]=3 3591 B13R1.19 COCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210968 [0,1,0,0,0,1|0,0,0]=2 3592 B13R1.19 COCC(=O)Nc1ccc(cc1)O 34a_100138415774_100000233757 [0,1,0,0,0,1|0,0,0]=2 3593 B13R1.19 COCC(=O)Nc1ccc(nc1)Cl 34a_100138415774_100020591235 [0,1,0,0,0,1|2,0,0]=4 3594 B13R1.19 COCC(=O)Oc1ccc(cc1)Br 34a_100138415774_200010760497 [0,1,0,0,0,1|1,0,0]=3 3595 B13R1.19 COCC(C)Nc1ccc(cc1)O 34a_100000185829_100000765312 [0,1,0,0,0,1|1,0,1]=4 3596 B13R1.19 COCC(C)Sc1ccc(cc1)O 62a_100000765312_100000185759 [0,1,0,0,0,1|1,0,1]=4 3597 B13R1.19 COCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000766300 [0,1,0,0,0,1|2,0,0]=4 3598 B13R1.19 COCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000766300 [0,1,0,0,0,1|2,0,0]=4 3599 B13R1.19 CSCC(=O)Cc1ccc(cc1)Br 1458a_100000184570_100000189115 [0,1,0,0,0,1|1,1,0]=4 3600 B13R1.19 CSCC(=O)Cc1ccc(cc1)C 1458a_100000184570_100000210814 [0,1,0,0,0,1|1,1,0]=4 3601 B13R1.19 CSCC(=O)Cc1ccc(cc1)Cl 1458a_100000184570_100000694040 [0,1,0,0,0,1|1,1,0]=4 3602 B13R1.19 CSCC(=O)Cc1ccc(cc1)F 1458a_100000184570_100000198546 [0,1,0,0,0,1|1,1,0]=4 3603 B13R1.19 CSCC(=O)Cc1ccc(cc1)I 1458a_100000184570_100000189116 [0,1,0,0,0,1|1,1,0]=4 3604 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000184570 [0,1,0,0,0,1|1,1,0]=4 3605 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000184570 [0,1,0,0,0,1|1,1,0]=4 3606 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000184570 [0,1,0,0,0,1|1,1,0]=4 3607 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000184570 [0,1,0,0,0,1|1,1,0]=4 3608 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_200000210301 [0,1,0,0,0,1|1,1,0]=4 3609 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br 62a_200000210301_100000183692 [0,1,0,0,0,1|1,1,0]=4 3610 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000184570 [0,1,0,0,0,1|1,1,0]=4 3611 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000184570 [0,1,0,0,0,1|1,1,0]=4 3612 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000184570 [0,1,0,0,0,1|1,1,0]=4 3613 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000184570 [0,1,0,0,0,1|1,1,0]=4 3614 B13R1.19 CSCC(=O)Nc1ccc(cc1)C 62a_200000210301_100000182914 [0,1,0,0,0,1|1,1,0]=4 3615 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000184570 [0,1,0,0,0,1|1,1,0]=4 3616 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000184570 [0,1,0,0,0,1|1,1,0]=4 3617 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000184570 [0,1,0,0,0,1|1,1,0]=4 3618 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000184570 [0,1,0,0,0,1|1,1,0]=4 3619 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 62a_200000210301_100000182960 [0,1,0,0,0,1|1,1,0]=4 3620 B13R1.19 CSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_200000210301 [0,1,0,0,0,1|1,1,0]=4 3621 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000184570 [0,1,0,0,0,1|1,1,0]=4 3622 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000184570 [0,1,0,0,0,1|1,1,0]=4 3623 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000184570 [0,1,0,0,0,1|1,1,0]=4 3624 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000184570 [0,1,0,0,0,1|1,1,0]=4 3625 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 62a_200000210301_100000181725 [0,1,0,0,0,1|1,1,0]=4 3626 B13R1.19 CSCC(=O)Nc1ccc(cc1)F 62a_200000243717_200000210301 [0,1,0,0,0,1|1,1,0]=4 3627 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000184570 [0,1,0,0,0,1|1,1,0]=4 3628 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000184570 [0,1,0,0,0,1|1,1,0]=4 3629 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000184570 [0,1,0,0,0,1|1,1,0]=4 3630 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000184570 [0,1,0,0,0,1|1,1,0]=4 3631 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 62a_100000183000_200000210301 [0,1,0,0,0,1|1,1,0]=4 3632 B13R1.19 CSCC(=O)Nc1ccc(cc1)I 62a_200000210301_100000183000 [0,1,0,0,0,1|1,1,0]=4 3633 B13R1.19 CSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000184570 [0,1,0,0,0,1|0,1,0]=3 3634 B13R1.19 CSCC(=O)Nc1ccc(cc1)O 62a_200000210301_100000233757 [0,1,0,0,0,1|0,1,0]=3 3635 B13R1.19 CSCC(=O)Oc1ccc(cc1)Br 62a_200000210301_200010760497 [0,1,0,0,0,1|1,1,0]=4 3636 B13R1.19 CSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_200000210301 [0,1,0,0,0,1|1,1,0]=4 3637 B13R1.19 Cc1ccc(cc1)CC(=O)CCF 1458a_100000212244_100011217306 [0,1,0,0,0,1|2,0,0]=4 3638 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100000212244_100000211926 [0,1,0,0,0,1|2,0,0]=4 3639 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000210814 [0,1,0,0,0,1|2,0,0]=4 3640 B13R1.19 Cc1ccc(cc1)NC(=O)CCO 22a_100000124888_100011216618 [0,1,0,0,0,1|2,0,0]=4 3641 B13R1.19 Cc1ccc(cc1)NC(=O)CS[13CH3] 62a_200025704644_100000182914 [0,1,0,0,0,1|1,1,0]=4 3642 B13R1.19 N#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011214920 [0,1,0,0,0,1|1,0,1]=4 3643 B13R1.19 N#CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100051588842 [0,1,0,0,0,1|1,0,1]=4 3644 B13R1.19 N#CCC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000187967 [0,1,0,0,0,1|1,0,1]=4 3645 B13R1.19 NCCC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000743120 [0,1,0,0,0,1|1,0,0]=3 3646 B13R1.19 O=C(CCF)Cc1ccc(cc1)Br 1458a_100000198978_100011217306 [0,1,0,0,0,1|2,0,0]=4 3647 B13R1.19 O=C(CCF)Cc1ccc(cc1)Cl 1458a_100000211027_100011217306 [0,1,0,0,0,1|2,0,0]=4 3648 B13R1.19 O=C(CCF)Cc1ccc(cc1)F 1458a_100000210951_100011217306 [0,1,0,0,0,1|2,0,0]=4 3649 B13R1.19 O=C(CCF)Cc1ccc(cc1)I 1458a_100000688869_100011217306 [0,1,0,0,0,1|2,0,0]=4 3650 B13R1.19 O=C(CCF)Cc1ccc(cc1)O 1458a_100000198540_100011217306 [0,1,0,0,0,1|1,0,0]=3 3651 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100000198978_100000211926 [0,1,0,0,0,1|2,0,0]=4 3652 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100011216618_100000189115 [0,1,0,0,0,1|2,0,0]=4 3653 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000211926 [0,1,0,0,0,1|2,0,0]=4 3654 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100011216618_100000694040 [0,1,0,0,0,1|2,0,0]=4 3655 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100000210951_100000211926 [0,1,0,0,0,1|2,0,0]=4 3656 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100011216618_100000198546 [0,1,0,0,0,1|2,0,0]=4 3657 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100000688869_100000211926 [0,1,0,0,0,1|2,0,0]=4 3658 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100011216618_100000189116 [0,1,0,0,0,1|2,0,0]=4 3659 B13R1.19 O=C(CCO)Cc1ccc(cc1)O 1458a_100000198540_100000211926 [0,1,0,0,0,1|1,0,0]=3 3660 B13R1.19 O=C(CCO)Nc1ccc(cc1)Br 22a_100000210018_100011216618 [0,1,0,0,0,1|2,0,0]=4 3661 B13R1.19 O=C(CCO)Nc1ccc(cc1)Cl 22a_100000210052_100011216618 [0,1,0,0,0,1|2,0,0]=4 3662 B13R1.19 O=C(CCO)Nc1ccc(cc1)F 22a_100000185862_100011216618 [0,1,0,0,0,1|2,0,0]=4 3663 B13R1.19 O=C(CCO)Nc1ccc(cc1)I 22a_100000185761_100011216618 [0,1,0,0,0,1|2,0,0]=4 3664 B13R1.19 O=C(CCO)Nc1ccc(cc1)O 22a_100000185829_100011216618 [0,1,0,0,0,1|1,0,0]=3 3665 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_200025704644 [0,1,0,0,0,1|2,0,0]=4 3666 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)F 2230a_100025683178_200025704644 [0,1,0,0,0,1|2,0,0]=4 3667 B13R1.19 [13CH3]NCC(=O)Nc1ccc(cc1)F 34a_100025683178_200025704644 [0,1,0,0,0,1|2,0,0]=4 3668 B13R1.19 [13CH3]OCC(=O)Nc1ccc(cc1)N 34a_100011269904_200025704644 [0,1,0,0,0,1|1,0,0]=3 3669 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Br 62a_100000183692_200025704644 [0,1,0,0,0,1|1,1,0]=4 3670 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Br 62a_200025704644_100000183692 [0,1,0,0,0,1|1,1,0]=4 3671 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_200025704644 [0,1,0,0,0,1|1,1,0]=4 3672 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)Cl 62a_200025704644_100000182960 [0,1,0,0,0,1|1,1,0]=4 3673 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)F 62a_200000243717_200025704644 [0,1,0,0,0,1|1,1,0]=4 3674 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)F 62a_200025704644_100000181725 [0,1,0,0,0,1|1,1,0]=4 3675 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)I 62a_100000183000_200025704644 [0,1,0,0,0,1|1,1,0]=4 3676 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)I 62a_200025704644_100000183000 [0,1,0,0,0,1|1,1,0]=4 3677 B13R1.19 [13CH3]SCC(=O)Nc1ccc(cc1)O 62a_200025704644_100000233757 [0,1,0,0,0,1|0,1,0]=3 3678 B13R1.19 [13CH3]SCC(=O)Oc1ccc(cc1)Br 62a_200010760497_200025704644 [0,1,0,0,0,1|1,1,0]=4 3679 B13R1.19 [13CH3]SCC(=O)Oc1ccc(cc1)Br 62a_200025704644_200010760497 [0,1,0,0,0,1|1,1,0]=4 3680 B13R1.21 C=CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000185746 [0,1,0,0,0,1|1,0,1]=4 3681 B13R1.21 CC(C(=O)CF)c1ccc(cc1)O 1458a_100000031422_100015361967 [0,1,0,0,0,1|2,0,0]=4 3682 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Br 1458a_100000210414_100000755118 [0,1,0,0,0,1|2,0,0]=4 3683 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000210414_100011261388 [0,1,0,0,0,1|2,0,0]=4 3684 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000210202 [0,1,0,0,0,1|2,0,0]=4 3685 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000210414_100000684792 [0,1,0,0,0,1|2,0,0]=4 3686 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000210202 [0,1,0,0,0,1|2,0,0]=4 3687 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100000210414_100000743420 [0,1,0,0,0,1|2,0,0]=4 3688 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000210202 [0,1,0,0,0,1|2,0,0]=4 3689 B13R1.21 CCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210202 [0,1,0,0,0,1|1,0,0]=3 3690 B13R1.21 CCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210202 [0,1,0,0,0,1|2,0,0]=4 3691 B13R1.21 CCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210202 [0,1,0,0,0,1|2,0,0]=4 3692 B13R1.21 CCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210202 [0,1,0,0,0,1|2,0,0]=4 3693 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [0,1,0,0,0,1|1,0,0]=3 3694 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000210414 [0,1,0,0,0,1|2,0,0]=4 3695 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000210414 [0,1,0,0,0,1|2,0,0]=4 3696 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000210414 [0,1,0,0,0,1|2,0,0]=4 3697 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000210414 [0,1,0,0,0,1|2,0,0]=4 3698 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000210414 [0,1,0,0,0,1|2,0,0]=4 3699 B13R1.21 CCC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000210414 [0,1,0,0,0,1|2,0,0]=4 3700 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000210414 [0,1,0,0,0,1|2,0,0]=4 3701 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000210414 [0,1,0,0,0,1|2,0,0]=4 3702 B13R1.21 CCC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000210414 [0,1,0,0,0,1|2,0,0]=4 3703 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000210414 [0,1,0,0,0,1|2,0,0]=4 3704 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000210414 [0,1,0,0,0,1|2,0,0]=4 3705 B13R1.21 CCC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000210414 [0,1,0,0,0,1|2,0,0]=4 3706 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000210414 [0,1,0,0,0,1|2,0,0]=4 3707 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000210414 [0,1,0,0,0,1|2,0,0]=4 3708 B13R1.21 CCC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000210414 [0,1,0,0,0,1|2,0,0]=4 3709 B13R1.21 CCC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000210414 [0,1,0,0,0,1|1,0,0]=3 3710 B13R1.21 CCC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100000210414 [0,1,0,0,0,1|1,0,0]=3 3711 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000210202 [0,1,0,0,0,1|2,0,0]=4 3712 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210202 [0,1,0,0,0,1|2,0,0]=4 3713 B13R1.21 CN(C(=O)CO)c1ccc(cc1)O 22a_100000182112_100000210174 [0,1,0,0,0,1|2,0,0]=4 3714 B13R1.21 CN(C(=O)CO)c1ccc(cc1)O 527a_100000182112_100000210174 [0,1,0,0,0,1|2,0,0]=4 3715 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 11a_106832991635_100000751627 [0,1,0,0,0,1|2,0,0]=4 3716 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 1626a_100102657272_100000751627 [0,1,0,0,0,1|2,0,0]=4 3717 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 240690a_100102657272_100000751627 [0,1,0,0,0,1|2,0,0]=4 3718 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 527a_100102657272_100000751627 [0,1,0,0,0,1|2,0,0]=4 3719 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 11a_106832991635_100011216001 [0,1,0,0,0,1|2,0,0]=4 3720 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 1626a_100102657272_100011216001 [0,1,0,0,0,1|2,0,0]=4 3721 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 240690a_100102657272_100011216001 [0,1,0,0,0,1|2,0,0]=4 3722 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 527a_100102657272_100011216001 [0,1,0,0,0,1|2,0,0]=4 3723 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 11a_106832991635_100011435297 [0,1,0,0,0,1|2,0,0]=4 3724 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 1626a_100102657272_100011435297 [0,1,0,0,0,1|2,0,0]=4 3725 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 240690a_100102657272_100011435297 [0,1,0,0,0,1|2,0,0]=4 3726 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 527a_100102657272_100011435297 [0,1,0,0,0,1|2,0,0]=4 3727 B13R1.21 CNC(=O)C(C)c1ccc(cc1)O 240690a_100102657272_100000031422 [0,1,0,0,0,1|1,0,0]=3 3728 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 11a_106832991635_100012277543 [0,1,0,0,0,1|2,0,0]=4 3729 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 1626a_100102657272_100012277543 [0,1,0,0,0,1|2,0,0]=4 3730 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 240690a_100102657272_100012277543 [0,1,0,0,0,1|2,0,0]=4 3731 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 527a_100102657272_100012277543 [0,1,0,0,0,1|2,0,0]=4 3732 B13R1.21 CNC(=O)C(O)c1ccc(cc1)Br 240690a_100102657272_100000756554 [0,1,0,0,0,1|2,0,0]=4 3733 B13R1.21 CNC(=O)C(O)c1ccc(cc1)F 240690a_100102657272_100000209909 [0,1,0,0,0,1|2,0,0]=4 3734 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [0,1,0,0,0,1|1,0,0]=3 3735 B13R1.21 CNC(=O)N(C)c1ccc(cc1)Br 512a_106832991638_100000219623 [0,1,0,0,0,1|2,0,0]=4 3736 B13R1.21 CNC(=O)N(C)c1ccc(cc1)C 512a_106832991638_100000219977 [0,1,0,0,0,1|2,0,0]=4 3737 B13R1.21 CNC(=O)N(C)c1ccc(cc1)I 512a_100000743151_100102657272 [0,1,0,0,0,1|2,0,0]=4 3738 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100102657272_100009815954 [0,1,0,0,0,1|2,0,0]=4 3739 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100102657272_100009817493 [0,1,0,0,0,1|2,0,0]=4 3740 B13R1.21 COC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_100012339527 [0,1,0,0,0,1|0,0,0]=2 3741 B13R1.21 COC(=O)C(N)c1ccc(cc1)O 271570a_203496583355_100000747369 [0,1,0,0,0,1|0,0,0]=2 3742 B13R1.21 COC(C)C(=O)c1ccc(cc1)O 34a_100138415774_200010205864 [0,1,0,0,0,1|1,0,1]=4 3743 B13R1.21 COC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100009879195 [0,1,0,0,0,1|1,0,1]=4 3744 B13R1.21 CON(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000153844 [0,1,0,0,0,1|2,0,0]=4 3745 B13R1.21 O=C(CF)C(O)c1ccc(cc1)O 1458a_100011215213_100015361967 [0,1,0,0,0,1|2,0,0]=4 3746 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Br 1458a_100000185857_100000189115 [0,1,0,0,0,1|2,0,0]=4 3747 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)C 1458a_100000185857_100000210814 [0,1,0,0,0,1|2,0,0]=4 3748 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000185857_100000694040 [0,1,0,0,0,1|2,0,0]=4 3749 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)F 1458a_100000185857_100000198546 [0,1,0,0,0,1|2,0,0]=4 3750 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)I 1458a_100000185857_100000189116 [0,1,0,0,0,1|2,0,0]=4 3751 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000185857 [0,1,0,0,0,1|2,0,0]=4 3752 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185857 [0,1,0,0,0,1|2,0,0]=4 3753 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185857 [0,1,0,0,0,1|2,0,0]=4 3754 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000185857 [0,1,0,0,0,1|2,0,0]=4 3755 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185857 [0,1,0,0,0,1|2,0,0]=4 3756 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000185857 [0,1,0,0,0,1|2,0,0]=4 3757 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000185857 [0,1,0,0,0,1|2,0,0]=4 3758 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185857 [0,1,0,0,0,1|2,0,0]=4 3759 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185857 [0,1,0,0,0,1|2,0,0]=4 3760 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000185857 [0,1,0,0,0,1|2,0,0]=4 3761 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185857 [0,1,0,0,0,1|2,0,0]=4 3762 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000185857 [0,1,0,0,0,1|2,0,0]=4 3763 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000185857 [0,1,0,0,0,1|2,0,0]=4 3764 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185857 [0,1,0,0,0,1|2,0,0]=4 3765 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000185857 [0,1,0,0,0,1|2,0,0]=4 3766 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000185857 [0,1,0,0,0,1|1,0,0]=3 3767 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000039160 [0,1,0,0,0,1|1,0,1]=4 3768 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000036797 [0,1,0,0,0,1|1,0,1]=4 3769 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_200000210301 [0,1,0,0,0,1|2,0,0]=4 3770 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210206 [0,1,0,0,0,1|2,0,0]=4 3771 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000210198_100000189115 [0,1,0,0,0,1|2,0,0]=4 3772 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000210198_100000694040 [0,1,0,0,0,1|2,0,0]=4 3773 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210206 [0,1,0,0,0,1|2,0,0]=4 3774 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210198_100000198546 [0,1,0,0,0,1|2,0,0]=4 3775 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210206 [0,1,0,0,0,1|2,0,0]=4 3776 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000210198_100000189116 [0,1,0,0,0,1|2,0,0]=4 3777 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210206 [0,1,0,0,0,1|2,0,0]=4 3778 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210206 [0,1,0,0,0,1|1,0,0]=3 3779 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210198 [0,1,0,0,0,1|2,0,0]=4 3780 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210198 [0,1,0,0,0,1|2,0,0]=4 3781 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210198 [0,1,0,0,0,1|2,0,0]=4 3782 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210198 [0,1,0,0,0,1|2,0,0]=4 3783 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210198 [0,1,0,0,0,1|2,0,0]=4 3784 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210198 [0,1,0,0,0,1|2,0,0]=4 3785 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210198 [0,1,0,0,0,1|2,0,0]=4 3786 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210198 [0,1,0,0,0,1|2,0,0]=4 3787 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000210198 [0,1,0,0,0,1|2,0,0]=4 3788 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210198 [0,1,0,0,0,1|2,0,0]=4 3789 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000210198 [0,1,0,0,0,1|2,0,0]=4 3790 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000210198 [0,1,0,0,0,1|2,0,0]=4 3791 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000210198 [0,1,0,0,0,1|2,0,0]=4 3792 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210198 [0,1,0,0,0,1|2,0,0]=4 3793 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000210198 [0,1,0,0,0,1|2,0,0]=4 3794 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000210198 [0,1,0,0,0,1|2,0,0]=4 3795 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000210198 [0,1,0,0,0,1|1,0,0]=3 3796 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 271570a_203496583355_200000153573 [0,1,0,0,0,1|1,0,0]=3 3797 B13R1.133 CC(C)C(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193314 [0,1,0,0,0,1|2,0,0]=4 3798 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Br 1458a_100000062450_100000189115 [0,1,0,0,0,1|2,0,0]=4 3799 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)Cl 1458a_100000062450_100000694040 [0,1,0,0,0,1|2,0,0]=4 3800 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)F 1458a_100000062450_100000198546 [0,1,0,0,0,1|2,0,0]=4 3801 B13R1.133 CC(F)C(=O)Cc1ccc(cc1)I 1458a_100000062450_100000189116 [0,1,0,0,0,1|2,0,0]=4 3802 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000062450 [0,1,0,0,0,1|2,0,0]=4 3803 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000062450 [0,1,0,0,0,1|2,0,0]=4 3804 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000062450 [0,1,0,0,0,1|2,0,0]=4 3805 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000062450 [0,1,0,0,0,1|2,0,0]=4 3806 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000062450 [0,1,0,0,0,1|2,0,0]=4 3807 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000062450 [0,1,0,0,0,1|2,0,0]=4 3808 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000062450 [0,1,0,0,0,1|2,0,0]=4 3809 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000062450 [0,1,0,0,0,1|2,0,0]=4 3810 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000062450 [0,1,0,0,0,1|2,0,0]=4 3811 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000062450 [0,1,0,0,0,1|2,0,0]=4 3812 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000062450 [0,1,0,0,0,1|2,0,0]=4 3813 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000062450 [0,1,0,0,0,1|2,0,0]=4 3814 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000062450 [0,1,0,0,0,1|2,0,0]=4 3815 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000062450 [0,1,0,0,0,1|2,0,0]=4 3816 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000062450 [0,1,0,0,0,1|2,0,0]=4 3817 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000062450 [0,1,0,0,0,1|2,0,0]=4 3818 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000062450 [0,1,0,0,0,1|1,0,0]=3 3819 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 11a_100102631434_100000198978 [0,1,0,0,0,1|2,0,0]=4 3820 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 240690a_100102631434_100000198978 [0,1,0,0,0,1|2,0,0]=4 3821 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Br 527a_100102631434_100000198978 [0,1,0,0,0,1|2,0,0]=4 3822 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 11a_100102631434_100000211027 [0,1,0,0,0,1|2,0,0]=4 3823 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100102631434_100000211027 [0,1,0,0,0,1|2,0,0]=4 3824 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)Cl 527a_100102631434_100000211027 [0,1,0,0,0,1|2,0,0]=4 3825 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 11a_100102631434_100000210951 [0,1,0,0,0,1|2,0,0]=4 3826 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 1626a_100102631434_100000210951 [0,1,0,0,0,1|2,0,0]=4 3827 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 240690a_100102631434_100000210951 [0,1,0,0,0,1|2,0,0]=4 3828 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)F 527a_100102631434_100000210951 [0,1,0,0,0,1|2,0,0]=4 3829 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 11a_100102631434_100000688869 [0,1,0,0,0,1|2,0,0]=4 3830 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 1626a_100102631434_100000688869 [0,1,0,0,0,1|2,0,0]=4 3831 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 240690a_100102631434_100000688869 [0,1,0,0,0,1|2,0,0]=4 3832 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)I 527a_100102631434_100000688869 [0,1,0,0,0,1|2,0,0]=4 3833 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 1626a_100102631434_100000198540 [0,1,0,0,0,1|1,0,0]=3 3834 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 240690a_100102631434_100000198540 [0,1,0,0,0,1|1,0,0]=3 3835 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 271570a_203496583355_100000159674 [0,1,0,0,0,1|1,0,0]=3 3836 B13R1.133 CN(C)C(=O)Cc1ccc(cc1)O 527a_100102631434_100000198540 [0,1,0,0,0,1|1,0,0]=3 3837 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102631434 [0,1,0,0,0,1|2,0,0]=4 3838 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102631434 [0,1,0,0,0,1|2,0,0]=4 3839 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)F 2430a_100000185862_100102631434 [0,1,0,0,0,1|2,0,0]=4 3840 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)I 2430a_100000185761_100102631434 [0,1,0,0,0,1|2,0,0]=4 3841 B13R1.133 CN(C)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100102631434 [0,1,0,0,0,1|1,0,0]=3 3842 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Br 1458a_100000717761_100000189115 [0,1,0,0,0,1|2,0,0]=4 3843 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_100000717761_100000694040 [0,1,0,0,0,1|2,0,0]=4 3844 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)F 1458a_100000717761_100000198546 [0,1,0,0,0,1|2,0,0]=4 3845 B13R1.133 C[C@@H](O)C(=O)Cc1ccc(cc1)I 1458a_100000717761_100000189116 [0,1,0,0,0,1|2,0,0]=4 3846 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000717761 [0,1,0,0,0,1|2,0,0]=4 3847 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000717761 [0,1,0,0,0,1|2,0,0]=4 3848 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000717761 [0,1,0,0,0,1|2,0,0]=4 3849 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000717761 [0,1,0,0,0,1|2,0,0]=4 3850 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000717761 [0,1,0,0,0,1|1,0,0]=3 3851 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Br 1458a_217856618621_100000189115 [0,1,0,0,0,1|2,0,0]=4 3852 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_217856618621_100000694040 [0,1,0,0,0,1|2,0,0]=4 3853 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)F 1458a_217856618621_100000198546 [0,1,0,0,0,1|2,0,0]=4 3854 B13R1.133 C[C@H](O)C(=O)Cc1ccc(cc1)I 1458a_217856618621_100000189116 [0,1,0,0,0,1|2,0,0]=4 3855 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_217856618621 [0,1,0,0,0,1|2,0,0]=4 3856 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_217856618621 [0,1,0,0,0,1|2,0,0]=4 3857 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_217856618621 [0,1,0,0,0,1|2,0,0]=4 3858 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_217856618621 [0,1,0,0,0,1|2,0,0]=4 3859 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_217856618621 [0,1,0,0,0,1|2,0,0]=4 3860 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 22a_100000185862_217856618621 [0,1,0,0,0,1|2,0,0]=4 3861 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_217856618621 [0,1,0,0,0,1|2,0,0]=4 3862 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I 22a_100000185761_217856618621 [0,1,0,0,0,1|2,0,0]=4 3863 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_217856618621 [0,1,0,0,0,1|1,0,0]=3 3864 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000210198_100000210814 [0,1,0,0,0,1|2,0,0]=4 3865 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)C 1458a_100000212244_100000210206 [0,1,0,0,0,1|2,0,0]=4 3866 B13R1.133 Cc1ccc(cc1)CC(=O)C(C)F 1458a_100000062450_100000210814 [0,1,0,0,0,1|2,0,0]=4 3867 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 11a_100102631434_100000212244 [0,1,0,0,0,1|2,0,0]=4 3868 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 240690a_100102631434_100000212244 [0,1,0,0,0,1|2,0,0]=4 3869 B13R1.133 Cc1ccc(cc1)CC(=O)N(C)C 527a_100102631434_100000212244 [0,1,0,0,0,1|2,0,0]=4 3870 B13R1.133 Cc1ccc(cc1)CC(=O)[C@@H](C)O 1458a_100000717761_100000210814 [0,1,0,0,0,1|2,0,0]=4 3871 B13R1.133 Cc1ccc(cc1)CC(=O)[C@H](C)O 1458a_217856618621_100000210814 [0,1,0,0,0,1|2,0,0]=4 3872 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)[13CH3] 1458a_100000189662_200025704644 [0,1,0,0,0,1|2,0,0]=4 3873 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 11a_100000124888_100000210198 [0,1,0,0,0,1|2,0,0]=4 3874 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 1626a_100000124888_100000210198 [0,1,0,0,0,1|2,0,0]=4 3875 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 22a_100000124888_100000210198 [0,1,0,0,0,1|2,0,0]=4 3876 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)C 527a_100000124888_100000210198 [0,1,0,0,0,1|2,0,0]=4 3877 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 11a_100000124888_100000062450 [0,1,0,0,0,1|2,0,0]=4 3878 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 1626a_100000124888_100000062450 [0,1,0,0,0,1|2,0,0]=4 3879 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 22a_100000124888_100000062450 [0,1,0,0,0,1|2,0,0]=4 3880 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)F 527a_100000124888_100000062450 [0,1,0,0,0,1|2,0,0]=4 3881 B13R1.133 Cc1ccc(cc1)NC(=O)N(C)C 2430a_100000124888_100102631434 [0,1,0,0,0,1|2,0,0]=4 3882 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)O 22a_100000124888_100000717761 [0,1,0,0,0,1|2,0,0]=4 3883 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 1626a_100000124888_217856618621 [0,1,0,0,0,1|2,0,0]=4 3884 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 22a_100000124888_217856618621 [0,1,0,0,0,1|2,0,0]=4 3885 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011215815 [0,1,0,0,0,1|2,0,0]=4 3886 B13R1.133 O=C(Nc1ccc(cc1)O)C(F)F 22a_100000185829_100000210393 [0,1,0,0,0,1|2,0,0]=4 3887 B13R1.133 O=C(Nc1ccc(cc1)O)C(O)O 22a_100000185829_100000233687 [0,1,0,0,0,1|2,0,0]=4 3888 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)O 232682a_100000185829_100000211323 [0,1,0,0,0,1|2,0,0]=4 3889 B13R1.2679 C=CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000185746 [0,1,0,0,0,1|1,0,1]=4 3890 B13R1.2679 C=CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000185746 [0,1,0,0,0,1|1,0,1]=4 3891 B13R1.2679 C=CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000185746 [0,1,0,0,0,1|1,0,1]=4 3892 B13R1.2679 C=CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000185746 [0,1,0,0,0,1|1,0,1]=4 3893 B13R1.2679 C=CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000185746 [0,1,0,0,0,1|1,0,1]=4 3894 B13R1.2679 C=CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000185746 [0,1,0,0,0,1|1,0,1]=4 3895 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100000210414_200012351560 [0,1,0,0,0,1|2,0,0]=4 3896 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210202 [0,1,0,0,0,1|2,0,0]=4 3897 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000210414_100000755608 [0,1,0,0,0,1|2,0,0]=4 3898 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210202 [0,1,0,0,0,1|2,0,0]=4 3899 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000210414_100000243222 [0,1,0,0,0,1|2,0,0]=4 3900 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210202 [0,1,0,0,0,1|2,0,0]=4 3901 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)I 1458a_100000210414_100010146610 [0,1,0,0,0,1|2,0,0]=4 3902 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210202 [0,1,0,0,0,1|1,0,0]=3 3903 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000210414_100000708836 [0,1,0,0,0,1|2,0,0]=4 3904 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210202 [0,1,0,0,0,1|2,0,0]=4 3905 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100000210414_100011219618 [0,1,0,0,0,1|2,0,0]=4 3906 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210202 [0,1,0,0,0,1|2,0,0]=4 3907 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Cl 1458a_100000210414_100012361307 [0,1,0,0,0,1|2,0,0]=4 3908 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100000210414_100000700533 [0,1,0,0,0,1|2,0,0]=4 3909 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210202 [0,1,0,0,0,1|2,0,0]=4 3910 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000210414_100011740631 [0,1,0,0,0,1|2,0,0]=4 3911 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210202 [0,1,0,0,0,1|2,0,0]=4 3912 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)C 1458a_100000210414_100012349684 [0,1,0,0,0,1|2,0,0]=4 3913 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210414_100000188473 [0,1,0,0,0,1|2,0,0]=4 3914 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210202 [0,1,0,0,0,1|2,0,0]=4 3915 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000210414_100011216360 [0,1,0,0,0,1|2,0,0]=4 3916 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210202 [0,1,0,0,0,1|2,0,0]=4 3917 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100000210414_100000211606 [0,1,0,0,0,1|2,0,0]=4 3918 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210202 [0,1,0,0,0,1|2,0,0]=4 3919 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210202 [0,1,0,0,0,1|2,0,0]=4 3920 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000210414_100012002367 [0,1,0,0,0,1|2,0,0]=4 3921 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100000210414_100000709361 [0,1,0,0,0,1|2,0,0]=4 3922 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210202 [0,1,0,0,0,1|2,0,0]=4 3923 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000210414_100000748237 [0,1,0,0,0,1|2,0,0]=4 3924 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210202 [0,1,0,0,0,1|2,0,0]=4 3925 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100000210414_100010244991 [0,1,0,0,0,1|2,0,0]=4 3926 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210202 [0,1,0,0,0,1|2,0,0]=4 3927 B13R1.2679 CCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210202 [0,1,0,0,0,1|1,0,0]=3 3928 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Br 1458a_100000210414_100010146615 [0,1,0,0,0,1|2,0,0]=4 3929 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Cl 1458a_100000210414_100010254388 [0,1,0,0,0,1|2,0,0]=4 3930 B13R1.2679 CCC(=O)Cc1ccc(cc1I)F 1458a_100000210414_100012354799 [0,1,0,0,0,1|2,0,0]=4 3931 B13R1.2679 CCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210202 [0,1,0,0,0,1|2,0,0]=4 3932 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000210414 [0,1,0,0,0,1|2,0,0]=4 3933 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000210414 [0,1,0,0,0,1|2,0,0]=4 3934 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000210414 [0,1,0,0,0,1|2,0,0]=4 3935 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000210414 [0,1,0,0,0,1|2,0,0]=4 3936 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000210414 [0,1,0,0,0,1|2,0,0]=4 3937 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000210414 [0,1,0,0,0,1|2,0,0]=4 3938 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000210414 [0,1,0,0,0,1|2,0,0]=4 3939 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000210414 [0,1,0,0,0,1|2,0,0]=4 3940 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000210414 [0,1,0,0,0,1|2,0,0]=4 3941 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000210414 [0,1,0,0,0,1|2,0,0]=4 3942 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000210414 [0,1,0,0,0,1|1,0,0]=3 3943 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000210414 [0,1,0,0,0,1|1,0,0]=3 3944 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000210414 [0,1,0,0,0,1|2,0,0]=4 3945 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000210414 [0,1,0,0,0,1|2,0,0]=4 3946 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000210414 [0,1,0,0,0,1|2,0,0]=4 3947 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000210414 [0,1,0,0,0,1|2,0,0]=4 3948 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000210414 [0,1,0,0,0,1|2,0,0]=4 3949 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000210414 [0,1,0,0,0,1|2,0,0]=4 3950 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000210414 [0,1,0,0,0,1|2,0,0]=4 3951 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000210414 [0,1,0,0,0,1|2,0,0]=4 3952 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000210414 [0,1,0,0,0,1|2,0,0]=4 3953 B13R1.2679 CCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000210414 [0,1,0,0,0,1|2,0,0]=4 3954 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 11a_100000211637_100000210414 [0,1,0,0,0,1|2,0,0]=4 3955 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000210414 [0,1,0,0,0,1|2,0,0]=4 3956 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000210414 [0,1,0,0,0,1|2,0,0]=4 3957 B13R1.2679 CCC(=O)Nc1ccc(cc1C)F 527a_100000211637_100000210414 [0,1,0,0,0,1|2,0,0]=4 3958 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 11a_100000184554_100000210414 [0,1,0,0,0,1|2,0,0]=4 3959 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000210414 [0,1,0,0,0,1|2,0,0]=4 3960 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000210414 [0,1,0,0,0,1|2,0,0]=4 3961 B13R1.2679 CCC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000210414 [0,1,0,0,0,1|1,0,0]=3 3962 B13R1.2679 CCC(=O)Nc1ccc(cc1C)O 527a_100000756630_100000210414 [0,1,0,0,0,1|1,0,0]=3 3963 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000210414 [0,1,0,0,0,1|2,0,0]=4 3964 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000210414 [0,1,0,0,0,1|2,0,0]=4 3965 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210414 [0,1,0,0,0,1|2,0,0]=4 3966 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210414 [0,1,0,0,0,1|2,0,0]=4 3967 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210414 [0,1,0,0,0,1|2,0,0]=4 3968 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000210414 [0,1,0,0,0,1|2,0,0]=4 3969 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000210414 [0,1,0,0,0,1|2,0,0]=4 3970 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000210414 [0,1,0,0,0,1|2,0,0]=4 3971 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000210414 [0,1,0,0,0,1|2,0,0]=4 3972 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000210414 [0,1,0,0,0,1|2,0,0]=4 3973 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000210414 [0,1,0,0,0,1|2,0,0]=4 3974 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000210414 [0,1,0,0,0,1|2,0,0]=4 3975 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000210414 [0,1,0,0,0,1|2,0,0]=4 3976 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000210414 [0,1,0,0,0,1|2,0,0]=4 3977 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000210414 [0,1,0,0,0,1|1,0,0]=3 3978 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000210414 [0,1,0,0,0,1|1,0,0]=3 3979 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000210414 [0,1,0,0,0,1|2,0,0]=4 3980 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000210414 [0,1,0,0,0,1|2,0,0]=4 3981 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000210414 [0,1,0,0,0,1|2,0,0]=4 3982 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000210414 [0,1,0,0,0,1|2,0,0]=4 3983 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000210414 [0,1,0,0,0,1|2,0,0]=4 3984 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000210414 [0,1,0,0,0,1|2,0,0]=4 3985 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000210414 [0,1,0,0,0,1|2,0,0]=4 3986 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000210414 [0,1,0,0,0,1|2,0,0]=4 3987 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000210414 [0,1,0,0,0,1|2,0,0]=4 3988 B13R1.2679 CCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000210414 [0,1,0,0,0,1|2,0,0]=4 3989 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 11a_100000210720_100000210414 [0,1,0,0,0,1|2,0,0]=4 3990 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000210414 [0,1,0,0,0,1|2,0,0]=4 3991 B13R1.2679 CCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000210414 [0,1,0,0,0,1|2,0,0]=4 3992 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 11a_100011215594_100000210414 [0,1,0,0,0,1|2,0,0]=4 3993 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000210414 [0,1,0,0,0,1|2,0,0]=4 3994 B13R1.2679 CCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000210414 [0,1,0,0,0,1|2,0,0]=4 3995 B13R1.2679 CCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3996 B13R1.2679 CCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100000210414 [0,1,0,0,0,1|1,0,0]=3 3997 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000210414 [0,1,0,0,0,1|2,0,0]=4 3998 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000210414 [0,1,0,0,0,1|2,0,0]=4 3999 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000210414 [0,1,0,0,0,1|2,0,0]=4 4000 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000210414 [0,1,0,0,0,1|2,0,0]=4 4001 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000210414 [0,1,0,0,0,1|2,0,0]=4 4002 B13R1.2679 CCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000210414 [0,1,0,0,0,1|2,0,0]=4 4003 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 11a_100000760547_100000210414 [0,1,0,0,0,1|2,0,0]=4 4004 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000210414 [0,1,0,0,0,1|2,0,0]=4 4005 B13R1.2679 CCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000210414 [0,1,0,0,0,1|2,0,0]=4 4006 B13R1.2679 CCC(=O)Nc1ccc(cc1I)I 11a_100010002754_100000210414 [0,1,0,0,0,1|2,0,0]=4 4007 B13R1.2679 CCC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000210414 [0,1,0,0,0,1|2,0,0]=4 4008 B13R1.2679 CCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000210414 [0,1,0,0,0,1|1,0,0]=3 4009 B13R1.2679 CCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100000210414 [0,1,0,0,0,1|1,0,0]=3 4010 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000210414 [0,1,0,0,0,1|2,0,0]=4 4011 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000210414 [0,1,0,0,0,1|2,0,0]=4 4012 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000210414 [0,1,0,0,0,1|2,0,0]=4 4013 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152038 [0,1,0,0,0,1|2,0,0]=4 4014 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000210414 [0,1,0,0,0,1|2,0,0]=4 4015 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210414 [0,1,0,0,0,1|2,0,0]=4 4016 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000210414 [0,1,0,0,0,1|2,0,0]=4 4017 B13R1.2679 CCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000210414 [0,1,0,0,0,1|2,0,0]=4 4018 B13R1.2679 CCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000210414 [0,1,0,0,0,1|2,0,0]=4 4019 B13R1.2679 CCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000210414 [0,1,0,0,0,1|2,0,0]=4 4020 B13R1.2679 CCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000210414 [0,1,0,0,0,1|2,0,0]=4 4021 B13R1.2679 CCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210414 [0,1,0,0,0,1|1,0,0]=3 4022 B13R1.2679 CCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000210414 [0,1,0,0,0,1|1,0,0]=3 4023 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 11a_106832991635_100010172832 [0,1,0,0,0,1|2,0,0]=4 4024 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 240690a_100102657272_100010172832 [0,1,0,0,0,1|2,0,0]=4 4025 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 527a_100102657272_100010172832 [0,1,0,0,0,1|2,0,0]=4 4026 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 11a_106832991635_100000755479 [0,1,0,0,0,1|2,0,0]=4 4027 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 1626a_100102657272_100000755479 [0,1,0,0,0,1|2,0,0]=4 4028 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 240690a_100102657272_100000755479 [0,1,0,0,0,1|2,0,0]=4 4029 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 527a_100102657272_100000755479 [0,1,0,0,0,1|2,0,0]=4 4030 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 11a_106832991635_100000708238 [0,1,0,0,0,1|2,0,0]=4 4031 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 1626a_100102657272_100000708238 [0,1,0,0,0,1|2,0,0]=4 4032 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 240690a_100102657272_100000708238 [0,1,0,0,0,1|2,0,0]=4 4033 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 527a_100102657272_100000708238 [0,1,0,0,0,1|2,0,0]=4 4034 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 240690a_100102657272_100010176083 [0,1,0,0,0,1|1,0,0]=3 4035 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 527a_100102657272_100010176083 [0,1,0,0,0,1|1,0,0]=3 4036 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 11a_106832991635_100000697930 [0,1,0,0,0,1|2,0,0]=4 4037 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 1626a_100102657272_100000697930 [0,1,0,0,0,1|2,0,0]=4 4038 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 240690a_100102657272_100000697930 [0,1,0,0,0,1|2,0,0]=4 4039 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 527a_100102657272_100000697930 [0,1,0,0,0,1|2,0,0]=4 4040 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 11a_106832991635_100011236500 [0,1,0,0,0,1|2,0,0]=4 4041 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 1626a_100102657272_100011236500 [0,1,0,0,0,1|2,0,0]=4 4042 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 240690a_100102657272_100011236500 [0,1,0,0,0,1|2,0,0]=4 4043 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 527a_100102657272_100011236500 [0,1,0,0,0,1|2,0,0]=4 4044 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 11a_106832991635_100011667441 [0,1,0,0,0,1|2,0,0]=4 4045 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 1626a_100102657272_100011667441 [0,1,0,0,0,1|2,0,0]=4 4046 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 240690a_100102657272_100011667441 [0,1,0,0,0,1|2,0,0]=4 4047 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 527a_100102657272_100011667441 [0,1,0,0,0,1|2,0,0]=4 4048 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 11a_106832991635_100012361378 [0,1,0,0,0,1|2,0,0]=4 4049 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 1626a_100102657272_100012361378 [0,1,0,0,0,1|2,0,0]=4 4050 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 240690a_100102657272_100012361378 [0,1,0,0,0,1|2,0,0]=4 4051 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 527a_100102657272_100012361378 [0,1,0,0,0,1|2,0,0]=4 4052 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 11a_106832991635_100000210926 [0,1,0,0,0,1|2,0,0]=4 4053 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100102657272_100000210926 [0,1,0,0,0,1|2,0,0]=4 4054 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100102657272_100000210926 [0,1,0,0,0,1|2,0,0]=4 4055 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 527a_100102657272_100000210926 [0,1,0,0,0,1|2,0,0]=4 4056 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 11a_106832991635_100000690284 [0,1,0,0,0,1|2,0,0]=4 4057 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 1626a_100102657272_100000690284 [0,1,0,0,0,1|2,0,0]=4 4058 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 240690a_100102657272_100000690284 [0,1,0,0,0,1|2,0,0]=4 4059 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 527a_100102657272_100000690284 [0,1,0,0,0,1|2,0,0]=4 4060 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 11a_106832991635_100011295475 [0,1,0,0,0,1|2,0,0]=4 4061 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 1626a_100102657272_100011295475 [0,1,0,0,0,1|2,0,0]=4 4062 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 240690a_100102657272_100011295475 [0,1,0,0,0,1|2,0,0]=4 4063 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 527a_100102657272_100011295475 [0,1,0,0,0,1|2,0,0]=4 4064 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 11a_106832991635_100000042674 [0,1,0,0,0,1|2,0,0]=4 4065 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 1626a_100102657272_100000042674 [0,1,0,0,0,1|2,0,0]=4 4066 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 240690a_100102657272_100000042674 [0,1,0,0,0,1|2,0,0]=4 4067 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 527a_100102657272_100000042674 [0,1,0,0,0,1|2,0,0]=4 4068 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 11a_106832991635_100011830378 [0,1,0,0,0,1|2,0,0]=4 4069 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 1626a_100102657272_100011830378 [0,1,0,0,0,1|2,0,0]=4 4070 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 240690a_100102657272_100011830378 [0,1,0,0,0,1|2,0,0]=4 4071 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 527a_100102657272_100011830378 [0,1,0,0,0,1|2,0,0]=4 4072 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 11a_106832991635_100000684719 [0,1,0,0,0,1|2,0,0]=4 4073 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 1626a_100102657272_100000684719 [0,1,0,0,0,1|2,0,0]=4 4074 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 240690a_100102657272_100000684719 [0,1,0,0,0,1|2,0,0]=4 4075 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 527a_100102657272_100000684719 [0,1,0,0,0,1|2,0,0]=4 4076 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 11a_106832991635_100010149628 [0,1,0,0,0,1|2,0,0]=4 4077 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 1626a_100102657272_100010149628 [0,1,0,0,0,1|2,0,0]=4 4078 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 240690a_100102657272_100010149628 [0,1,0,0,0,1|2,0,0]=4 4079 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 527a_100102657272_100010149628 [0,1,0,0,0,1|2,0,0]=4 4080 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 240690a_100102657272_100000090534 [0,1,0,0,0,1|1,0,0]=3 4081 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 527a_100102657272_100000090534 [0,1,0,0,0,1|1,0,0]=3 4082 B13R1.2679 CNC(=O)Cc1ccc(cc1O)Br 240690a_100102657272_100000707504 [0,1,0,0,0,1|2,0,0]=4 4083 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100102657272 [0,1,0,0,0,1|2,0,0]=4 4084 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100102657272 [0,1,0,0,0,1|2,0,0]=4 4085 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100102657272 [0,1,0,0,0,1|2,0,0]=4 4086 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100102657272 [0,1,0,0,0,1|2,0,0]=4 4087 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100102657272 [0,1,0,0,0,1|2,0,0]=4 4088 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100102657272 [0,1,0,0,0,1|1,0,0]=3 4089 B13R1.2679 CNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100102657272 [0,1,0,0,0,1|2,0,0]=4 4090 B13R1.2679 CNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100102657272 [0,1,0,0,0,1|2,0,0]=4 4091 B13R1.2679 CNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100102657272 [0,1,0,0,0,1|2,0,0]=4 4092 B13R1.2679 CNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100102657272 [0,1,0,0,0,1|2,0,0]=4 4093 B13R1.2679 CNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100102657272 [0,1,0,0,0,1|2,0,0]=4 4094 B13R1.2679 CNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100102657272 [0,1,0,0,0,1|1,0,0]=3 4095 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100102657272 [0,1,0,0,0,1|2,0,0]=4 4096 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100102657272 [0,1,0,0,0,1|2,0,0]=4 4097 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100102657272 [0,1,0,0,0,1|2,0,0]=4 4098 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100102657272 [0,1,0,0,0,1|2,0,0]=4 4099 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100102657272 [0,1,0,0,0,1|2,0,0]=4 4100 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100102657272 [0,1,0,0,0,1|1,0,0]=3 4101 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100102657272 [0,1,0,0,0,1|2,0,0]=4 4102 B13R1.2679 CNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100102657272 [0,1,0,0,0,1|2,0,0]=4 4103 B13R1.2679 CNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100102657272 [0,1,0,0,0,1|2,0,0]=4 4104 B13R1.2679 CNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100102657272 [0,1,0,0,0,1|2,0,0]=4 4105 B13R1.2679 CNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100102657272 [0,1,0,0,0,1|2,0,0]=4 4106 B13R1.2679 CNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100102657272 [0,1,0,0,0,1|1,0,0]=3 4107 B13R1.2679 CNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100102657272 [0,1,0,0,0,1|2,0,0]=4 4108 B13R1.2679 CNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100102657272 [0,1,0,0,0,1|2,0,0]=4 4109 B13R1.2679 CNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100102657272 [0,1,0,0,0,1|2,0,0]=4 4110 B13R1.2679 CNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100102657272 [0,1,0,0,0,1|2,0,0]=4 4111 B13R1.2679 CNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100102657272 [0,1,0,0,0,1|2,0,0]=4 4112 B13R1.2679 CNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100102657272 [0,1,0,0,0,1|1,0,0]=3 4113 B13R1.2679 CNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100102657272 [0,1,0,0,0,1|2,0,0]=4 4114 B13R1.2679 CNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100102657272 [0,1,0,0,0,1|2,0,0]=4 4115 B13R1.2679 CNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100102657272 [0,1,0,0,0,1|2,0,0]=4 4116 B13R1.2679 CNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100102657272 [0,1,0,0,0,1|2,0,0]=4 4117 B13R1.2679 CNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100102657272 [0,1,0,0,0,1|1,0,0]=3 4118 B13R1.2679 COC(=O)Cc1ccc(cc1F)O 271570a_203496583355_100013023952 [0,1,0,0,0,1|0,0,0]=2 4119 B13R1.2679 COC(=O)Cc1ccc(cc1O)F 271570a_203496583355_200012569216 [0,1,0,0,0,1|1,0,0]=3 4120 B13R1.2679 COC(=O)Cc1ccc(cc1O)O 271570a_203496583355_100010150832 [0,1,0,0,0,1|0,0,0]=2 4121 B13R1.2679 COC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000750523 [0,1,0,0,0,1|1,0,0]=3 4122 B13R1.2679 COC(C)Sc1ccc(cc1Br)O 62a_100000701344_100009879195 [0,1,0,0,0,1|1,0,1]=4 4123 B13R1.2679 COC(C)Sc1ccc(cc1Br)O 62a_100009879195_100000701344 [0,1,0,0,0,1|1,0,1]=4 4124 B13R1.2679 COC(C)Sc1ccc(cc1C)O 62a_100009879195_100000690111 [0,1,0,0,0,1|1,0,1]=4 4125 B13R1.2679 COC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100009879195 [0,1,0,0,0,1|1,0,1]=4 4126 B13R1.2679 COC(C)Sc1ccc(cc1Cl)O 62a_100009879195_100000047559 [0,1,0,0,0,1|1,0,1]=4 4127 B13R1.2679 COC(C)Sc1ccc(cc1F)O 62a_100000755031_100009879195 [0,1,0,0,0,1|1,0,1]=4 4128 B13R1.2679 COC(C)Sc1ccc(cc1F)O 62a_100009879195_100000755031 [0,1,0,0,0,1|1,0,1]=4 4129 B13R1.2679 COC(C)Sc1ccc(cc1N)O 62a_100009879195_100011999798 [0,1,0,0,0,1|1,0,1]=4 4130 B13R1.2679 COC(C)Sc1ccc(cc1N)O 62a_100011999798_100009879195 [0,1,0,0,0,1|1,0,1]=4 4131 B13R1.2679 COC(C)Sc1ccc(cc1O)O 62a_100009879195_100009813921 [0,1,0,0,0,1|1,0,1]=4 4132 B13R1.2679 Cc1cc(ccc1NC(=O)CO)O 22a_100000756630_100000210174 [0,1,0,0,0,1|2,0,0]=4 4133 B13R1.2679 Cc1cc(ccc1NC(=O)CO)O 527a_100000756630_100000210174 [0,1,0,0,0,1|2,0,0]=4 4134 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)O 1458a_100010176083_100015361967 [0,1,0,0,0,1|2,0,0]=4 4135 B13R1.2679 O=C(CF)Cc1ccc(cc1F)O 1458a_100000090534_100015361967 [0,1,0,0,0,1|2,0,0]=4 4136 B13R1.2679 O=C(CO)Nc1ccc(cc1Br)O 22a_100012001276_100000210174 [0,1,0,0,0,1|2,0,0]=4 4137 B13R1.2679 O=C(CO)Nc1ccc(cc1Br)O 527a_100012001276_100000210174 [0,1,0,0,0,1|2,0,0]=4 4138 B13R1.2679 O=C(CO)Nc1ccc(cc1Cl)O 22a_100011215599_100000210174 [0,1,0,0,0,1|2,0,0]=4 4139 B13R1.2679 O=C(CO)Nc1ccc(cc1Cl)O 527a_100011215599_100000210174 [0,1,0,0,0,1|2,0,0]=4 4140 B13R1.2679 O=C(CO)Nc1ccc(cc1F)O 22a_100000759473_100000210174 [0,1,0,0,0,1|2,0,0]=4 4141 B13R1.2679 O=C(CO)Nc1ccc(cc1F)O 527a_100000759473_100000210174 [0,1,0,0,0,1|2,0,0]=4 4142 B13R1.2679 O=C(CO)Nc1ccc(cc1I)O 22a_100010084370_100000210174 [0,1,0,0,0,1|2,0,0]=4 4143 B13R1.2679 O=C(CO)Nc1ccc(cc1I)O 527a_100010084370_100000210174 [0,1,0,0,0,1|2,0,0]=4 4144 B13R1.2679 O=C(CO)Nc1ccc(cc1O)O 22a_100000106777_100000210174 [0,1,0,0,0,1|2,0,0]=4 4145 B13R1.2679 O=C(CO)Nc1ccc(cc1O)O 527a_100000106777_100000210174 [0,1,0,0,0,1|2,0,0]=4 4146 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000185746 [0,1,0,0,0,1|1,0,1]=4 4147 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000185746 [0,1,0,0,0,1|1,0,1]=4 4148 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000185746 [0,1,0,0,0,1|1,0,1]=4 4149 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000185746 [0,1,0,0,0,1|1,0,1]=4 4150 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185746 [0,1,0,0,0,1|1,0,1]=4 4151 B13R1.2879 CCC(=O)Cc1cc(=O)c(co1)O 1458a_100000210414_100000010605 [0,1,0,0,0,1|2,0,0]=4 4152 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000210414_100012353900 [0,1,0,0,0,1|2,0,0]=4 4153 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000210414_100012232412 [0,1,0,0,0,1|2,0,0]=4 4154 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000210202 [0,1,0,0,0,1|2,0,0]=4 4155 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000210414_100012353894 [0,1,0,0,0,1|2,0,0]=4 4156 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210202 [0,1,0,0,0,1|2,0,0]=4 4157 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000210414_100011206884 [0,1,0,0,0,1|2,0,0]=4 4158 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210202 [0,1,0,0,0,1|2,0,0]=4 4159 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [0,1,0,0,0,1|1,0,0]=3 4160 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000210414_100000727479 [0,1,0,0,0,1|2,0,0]=4 4161 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000210202 [0,1,0,0,0,1|2,0,0]=4 4162 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000210202 [0,1,0,0,0,1|2,0,0]=4 4163 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000210414_100000742320 [0,1,0,0,0,1|2,0,0]=4 4164 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000210414_100012184735 [0,1,0,0,0,1|2,0,0]=4 4165 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100000210414_100011216667 [0,1,0,0,0,1|2,0,0]=4 4166 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000210202 [0,1,0,0,0,1|2,0,0]=4 4167 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [0,1,0,0,0,1|1,0,0]=3 4168 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000210414_100012353895 [0,1,0,0,0,1|2,0,0]=4 4169 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210202 [0,1,0,0,0,1|2,0,0]=4 4170 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000210414_100011823929 [0,1,0,0,0,1|2,0,0]=4 4171 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210414_100000184707 [0,1,0,0,0,1|2,0,0]=4 4172 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210202 [0,1,0,0,0,1|2,0,0]=4 4173 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000210414_100000717365 [0,1,0,0,0,1|2,0,0]=4 4174 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210202 [0,1,0,0,0,1|2,0,0]=4 4175 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000210414_100012349665 [0,1,0,0,0,1|2,0,0]=4 4176 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [0,1,0,0,0,1|1,0,0]=3 4177 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000210414_100000767054 [0,1,0,0,0,1|2,0,0]=4 4178 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210202 [0,1,0,0,0,1|2,0,0]=4 4179 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100000210414_100011217369 [0,1,0,0,0,1|2,0,0]=4 4180 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000210202 [0,1,0,0,0,1|2,0,0]=4 4181 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000210414_100000716492 [0,1,0,0,0,1|2,0,0]=4 4182 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210202 [0,1,0,0,0,1|2,0,0]=4 4183 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000210414_100000757363 [0,1,0,0,0,1|2,0,0]=4 4184 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210202 [0,1,0,0,0,1|2,0,0]=4 4185 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100000210414_100010149604 [0,1,0,0,0,1|2,0,0]=4 4186 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210202 [0,1,0,0,0,1|2,0,0]=4 4187 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [0,1,0,0,0,1|1,0,0]=3 4188 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000210414_100010146616 [0,1,0,0,0,1|2,0,0]=4 4189 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)C 1458a_100000210414_100010206137 [0,1,0,0,0,1|2,0,0]=4 4190 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)F 1458a_100000210414_100010188208 [0,1,0,0,0,1|2,0,0]=4 4191 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210202 [0,1,0,0,0,1|2,0,0]=4 4192 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [0,1,0,0,0,1|1,0,0]=3 4193 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100000210414 [0,1,0,0,0,1|2,0,0]=4 4194 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100000210414 [0,1,0,0,0,1|2,0,0]=4 4195 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000210414 [0,1,0,0,0,1|2,0,0]=4 4196 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000210414 [0,1,0,0,0,1|2,0,0]=4 4197 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100000210414 [0,1,0,0,0,1|2,0,0]=4 4198 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100000210414 [0,1,0,0,0,1|2,0,0]=4 4199 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000210414 [0,1,0,0,0,1|2,0,0]=4 4200 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100000210414 [0,1,0,0,0,1|2,0,0]=4 4201 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000210414 [0,1,0,0,0,1|2,0,0]=4 4202 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000210414 [0,1,0,0,0,1|2,0,0]=4 4203 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000210414 [0,1,0,0,0,1|2,0,0]=4 4204 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000210414 [0,1,0,0,0,1|2,0,0]=4 4205 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100000210414 [0,1,0,0,0,1|2,0,0]=4 4206 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100000210414 [0,1,0,0,0,1|2,0,0]=4 4207 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000210414 [0,1,0,0,0,1|2,0,0]=4 4208 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100000210414 [0,1,0,0,0,1|2,0,0]=4 4209 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100000210414 [0,1,0,0,0,1|2,0,0]=4 4210 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100000210414 [0,1,0,0,0,1|2,0,0]=4 4211 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000210414 [0,1,0,0,0,1|2,0,0]=4 4212 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100000210414 [0,1,0,0,0,1|2,0,0]=4 4213 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210414 [0,1,0,0,0,1|1,0,0]=3 4214 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210414 [0,1,0,0,0,1|1,0,0]=3 4215 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100000210414 [0,1,0,0,0,1|2,0,0]=4 4216 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100000210414 [0,1,0,0,0,1|2,0,0]=4 4217 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000210414 [0,1,0,0,0,1|2,0,0]=4 4218 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100000210414 [0,1,0,0,0,1|2,0,0]=4 4219 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100000210414 [0,1,0,0,0,1|2,0,0]=4 4220 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100000210414 [0,1,0,0,0,1|2,0,0]=4 4221 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000210414 [0,1,0,0,0,1|2,0,0]=4 4222 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100000210414 [0,1,0,0,0,1|2,0,0]=4 4223 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000210414 [0,1,0,0,0,1|2,0,0]=4 4224 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000210414 [0,1,0,0,0,1|2,0,0]=4 4225 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000210414 [0,1,0,0,0,1|2,0,0]=4 4226 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000210414 [0,1,0,0,0,1|2,0,0]=4 4227 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100000210414 [0,1,0,0,0,1|2,0,0]=4 4228 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100000210414 [0,1,0,0,0,1|2,0,0]=4 4229 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000210414 [0,1,0,0,0,1|2,0,0]=4 4230 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100000210414 [0,1,0,0,0,1|2,0,0]=4 4231 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100000210414 [0,1,0,0,0,1|2,0,0]=4 4232 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100000210414 [0,1,0,0,0,1|2,0,0]=4 4233 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000210414 [0,1,0,0,0,1|2,0,0]=4 4234 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100000210414 [0,1,0,0,0,1|2,0,0]=4 4235 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000210414 [0,1,0,0,0,1|1,0,0]=3 4236 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000210414 [0,1,0,0,0,1|1,0,0]=3 4237 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000210414 [0,1,0,0,0,1|1,0,0]=3 4238 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100000210414 [0,1,0,0,0,1|2,0,0]=4 4239 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100000210414 [0,1,0,0,0,1|2,0,0]=4 4240 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000210414 [0,1,0,0,0,1|2,0,0]=4 4241 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000210414 [0,1,0,0,0,1|2,0,0]=4 4242 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100000210414 [0,1,0,0,0,1|2,0,0]=4 4243 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100000210414 [0,1,0,0,0,1|2,0,0]=4 4244 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000210414 [0,1,0,0,0,1|2,0,0]=4 4245 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100000210414 [0,1,0,0,0,1|2,0,0]=4 4246 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000210414 [0,1,0,0,0,1|2,0,0]=4 4247 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000210414 [0,1,0,0,0,1|2,0,0]=4 4248 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000210414 [0,1,0,0,0,1|2,0,0]=4 4249 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000210414 [0,1,0,0,0,1|2,0,0]=4 4250 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100000210414 [0,1,0,0,0,1|2,0,0]=4 4251 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100000210414 [0,1,0,0,0,1|2,0,0]=4 4252 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000210414 [0,1,0,0,0,1|2,0,0]=4 4253 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000210414 [0,1,0,0,0,1|2,0,0]=4 4254 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100000210414 [0,1,0,0,0,1|2,0,0]=4 4255 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100000210414 [0,1,0,0,0,1|2,0,0]=4 4256 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000210414 [0,1,0,0,0,1|2,0,0]=4 4257 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210414 [0,1,0,0,0,1|1,0,0]=3 4258 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100000210414 [0,1,0,0,0,1|2,0,0]=4 4259 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100000210414 [0,1,0,0,0,1|2,0,0]=4 4260 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000210414 [0,1,0,0,0,1|2,0,0]=4 4261 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100000210414 [0,1,0,0,0,1|2,0,0]=4 4262 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100000210414 [0,1,0,0,0,1|2,0,0]=4 4263 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100000210414 [0,1,0,0,0,1|2,0,0]=4 4264 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000210414 [0,1,0,0,0,1|2,0,0]=4 4265 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100000210414 [0,1,0,0,0,1|2,0,0]=4 4266 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000210414 [0,1,0,0,0,1|2,0,0]=4 4267 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000210414 [0,1,0,0,0,1|2,0,0]=4 4268 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000210414 [0,1,0,0,0,1|2,0,0]=4 4269 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100000210414 [0,1,0,0,0,1|2,0,0]=4 4270 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100000210414 [0,1,0,0,0,1|2,0,0]=4 4271 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000210414 [0,1,0,0,0,1|2,0,0]=4 4272 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100000210414 [0,1,0,0,0,1|2,0,0]=4 4273 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100000210414 [0,1,0,0,0,1|2,0,0]=4 4274 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000210414 [0,1,0,0,0,1|2,0,0]=4 4275 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000210414 [0,1,0,0,0,1|1,0,0]=3 4276 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000210414 [0,1,0,0,0,1|1,0,0]=3 4277 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100000210414 [0,1,0,0,0,1|2,0,0]=4 4278 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100000210414 [0,1,0,0,0,1|2,0,0]=4 4279 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000210414 [0,1,0,0,0,1|2,0,0]=4 4280 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100000210414 [0,1,0,0,0,1|2,0,0]=4 4281 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100000210414 [0,1,0,0,0,1|2,0,0]=4 4282 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100000210414 [0,1,0,0,0,1|2,0,0]=4 4283 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000210414 [0,1,0,0,0,1|2,0,0]=4 4284 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100000210414 [0,1,0,0,0,1|2,0,0]=4 4285 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000210414 [0,1,0,0,0,1|2,0,0]=4 4286 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000210414 [0,1,0,0,0,1|2,0,0]=4 4287 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000210414 [0,1,0,0,0,1|2,0,0]=4 4288 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000210414 [0,1,0,0,0,1|2,0,0]=4 4289 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100000210414 [0,1,0,0,0,1|2,0,0]=4 4290 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100000210414 [0,1,0,0,0,1|2,0,0]=4 4291 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000210414 [0,1,0,0,0,1|2,0,0]=4 4292 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100000210414 [0,1,0,0,0,1|2,0,0]=4 4293 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000210414 [0,1,0,0,0,1|2,0,0]=4 4294 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000210414 [0,1,0,0,0,1|2,0,0]=4 4295 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000210414 [0,1,0,0,0,1|2,0,0]=4 4296 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210414 [0,1,0,0,0,1|2,0,0]=4 4297 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000210414 [0,1,0,0,0,1|2,0,0]=4 4298 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000210414 [0,1,0,0,0,1|2,0,0]=4 4299 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210414 [0,1,0,0,0,1|1,0,0]=3 4300 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210414 [0,1,0,0,0,1|1,0,0]=3 4301 B13R1.2879 CCC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187203 [0,1,0,0,0,1|2,0,0]=4 4302 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 11a_106832991635_100000709925 [0,1,0,0,0,1|2,0,0]=4 4303 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 240690a_100102657272_100000709925 [0,1,0,0,0,1|2,0,0]=4 4304 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 527a_100102657272_100000709925 [0,1,0,0,0,1|2,0,0]=4 4305 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 11a_106832991635_100012349508 [0,1,0,0,0,1|2,0,0]=4 4306 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100012349508 [0,1,0,0,0,1|2,0,0]=4 4307 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100102657272_100012349508 [0,1,0,0,0,1|2,0,0]=4 4308 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 11a_106832991635_100000742997 [0,1,0,0,0,1|2,0,0]=4 4309 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 240690a_100102657272_100000742997 [0,1,0,0,0,1|2,0,0]=4 4310 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 527a_100102657272_100000742997 [0,1,0,0,0,1|2,0,0]=4 4311 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [0,1,0,0,0,1|1,0,0]=3 4312 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [0,1,0,0,0,1|1,0,0]=3 4313 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 11a_106832991635_100012340274 [0,1,0,0,0,1|2,0,0]=4 4314 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 240690a_100102657272_100012340274 [0,1,0,0,0,1|2,0,0]=4 4315 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 527a_100102657272_100012340274 [0,1,0,0,0,1|2,0,0]=4 4316 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 11a_106832991635_100000184070 [0,1,0,0,0,1|2,0,0]=4 4317 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 240690a_100102657272_100000184070 [0,1,0,0,0,1|2,0,0]=4 4318 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 527a_100102657272_100000184070 [0,1,0,0,0,1|2,0,0]=4 4319 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 11a_106832991635_100011667458 [0,1,0,0,0,1|2,0,0]=4 4320 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 240690a_100102657272_100011667458 [0,1,0,0,0,1|2,0,0]=4 4321 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 527a_100102657272_100011667458 [0,1,0,0,0,1|2,0,0]=4 4322 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [0,1,0,0,0,1|1,0,0]=3 4323 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [0,1,0,0,0,1|1,0,0]=3 4324 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 11a_106832991635_100000766880 [0,1,0,0,0,1|2,0,0]=4 4325 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100102657272_100000766880 [0,1,0,0,0,1|2,0,0]=4 4326 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100102657272_100000766880 [0,1,0,0,0,1|2,0,0]=4 4327 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000210702 [0,1,0,0,0,1|2,0,0]=4 4328 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210702 [0,1,0,0,0,1|2,0,0]=4 4329 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100102657272_100000210702 [0,1,0,0,0,1|2,0,0]=4 4330 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 11a_106832991635_100011217296 [0,1,0,0,0,1|2,0,0]=4 4331 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100102657272_100011217296 [0,1,0,0,0,1|2,0,0]=4 4332 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100102657272_100011217296 [0,1,0,0,0,1|2,0,0]=4 4333 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 527a_100102657272_100011217296 [0,1,0,0,0,1|2,0,0]=4 4334 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [0,1,0,0,0,1|1,0,0]=3 4335 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [0,1,0,0,0,1|1,0,0]=3 4336 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 11a_106832991635_100000691132 [0,1,0,0,0,1|2,0,0]=4 4337 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 240690a_100102657272_100000691132 [0,1,0,0,0,1|2,0,0]=4 4338 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 527a_100102657272_100000691132 [0,1,0,0,0,1|2,0,0]=4 4339 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 11a_106832991635_100011217375 [0,1,0,0,0,1|2,0,0]=4 4340 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 240690a_100102657272_100011217375 [0,1,0,0,0,1|2,0,0]=4 4341 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 527a_100102657272_100011217375 [0,1,0,0,0,1|2,0,0]=4 4342 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 11a_106832991635_100000722404 [0,1,0,0,0,1|2,0,0]=4 4343 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100102657272_100000722404 [0,1,0,0,0,1|2,0,0]=4 4344 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 527a_100102657272_100000722404 [0,1,0,0,0,1|2,0,0]=4 4345 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 11a_106832991635_100000684721 [0,1,0,0,0,1|2,0,0]=4 4346 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 1626a_100102657272_100000684721 [0,1,0,0,0,1|2,0,0]=4 4347 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 240690a_100102657272_100000684721 [0,1,0,0,0,1|2,0,0]=4 4348 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 527a_100102657272_100000684721 [0,1,0,0,0,1|2,0,0]=4 4349 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 11a_106832991635_100010149632 [0,1,0,0,0,1|2,0,0]=4 4350 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 1626a_100102657272_100010149632 [0,1,0,0,0,1|2,0,0]=4 4351 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 240690a_100102657272_100010149632 [0,1,0,0,0,1|2,0,0]=4 4352 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 527a_100102657272_100010149632 [0,1,0,0,0,1|2,0,0]=4 4353 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [0,1,0,0,0,1|1,0,0]=3 4354 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [0,1,0,0,0,1|1,0,0]=3 4355 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 11a_106832991635_100000082272 [0,1,0,0,0,1|2,0,0]=4 4356 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 240690a_100102657272_100000082272 [0,1,0,0,0,1|2,0,0]=4 4357 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 527a_100102657272_100000082272 [0,1,0,0,0,1|2,0,0]=4 4358 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [0,1,0,0,0,1|1,0,0]=3 4359 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100102657272 [0,1,0,0,0,1|2,0,0]=4 4360 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)C 2430a_100000736455_100102657272 [0,1,0,0,0,1|2,0,0]=4 4361 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100102657272 [0,1,0,0,0,1|2,0,0]=4 4362 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)F 2430a_100000760356_100102657272 [0,1,0,0,0,1|2,0,0]=4 4363 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)I 2430a_100000750458_100102657272 [0,1,0,0,0,1|2,0,0]=4 4364 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100102657272 [0,1,0,0,0,1|1,0,0]=3 4365 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Br 2430a_100000210723_100102657272 [0,1,0,0,0,1|2,0,0]=4 4366 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)C 2430a_100000724040_100102657272 [0,1,0,0,0,1|2,0,0]=4 4367 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100102657272 [0,1,0,0,0,1|2,0,0]=4 4368 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)F 2430a_100000750164_100102657272 [0,1,0,0,0,1|2,0,0]=4 4369 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)I 2430a_100000198070_100102657272 [0,1,0,0,0,1|2,0,0]=4 4370 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100102657272 [0,1,0,0,0,1|1,0,0]=3 4371 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100102657272 [0,1,0,0,0,1|2,0,0]=4 4372 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)C 2430a_100000188892_100102657272 [0,1,0,0,0,1|2,0,0]=4 4373 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100102657272 [0,1,0,0,0,1|2,0,0]=4 4374 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100102657272 [0,1,0,0,0,1|2,0,0]=4 4375 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100102657272 [0,1,0,0,0,1|2,0,0]=4 4376 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100102657272 [0,1,0,0,0,1|1,0,0]=3 4377 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Br 2430a_100000759894_100102657272 [0,1,0,0,0,1|2,0,0]=4 4378 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)C 2430a_100000210958_100102657272 [0,1,0,0,0,1|2,0,0]=4 4379 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100102657272 [0,1,0,0,0,1|2,0,0]=4 4380 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)F 2430a_100000210724_100102657272 [0,1,0,0,0,1|2,0,0]=4 4381 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)I 2430a_100011356925_100102657272 [0,1,0,0,0,1|2,0,0]=4 4382 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100102657272 [0,1,0,0,0,1|1,0,0]=3 4383 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Br 2430a_100000750459_100102657272 [0,1,0,0,0,1|2,0,0]=4 4384 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)C 2430a_100000184131_100102657272 [0,1,0,0,0,1|2,0,0]=4 4385 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100102657272 [0,1,0,0,0,1|2,0,0]=4 4386 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 2430a_114828291077_100102657272 [0,1,0,0,0,1|2,0,0]=4 4387 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 512a_114828291077_100102657272 [0,1,0,0,0,1|2,0,0]=4 4388 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100102657272 [0,1,0,0,0,1|2,0,0]=4 4389 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100102657272 [0,1,0,0,0,1|2,0,0]=4 4390 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100102657272 [0,1,0,0,0,1|2,0,0]=4 4391 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100102657272 [0,1,0,0,0,1|1,0,0]=3 4392 B13R1.2879 COC(=O)Cc1cc(c(cn1)C)O 271570a_203496583355_100015669916 [0,1,0,0,0,1|2,0,0]=4 4393 B13R1.2879 COC(=O)Cc1cc(c(nn1)O)C 271570a_203496583355_100010742824 [0,1,0,0,0,1|2,0,0]=4 4394 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [0,1,0,0,0,1|0,0,0]=2 4395 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)F 271570a_203496583355_100011435807 [0,1,0,0,0,1|1,0,0]=3 4396 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [0,1,0,0,0,1|0,0,0]=2 4397 B13R1.2879 COC(=O)Nc1ccc(c(c1)N)O 271570a_203496583355_100012639261 [0,1,0,0,0,1|0,0,0]=2 4398 B13R1.2879 COC(C)Sc1ccc(c(c1)Br)O 62a_100009879195_100012361655 [0,1,0,0,0,1|1,0,1]=4 4399 B13R1.2879 COC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100009879195 [0,1,0,0,0,1|1,0,1]=4 4400 B13R1.2879 COC(C)Sc1ccc(c(c1)C)O 62a_100009879195_100000186361 [0,1,0,0,0,1|1,0,1]=4 4401 B13R1.2879 COC(C)Sc1ccc(c(c1)Cl)O 62a_100009879195_100012360047 [0,1,0,0,0,1|1,0,1]=4 4402 B13R1.2879 COC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009879195 [0,1,0,0,0,1|1,0,1]=4 4403 B13R1.2879 COC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100009879195 [0,1,0,0,0,1|1,0,1]=4 4404 B13R1.2879 COC(C)Sc1ccc(c(c1)F)O 62a_100009879195_100000185481 [0,1,0,0,0,1|1,0,1]=4 4405 B13R1.2879 COC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100009879195 [0,1,0,0,0,1|1,0,1]=4 4406 B13R1.2879 COC(C)Sc1ccc(c(c1)N)O 62a_100009879195_100000752626 [0,1,0,0,0,1|1,0,1]=4 4407 B13R1.2879 COC(C)Sc1ccc(c(c1)O)O 62a_100009879195_100009813601 [0,1,0,0,0,1|1,0,1]=4 4408 B13R1.2879 Cc1cc(ccc1O)CC(=O)CF 1458a_100000083968_100015361967 [0,1,0,0,0,1|2,0,0]=4 4409 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 22a_100011218179_100000210174 [0,1,0,0,0,1|2,0,0]=4 4410 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 527a_100011218179_100000210174 [0,1,0,0,0,1|2,0,0]=4 4411 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)O 1458a_100009990404_100015361967 [0,1,0,0,0,1|2,0,0]=4 4412 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100015361967 [0,1,0,0,0,1|2,0,0]=4 4413 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)O 1458a_100000039761_100015361967 [0,1,0,0,0,1|2,0,0]=4 4414 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [0,1,0,0,0,1|2,0,0]=4 4415 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210174 [0,1,0,0,0,1|2,0,0]=4 4416 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210174 [0,1,0,0,0,1|2,0,0]=4 4417 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210174 [0,1,0,0,0,1|2,0,0]=4 4418 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 22a_100011220035_100000210174 [0,1,0,0,0,1|2,0,0]=4 4419 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 527a_100011220035_100000210174 [0,1,0,0,0,1|2,0,0]=4 4420 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 22a_100102946323_100000210174 [0,1,0,0,0,1|2,0,0]=4 4421 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 527a_100102946323_100000210174 [0,1,0,0,0,1|2,0,0]=4 4422 B13R1.36 C#Cc1ccc(cc1)C(=O)C(C)C 1458a_100011217615_100000210206 [0,2,0,0,0,0|2,0,0]=4 4423 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100011217615 [0,2,0,0,0,0|2,0,0]=4 4424 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100011217615 [0,2,0,0,0,0|2,0,0]=4 4425 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100011217615 [0,2,0,0,0,0|2,0,0]=4 4426 B13R1.36 C#Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100011217615 [0,2,0,0,0,0|2,0,0]=4 4427 B13R1.36 C=Cc1ccc(cc1)C(=O)C(C)C 1458a_100000687532_100000210206 [0,2,0,0,0,0|2,0,0]=4 4428 B13R1.36 C=Cc1ccc(cc1)C(=O)C(C)C 271570a_100011290941_100011220430 [0,2,0,0,0,0|2,0,0]=4 4429 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000687532 [0,2,0,0,0,0|2,0,0]=4 4430 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000687532 [0,2,0,0,0,0|2,0,0]=4 4431 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000687532 [0,2,0,0,0,0|2,0,0]=4 4432 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 271570a_100011290941_100000159574 [0,2,0,0,0,0|2,0,0]=4 4433 B13R1.36 C=Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000687532 [0,2,0,0,0,0|2,0,0]=4 4434 B13R1.36 CC(=C(C)c1ccc(cc1)CO)C 271570a_200000049429_100000690907 [0,2,0,0,0,0|2,0,0]=4 4435 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 34a_200010205864_200025704644 [0,2,0,0,0,0|1,0,0]=3 4436 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 7a_200010205864_200025704644 [0,2,0,0,0,0|1,0,0]=3 4437 B13R1.36 CC(C)C(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210206 [0,2,0,0,0,0|2,0,0]=4 4438 B13R1.36 CC(C)C(=O)c1ccc(cc1)CO 1458a_100000183892_100000210206 [0,2,0,0,0,0|1,0,0]=3 4439 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100011995950_200025704644 [0,2,0,0,0,0|1,0,0]=3 4440 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100011995950_200025704644 [0,2,0,0,0,0|1,0,0]=3 4441 B13R1.36 CC(C)C(=O)c1ccc(cc1)S[13CH3] 62a_100011220430_200025704644 [0,2,0,0,0,0|1,1,0]=4 4442 B13R1.36 CC(C)C(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011220430 [0,2,0,0,0,0|1,1,0]=4 4443 B13R1.36 CCc1ccc(cc1)C(=O)C(C)C 1458a_100000211226_100000210206 [0,2,0,0,0,0|2,0,0]=4 4444 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000211226 [0,2,0,0,0,0|2,0,0]=4 4445 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000211226 [0,2,0,0,0,0|2,0,0]=4 4446 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000211226 [0,2,0,0,0,0|2,0,0]=4 4447 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000211226 [0,2,0,0,0,0|2,0,0]=4 4448 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 11a_100102631434_100000210717 [0,2,0,0,0,0|2,0,0]=4 4449 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 1626a_100102631434_100000210717 [0,2,0,0,0,0|2,0,0]=4 4450 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 240690a_100102631434_100000210717 [0,2,0,0,0,0|2,0,0]=4 4451 B13R1.36 CN(C)C(=O)c1ccc(cc1)C#N 527a_100102631434_100000210717 [0,2,0,0,0,0|2,0,0]=4 4452 B13R1.36 CN(C)C(=O)c1ccc(cc1)CO 1626a_100102631434_100000183892 [0,2,0,0,0,0|1,0,0]=3 4453 B13R1.36 CN(C)C(=O)c1ccc(cc1)CO 240690a_100102631434_100000183892 [0,2,0,0,0,0|1,0,0]=3 4454 B13R1.36 CN(C)C(=O)c1ccc(cc1)N[13CH3] 34a_100000184784_200025704644 [0,2,0,0,0,0|2,0,0]=4 4455 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100000192105_200025704644 [0,2,0,0,0,0|1,0,0]=3 4456 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100000192105_200025704644 [0,2,0,0,0,0|1,0,0]=3 4457 B13R1.36 CN(C)C(=O)c1ccc(cc1)S[13CH3] 62a_100000159574_200025704644 [0,2,0,0,0,0|1,1,0]=4 4458 B13R1.36 CN(C)C(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000159574 [0,2,0,0,0,0|1,1,0]=4 4459 B13R1.36 CNc1ccc(cc1)C(=O)C(C)C 27a_100102657272_100011220430 [0,2,0,0,0,0|2,0,0]=4 4460 B13R1.36 CNc1ccc(cc1)C(=O)N(C)C 27a_100102657272_100000159574 [0,2,0,0,0,0|2,0,0]=4 4461 B13R1.36 CNc1ccc(cc1)C(=O)N(C)C 34a_100000184784_200000210301 [0,2,0,0,0,0|2,0,0]=4 4462 B13R1.36 COc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000171711 [0,2,0,0,0,0|2,0,0]=4 4463 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_200000210301 [0,2,0,0,0,0|1,0,0]=3 4464 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_200000210301 [0,2,0,0,0,0|1,0,0]=3 4465 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 1458a_100000184203_100000210206 [0,2,0,0,0,0|1,0,0]=3 4466 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 34a_100011995950_200000210301 [0,2,0,0,0,0|1,0,0]=3 4467 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 7a_100011995950_200000210301 [0,2,0,0,0,0|1,0,0]=3 4468 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000184203 [0,2,0,0,0,0|1,0,0]=3 4469 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000184203 [0,2,0,0,0,0|1,0,0]=3 4470 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000184203 [0,2,0,0,0,0|1,0,0]=3 4471 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 34a_100000192105_200000210301 [0,2,0,0,0,0|1,0,0]=3 4472 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000184203 [0,2,0,0,0,0|1,0,0]=3 4473 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 7a_100000192105_200000210301 [0,2,0,0,0,0|1,0,0]=3 4474 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 1458a_100000189692_100000210206 [0,2,0,0,0,0|1,1,0]=4 4475 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 62a_100011220430_200000210301 [0,2,0,0,0,0|1,1,0]=4 4476 B13R1.36 CSc1ccc(cc1)C(=O)C(C)C 62a_200000210301_100011220430 [0,2,0,0,0,0|1,1,0]=4 4477 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000189692 [0,2,0,0,0,0|1,1,0]=4 4478 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000189692 [0,2,0,0,0,0|1,1,0]=4 4479 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000189692 [0,2,0,0,0,0|1,1,0]=4 4480 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000189692 [0,2,0,0,0,0|1,1,0]=4 4481 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 62a_100000159574_200000210301 [0,2,0,0,0,0|1,1,0]=4 4482 B13R1.36 CSc1ccc(cc1)C(=O)N(C)C 62a_200000210301_100000159574 [0,2,0,0,0,0|1,1,0]=4 4483 B13R1.39 CCC(=NO)c1ccc(cc1)OC 34a_100000740173_200000210301 [0,2,0,0,0,0|1,0,1]=4 4484 B13R1.39 CCC(=NO)c1ccc(cc1)O[13CH3] 34a_100000740173_200025704644 [0,2,0,0,0,0|1,0,1]=4 4485 B13R1.39 CCC(OC)c1ccc(cc1)OC 34a_100000246523_200000210301 [0,2,0,0,0,0|1,0,1]=4 4486 B13R1.39 CCC(OC)c1ccc(cc1)OC 7a_100000246523_200000210301 [0,2,0,0,0,0|1,0,1]=4 4487 B13R1.39 CCC(O[13CH3])c1ccc(cc1)OC 34a_100000246523_200025704644 [0,2,0,0,0,0|1,0,1]=4 4488 B13R1.39 CCC(O[13CH3])c1ccc(cc1)OC 7a_100000246523_200025704644 [0,2,0,0,0,0|1,0,1]=4 4489 B13R1.39 COc1ccc(cc1)C(C#N)OC 34a_100011218237_200000210301 [0,2,0,0,0,0|1,0,1]=4 4490 B13R1.39 COc1ccc(cc1)C(C#N)OC 7a_100011218237_200000210301 [0,2,0,0,0,0|1,0,1]=4 4491 B13R1.39 COc1ccc(cc1)C(C#N)O[13CH3] 34a_100011218237_200025704644 [0,2,0,0,0,0|1,0,1]=4 4492 B13R1.39 COc1ccc(cc1)C(C#N)O[13CH3] 7a_100011218237_200025704644 [0,2,0,0,0,0|1,0,1]=4 4493 B13R1.39 COc1ccc(cc1)C(CN)OC 34a_100000738651_200000210301 [0,2,0,0,0,0|1,0,1]=4 4494 B13R1.39 COc1ccc(cc1)C(CN)O[13CH3] 34a_100000738651_200025704644 [0,2,0,0,0,0|1,0,1]=4 4495 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)CC 1458a_100103168756_100000210202 [0,2,0,0,0,0|2,0,0]=4 4496 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 11a_106832991635_100103168756 [0,2,0,0,0,0|2,0,0]=4 4497 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 1626a_100102657272_100103168756 [0,2,0,0,0,0|2,0,0]=4 4498 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 240690a_100102657272_100103168756 [0,2,0,0,0,0|2,0,0]=4 4499 B13R1.95 C#Cc1ccc(c(c1)Cl)C(=O)NC 527a_100102657272_100103168756 [0,2,0,0,0,0|2,0,0]=4 4500 B13R1.95 C=Cc1cc(c(cn1)C(=O)OC)C 271570a_100011290941_100009871181 [0,2,0,0,0,0|2,0,0]=4 4501 B13R1.95 C=Cc1cc(c(cn1)C(=O)OC)N 271570a_100011290941_100009862510 [0,2,0,0,0,0|2,0,0]=4 4502 B13R1.95 C=Cc1ccc([n+](c1)[O-])C(=O)OC 271570a_100011290941_100015641791 [0,2,0,0,0,0|2,0,0]=4 4503 B13R1.95 C=Cc1ccc(c(c1)Br)C(=O)OC 271570a_100011290941_100010247156 [0,2,0,0,0,0|1,0,0]=3 4504 B13R1.95 C=Cc1ccc(c(c1)C)C(=O)CC 271570a_100011290941_200012361375 [0,2,0,0,0,0|2,0,0]=4 4505 B13R1.95 C=Cc1ccc(c(c1)C)C(=O)OC 271570a_100011290941_100000747612 [0,2,0,0,0,0|1,0,0]=3 4506 B13R1.95 C=Cc1ccc(c(c1)Cl)C(=O)OC 271570a_100011290941_100000060724 [0,2,0,0,0,0|1,0,0]=3 4507 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)CC 271570a_100011290941_100012360378 [0,2,0,0,0,0|2,0,0]=4 4508 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)NC 271570a_100011290941_100000233932 [0,2,0,0,0,0|2,0,0]=4 4509 B13R1.95 C=Cc1ccc(c(c1)F)C(=O)OC 271570a_100011290941_100000216654 [0,2,0,0,0,0|1,0,0]=3 4510 B13R1.95 C=Cc1ccc(c(c1)N)C(=O)OC 271570a_100011290941_100011373473 [0,2,0,0,0,0|1,0,0]=3 4511 B13R1.95 C=Cc1ccc(c(c1)O)C(=O)OC 271570a_100011290941_100000062286 [0,2,0,0,0,0|1,0,0]=3 4512 B13R1.95 C=Cc1ccc(c(n1)C)C(=O)OC 271570a_100011290941_100000692007 [0,2,0,0,0,0|2,0,0]=4 4513 B13R1.95 C=Cc1ccc(c(n1)F)C(=O)OC 271570a_100011290941_100010189635 [0,2,0,0,0,0|2,0,0]=4 4514 B13R1.95 C=Cc1ccc(c(n1)N)C(=O)OC 271570a_100011290941_100000142702 [0,2,0,0,0,0|2,0,0]=4 4515 B13R1.95 C=Cc1ccc(c(n1)O)C(=O)OC 271570a_100011290941_100015962272 [0,2,0,0,0,0|2,0,0]=4 4516 B13R1.95 C=Cc1cnc(c(c1)C)C(=O)OC 271570a_100011290941_100010178714 [0,2,0,0,0,0|2,0,0]=4 4517 B13R1.95 C=Cc1cnc(c(c1)F)C(=O)OC 271570a_100011290941_100000695675 [0,2,0,0,0,0|2,0,0]=4 4518 B13R1.95 C=Cc1cnc(c(c1)N)C(=O)OC 271570a_100011290941_100010090751 [0,2,0,0,0,0|2,0,0]=4 4519 B13R1.95 C=Cc1cnc(c(c1)O)C(=O)OC 271570a_100011290941_100010071521 [0,2,0,0,0,0|2,0,0]=4 4520 B13R1.95 CCC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_100000210202 [0,2,0,0,0,0|2,0,0]=4 4521 B13R1.95 CCC(=O)c1ccc(cc1Br)OC 1458a_100000748873_100000210202 [0,2,0,0,0,0|1,0,0]=3 4522 B13R1.95 CCC(=O)c1ccc(cc1C)C#N 1458a_100000691869_100000210202 [0,2,0,0,0,0|2,0,0]=4 4523 B13R1.95 CCC(=O)c1ccc(cc1C)OC 1458a_100000763155_100000210202 [0,2,0,0,0,0|1,0,0]=3 4524 B13R1.95 CCC(=O)c1ccc(cc1C)SC 1458a_100012278374_100000210202 [0,2,0,0,0,0|1,1,0]=4 4525 B13R1.95 CCC(=O)c1ccc(cc1C)SC 62a_200000210301_200012361375 [0,2,0,0,0,0|1,1,0]=4 4526 B13R1.95 CCC(=O)c1ccc(cc1C)SC 62a_200012361375_200000210301 [0,2,0,0,0,0|1,1,0]=4 4527 B13R1.95 CCC(=O)c1ccc(cc1C)S[13CH3] 62a_200012361375_200025704644 [0,2,0,0,0,0|1,1,0]=4 4528 B13R1.95 CCC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_200012361375 [0,2,0,0,0,0|1,1,0]=4 4529 B13R1.95 CCC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_100000210202 [0,2,0,0,0,0|2,0,0]=4 4530 B13R1.95 CCC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_100000210202 [0,2,0,0,0,0|1,0,0]=3 4531 B13R1.95 CCC(=O)c1ccc(cc1Cl)OC 1458a_100000753557_100000210202 [0,2,0,0,0,0|1,0,0]=3 4532 B13R1.95 CCC(=O)c1ccc(cc1F)C#N 1458a_100000238375_100000210202 [0,2,0,0,0,0|2,0,0]=4 4533 B13R1.95 CCC(=O)c1ccc(cc1F)CC 1458a_200009867912_100000210202 [0,2,0,0,0,0|2,0,0]=4 4534 B13R1.95 CCC(=O)c1ccc(cc1F)CO 1458a_100011934814_100000210202 [0,2,0,0,0,0|1,0,0]=3 4535 B13R1.95 CCC(=O)c1ccc(cc1F)NC 27a_100102657272_100012360378 [0,2,0,0,0,0|2,0,0]=4 4536 B13R1.95 CCC(=O)c1ccc(cc1F)OC 1458a_100000198494_100000210202 [0,2,0,0,0,0|1,0,0]=3 4537 B13R1.95 CCC(=O)c1ccc(cc1F)SC 62a_100012360378_200000210301 [0,2,0,0,0,0|1,1,0]=4 4538 B13R1.95 CCC(=O)c1ccc(cc1F)SC 62a_200000210301_100012360378 [0,2,0,0,0,0|1,1,0]=4 4539 B13R1.95 CCC(=O)c1ccc(cc1F)S[13CH3] 62a_100012360378_200025704644 [0,2,0,0,0,0|1,1,0]=4 4540 B13R1.95 CCC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100012360378 [0,2,0,0,0,0|1,1,0]=4 4541 B13R1.95 CCC(=O)c1ccc(cc1I)OC 1458a_100000688016_100000210202 [0,2,0,0,0,0|1,0,0]=3 4542 B13R1.95 CCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210202 [0,2,0,0,0,0|1,0,0]=3 4543 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 11a_106832991635_200009867912 [0,2,0,0,0,0|2,0,0]=4 4544 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 1626a_100102657272_200009867912 [0,2,0,0,0,0|2,0,0]=4 4545 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 240690a_100102657272_200009867912 [0,2,0,0,0,0|2,0,0]=4 4546 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 527a_100102657272_200009867912 [0,2,0,0,0,0|2,0,0]=4 4547 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 11a_106832991635_100010244945 [0,2,0,0,0,0|2,0,0]=4 4548 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 1626a_100102657272_100010244945 [0,2,0,0,0,0|2,0,0]=4 4549 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 240690a_100102657272_100010244945 [0,2,0,0,0,0|2,0,0]=4 4550 B13R1.95 CNC(=O)c1ccc(cc1Br)C#N 527a_100102657272_100010244945 [0,2,0,0,0,0|2,0,0]=4 4551 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 11a_106832991635_100000748873 [0,2,0,0,0,0|1,0,0]=3 4552 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 1626a_100102657272_100000748873 [0,2,0,0,0,0|1,0,0]=3 4553 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 240690a_100102657272_100000748873 [0,2,0,0,0,0|1,0,0]=3 4554 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 527a_100102657272_100000748873 [0,2,0,0,0,0|1,0,0]=3 4555 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 11a_106832991635_100000691869 [0,2,0,0,0,0|2,0,0]=4 4556 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 1626a_100102657272_100000691869 [0,2,0,0,0,0|2,0,0]=4 4557 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 240690a_100102657272_100000691869 [0,2,0,0,0,0|2,0,0]=4 4558 B13R1.95 CNC(=O)c1ccc(cc1C)C#N 527a_100102657272_100000691869 [0,2,0,0,0,0|2,0,0]=4 4559 B13R1.95 CNC(=O)c1ccc(cc1C)OC 11a_106832991635_100000763155 [0,2,0,0,0,0|1,0,0]=3 4560 B13R1.95 CNC(=O)c1ccc(cc1C)OC 1626a_100102657272_100000763155 [0,2,0,0,0,0|1,0,0]=3 4561 B13R1.95 CNC(=O)c1ccc(cc1C)OC 240690a_100102657272_100000763155 [0,2,0,0,0,0|1,0,0]=3 4562 B13R1.95 CNC(=O)c1ccc(cc1C)OC 527a_100102657272_100000763155 [0,2,0,0,0,0|1,0,0]=3 4563 B13R1.95 CNC(=O)c1ccc(cc1C)SC 11a_106832991635_100012278374 [0,2,0,0,0,0|1,1,0]=4 4564 B13R1.95 CNC(=O)c1ccc(cc1C)SC 1626a_100102657272_100012278374 [0,2,0,0,0,0|1,1,0]=4 4565 B13R1.95 CNC(=O)c1ccc(cc1C)SC 240690a_100102657272_100012278374 [0,2,0,0,0,0|1,1,0]=4 4566 B13R1.95 CNC(=O)c1ccc(cc1C)SC 527a_100102657272_100012278374 [0,2,0,0,0,0|1,1,0]=4 4567 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 11a_106832991635_100000100588 [0,2,0,0,0,0|2,0,0]=4 4568 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 1626a_100102657272_100000100588 [0,2,0,0,0,0|2,0,0]=4 4569 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 240690a_100102657272_100000100588 [0,2,0,0,0,0|2,0,0]=4 4570 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N 527a_100102657272_100000100588 [0,2,0,0,0,0|2,0,0]=4 4571 B13R1.95 CNC(=O)c1ccc(cc1Cl)CO 240690a_100102657272_100015659073 [0,2,0,0,0,0|1,0,0]=3 4572 B13R1.95 CNC(=O)c1ccc(cc1Cl)NC 34a_100000742945_200000210301 [0,2,0,0,0,0|2,0,0]=4 4573 B13R1.95 CNC(=O)c1ccc(cc1Cl)NC 7a_100000742945_200000210301 [0,2,0,0,0,0|2,0,0]=4 4574 B13R1.95 CNC(=O)c1ccc(cc1Cl)N[13CH3] 34a_100000742945_200025704644 [0,2,0,0,0,0|2,0,0]=4 4575 B13R1.95 CNC(=O)c1ccc(cc1Cl)N[13CH3] 7a_100000742945_200025704644 [0,2,0,0,0,0|2,0,0]=4 4576 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 11a_106832991635_100000753557 [0,2,0,0,0,0|1,0,0]=3 4577 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 1626a_100102657272_100000753557 [0,2,0,0,0,0|1,0,0]=3 4578 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 240690a_100102657272_100000753557 [0,2,0,0,0,0|1,0,0]=3 4579 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 527a_100102657272_100000753557 [0,2,0,0,0,0|1,0,0]=3 4580 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 11a_106832991635_100000238375 [0,2,0,0,0,0|2,0,0]=4 4581 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 1626a_100102657272_100000238375 [0,2,0,0,0,0|2,0,0]=4 4582 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 240690a_100102657272_100000238375 [0,2,0,0,0,0|2,0,0]=4 4583 B13R1.95 CNC(=O)c1ccc(cc1F)C#N 527a_100102657272_100000238375 [0,2,0,0,0,0|2,0,0]=4 4584 B13R1.95 CNC(=O)c1ccc(cc1F)CO 240690a_100102657272_100011934814 [0,2,0,0,0,0|1,0,0]=3 4585 B13R1.95 CNC(=O)c1ccc(cc1F)NC 27a_100102657272_100000233932 [0,2,0,0,0,0|2,0,0]=4 4586 B13R1.95 CNC(=O)c1ccc(cc1F)NC 34a_100011533607_200000210301 [0,2,0,0,0,0|2,0,0]=4 4587 B13R1.95 CNC(=O)c1ccc(cc1F)NC 7a_100011533607_200000210301 [0,2,0,0,0,0|2,0,0]=4 4588 B13R1.95 CNC(=O)c1ccc(cc1F)N[13CH3] 34a_100011533607_200025704644 [0,2,0,0,0,0|2,0,0]=4 4589 B13R1.95 CNC(=O)c1ccc(cc1F)N[13CH3] 7a_100011533607_200025704644 [0,2,0,0,0,0|2,0,0]=4 4590 B13R1.95 CNC(=O)c1ccc(cc1F)OC 11a_106832991635_100000198494 [0,2,0,0,0,0|1,0,0]=3 4591 B13R1.95 CNC(=O)c1ccc(cc1F)OC 1626a_100102657272_100000198494 [0,2,0,0,0,0|1,0,0]=3 4592 B13R1.95 CNC(=O)c1ccc(cc1F)OC 240690a_100102657272_100000198494 [0,2,0,0,0,0|1,0,0]=3 4593 B13R1.95 CNC(=O)c1ccc(cc1F)OC 527a_100102657272_100000198494 [0,2,0,0,0,0|1,0,0]=3 4594 B13R1.95 CNC(=O)c1ccc(cc1F)SC 62a_100000233932_200000210301 [0,2,0,0,0,0|1,1,0]=4 4595 B13R1.95 CNC(=O)c1ccc(cc1F)SC 62a_200000210301_100000233932 [0,2,0,0,0,0|1,1,0]=4 4596 B13R1.95 CNC(=O)c1ccc(cc1F)S[13CH3] 62a_100000233932_200025704644 [0,2,0,0,0,0|1,1,0]=4 4597 B13R1.95 CNC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000233932 [0,2,0,0,0,0|1,1,0]=4 4598 B13R1.95 CNC(=O)c1ccc(cc1I)OC 11a_106832991635_100000688016 [0,2,0,0,0,0|1,0,0]=3 4599 B13R1.95 CNC(=O)c1ccc(cc1I)OC 1626a_100102657272_100000688016 [0,2,0,0,0,0|1,0,0]=3 4600 B13R1.95 CNC(=O)c1ccc(cc1I)OC 240690a_100102657272_100000688016 [0,2,0,0,0,0|1,0,0]=3 4601 B13R1.95 CNC(=O)c1ccc(cc1I)OC 527a_100102657272_100000688016 [0,2,0,0,0,0|1,0,0]=3 4602 B13R1.95 CNC(=O)c1ccc(cc1O)NC 34a_100000223174_200000210301 [0,2,0,0,0,0|2,0,0]=4 4603 B13R1.95 CNC(=O)c1ccc(cc1O)N[13CH3] 34a_100000223174_200025704644 [0,2,0,0,0,0|2,0,0]=4 4604 B13R1.95 CNC(=O)c1ccc(cc1O)OC 11a_106832991635_100000212123 [0,2,0,0,0,0|1,0,0]=3 4605 B13R1.95 CNC(=O)c1ccc(cc1O)OC 240690a_100102657272_100000212123 [0,2,0,0,0,0|1,0,0]=3 4606 B13R1.95 CNC(=O)c1ccc(cc1O)OC 527a_100102657272_100000212123 [0,2,0,0,0,0|1,0,0]=3 4607 B13R1.95 CNc1cc(c(cn1)C(=O)OC)C 27a_100102657272_100009871181 [0,2,0,0,0,0|2,0,0]=4 4608 B13R1.95 CNc1ccc(c(n1)C)C(=O)OC 27a_100102657272_100000692007 [0,2,0,0,0,0|2,0,0]=4 4609 B13R1.95 COC(=O)c1ccc(cc1Br)OC 34a_100010150825_200000210301 [0,2,0,0,0,0|0,0,0]=2 4610 B13R1.95 COC(=O)c1ccc(cc1Br)OC 7a_100010150825_200000210301 [0,2,0,0,0,0|0,0,0]=2 4611 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 34a_100010150825_200025704644 [0,2,0,0,0,0|0,0,0]=2 4612 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 7a_100010150825_200025704644 [0,2,0,0,0,0|0,0,0]=2 4613 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_100010247156_200000210301 [0,2,0,0,0,0|0,1,0]=3 4614 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_200000210301_100010247156 [0,2,0,0,0,0|0,1,0]=3 4615 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_100010247156_200025704644 [0,2,0,0,0,0|0,1,0]=3 4616 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_200025704644_100010247156 [0,2,0,0,0,0|0,1,0]=3 4617 B13R1.95 COC(=O)c1ccc(cc1C)OC 34a_100012000157_200000210301 [0,2,0,0,0,0|0,0,0]=2 4618 B13R1.95 COC(=O)c1ccc(cc1C)OC 7a_100012000157_200000210301 [0,2,0,0,0,0|0,0,0]=2 4619 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 34a_100012000157_200025704644 [0,2,0,0,0,0|0,0,0]=2 4620 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 7a_100012000157_200025704644 [0,2,0,0,0,0|0,0,0]=2 4621 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_100000747612_200000210301 [0,2,0,0,0,0|0,1,0]=3 4622 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_200000210301_100000747612 [0,2,0,0,0,0|0,1,0]=3 4623 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_100000747612_200025704644 [0,2,0,0,0,0|0,1,0]=3 4624 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100000747612 [0,2,0,0,0,0|0,1,0]=3 4625 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 34a_100000081488_200000210301 [0,2,0,0,0,0|0,0,0]=2 4626 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 7a_100000081488_200000210301 [0,2,0,0,0,0|0,0,0]=2 4627 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100000081488_200025704644 [0,2,0,0,0,0|0,0,0]=2 4628 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100000081488_200025704644 [0,2,0,0,0,0|0,0,0]=2 4629 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_100000060724_200000210301 [0,2,0,0,0,0|0,1,0]=3 4630 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_200000210301_100000060724 [0,2,0,0,0,0|0,1,0]=3 4631 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_100000060724_200025704644 [0,2,0,0,0,0|0,1,0]=3 4632 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_200025704644_100000060724 [0,2,0,0,0,0|0,1,0]=3 4633 B13R1.95 COC(=O)c1ccc(cc1F)OC 34a_100011999631_200000210301 [0,2,0,0,0,0|0,0,0]=2 4634 B13R1.95 COC(=O)c1ccc(cc1F)OC 7a_100011999631_200000210301 [0,2,0,0,0,0|0,0,0]=2 4635 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 34a_100011999631_200025704644 [0,2,0,0,0,0|0,0,0]=2 4636 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 7a_100011999631_200025704644 [0,2,0,0,0,0|0,0,0]=2 4637 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_100000216654_200000210301 [0,2,0,0,0,0|0,1,0]=3 4638 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_200000210301_100000216654 [0,2,0,0,0,0|0,1,0]=3 4639 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_100000216654_200025704644 [0,2,0,0,0,0|0,1,0]=3 4640 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000216654 [0,2,0,0,0,0|0,1,0]=3 4641 B13R1.95 COC(=O)c1ccc(cc1N)OC 34a_100000701581_200000210301 [0,2,0,0,0,0|0,0,0]=2 4642 B13R1.95 COC(=O)c1ccc(cc1N)OC 7a_100000701581_200000210301 [0,2,0,0,0,0|0,0,0]=2 4643 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 34a_100000701581_200025704644 [0,2,0,0,0,0|0,0,0]=2 4644 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 7a_100000701581_200025704644 [0,2,0,0,0,0|0,0,0]=2 4645 B13R1.95 COC(=O)c1ccc(cc1N)SC 62a_100011373473_200000210301 [0,2,0,0,0,0|0,1,0]=3 4646 B13R1.95 COC(=O)c1ccc(cc1N)S[13CH3] 62a_100011373473_200025704644 [0,2,0,0,0,0|0,1,0]=3 4647 B13R1.95 COC(=O)c1ccc(cc1O)C#N 271570a_203496583355_100009832033 [0,2,0,0,0,0|1,0,0]=3 4648 B13R1.95 COC(=O)c1ccc(cc1O)C=O 271570a_203496583355_100010630601 [0,2,0,0,0,0|0,0,1]=3 4649 B13R1.95 COC(=O)c1ccc(cc1O)OC 271570a_203496583355_100009815674 [0,2,0,0,0,0|0,0,0]=2 4650 B13R1.95 COC(=O)c1ccc(cc1O)SC 62a_200000210301_100000062286 [0,2,0,0,0,0|0,1,0]=3 4651 B13R1.95 COC(=O)c1ccc(cc1O)S[13CH3] 62a_200025704644_100000062286 [0,2,0,0,0,0|0,1,0]=3 4652 B13R1.95 COC(=O)c1ccc(nc1C)SC 62a_100000692007_200000210301 [0,2,0,0,0,0|1,1,0]=4 4653 B13R1.95 COC(=O)c1ccc(nc1C)SC 62a_200000210301_100000692007 [0,2,0,0,0,0|1,1,0]=4 4654 B13R1.95 COC(=O)c1ccc(nc1C)S[13CH3] 62a_100000692007_200025704644 [0,2,0,0,0,0|1,1,0]=4 4655 B13R1.95 COC(=O)c1ccc(nc1C)S[13CH3] 62a_200025704644_100000692007 [0,2,0,0,0,0|1,1,0]=4 4656 B13R1.95 COC(=O)c1ccc(nc1F)SC 62a_100010189635_200000210301 [0,2,0,0,0,0|1,1,0]=4 4657 B13R1.95 COC(=O)c1ccc(nc1F)SC 62a_200000210301_100010189635 [0,2,0,0,0,0|1,1,0]=4 4658 B13R1.95 COC(=O)c1ccc(nc1F)S[13CH3] 62a_100010189635_200025704644 [0,2,0,0,0,0|1,1,0]=4 4659 B13R1.95 COC(=O)c1ccc(nc1F)S[13CH3] 62a_200025704644_100010189635 [0,2,0,0,0,0|1,1,0]=4 4660 B13R1.95 COC(=O)c1ccc(nc1N)SC 62a_100000142702_200000210301 [0,2,0,0,0,0|1,1,0]=4 4661 B13R1.95 COC(=O)c1ccc(nc1N)S[13CH3] 62a_100000142702_200025704644 [0,2,0,0,0,0|1,1,0]=4 4662 B13R1.95 COC(=O)c1ccc(nc1O)C=O 271570a_203496583355_200009848447 [0,2,0,0,0,0|1,0,1]=4 4663 B13R1.95 COC(=O)c1ccc(nc1O)OC 271570a_203496583355_100010136187 [0,2,0,0,0,0|1,0,0]=3 4664 B13R1.95 COC(=O)c1cnc(cc1C)SC 62a_100009871181_200000210301 [0,2,0,0,0,0|1,1,0]=4 4665 B13R1.95 COC(=O)c1cnc(cc1C)SC 62a_200000210301_100009871181 [0,2,0,0,0,0|1,1,0]=4 4666 B13R1.95 COC(=O)c1cnc(cc1C)S[13CH3] 62a_100009871181_200025704644 [0,2,0,0,0,0|1,1,0]=4 4667 B13R1.95 COC(=O)c1cnc(cc1C)S[13CH3] 62a_200025704644_100009871181 [0,2,0,0,0,0|1,1,0]=4 4668 B13R1.95 COC(=O)c1cnc(cc1N)SC 62a_100009862510_200000210301 [0,2,0,0,0,0|1,1,0]=4 4669 B13R1.95 COC(=O)c1cnc(cc1N)SC 62a_200000210301_100009862510 [0,2,0,0,0,0|1,1,0]=4 4670 B13R1.95 COC(=O)c1cnc(cc1N)S[13CH3] 62a_100009862510_200025704644 [0,2,0,0,0,0|1,1,0]=4 4671 B13R1.95 COC(=O)c1cnc(cc1N)S[13CH3] 62a_200025704644_100009862510 [0,2,0,0,0,0|1,1,0]=4 4672 B13R1.95 COC(=O)c1cnc(cc1O)OC 271570a_203496583355_100010136350 [0,2,0,0,0,0|1,0,0]=3 4673 B13R1.95 COC(=O)c1ncc(cc1C)SC 62a_100010178714_200000210301 [0,2,0,0,0,0|1,1,0]=4 4674 B13R1.95 COC(=O)c1ncc(cc1C)SC 62a_200000210301_100010178714 [0,2,0,0,0,0|1,1,0]=4 4675 B13R1.95 COC(=O)c1ncc(cc1C)S[13CH3] 62a_100010178714_200025704644 [0,2,0,0,0,0|1,1,0]=4 4676 B13R1.95 COC(=O)c1ncc(cc1C)S[13CH3] 62a_200025704644_100010178714 [0,2,0,0,0,0|1,1,0]=4 4677 B13R1.95 COC(=O)c1ncc(cc1Cl)OC 34a_100009855505_200000210301 [0,2,0,0,0,0|1,0,0]=3 4678 B13R1.95 COC(=O)c1ncc(cc1Cl)OC 7a_100009855505_200000210301 [0,2,0,0,0,0|1,0,0]=3 4679 B13R1.95 COC(=O)c1ncc(cc1Cl)O[13CH3] 34a_100009855505_200025704644 [0,2,0,0,0,0|1,0,0]=3 4680 B13R1.95 COC(=O)c1ncc(cc1Cl)O[13CH3] 7a_100009855505_200025704644 [0,2,0,0,0,0|1,0,0]=3 4681 B13R1.95 COC(=O)c1ncc(cc1F)SC 62a_100000695675_200000210301 [0,2,0,0,0,0|1,1,0]=4 4682 B13R1.95 COC(=O)c1ncc(cc1F)SC 62a_200000210301_100000695675 [0,2,0,0,0,0|1,1,0]=4 4683 B13R1.95 COC(=O)c1ncc(cc1F)S[13CH3] 62a_100000695675_200025704644 [0,2,0,0,0,0|1,1,0]=4 4684 B13R1.95 COC(=O)c1ncc(cc1F)S[13CH3] 62a_200025704644_100000695675 [0,2,0,0,0,0|1,1,0]=4 4685 B13R1.95 COC(=O)c1ncc(cc1N)SC 62a_100010090751_200000210301 [0,2,0,0,0,0|1,1,0]=4 4686 B13R1.95 COC(=O)c1ncc(cc1N)SC 62a_200000210301_100010090751 [0,2,0,0,0,0|1,1,0]=4 4687 B13R1.95 COC(=O)c1ncc(cc1N)S[13CH3] 62a_100010090751_200025704644 [0,2,0,0,0,0|1,1,0]=4 4688 B13R1.95 COC(=O)c1ncc(cc1N)S[13CH3] 62a_200025704644_100010090751 [0,2,0,0,0,0|1,1,0]=4 4689 B13R1.95 COC(=O)c1ncc(cc1O)SC 62a_200000210301_100010071521 [0,2,0,0,0,0|1,1,0]=4 4690 B13R1.95 COC(=O)c1ncc(cc1O)S[13CH3] 62a_200025704644_100010071521 [0,2,0,0,0,0|1,1,0]=4 4691 B13R1.95 COc1ccc(c(c1)Br)C(=O)CF 1458a_100000748873_100015361967 [0,2,0,0,0,0|2,0,0]=4 4692 B13R1.95 COc1ccc(c(c1)Br)C(C)OC 34a_100000697252_200000210301 [0,2,0,0,0,0|1,0,1]=4 4693 B13R1.95 COc1ccc(c(c1)Br)C(C)OC 7a_100000697252_200000210301 [0,2,0,0,0,0|1,0,1]=4 4694 B13R1.95 COc1ccc(c(c1)Br)C(C)O[13CH3] 34a_100000697252_200025704644 [0,2,0,0,0,0|1,0,1]=4 4695 B13R1.95 COc1ccc(c(c1)Br)C(C)O[13CH3] 7a_100000697252_200025704644 [0,2,0,0,0,0|1,0,1]=4 4696 B13R1.95 COc1ccc(c(c1)C)C(=O)CF 1458a_100000763155_100015361967 [0,2,0,0,0,0|2,0,0]=4 4697 B13R1.95 COc1ccc(c(c1)Cl)C(=O)CF 1458a_100000753557_100015361967 [0,2,0,0,0,0|2,0,0]=4 4698 B13R1.95 COc1ccc(c(c1)F)C(=O)CF 1458a_100000198494_100015361967 [0,2,0,0,0,0|2,0,0]=4 4699 B13R1.95 COc1ccc(c(c1)I)C(=O)CF 1458a_100000688016_100015361967 [0,2,0,0,0,0|2,0,0]=4 4700 B13R1.95 COc1ccc(c(c1)O)C(=O)CF 1458a_100000212123_100015361967 [0,2,0,0,0,0|2,0,0]=4 4701 B13R1.95 O=C(CF)c1ccc(cc1Cl)CO 1458a_100015659073_100015361967 [0,2,0,0,0,0|2,0,0]=4 4702 B13R1.95 O=C(CF)c1ccc(cc1F)CO 1458a_100011934814_100015361967 [0,2,0,0,0,0|2,0,0]=4 4703 B13R1.139 C=C=Cc1ccc(cc1)C(=O)CC 271570a_100015277604_100000211647 [0,2,0,0,0,0|2,0,0]=4 4704 B13R1.139 C=C=Cc1ccc(cc1)C(=O)NC 271570a_100015277604_100000155074 [0,2,0,0,0,0|2,0,0]=4 4705 B13R1.139 C=C=Cc1ccc(cc1)C(=O)OC 271570a_100015277604_100000150774 [0,2,0,0,0,0|1,0,0]=3 4706 B13R1.139 C=C=Cc1ccc(cn1)C(=O)OC 271570a_100015277604_100000733799 [0,2,0,0,0,0|2,0,0]=4 4707 B13R1.139 C=C=Cc1ccc(nc1)C(=O)OC 271570a_100015277604_100000690920 [0,2,0,0,0,0|2,0,0]=4 4708 B13R1.139 CC#Cc1ccc(cc1)C(=O)CC 1458a_100009923575_100000210202 [0,2,0,0,0,0|2,0,0]=4 4709 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 11a_106832991635_100009923575 [0,2,0,0,0,0|2,0,0]=4 4710 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100009923575 [0,2,0,0,0,0|2,0,0]=4 4711 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100009923575 [0,2,0,0,0,0|2,0,0]=4 4712 B13R1.139 CC#Cc1ccc(cc1)C(=O)NC 527a_100102657272_100009923575 [0,2,0,0,0,0|2,0,0]=4 4713 B13R1.139 CC=Cc1ccc(cc1)C(=O)CC 271570a_100016259895_100000211647 [0,2,0,0,0,0|2,0,0]=4 4714 B13R1.139 CC=Cc1ccc(cc1)C(=O)NC 271570a_100016259895_100000155074 [0,2,0,0,0,0|2,0,0]=4 4715 B13R1.139 CC=Cc1ccc(cc1)C(=O)OC 271570a_100016259895_100000150774 [0,2,0,0,0,0|1,0,0]=3 4716 B13R1.139 CC=Cc1ccc(cn1)C(=O)OC 271570a_100016259895_100000733799 [0,2,0,0,0,0|2,0,0]=4 4717 B13R1.139 CC=Cc1ccc(nc1)C(=O)OC 271570a_100016259895_100000690920 [0,2,0,0,0,0|2,0,0]=4 4718 B13R1.139 CCC(=O)c1ccc(cc1)CC#N 1458a_100000693995_100000210202 [0,2,0,0,0,0|2,0,0]=4 4719 B13R1.139 CCC(=O)c1ccc(cc1)CCO 1458a_100000078963_100000210202 [0,2,0,0,0,0|1,0,0]=3 4720 B13R1.139 CCC(=O)c1ccc(cc1)CNC 26a_100102657272_100000212119 [0,2,0,0,0,0|2,0,0]=4 4721 B13R1.139 CCC(=O)c1ccc(cc1)COC 1458a_100000189608_100000210202 [0,2,0,0,0,0|1,0,0]=3 4722 B13R1.139 CCC(=O)c1ccc(cc1)CSC 1458a_100000175442_100000210202 [0,2,0,0,0,0|1,1,0]=4 4723 B13R1.139 CCC(=O)c1ccc(cc1)N=[N+]=[N-] 1458a_100000039380_100000210202 [0,2,0,0,0,0|2,0,0]=4 4724 B13R1.139 CCC(=O)c1ccc(cc1)OCF 34a_100000212119_100015361967 [0,2,0,0,0,0|1,0,0]=3 4725 B13R1.139 CCC(=O)c1ccc(cc1)OCF 7a_100000212119_100015361967 [0,2,0,0,0,0|1,0,0]=3 4726 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100000211647_100015361967 [0,2,0,0,0,0|1,1,0]=4 4727 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100015361967_100000211647 [0,2,0,0,0,0|1,1,0]=4 4728 B13R1.139 CCCc1ccc(cc1)C(=O)CC 1458a_100011207308_100000210202 [0,2,0,0,0,0|2,0,0]=4 4729 B13R1.139 CCCc1ccc(cc1)C(=O)NC 11a_106832991635_100011207308 [0,2,0,0,0,0|2,0,0]=4 4730 B13R1.139 CCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100011207308 [0,2,0,0,0,0|2,0,0]=4 4731 B13R1.139 CCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100011207308 [0,2,0,0,0,0|2,0,0]=4 4732 B13R1.139 CCCc1ccc(cc1)C(=O)NC 527a_100102657272_100011207308 [0,2,0,0,0,0|2,0,0]=4 4733 B13R1.139 CCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210202 [0,2,0,0,0,0|2,0,0]=4 4734 B13R1.139 CCNc1ccc(cc1)C(=O)NC 27a_100015525214_100000155074 [0,2,0,0,0,0|2,0,0]=4 4735 B13R1.139 CCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210202 [0,2,0,0,0,0|2,0,0]=4 4736 B13R1.139 CCNc1ccc(cn1)C(=O)OC 27a_100015525214_100000733799 [0,2,0,0,0,0|2,0,0]=4 4737 B13R1.139 CCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210202 [0,2,0,0,0,0|2,0,0]=4 4738 B13R1.139 CCOc1ccc(cc1)C(=O)CC 1458a_100000181891_100000210202 [0,2,0,0,0,0|1,0,0]=3 4739 B13R1.139 CCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210202 [0,2,0,0,0,0|1,0,0]=3 4740 B13R1.139 CCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210202 [0,2,0,0,0,0|1,0,0]=3 4741 B13R1.139 CCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210202 [0,2,0,0,0,0|2,0,0]=4 4742 B13R1.139 CCOc1ccc(cc1)C(=O)CF 1458a_100000181891_100015361967 [0,2,0,0,0,0|2,0,0]=4 4743 B13R1.139 CCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000210202 [0,2,0,0,0,0|2,0,0]=4 4744 B13R1.139 CCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000210202 [0,2,0,0,0,0|2,0,0]=4 4745 B13R1.139 CCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000181891 [0,2,0,0,0,0|1,0,0]=3 4746 B13R1.139 CCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000181891 [0,2,0,0,0,0|1,0,0]=3 4747 B13R1.139 CCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000181891 [0,2,0,0,0,0|1,0,0]=3 4748 B13R1.139 CCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210202 [0,2,0,0,0,0|1,0,0]=3 4749 B13R1.139 CCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000181891 [0,2,0,0,0,0|1,0,0]=3 4750 B13R1.139 CCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210202 [0,2,0,0,0,0|1,0,0]=3 4751 B13R1.139 CCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210202 [0,2,0,0,0,0|2,0,0]=4 4752 B13R1.139 CCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210202 [0,2,0,0,0,0|0,0,0]=2 4753 B13R1.139 CCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210202 [0,2,0,0,0,0|0,0,0]=2 4754 B13R1.139 CCOc1ccc(cc1)C(C)OC 34a_200010658654_100000210202 [0,2,0,0,0,0|1,0,1]=4 4755 B13R1.139 CCOc1ccc(cc1)C(C)OC 7a_200010658654_100000210202 [0,2,0,0,0,0|1,0,1]=4 4756 B13R1.139 CCOc1ccc(cc1)[C@@H](C)OC 34a_100000761365_200000210301 [0,2,0,0,0,0|1,0,1]=4 4757 B13R1.139 CCOc1ccc(cc1)[C@@H](C)OC 7a_100000761365_200000210301 [0,2,0,0,0,0|1,0,1]=4 4758 B13R1.139 CCOc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000761365_200025704644 [0,2,0,0,0,0|1,0,1]=4 4759 B13R1.139 CCOc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000761365_200025704644 [0,2,0,0,0,0|1,0,1]=4 4760 B13R1.139 CCOc1ccc(nc1)C(=O)NC 34a_100009861314_100000210202 [0,2,0,0,0,0|2,0,0]=4 4761 B13R1.139 CCOc1ccc(nc1)C(=O)NC 7a_100009861314_100000210202 [0,2,0,0,0,0|2,0,0]=4 4762 B13R1.139 CCOc1ccc(nc1)C(=O)OC 34a_100011997255_100000210202 [0,2,0,0,0,0|1,0,0]=3 4763 B13R1.139 CCOc1ccc(nc1)C(=O)OC 7a_100011997255_100000210202 [0,2,0,0,0,0|1,0,0]=3 4764 B13R1.139 CCSc1ccc(cc1)C(=O)CC 1458a_100000244969_100000210202 [0,2,0,0,0,0|1,1,0]=4 4765 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000210202_100000211647 [0,2,0,0,0,0|1,1,0]=4 4766 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210202 [0,2,0,0,0,0|1,1,0]=4 4767 B13R1.139 CCSc1ccc(cc1)C(=O)NC 11a_106832991635_100000244969 [0,2,0,0,0,0|1,1,0]=4 4768 B13R1.139 CCSc1ccc(cc1)C(=O)NC 1626a_100102657272_100000244969 [0,2,0,0,0,0|1,1,0]=4 4769 B13R1.139 CCSc1ccc(cc1)C(=O)NC 240690a_100102657272_100000244969 [0,2,0,0,0,0|1,1,0]=4 4770 B13R1.139 CCSc1ccc(cc1)C(=O)NC 527a_100102657272_100000244969 [0,2,0,0,0,0|1,1,0]=4 4771 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210202 [0,2,0,0,0,0|1,1,0]=4 4772 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000210202_100000155074 [0,2,0,0,0,0|1,1,0]=4 4773 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210202 [0,2,0,0,0,0|0,1,0]=3 4774 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000210202_100000150774 [0,2,0,0,0,0|0,1,0]=3 4775 B13R1.139 CCSc1ccc(cn1)C(=O)OC 62a_100000210202_100000733799 [0,2,0,0,0,0|1,1,0]=4 4776 B13R1.139 CCSc1ccc(cn1)C(=O)OC 62a_100000733799_100000210202 [0,2,0,0,0,0|1,1,0]=4 4777 B13R1.139 CCSc1ccc(nc1)C(=O)OC 62a_100000210202_100102712061 [0,2,0,0,0,0|1,1,0]=4 4778 B13R1.139 CCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210202 [0,2,0,0,0,0|1,1,0]=4 4779 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 11a_106832991635_100000693995 [0,2,0,0,0,0|2,0,0]=4 4780 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 1626a_100102657272_100000693995 [0,2,0,0,0,0|2,0,0]=4 4781 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 240690a_100102657272_100000693995 [0,2,0,0,0,0|2,0,0]=4 4782 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 527a_100102657272_100000693995 [0,2,0,0,0,0|2,0,0]=4 4783 B13R1.139 CNC(=O)c1ccc(cc1)CCO 1626a_100102657272_100000078963 [0,2,0,0,0,0|1,0,0]=3 4784 B13R1.139 CNC(=O)c1ccc(cc1)CCO 240690a_100102657272_100000078963 [0,2,0,0,0,0|1,0,0]=3 4785 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 2230a_100000743749_200025704644 [0,2,0,0,0,0|2,0,0]=4 4786 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 34a_100000743749_200025704644 [0,2,0,0,0,0|2,0,0]=4 4787 B13R1.139 CNC(=O)c1ccc(cc1)COC 11a_106832991635_100000189608 [0,2,0,0,0,0|1,0,0]=3 4788 B13R1.139 CNC(=O)c1ccc(cc1)COC 1626a_100102657272_100000189608 [0,2,0,0,0,0|1,0,0]=3 4789 B13R1.139 CNC(=O)c1ccc(cc1)COC 240690a_100102657272_100000189608 [0,2,0,0,0,0|1,0,0]=3 4790 B13R1.139 CNC(=O)c1ccc(cc1)COC 34a_100138415774_100000753832 [0,2,0,0,0,0|1,0,0]=3 4791 B13R1.139 CNC(=O)c1ccc(cc1)COC 527a_100102657272_100000189608 [0,2,0,0,0,0|1,0,0]=3 4792 B13R1.139 CNC(=O)c1ccc(cc1)CSC 11a_106832991635_100000175442 [0,2,0,0,0,0|1,1,0]=4 4793 B13R1.139 CNC(=O)c1ccc(cc1)CSC 1626a_100102657272_100000175442 [0,2,0,0,0,0|1,1,0]=4 4794 B13R1.139 CNC(=O)c1ccc(cc1)CSC 240690a_100102657272_100000175442 [0,2,0,0,0,0|1,1,0]=4 4795 B13R1.139 CNC(=O)c1ccc(cc1)CSC 527a_100102657272_100000175442 [0,2,0,0,0,0|1,1,0]=4 4796 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_100000753832_200000210301 [0,2,0,0,0,0|1,1,0]=4 4797 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_200000210301_100000753832 [0,2,0,0,0,0|1,1,0]=4 4798 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_100000753832_200025704644 [0,2,0,0,0,0|1,1,0]=4 4799 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000753832 [0,2,0,0,0,0|1,1,0]=4 4800 B13R1.139 CNC(=O)c1ccc(cc1)N=[N+]=[N-] 11a_106832991635_100000039380 [0,2,0,0,0,0|2,0,0]=4 4801 B13R1.139 CNC(=O)c1ccc(cc1)N=[N+]=[N-] 240690a_100102657272_100000039380 [0,2,0,0,0,0|2,0,0]=4 4802 B13R1.139 CNC(=O)c1ccc(cc1)NCF 34a_100000184841_100015361967 [0,2,0,0,0,0|2,0,0]=4 4803 B13R1.139 CNC(=O)c1ccc(cc1)OCF 34a_100000192141_100015361967 [0,2,0,0,0,0|1,0,0]=3 4804 B13R1.139 CNC(=O)c1ccc(cc1)OCF 7a_100000192141_100015361967 [0,2,0,0,0,0|1,0,0]=3 4805 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100000155074_100015361967 [0,2,0,0,0,0|1,1,0]=4 4806 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100015361967_100000155074 [0,2,0,0,0,0|1,1,0]=4 4807 B13R1.139 CNC(=O)c1ccc(cn1)OCF 34a_100009861314_100015361967 [0,2,0,0,0,0|2,0,0]=4 4808 B13R1.139 CNC(=O)c1ccc(cn1)OCF 7a_100009861314_100015361967 [0,2,0,0,0,0|2,0,0]=4 4809 B13R1.139 CNCc1ccc(cc1)C(=O)NC 207a_100102657272_100000043907 [0,2,0,0,0,0|2,0,0]=4 4810 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_200000210301 [0,2,0,0,0,0|2,0,0]=4 4811 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_106832991635_100000753832 [0,2,0,0,0,0|2,0,0]=4 4812 B13R1.139 CNCc1ccc(cc1)C(=O)NC 270004a_106832991635_100000043907 [0,2,0,0,0,0|2,0,0]=4 4813 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100000743749_200000210301 [0,2,0,0,0,0|2,0,0]=4 4814 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100102657272_100000753832 [0,2,0,0,0,0|2,0,0]=4 4815 B13R1.139 CNCc1ccc(cc1)C(=O)NC 7a_106832991635_100000753832 [0,2,0,0,0,0|2,0,0]=4 4816 B13R1.139 CNCc1ccc(cc1)C(=O)OC 2230a_106832991635_100000735637 [0,2,0,0,0,0|1,0,0]=3 4817 B13R1.139 CNCc1ccc(cc1)C(=O)OC 26a_100102657272_100000150123 [0,2,0,0,0,0|1,0,0]=3 4818 B13R1.139 CNCc1ccc(cc1)C(=O)OC 270004a_106832991635_100000148700 [0,2,0,0,0,0|1,0,0]=3 4819 B13R1.139 CNCc1ccc(cc1)C(=O)OC 34a_100102657272_100000735637 [0,2,0,0,0,0|1,0,0]=3 4820 B13R1.139 CNCc1ccc(cc1)C(=O)OC 7a_106832991635_100000735637 [0,2,0,0,0,0|1,0,0]=3 4821 B13R1.139 CNCc1ccc(cn1)C(=O)OC 2230a_106832991635_100000063545 [0,2,0,0,0,0|2,0,0]=4 4822 B13R1.139 CNCc1ccc(cn1)C(=O)OC 270004a_106832991635_100000762506 [0,2,0,0,0,0|2,0,0]=4 4823 B13R1.139 CNCc1ccc(cn1)C(=O)OC 34a_100102657272_100010230174 [0,2,0,0,0,0|2,0,0]=4 4824 B13R1.139 CNCc1ccc(cn1)C(=O)OC 7a_106832991635_100000063545 [0,2,0,0,0,0|2,0,0]=4 4825 B13R1.139 CNCc1ccc(nc1)C(=O)OC 2230a_106832991635_100010177729 [0,2,0,0,0,0|2,0,0]=4 4826 B13R1.139 CNCc1ccc(nc1)C(=O)OC 270004a_106832991635_102516457225 [0,2,0,0,0,0|2,0,0]=4 4827 B13R1.139 CNCc1ccc(nc1)C(=O)OC 34a_100102657272_100010177729 [0,2,0,0,0,0|2,0,0]=4 4828 B13R1.139 CNCc1ccc(nc1)C(=O)OC 7a_106832991635_100010177729 [0,2,0,0,0,0|2,0,0]=4 4829 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 34a_100000151488_200025704644 [0,2,0,0,0,0|0,0,0]=2 4830 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 7a_100000151488_200025704644 [0,2,0,0,0,0|0,0,0]=2 4831 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_100000735637_200000210301 [0,2,0,0,0,0|0,1,0]=3 4832 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_200000210301_100000187170 [0,2,0,0,0,0|0,1,0]=3 4833 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_100000735637_200025704644 [0,2,0,0,0,0|0,1,0]=3 4834 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000187170 [0,2,0,0,0,0|0,1,0]=3 4835 B13R1.139 COC(=O)c1ccc(cc1)OCF 34a_100000150123_100015361967 [0,2,0,0,0,0|0,0,0]=2 4836 B13R1.139 COC(=O)c1ccc(cc1)OCF 7a_100000150123_100015361967 [0,2,0,0,0,0|0,0,0]=2 4837 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100000150774_100015361967 [0,2,0,0,0,0|0,1,0]=3 4838 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100015361967_100000150774 [0,2,0,0,0,0|0,1,0]=3 4839 B13R1.139 COC(=O)c1ccc(cn1)CO[13CH3] 34a_100009873365_200025704644 [0,2,0,0,0,0|1,0,0]=3 4840 B13R1.139 COC(=O)c1ccc(cn1)CO[13CH3] 7a_100009873365_200025704644 [0,2,0,0,0,0|1,0,0]=3 4841 B13R1.139 COC(=O)c1ccc(cn1)CSC 62a_100010177729_200000210301 [0,2,0,0,0,0|1,1,0]=4 4842 B13R1.139 COC(=O)c1ccc(cn1)CSC 62a_200000210301_100010177729 [0,2,0,0,0,0|1,1,0]=4 4843 B13R1.139 COC(=O)c1ccc(cn1)CS[13CH3] 62a_100010177729_200025704644 [0,2,0,0,0,0|1,1,0]=4 4844 B13R1.139 COC(=O)c1ccc(cn1)CS[13CH3] 62a_200025704644_100010177729 [0,2,0,0,0,0|1,1,0]=4 4845 B13R1.139 COC(=O)c1ccc(cn1)OCF 34a_100011997255_100015361967 [0,2,0,0,0,0|1,0,0]=3 4846 B13R1.139 COC(=O)c1ccc(cn1)OCF 7a_100011997255_100015361967 [0,2,0,0,0,0|1,0,0]=3 4847 B13R1.139 COC(=O)c1ccc(cn1)SCF 62a_100015361967_100102712061 [0,2,0,0,0,0|1,1,0]=4 4848 B13R1.139 COC(=O)c1ccc(cn1)SCF 62a_100102712061_100015361967 [0,2,0,0,0,0|1,1,0]=4 4849 B13R1.139 COC(=O)c1ccc(nc1)CO[13CH3] 34a_100000239634_200025704644 [0,2,0,0,0,0|1,0,0]=3 4850 B13R1.139 COC(=O)c1ccc(nc1)CSC 62a_100010230174_200000210301 [0,2,0,0,0,0|1,1,0]=4 4851 B13R1.139 COC(=O)c1ccc(nc1)CSC 62a_200000210301_100010230174 [0,2,0,0,0,0|1,1,0]=4 4852 B13R1.139 COC(=O)c1ccc(nc1)CS[13CH3] 62a_100010230174_200025704644 [0,2,0,0,0,0|1,1,0]=4 4853 B13R1.139 COC(=O)c1ccc(nc1)CS[13CH3] 62a_200025704644_100010230174 [0,2,0,0,0,0|1,1,0]=4 4854 B13R1.139 COC(=O)c1ccc(nc1)SCF 62a_100000733799_100015361967 [0,2,0,0,0,0|1,1,0]=4 4855 B13R1.139 COC(=O)c1ccc(nc1)SCF 62a_100015361967_100000733799 [0,2,0,0,0,0|1,1,0]=4 4856 B13R1.139 COC(C)c1ccc(cc1)OCF 34a_200010658654_100015361967 [0,2,0,0,0,0|1,0,1]=4 4857 B13R1.139 COC(C)c1ccc(cc1)OCF 7a_200010658654_100015361967 [0,2,0,0,0,0|1,0,1]=4 4858 B13R1.139 COCc1ccc(cc1)C(=O)CF 1458a_100000189608_100015361967 [0,2,0,0,0,0|2,0,0]=4 4859 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100000151488_200000210301 [0,2,0,0,0,0|0,0,0]=2 4860 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100138415774_100000735637 [0,2,0,0,0,0|0,0,0]=2 4861 B13R1.139 COCc1ccc(cc1)C(=O)OC 7a_100000151488_200000210301 [0,2,0,0,0,0|0,0,0]=2 4862 B13R1.139 COCc1ccc(cn1)C(=O)OC 34a_100000239634_200000210301 [0,2,0,0,0,0|1,0,0]=3 4863 B13R1.139 COCc1ccc(cn1)C(=O)OC 34a_100138415774_100010230174 [0,2,0,0,0,0|1,0,0]=3 4864 B13R1.139 COCc1ccc(nc1)C(=O)OC 34a_100009873365_200000210301 [0,2,0,0,0,0|1,0,0]=3 4865 B13R1.139 COCc1ccc(nc1)C(=O)OC 34a_100138415774_100010177729 [0,2,0,0,0,0|1,0,0]=3 4866 B13R1.139 COCc1ccc(nc1)C(=O)OC 7a_100009873365_200000210301 [0,2,0,0,0,0|1,0,0]=3 4867 B13R1.139 COCc1cnc(cn1)C(=O)OC 34a_100138415774_200010203303 [0,2,0,0,0,0|2,0,0]=4 4868 B13R1.139 NNC(=O)c1ccc(cc1)OCF 34a_100000185078_100015361967 [0,2,0,0,0,0|2,0,0]=4 4869 B13R1.139 O=C(CBr)c1ccc(cc1)OCF 7a_100009814261_100015361967 [0,2,0,0,0,0|2,0,0]=4 4870 B13R1.139 O=C(CCl)c1ccc(cc1)OCF 7a_100000018856_100015361967 [0,2,0,0,0,0|2,0,0]=4 4871 B13R1.139 O=C(CF)c1ccc(cc1)CCO 1458a_100000078963_100015361967 [0,2,0,0,0,0|2,0,0]=4 4872 B13R1.139 O=C(CF)c1ccc(cc1)OCF 34a_200010654591_100015361967 [0,2,0,0,0,0|2,0,0]=4 4873 B13R1.139 O=C(CF)c1ccc(cc1)OCF 7a_200010654591_100015361967 [0,2,0,0,0,0|2,0,0]=4 4874 B13R1.187 C=Cc1ccc(cc1)S(=O)(=O)OC 271570a_100011290941_100000004522 [0,2,0,0,0,0|2,0,0]=4 4875 B13R1.187 CNS(=O)(=O)c1ccc(cc1)OC 270084a_100102657272_100000182833 [0,2,0,0,0,0|2,0,0]=4 4876 B13R1.187 CNS(=O)(=O)c1ccc(cc1)OC 274078a_100102657272_100000182833 [0,2,0,0,0,0|2,0,0]=4 4877 B13R1.187 COc1ccc(cc1)C(C)(C)OC 34a_100000744786_200000210301 [0,2,0,0,0,0|1,0,1]=4 4878 B13R1.187 COc1ccc(cc1)C(C)(C)OC 7a_100000744786_200000210301 [0,2,0,0,0,0|1,0,1]=4 4879 B13R1.187 COc1ccc(cc1)C(C)(C)O[13CH3] 34a_100000744786_200025704644 [0,2,0,0,0,0|1,0,1]=4 4880 B13R1.187 COc1ccc(cc1)C(C)(C)O[13CH3] 7a_100000744786_200025704644 [0,2,0,0,0,0|1,0,1]=4 4881 B13R1.452 C#CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000184674 [0,2,0,0,0,0|1,0,1]=4 4882 B13R1.452 C#CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000184674 [0,2,0,0,0,0|1,0,1]=4 4883 B13R1.452 C#Cc1ccc(cc1)C(=O)CCC 1458a_100011217615_100000210303 [0,2,0,0,0,0|2,0,0]=4 4884 B13R1.452 C#Cc1ccc(cc1)C(=O)CCF 1458a_100011217615_100011217306 [0,2,0,0,0,0|2,0,0]=4 4885 B13R1.452 C#Cc1ccc(cc1)C(=O)CCO 1458a_100011217615_100000211926 [0,2,0,0,0,0|2,0,0]=4 4886 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100011217615 [0,2,0,0,0,0|2,0,0]=4 4887 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100011217615 [0,2,0,0,0,0|2,0,0]=4 4888 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100011217615 [0,2,0,0,0,0|2,0,0]=4 4889 B13R1.452 C#Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100011217615 [0,2,0,0,0,0|2,0,0]=4 4890 B13R1.452 C=CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210623 [0,2,0,0,0,0|1,0,1]=4 4891 B13R1.452 C=CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210623 [0,2,0,0,0,0|1,0,1]=4 4892 B13R1.452 C=Cc1ccc(cc1)C(=O)C#CC 271570a_100011290941_100153741113 [0,2,0,0,0,0|2,0,0]=4 4893 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 1458a_100000687532_100000210303 [0,2,0,0,0,0|2,0,0]=4 4894 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 271570a_100011290941_100011267722 [0,2,0,0,0,0|2,0,0]=4 4895 B13R1.452 C=Cc1ccc(cc1)C(=O)CCF 1458a_100000687532_100011217306 [0,2,0,0,0,0|2,0,0]=4 4896 B13R1.452 C=Cc1ccc(cc1)C(=O)CCO 1458a_100000687532_100000211926 [0,2,0,0,0,0|2,0,0]=4 4897 B13R1.452 C=Cc1ccc(cc1)C(=O)COC 271570a_100011290941_200011343064 [0,2,0,0,0,0|1,0,0]=3 4898 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100000687532 [0,2,0,0,0,0|2,0,0]=4 4899 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000687532 [0,2,0,0,0,0|2,0,0]=4 4900 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 271570a_100011290941_100000155177 [0,2,0,0,0,0|2,0,0]=4 4901 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100000687532 [0,2,0,0,0,0|2,0,0]=4 4902 B13R1.452 C=Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100000687532 [0,2,0,0,0,0|2,0,0]=4 4903 B13R1.452 C=Cc1ccc(cc1)C(=O)OCC 271570a_100011290941_100000170077 [0,2,0,0,0,0|1,0,0]=3 4904 B13R1.452 C=Cc1ccc(cn1)C(=O)OCC 271570a_100011290941_100000170224 [0,2,0,0,0,0|2,0,0]=4 4905 B13R1.452 C=Cc1ccc(nc1)C(=O)OCC 271570a_100011290941_100011781174 [0,2,0,0,0,0|2,0,0]=4 4906 B13R1.452 CC#CC(=O)c1ccc(cc1)SC 62a_200000210301_100153741113 [0,2,0,0,0,0|1,1,0]=4 4907 B13R1.452 CC#CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100153741113 [0,2,0,0,0,0|1,1,0]=4 4908 B13R1.452 CCCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210303 [0,2,0,0,0,0|2,0,0]=4 4909 B13R1.452 CCCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210303 [0,2,0,0,0,0|2,0,0]=4 4910 B13R1.452 CCCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210303 [0,2,0,0,0,0|1,0,0]=3 4911 B13R1.452 CCCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210303 [0,2,0,0,0,0|1,0,0]=3 4912 B13R1.452 CCCC(=O)c1ccc(cc1)OC 34a_100011216482_200000210301 [0,2,0,0,0,0|1,0,0]=3 4913 B13R1.452 CCCC(=O)c1ccc(cc1)OC 7a_100011216482_200000210301 [0,2,0,0,0,0|1,0,0]=3 4914 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 34a_100011216482_200025704644 [0,2,0,0,0,0|1,0,0]=3 4915 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 7a_100011216482_200025704644 [0,2,0,0,0,0|1,0,0]=3 4916 B13R1.452 CCCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210303 [0,2,0,0,0,0|1,1,0]=4 4917 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_100011267722_200000210301 [0,2,0,0,0,0|1,1,0]=4 4918 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_200000210301_100011267722 [0,2,0,0,0,0|1,1,0]=4 4919 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_100011267722_200025704644 [0,2,0,0,0,0|1,1,0]=4 4920 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011267722 [0,2,0,0,0,0|1,1,0]=4 4921 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 11a_100015525214_100000210717 [0,2,0,0,0,0|2,0,0]=4 4922 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 240690a_100015525214_100000210717 [0,2,0,0,0,0|2,0,0]=4 4923 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 527a_100015525214_100000210717 [0,2,0,0,0,0|2,0,0]=4 4924 B13R1.452 CCNC(=O)c1ccc(cc1)CC 11a_100015525214_100000211226 [0,2,0,0,0,0|2,0,0]=4 4925 B13R1.452 CCNC(=O)c1ccc(cc1)CC 240690a_100015525214_100000211226 [0,2,0,0,0,0|2,0,0]=4 4926 B13R1.452 CCNC(=O)c1ccc(cc1)CC 527a_100015525214_100000211226 [0,2,0,0,0,0|2,0,0]=4 4927 B13R1.452 CCNC(=O)c1ccc(cc1)CO 240690a_100015525214_100000183892 [0,2,0,0,0,0|1,0,0]=3 4928 B13R1.452 CCNC(=O)c1ccc(cc1)NC 2230a_100000741011_200000210301 [0,2,0,0,0,0|2,0,0]=4 4929 B13R1.452 CCNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155177 [0,2,0,0,0,0|2,0,0]=4 4930 B13R1.452 CCNC(=O)c1ccc(cc1)NC 34a_100000741011_200000210301 [0,2,0,0,0,0|2,0,0]=4 4931 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000741011_200025704644 [0,2,0,0,0,0|2,0,0]=4 4932 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 34a_100000741011_200025704644 [0,2,0,0,0,0|2,0,0]=4 4933 B13R1.452 CCNC(=O)c1ccc(cc1)OC 11a_100015525214_100000184203 [0,2,0,0,0,0|1,0,0]=3 4934 B13R1.452 CCNC(=O)c1ccc(cc1)OC 240690a_100015525214_100000184203 [0,2,0,0,0,0|1,0,0]=3 4935 B13R1.452 CCNC(=O)c1ccc(cc1)OC 527a_100015525214_100000184203 [0,2,0,0,0,0|1,0,0]=3 4936 B13R1.452 CCNC(=O)c1ccc(cc1)SC 11a_100015525214_100000189692 [0,2,0,0,0,0|1,1,0]=4 4937 B13R1.452 CCNC(=O)c1ccc(cc1)SC 240690a_100015525214_100000189692 [0,2,0,0,0,0|1,1,0]=4 4938 B13R1.452 CCNC(=O)c1ccc(cc1)SC 527a_100015525214_100000189692 [0,2,0,0,0,0|1,1,0]=4 4939 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_100000155177_200000210301 [0,2,0,0,0,0|1,1,0]=4 4940 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155177 [0,2,0,0,0,0|1,1,0]=4 4941 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155177_200025704644 [0,2,0,0,0,0|1,1,0]=4 4942 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155177 [0,2,0,0,0,0|1,1,0]=4 4943 B13R1.452 CCOC(=O)c1ccc(cc1)OC 34a_100000169885_200000210301 [0,2,0,0,0,0|0,0,0]=2 4944 B13R1.452 CCOC(=O)c1ccc(cc1)OC 7a_100000169885_200000210301 [0,2,0,0,0,0|0,0,0]=2 4945 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 34a_100000169885_200025704644 [0,2,0,0,0,0|0,0,0]=2 4946 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 7a_100000169885_200025704644 [0,2,0,0,0,0|0,0,0]=2 4947 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_100000169895_200000210301 [0,2,0,0,0,0|0,1,0]=3 4948 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_200000210301_100000169919 [0,2,0,0,0,0|0,1,0]=3 4949 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_100000169895_200025704644 [0,2,0,0,0,0|0,1,0]=3 4950 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000169919 [0,2,0,0,0,0|0,1,0]=3 4951 B13R1.452 CCOC(=O)c1ccc(cn1)SC 62a_100011781174_200000210301 [0,2,0,0,0,0|1,1,0]=4 4952 B13R1.452 CCOC(=O)c1ccc(cn1)SC 62a_200000210301_100011781174 [0,2,0,0,0,0|1,1,0]=4 4953 B13R1.452 CCOC(=O)c1ccc(cn1)S[13CH3] 62a_100011781174_200025704644 [0,2,0,0,0,0|1,1,0]=4 4954 B13R1.452 CCOC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100011781174 [0,2,0,0,0,0|1,1,0]=4 4955 B13R1.452 CCOC(=O)c1ccc(nc1)NC 27a_100102657272_100000170224 [0,2,0,0,0,0|2,0,0]=4 4956 B13R1.452 CCOC(=O)c1ccc(nc1)SC 62a_100011291635_200000210301 [0,2,0,0,0,0|1,1,0]=4 4957 B13R1.452 CCOC(=O)c1ccc(nc1)SC 62a_200000210301_100000170224 [0,2,0,0,0,0|1,1,0]=4 4958 B13R1.452 CCOC(=O)c1ccc(nc1)S[13CH3] 62a_100011291635_200025704644 [0,2,0,0,0,0|1,1,0]=4 4959 B13R1.452 CCOC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000170224 [0,2,0,0,0,0|1,1,0]=4 4960 B13R1.452 CCOC(C)c1ccc(cc1)OC 34a_100000742907_100000210202 [0,2,0,0,0,0|1,0,1]=4 4961 B13R1.452 CCOC(C)c1ccc(cc1)OC 7a_100000742907_100000210202 [0,2,0,0,0,0|1,0,1]=4 4962 B13R1.452 CCc1ccc(cc1)C(=O)CCF 1458a_100000211226_100011217306 [0,2,0,0,0,0|2,0,0]=4 4963 B13R1.452 CCc1ccc(cc1)C(=O)CCO 1458a_100000211226_100000211926 [0,2,0,0,0,0|2,0,0]=4 4964 B13R1.452 CCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000689809 [0,2,0,0,0,0|2,0,0]=4 4965 B13R1.452 CCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000183122 [0,2,0,0,0,0|2,0,0]=4 4966 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_100000689809_200000210301 [0,2,0,0,0,0|1,1,0]=4 4967 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000689809 [0,2,0,0,0,0|1,1,0]=4 4968 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000689809_200025704644 [0,2,0,0,0,0|1,1,0]=4 4969 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000689809 [0,2,0,0,0,0|1,1,0]=4 4970 B13R1.452 CCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000211226 [0,2,0,0,0,0|2,0,0]=4 4971 B13R1.452 CNCC(=O)c1ccc(cc1)C#N 2230a_106832991635_100000212069 [0,2,0,0,0,0|2,0,0]=4 4972 B13R1.452 CNCC(=O)c1ccc(cc1)OC 2230a_106832991635_100000212054 [0,2,0,0,0,0|1,0,0]=3 4973 B13R1.452 CNCC(=O)c1ccc(cc1)OC 7a_106832991635_100000212054 [0,2,0,0,0,0|1,0,0]=3 4974 B13R1.452 CNCC(=O)c1ccc(cc1)SC 2230a_106832991635_100011216809 [0,2,0,0,0,0|1,1,0]=4 4975 B13R1.452 CNCC(=O)c1ccc(cc1)SC 34a_100102657272_100011216809 [0,2,0,0,0,0|1,1,0]=4 4976 B13R1.452 CNNC(=O)c1ccc(cc1)C#N 22a_100016993582_100000210717 [0,2,0,0,0,0|2,0,0]=4 4977 B13R1.452 CNNC(=O)c1ccc(cc1)CO 22a_100016993582_100000183892 [0,2,0,0,0,0|1,0,0]=3 4978 B13R1.452 CNNC(=O)c1ccc(cc1)OC 22a_100016993582_100000184203 [0,2,0,0,0,0|1,0,0]=3 4979 B13R1.452 CNNC(=O)c1ccc(cc1)SC 22a_100016993582_100000189692 [0,2,0,0,0,0|1,1,0]=4 4980 B13R1.452 COCC(=O)c1ccc(cc1)C#N 34a_100011592799_200000210301 [0,2,0,0,0,0|1,0,0]=3 4981 B13R1.452 COCC(=O)c1ccc(cc1)OC 34a_200009861119_200000210301 [0,2,0,0,0,0|0,0,0]=2 4982 B13R1.452 COCC(=O)c1ccc(cc1)OC 7a_200009861119_200000210301 [0,2,0,0,0,0|0,0,0]=2 4983 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 34a_200009861119_200025704644 [0,2,0,0,0,0|0,0,0]=2 4984 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 7a_200009861119_200025704644 [0,2,0,0,0,0|0,0,0]=2 4985 B13R1.452 COCC(=O)c1ccc(cc1)SC 34a_100138415774_100011216809 [0,2,0,0,0,0|0,1,0]=3 4986 B13R1.452 COCC(=O)c1ccc(cc1)SC 62a_200011343064_200000210301 [0,2,0,0,0,0|0,1,0]=3 4987 B13R1.452 COCC(=O)c1ccc(cc1)S[13CH3] 62a_200011343064_200025704644 [0,2,0,0,0,0|0,1,0]=3 4988 B13R1.452 COCC(N)c1ccc(cc1)OC 34a_100000751956_200000210301 [0,2,0,0,0,0|1,0,1]=4 4989 B13R1.452 COCN(C)c1ccc(cc1)OC 2230a_100000220023_100000766300 [0,2,0,0,0,0|2,0,0]=4 4990 B13R1.452 COCN(C)c1ccc(cc1)OC 269982a_100000220023_100000766300 [0,2,0,0,0,0|2,0,0]=4 4991 B13R1.452 COc1ccc(cc1)C(=O)CC#N 1458a_100000184203_100011214920 [0,2,0,0,0,0|1,0,1]=4 4992 B13R1.452 COc1ccc(cc1)C(=O)CC#N 7a_100009871544_200000210301 [0,2,0,0,0,0|1,0,1]=4 4993 B13R1.452 COc1ccc(cc1)C(=O)CCCl 7a_100009879949_200000210301 [0,2,0,0,0,0|1,0,0]=3 4994 B13R1.452 COc1ccc(cc1)C(=O)CCF 1458a_100000184203_100011217306 [0,2,0,0,0,0|1,0,0]=3 4995 B13R1.452 COc1ccc(cc1)C(=O)CCO 1458a_100000184203_100000211926 [0,2,0,0,0,0|1,0,0]=3 4996 B13R1.452 COc1ccc(cc1)C(=O)CSC 62a_100000212054_200000210301 [0,2,0,0,0,0|0,1,0]=3 4997 B13R1.452 COc1ccc(cc1)C(=O)CSC 62a_200000210301_100000212054 [0,2,0,0,0,0|0,1,0]=3 4998 B13R1.452 COc1ccc(cc1)C(=O)CS[13CH3] 62a_100000212054_200025704644 [0,2,0,0,0,0|0,1,0]=3 4999 B13R1.452 COc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000212054 [0,2,0,0,0,0|0,1,0]=3 5000 B13R1.452 COc1ccc(cc1)C(C)OCF 34a_100000742907_100015361967 [0,2,0,0,0,0|1,0,1]=4 5001 B13R1.452 COc1ccc(cc1)C(C)OCF 7a_100000742907_100015361967 [0,2,0,0,0,0|1,0,1]=4 5002 B13R1.452 COc1ccc(cc1)C(N)CO[13CH3] 34a_100000751956_200025704644 [0,2,0,0,0,0|1,0,1]=4 5003 B13R1.452 CSCC(=O)c1ccc(cc1)C#N 62a_100000212069_200000210301 [0,2,0,0,0,0|1,1,0]=4 5004 B13R1.452 CSCC(=O)c1ccc(cc1)C#N 62a_200000210301_100000212069 [0,2,0,0,0,0|1,1,0]=4 5005 B13R1.452 CSCC(=O)c1ccc(cc1)SC 62a_100011216809_200000210301 [0,2,0,0,0,0|0,2,0]=4 5006 B13R1.452 CSCC(=O)c1ccc(cc1)SC 62a_200000210301_100011216809 [0,2,0,0,0,0|0,2,0]=4 5007 B13R1.452 CSc1ccc(cc1)C(=O)CCF 1458a_100000189692_100011217306 [0,2,0,0,0,0|1,1,0]=4 5008 B13R1.452 CSc1ccc(cc1)C(=O)CCO 1458a_100000189692_100000211926 [0,2,0,0,0,0|1,1,0]=4 5009 B13R1.452 CSc1ccc(cc1)C(=O)CS[13CH3] 62a_100011216809_200025704644 [0,2,0,0,0,0|0,2,0]=4 5010 B13R1.452 CSc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100011216809 [0,2,0,0,0,0|0,2,0]=4 5011 B13R1.452 N#CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100011214920 [0,2,0,0,0,0|1,0,1]=4 5012 B13R1.452 N#Cc1ccc(cc1)C(=O)CCF 1458a_100000210717_100011217306 [0,2,0,0,0,0|2,0,0]=4 5013 B13R1.452 N#Cc1ccc(cc1)C(=O)CCO 1458a_100000210717_100000211926 [0,2,0,0,0,0|2,0,0]=4 5014 B13R1.452 O=C(CCF)c1ccc(cc1)CO 1458a_100000183892_100011217306 [0,2,0,0,0,0|1,0,0]=3 5015 B13R1.452 O=C(CCO)c1ccc(cc1)CO 1458a_100000183892_100000211926 [0,2,0,0,0,0|1,0,0]=3 5016 B13R1.452 [13CH3]OCC(=O)c1ccc(cc1)C#N 34a_100011592799_200025704644 [0,2,0,0,0,0|1,0,0]=3 5017 B13R1.452 [13CH3]Oc1ccc(cc1)C(=O)CC#N 7a_100009871544_200025704644 [0,2,0,0,0,0|1,0,1]=4 5018 B13R1.452 [13CH3]Oc1ccc(cc1)C(=O)CCCl 7a_100009879949_200025704644 [0,2,0,0,0,0|1,0,0]=3 5019 B13R1.452 [13CH3]SCC(=O)c1ccc(cc1)C#N 62a_100000212069_200025704644 [0,2,0,0,0,0|1,1,0]=4 5020 B13R1.452 [13CH3]SCC(=O)c1ccc(cc1)C#N 62a_200025704644_100000212069 [0,2,0,0,0,0|1,1,0]=4 5021 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 1458a_200009908186_100000210202 [0,2,0,0,0,0|2,0,0]=4 5022 B13R1.537 C=C(C)c1ccc(cc1)C(=O)CC 271570a_100000694244_100000211647 [0,2,0,0,0,0|2,0,0]=4 5023 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 11a_106832991635_200009908186 [0,2,0,0,0,0|2,0,0]=4 5024 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 1626a_100102657272_200009908186 [0,2,0,0,0,0|2,0,0]=4 5025 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 240690a_100102657272_200009908186 [0,2,0,0,0,0|2,0,0]=4 5026 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 271570a_100000694244_100000155074 [0,2,0,0,0,0|2,0,0]=4 5027 B13R1.537 C=C(C)c1ccc(cc1)C(=O)NC 527a_100102657272_200009908186 [0,2,0,0,0,0|2,0,0]=4 5028 B13R1.537 C=C(C)c1ccc(cc1)C(=O)OC 271570a_100000694244_100000150774 [0,2,0,0,0,0|1,0,0]=3 5029 B13R1.537 C=C(C)c1ccc(cn1)C(=O)OC 271570a_100000694244_100000733799 [0,2,0,0,0,0|2,0,0]=4 5030 B13R1.537 C=C(C)c1ccc(nc1)C(=O)OC 271570a_100000694244_100000690920 [0,2,0,0,0,0|2,0,0]=4 5031 B13R1.537 CC(O)c1ccc(cc1)C(=O)CF 1458a_100000076921_100015361967 [0,2,0,0,0,0|2,0,0]=4 5032 B13R1.537 CCC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_100000210202 [0,2,0,0,0,0|1,0,1]=4 5033 B13R1.537 CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210202 [0,2,0,0,0,0|2,0,0]=4 5034 B13R1.537 CCC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_100000210202 [0,2,0,0,0,0|1,0,0]=3 5035 B13R1.537 CCC(=O)c1ccc(cc1)C(F)F 1458a_100011735500_100000210202 [0,2,0,0,0,0|2,0,0]=4 5036 B13R1.537 CCC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_100000210202 [0,2,0,0,0,0|2,0,0]=4 5037 B13R1.537 CCC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_100000210202 [0,2,0,0,0,0|1,0,1]=4 5038 B13R1.537 CCC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100000210202 [0,2,0,0,0,0|1,0,1]=4 5039 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)C 1458a_100011298788_200000210301 [0,2,0,0,0,0|1,0,1]=4 5040 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 11a_106832991635_100000230133 [0,2,0,0,0,0|1,0,1]=4 5041 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 1626a_100102657272_100000230133 [0,2,0,0,0,0|1,0,1]=4 5042 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)N 240690a_100102657272_100000230133 [0,2,0,0,0,0|1,0,1]=4 5043 B13R1.537 CNC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100011298788_200025704644 [0,2,0,0,0,0|1,0,1]=4 5044 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 11a_106832991635_100000210772 [0,2,0,0,0,0|2,0,0]=4 5045 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 1626a_100102657272_100000210772 [0,2,0,0,0,0|2,0,0]=4 5046 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 240690a_100102657272_100000210772 [0,2,0,0,0,0|2,0,0]=4 5047 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 527a_100102657272_100000210772 [0,2,0,0,0,0|2,0,0]=4 5048 B13R1.537 CNC(=O)c1ccc(cc1)C(C)O 240690a_100102657272_100000076921 [0,2,0,0,0,0|1,0,0]=3 5049 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 11a_106832991635_100011735500 [0,2,0,0,0,0|2,0,0]=4 5050 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 1626a_100102657272_100011735500 [0,2,0,0,0,0|2,0,0]=4 5051 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 240690a_100102657272_100011735500 [0,2,0,0,0,0|2,0,0]=4 5052 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F 527a_100102657272_100011735500 [0,2,0,0,0,0|2,0,0]=4 5053 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 11a_106832991635_100000210873 [0,2,0,0,0,0|2,0,0]=4 5054 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 1626a_100102657272_100000210873 [0,2,0,0,0,0|2,0,0]=4 5055 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 240690a_100102657272_100000210873 [0,2,0,0,0,0|2,0,0]=4 5056 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 27a_100102631434_100000155074 [0,2,0,0,0,0|2,0,0]=4 5057 B13R1.537 CNC(=O)c1ccc(cc1)N(C)C 527a_100102657272_100000210873 [0,2,0,0,0,0|2,0,0]=4 5058 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 1626a_100102657272_200000217594 [0,2,0,0,0,0|1,0,1]=4 5059 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 240690a_100102657272_200000217594 [0,2,0,0,0,0|1,0,1]=4 5060 B13R1.537 CNC(=O)c1ccc(cc1)S(=O)C 527a_100102657272_200000217594 [0,2,0,0,0,0|1,0,1]=4 5061 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000185811 [0,2,0,0,0,0|1,0,1]=4 5062 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000185811 [0,2,0,0,0,0|1,0,1]=4 5063 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000185811 [0,2,0,0,0,0|1,0,1]=4 5064 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000185811 [0,2,0,0,0,0|1,0,1]=4 5065 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C 1458a_100000211811_200000210301 [0,2,0,0,0,0|0,0,1]=3 5066 B13R1.537 COC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000211811_200025704644 [0,2,0,0,0,0|0,0,1]=3 5067 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 2230a_100000220287_200000210301 [0,2,0,0,0,0|1,0,0]=3 5068 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 269982a_100000220287_200000210301 [0,2,0,0,0,0|1,0,0]=3 5069 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 34a_100000220287_200000210301 [0,2,0,0,0,0|1,0,0]=3 5070 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 2230a_100000220287_200025704644 [0,2,0,0,0,0|1,0,0]=3 5071 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 269982a_100000220287_200025704644 [0,2,0,0,0,0|1,0,0]=3 5072 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 34a_100000220287_200025704644 [0,2,0,0,0,0|1,0,0]=3 5073 B13R1.537 COC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000733799 [0,2,0,0,0,0|2,0,0]=4 5074 B13R1.3088 C#Cc1ccc(cc1C)C(=O)CC 1458a_100013243528_100000210202 [0,2,0,0,0,0|2,0,0]=4 5075 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 11a_106832991635_100013243528 [0,2,0,0,0,0|2,0,0]=4 5076 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 1626a_100102657272_100013243528 [0,2,0,0,0,0|2,0,0]=4 5077 B13R1.3088 C#Cc1ccc(cc1C)C(=O)NC 527a_100102657272_100013243528 [0,2,0,0,0,0|2,0,0]=4 5078 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)CC 1458a_100014797261_100000210202 [0,2,0,0,0,0|2,0,0]=4 5079 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 11a_106832991635_100014797261 [0,2,0,0,0,0|2,0,0]=4 5080 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 1626a_100102657272_100014797261 [0,2,0,0,0,0|2,0,0]=4 5081 B13R1.3088 C#Cc1ccc(cc1Cl)C(=O)NC 527a_100102657272_100014797261 [0,2,0,0,0,0|2,0,0]=4 5082 B13R1.3088 C=Cc1ccc(cc1Br)C(=O)OC 271570a_100011290941_100011294788 [0,2,0,0,0,0|1,0,0]=3 5083 B13R1.3088 C=Cc1ccc(cc1C)C(=O)CC 271570a_100011290941_200012349626 [0,2,0,0,0,0|2,0,0]=4 5084 B13R1.3088 C=Cc1ccc(cc1C)C(=O)NC 271570a_100011290941_200013065384 [0,2,0,0,0,0|2,0,0]=4 5085 B13R1.3088 C=Cc1ccc(cc1C)C(=O)OC 271570a_100011290941_100011215878 [0,2,0,0,0,0|1,0,0]=3 5086 B13R1.3088 C=Cc1ccc(cc1Cl)C(=O)OC 271570a_100011290941_100012356344 [0,2,0,0,0,0|1,0,0]=3 5087 B13R1.3088 C=Cc1ccc(cc1F)C(=O)OC 271570a_100011290941_100000703229 [0,2,0,0,0,0|1,0,0]=3 5088 B13R1.3088 C=Cc1ccc(cc1N)C(=O)OC 271570a_100011290941_100011450966 [0,2,0,0,0,0|1,0,0]=3 5089 B13R1.3088 C=Cc1ccc(cc1O)C(=O)OC 271570a_100011290941_100012350776 [0,2,0,0,0,0|1,0,0]=3 5090 B13R1.3088 C=Cc1ccc(nc1C)C(=O)OC 271570a_100011290941_100010207261 [0,2,0,0,0,0|2,0,0]=4 5091 B13R1.3088 C=Cc1ccc(nc1F)C(=O)OC 271570a_100011290941_100010189630 [0,2,0,0,0,0|2,0,0]=4 5092 B13R1.3088 C=Cc1ccc(nc1N)C(=O)OC 271570a_100011290941_100010187631 [0,2,0,0,0,0|2,0,0]=4 5093 B13R1.3088 C=Cc1ccc(nc1O)C(=O)OC 271570a_100011290941_100010189637 [0,2,0,0,0,0|2,0,0]=4 5094 B13R1.3088 C=Cc1cnc(cc1C)C(=O)OC 271570a_100011290941_100010080863 [0,2,0,0,0,0|2,0,0]=4 5095 B13R1.3088 C=Cc1cnc(cc1N)C(=O)OC 271570a_100011290941_100016001589 [0,2,0,0,0,0|2,0,0]=4 5096 B13R1.3088 C=Cc1ncc(cc1Br)C(=O)OC 271570a_100011290941_100010114297 [0,2,0,0,0,0|2,0,0]=4 5097 B13R1.3088 C=Cc1ncc(cc1C)C(=O)OC 271570a_100011290941_100009862495 [0,2,0,0,0,0|2,0,0]=4 5098 B13R1.3088 C=Cc1ncc(cc1F)C(=O)OC 271570a_100011290941_100010189625 [0,2,0,0,0,0|2,0,0]=4 5099 B13R1.3088 C=Cc1ncc(cc1N)C(=O)OC 271570a_100011290941_100000079130 [0,2,0,0,0,0|2,0,0]=4 5100 B13R1.3088 C=Cc1ncc(cc1O)C(=O)OC 271570a_100011290941_100010999399 [0,2,0,0,0,0|2,0,0]=4 5101 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_100000210202 [0,2,0,0,0,0|2,0,0]=4 5102 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)CC 1458a_100012340589_100000210202 [0,2,0,0,0,0|2,0,0]=4 5103 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)OC 1458a_100000187947_100000210202 [0,2,0,0,0,0|1,0,0]=3 5104 B13R1.3088 CCC(=O)c1ccc(c(c1)C)C#N 1458a_100012180287_100000210202 [0,2,0,0,0,0|2,0,0]=4 5105 B13R1.3088 CCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210202 [0,2,0,0,0,0|1,0,0]=3 5106 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200012349626 [0,2,0,0,0,0|1,1,0]=4 5107 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200012349626_200000210301 [0,2,0,0,0,0|1,1,0]=4 5108 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200012349626_200025704644 [0,2,0,0,0,0|1,1,0]=4 5109 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200012349626 [0,2,0,0,0,0|1,1,0]=4 5110 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_100000210202 [0,2,0,0,0,0|2,0,0]=4 5111 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 1458a_100000188346_100000210202 [0,2,0,0,0,0|1,0,0]=3 5112 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 34a_100011218862_200000210301 [0,2,0,0,0,0|1,0,0]=3 5113 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 7a_100011218862_200000210301 [0,2,0,0,0,0|1,0,0]=3 5114 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100011218862_200025704644 [0,2,0,0,0,0|1,0,0]=3 5115 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100011218862_200025704644 [0,2,0,0,0,0|1,0,0]=3 5116 B13R1.3088 CCC(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_100000210202 [0,2,0,0,0,0|2,0,0]=4 5117 B13R1.3088 CCC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_100000210202 [0,2,0,0,0,0|1,0,0]=3 5118 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC 1458a_100000186160_100000210202 [0,2,0,0,0,0|1,0,0]=3 5119 B13R1.3088 CCC(=O)c1ccc(c(c1)I)OC 1458a_100000188716_100000210202 [0,2,0,0,0,0|1,0,0]=3 5120 B13R1.3088 CCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210202 [0,2,0,0,0,0|2,0,0]=4 5121 B13R1.3088 CCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210202 [0,2,0,0,0,0|1,0,0]=3 5122 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 11a_106832991635_100012340589 [0,2,0,0,0,0|2,0,0]=4 5123 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 1626a_100102657272_100012340589 [0,2,0,0,0,0|2,0,0]=4 5124 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 240690a_100102657272_100012340589 [0,2,0,0,0,0|2,0,0]=4 5125 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 527a_100102657272_100012340589 [0,2,0,0,0,0|2,0,0]=4 5126 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 240690a_100102657272_100000089006 [0,2,0,0,0,0|2,0,0]=4 5127 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 527a_100102657272_100000089006 [0,2,0,0,0,0|2,0,0]=4 5128 B13R1.3088 CCc1ccc(cc1O)C(=O)OC 271570a_203496583355_200012360130 [0,2,0,0,0,0|1,0,0]=3 5129 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 11a_106832991635_100012355661 [0,2,0,0,0,0|2,0,0]=4 5130 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 1626a_100102657272_100012355661 [0,2,0,0,0,0|2,0,0]=4 5131 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 240690a_100102657272_100012355661 [0,2,0,0,0,0|2,0,0]=4 5132 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)C#N 527a_100102657272_100012355661 [0,2,0,0,0,0|2,0,0]=4 5133 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 11a_106832991635_100000187947 [0,2,0,0,0,0|1,0,0]=3 5134 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 1626a_100102657272_100000187947 [0,2,0,0,0,0|1,0,0]=3 5135 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 240690a_100102657272_100000187947 [0,2,0,0,0,0|1,0,0]=3 5136 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 527a_100102657272_100000187947 [0,2,0,0,0,0|1,0,0]=3 5137 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 11a_106832991635_100012180287 [0,2,0,0,0,0|2,0,0]=4 5138 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 1626a_100102657272_100012180287 [0,2,0,0,0,0|2,0,0]=4 5139 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 240690a_100102657272_100012180287 [0,2,0,0,0,0|2,0,0]=4 5140 B13R1.3088 CNC(=O)c1ccc(c(c1)C)C#N 527a_100102657272_100012180287 [0,2,0,0,0,0|2,0,0]=4 5141 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 2230a_100000739472_200000210301 [0,2,0,0,0,0|2,0,0]=4 5142 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200013065384 [0,2,0,0,0,0|2,0,0]=4 5143 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 34a_100000739472_200000210301 [0,2,0,0,0,0|2,0,0]=4 5144 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 7a_100000739472_200000210301 [0,2,0,0,0,0|2,0,0]=4 5145 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 2230a_100000739472_200025704644 [0,2,0,0,0,0|2,0,0]=4 5146 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 34a_100000739472_200025704644 [0,2,0,0,0,0|2,0,0]=4 5147 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 7a_100000739472_200025704644 [0,2,0,0,0,0|2,0,0]=4 5148 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 11a_106832991635_100011202886 [0,2,0,0,0,0|1,0,0]=3 5149 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 1626a_100102657272_100011202886 [0,2,0,0,0,0|1,0,0]=3 5150 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 240690a_100102657272_100011202886 [0,2,0,0,0,0|1,0,0]=3 5151 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 527a_100102657272_100011202886 [0,2,0,0,0,0|1,0,0]=3 5152 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200013065384 [0,2,0,0,0,0|1,1,0]=4 5153 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200013065384_200000210301 [0,2,0,0,0,0|1,1,0]=4 5154 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200013065384_200025704644 [0,2,0,0,0,0|1,1,0]=4 5155 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200013065384 [0,2,0,0,0,0|1,1,0]=4 5156 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 11a_106832991635_100000694585 [0,2,0,0,0,0|2,0,0]=4 5157 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 1626a_100102657272_100000694585 [0,2,0,0,0,0|2,0,0]=4 5158 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)C#N 527a_100102657272_100000694585 [0,2,0,0,0,0|2,0,0]=4 5159 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 11a_106832991635_100000188346 [0,2,0,0,0,0|1,0,0]=3 5160 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 1626a_100102657272_100000188346 [0,2,0,0,0,0|1,0,0]=3 5161 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 240690a_100102657272_100000188346 [0,2,0,0,0,0|1,0,0]=3 5162 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 527a_100102657272_100000188346 [0,2,0,0,0,0|1,0,0]=3 5163 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 11a_106832991635_100011217213 [0,2,0,0,0,0|2,0,0]=4 5164 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 1626a_100102657272_100011217213 [0,2,0,0,0,0|2,0,0]=4 5165 B13R1.3088 CNC(=O)c1ccc(c(c1)F)C#N 527a_100102657272_100011217213 [0,2,0,0,0,0|2,0,0]=4 5166 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 1626a_100102657272_100000687192 [0,2,0,0,0,0|1,0,0]=3 5167 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 240690a_100102657272_100000687192 [0,2,0,0,0,0|1,0,0]=3 5168 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 11a_106832991635_100000186160 [0,2,0,0,0,0|1,0,0]=3 5169 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 1626a_100102657272_100000186160 [0,2,0,0,0,0|1,0,0]=3 5170 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 240690a_100102657272_100000186160 [0,2,0,0,0,0|1,0,0]=3 5171 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 527a_100102657272_100000186160 [0,2,0,0,0,0|1,0,0]=3 5172 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 11a_106832991635_100000188716 [0,2,0,0,0,0|1,0,0]=3 5173 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 1626a_100102657272_100000188716 [0,2,0,0,0,0|1,0,0]=3 5174 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 240690a_100102657272_100000188716 [0,2,0,0,0,0|1,0,0]=3 5175 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 527a_100102657272_100000188716 [0,2,0,0,0,0|1,0,0]=3 5176 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 240690a_100102657272_100000766810 [0,2,0,0,0,0|1,0,0]=3 5177 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 527a_100102657272_100000766810 [0,2,0,0,0,0|1,0,0]=3 5178 B13R1.3088 CNc1ccc(nc1F)C(=O)OC 27a_100102657272_100010189630 [0,2,0,0,0,0|2,0,0]=4 5179 B13R1.3088 CNc1ncc(cc1Br)C(=O)OC 27a_100102657272_100010114297 [0,2,0,0,0,0|2,0,0]=4 5180 B13R1.3088 CNc1ncc(cc1C)C(=O)OC 27a_100102657272_100009862495 [0,2,0,0,0,0|2,0,0]=4 5181 B13R1.3088 CNc1ncc(cc1F)C(=O)OC 27a_100102657272_100009877320 [0,2,0,0,0,0|2,0,0]=4 5182 B13R1.3088 CNc1ncc(cc1N)C(=O)OC 27a_100102657272_100000079130 [0,2,0,0,0,0|2,0,0]=4 5183 B13R1.3088 COC(=O)c1cc(c(cn1)OC)O 271570a_203496583355_200010136175 [0,2,0,0,0,0|1,0,0]=3 5184 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_100010080863_200000210301 [0,2,0,0,0,0|1,1,0]=4 5185 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_200000210301_100010080863 [0,2,0,0,0,0|1,1,0]=4 5186 B13R1.3088 COC(=O)c1cc(c(cn1)SC)N 62a_100016001589_200000210301 [0,2,0,0,0,0|1,1,0]=4 5187 B13R1.3088 COC(=O)c1cc(c(cn1)SC)N 62a_200000210301_100016001589 [0,2,0,0,0,0|1,1,0]=4 5188 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_100010080863_200025704644 [0,2,0,0,0,0|1,1,0]=4 5189 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100010080863 [0,2,0,0,0,0|1,1,0]=4 5190 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])N 62a_100016001589_200025704644 [0,2,0,0,0,0|1,1,0]=4 5191 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])N 62a_200025704644_100016001589 [0,2,0,0,0,0|1,1,0]=4 5192 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 34a_100000216328_200000210301 [0,2,0,0,0,0|0,0,0]=2 5193 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 7a_100000216328_200000210301 [0,2,0,0,0,0|0,0,0]=2 5194 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100000216328_200025704644 [0,2,0,0,0,0|0,0,0]=2 5195 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100000216328_200025704644 [0,2,0,0,0,0|0,0,0]=2 5196 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_100011294788_200000210301 [0,2,0,0,0,0|0,1,0]=3 5197 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_200000210301_100011294788 [0,2,0,0,0,0|0,1,0]=3 5198 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100011294788_200025704644 [0,2,0,0,0,0|0,1,0]=3 5199 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100011294788 [0,2,0,0,0,0|0,1,0]=3 5200 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 34a_100011997373_200000210301 [0,2,0,0,0,0|0,0,0]=2 5201 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 7a_100011997373_200000210301 [0,2,0,0,0,0|0,0,0]=2 5202 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100011997373_200025704644 [0,2,0,0,0,0|0,0,0]=2 5203 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100011997373_200025704644 [0,2,0,0,0,0|0,0,0]=2 5204 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_100011215878_200000210301 [0,2,0,0,0,0|0,1,0]=3 5205 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100011215878 [0,2,0,0,0,0|0,1,0]=3 5206 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100011215878_200025704644 [0,2,0,0,0,0|0,1,0]=3 5207 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011215878 [0,2,0,0,0,0|0,1,0]=3 5208 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 34a_100000151454_200000210301 [0,2,0,0,0,0|0,0,0]=2 5209 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 7a_100000151454_200000210301 [0,2,0,0,0,0|0,0,0]=2 5210 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000151454_200025704644 [0,2,0,0,0,0|0,0,0]=2 5211 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000151454_200025704644 [0,2,0,0,0,0|0,0,0]=2 5212 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_100012356344_200000210301 [0,2,0,0,0,0|0,1,0]=3 5213 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_200000210301_100012356344 [0,2,0,0,0,0|0,1,0]=3 5214 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_100012356344_200025704644 [0,2,0,0,0,0|0,1,0]=3 5215 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100012356344 [0,2,0,0,0,0|0,1,0]=3 5216 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 34a_100000075456_200000210301 [0,2,0,0,0,0|0,0,0]=2 5217 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 7a_100000075456_200000210301 [0,2,0,0,0,0|0,0,0]=2 5218 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000075456_200025704644 [0,2,0,0,0,0|0,0,0]=2 5219 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000075456_200025704644 [0,2,0,0,0,0|0,0,0]=2 5220 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_100000703229_200000210301 [0,2,0,0,0,0|0,1,0]=3 5221 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_200000210301_100000703229 [0,2,0,0,0,0|0,1,0]=3 5222 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000703229_200025704644 [0,2,0,0,0,0|0,1,0]=3 5223 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000703229 [0,2,0,0,0,0|0,1,0]=3 5224 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 34a_100010162523_200000210301 [0,2,0,0,0,0|0,0,0]=2 5225 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 7a_100010162523_200000210301 [0,2,0,0,0,0|0,0,0]=2 5226 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 34a_100010162523_200025704644 [0,2,0,0,0,0|0,0,0]=2 5227 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 7a_100010162523_200025704644 [0,2,0,0,0,0|0,0,0]=2 5228 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 34a_100000724433_200000210301 [0,2,0,0,0,0|0,0,0]=2 5229 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 7a_100000724433_200000210301 [0,2,0,0,0,0|0,0,0]=2 5230 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000724433_200025704644 [0,2,0,0,0,0|0,0,0]=2 5231 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000724433_200025704644 [0,2,0,0,0,0|0,0,0]=2 5232 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_100011450966_200000210301 [0,2,0,0,0,0|0,1,0]=3 5233 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_200000210301_100011450966 [0,2,0,0,0,0|0,1,0]=3 5234 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100011450966_200025704644 [0,2,0,0,0,0|0,1,0]=3 5235 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011450966 [0,2,0,0,0,0|0,1,0]=3 5236 B13R1.3088 COC(=O)c1ccc(c(c1)O)C#N 271570a_203496583355_100009861381 [0,2,0,0,0,0|1,0,0]=3 5237 B13R1.3088 COC(=O)c1ccc(c(c1)O)C=O 271570a_203496583355_100012179231 [0,2,0,0,0,0|0,0,1]=3 5238 B13R1.3088 COC(=O)c1ccc(c(c1)O)CO 271570a_203496583355_100012355398 [0,2,0,0,0,0|0,0,0]=2 5239 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100000189012 [0,2,0,0,0,0|0,0,0]=2 5240 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_100012350776_200000210301 [0,2,0,0,0,0|0,1,0]=3 5241 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012350776 [0,2,0,0,0,0|0,1,0]=3 5242 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_100012350776_200025704644 [0,2,0,0,0,0|0,1,0]=3 5243 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012350776 [0,2,0,0,0,0|0,1,0]=3 5244 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 34a_200009815348_200000210301 [0,2,0,0,0,0|1,0,0]=3 5245 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 7a_200009815348_200000210301 [0,2,0,0,0,0|1,0,0]=3 5246 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 34a_200009815348_200025704644 [0,2,0,0,0,0|1,0,0]=3 5247 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 7a_200009815348_200025704644 [0,2,0,0,0,0|1,0,0]=3 5248 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_100010207261_200000210301 [0,2,0,0,0,0|1,1,0]=4 5249 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_200000210301_100010207261 [0,2,0,0,0,0|1,1,0]=4 5250 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_100010207261_200025704644 [0,2,0,0,0,0|1,1,0]=4 5251 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_200025704644_100010207261 [0,2,0,0,0,0|1,1,0]=4 5252 B13R1.3088 COC(=O)c1ccc(c(n1)F)SC 62a_100010189630_200000210301 [0,2,0,0,0,0|1,1,0]=4 5253 B13R1.3088 COC(=O)c1ccc(c(n1)F)SC 62a_200000210301_100010189630 [0,2,0,0,0,0|1,1,0]=4 5254 B13R1.3088 COC(=O)c1ccc(c(n1)F)S[13CH3] 62a_100010189630_200025704644 [0,2,0,0,0,0|1,1,0]=4 5255 B13R1.3088 COC(=O)c1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010189630 [0,2,0,0,0,0|1,1,0]=4 5256 B13R1.3088 COC(=O)c1ccc(c(n1)N)SC 62a_100010187631_200000210301 [0,2,0,0,0,0|1,1,0]=4 5257 B13R1.3088 COC(=O)c1ccc(c(n1)N)S[13CH3] 62a_100010187631_200025704644 [0,2,0,0,0,0|1,1,0]=4 5258 B13R1.3088 COC(=O)c1ccc(c(n1)O)OC 271570a_203496583355_100010205418 [0,2,0,0,0,0|1,0,0]=3 5259 B13R1.3088 COC(=O)c1ccc(c(n1)O)SC 62a_200000210301_100010189637 [0,2,0,0,0,0|1,1,0]=4 5260 B13R1.3088 COC(=O)c1ccc(c(n1)O)S[13CH3] 62a_200025704644_100010189637 [0,2,0,0,0,0|1,1,0]=4 5261 B13R1.3088 COC(=O)c1cnc(c(c1)Br)OC 34a_100015192546_200000210301 [0,2,0,0,0,0|1,0,0]=3 5262 B13R1.3088 COC(=O)c1cnc(c(c1)Br)O[13CH3] 34a_100015192546_200025704644 [0,2,0,0,0,0|1,0,0]=3 5263 B13R1.3088 COC(=O)c1cnc(c(c1)Br)SC 62a_100010114297_200000210301 [0,2,0,0,0,0|1,1,0]=4 5264 B13R1.3088 COC(=O)c1cnc(c(c1)Br)SC 62a_200000210301_100010114297 [0,2,0,0,0,0|1,1,0]=4 5265 B13R1.3088 COC(=O)c1cnc(c(c1)Br)S[13CH3] 62a_100010114297_200025704644 [0,2,0,0,0,0|1,1,0]=4 5266 B13R1.3088 COC(=O)c1cnc(c(c1)Br)S[13CH3] 62a_200025704644_100010114297 [0,2,0,0,0,0|1,1,0]=4 5267 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200000210301_100009862495 [0,2,0,0,0,0|1,1,0]=4 5268 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200010136688_200000210301 [0,2,0,0,0,0|1,1,0]=4 5269 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200010136688_200025704644 [0,2,0,0,0,0|1,1,0]=4 5270 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009862495 [0,2,0,0,0,0|1,1,0]=4 5271 B13R1.3088 COC(=O)c1cnc(c(c1)F)SC 62a_100010189625_200000210301 [0,2,0,0,0,0|1,1,0]=4 5272 B13R1.3088 COC(=O)c1cnc(c(c1)F)SC 62a_200000210301_100010189625 [0,2,0,0,0,0|1,1,0]=4 5273 B13R1.3088 COC(=O)c1cnc(c(c1)F)S[13CH3] 62a_100010189625_200025704644 [0,2,0,0,0,0|1,1,0]=4 5274 B13R1.3088 COC(=O)c1cnc(c(c1)F)S[13CH3] 62a_200025704644_100010189625 [0,2,0,0,0,0|1,1,0]=4 5275 B13R1.3088 COC(=O)c1cnc(c(c1)N)SC 62a_200000210301_100000079130 [0,2,0,0,0,0|1,1,0]=4 5276 B13R1.3088 COC(=O)c1cnc(c(c1)N)S[13CH3] 62a_200025704644_100000079130 [0,2,0,0,0,0|1,1,0]=4 5277 B13R1.3088 COC(=O)c1cnc(c(c1)O)OC 271570a_203496583355_100010189640 [0,2,0,0,0,0|1,0,0]=3 5278 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_100010999399_200000210301 [0,2,0,0,0,0|1,1,0]=4 5279 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_200000210301_100010999399 [0,2,0,0,0,0|1,1,0]=4 5280 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_100010999399_200025704644 [0,2,0,0,0,0|1,1,0]=4 5281 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_200025704644_100010999399 [0,2,0,0,0,0|1,1,0]=4 5282 B13R1.3088 COc1ccc(cc1Br)C(=O)CF 1458a_100000187947_100015361967 [0,2,0,0,0,0|2,0,0]=4 5283 B13R1.3088 COc1ccc(cc1Br)C(C)OC 34a_100000246541_200000210301 [0,2,0,0,0,0|1,0,1]=4 5284 B13R1.3088 COc1ccc(cc1Br)C(C)OC 7a_100000246541_200000210301 [0,2,0,0,0,0|1,0,1]=4 5285 B13R1.3088 COc1ccc(cc1Br)C(C)O[13CH3] 34a_100000246541_200025704644 [0,2,0,0,0,0|1,0,1]=4 5286 B13R1.3088 COc1ccc(cc1Br)C(C)O[13CH3] 7a_100000246541_200025704644 [0,2,0,0,0,0|1,0,1]=4 5287 B13R1.3088 COc1ccc(cc1C)C(=O)CF 1458a_100011202886_100015361967 [0,2,0,0,0,0|2,0,0]=4 5288 B13R1.3088 COc1ccc(cc1Cl)C(=O)CCl 7a_200010170092_200000210301 [0,2,0,0,0,0|2,0,0]=4 5289 B13R1.3088 COc1ccc(cc1Cl)C(=O)CF 1458a_100000188346_100015361967 [0,2,0,0,0,0|2,0,0]=4 5290 B13R1.3088 COc1ccc(cc1F)C(=O)CF 1458a_100000186160_100015361967 [0,2,0,0,0,0|2,0,0]=4 5291 B13R1.3088 COc1ccc(cc1F)C(C)OC 34a_100000242639_200000210301 [0,2,0,0,0,0|1,0,1]=4 5292 B13R1.3088 COc1ccc(cc1F)C(C)OC 7a_100000242639_200000210301 [0,2,0,0,0,0|1,0,1]=4 5293 B13R1.3088 COc1ccc(cc1F)C(C)O[13CH3] 34a_100000242639_200025704644 [0,2,0,0,0,0|1,0,1]=4 5294 B13R1.3088 COc1ccc(cc1F)C(C)O[13CH3] 7a_100000242639_200025704644 [0,2,0,0,0,0|1,0,1]=4 5295 B13R1.3088 COc1ccc(cc1I)C(=O)CF 1458a_100000188716_100015361967 [0,2,0,0,0,0|2,0,0]=4 5296 B13R1.3088 COc1ccc(cc1I)C(C)OC 34a_202516928852_200000210301 [0,2,0,0,0,0|1,0,1]=4 5297 B13R1.3088 COc1ccc(cc1I)C(C)OC 7a_202516928852_200000210301 [0,2,0,0,0,0|1,0,1]=4 5298 B13R1.3088 COc1ccc(cc1I)C(C)O[13CH3] 34a_202516928852_200025704644 [0,2,0,0,0,0|1,0,1]=4 5299 B13R1.3088 COc1ccc(cc1I)C(C)O[13CH3] 7a_202516928852_200025704644 [0,2,0,0,0,0|1,0,1]=4 5300 B13R1.3088 COc1ccc(cc1N)C(=O)NN 34a_200000039609_200000210301 [0,2,0,0,0,0|2,0,0]=4 5301 B13R1.3088 COc1ccc(cc1O)C(=O)CF 1458a_100000766810_100015361967 [0,2,0,0,0,0|2,0,0]=4 5302 B13R1.3088 COc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000186317 [0,2,0,0,0,0|2,0,0]=4 5303 B13R1.3088 O=C(CF)c1ccc(c(c1)F)CO 1458a_100000687192_100015361967 [0,2,0,0,0,0|2,0,0]=4 5304 B13R1.3088 [13CH3]Oc1ccc(cc1Cl)C(=O)CCl 7a_200010170092_200025704644 [0,2,0,0,0,0|2,0,0]=4 5305 B13R1.3088 [13CH3]Oc1ccc(cc1N)C(=O)NN 34a_200000039609_200025704644 [0,2,0,0,0,0|2,0,0]=4 5306 B13R1.29 CCCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_200010264448 [0,2,0,0,0,0|2,0,0]=4 5307 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 270084a_100015525214_100020667864 [0,2,0,0,0,0|2,0,0]=4 5308 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_200000165184 [0,2,0,0,0,0|2,0,0]=4 5309 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 274078a_100015525214_100020667864 [0,2,0,0,0,0|2,0,0]=4 5310 B13R1.29 COCS(=O)(=O)c1ccc(cc1)C 34a_100138415774_100000183660 [0,2,0,0,0,0|2,0,0]=4 5311 B13R1.29 NCCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000744336 [0,2,0,0,0,0|2,0,0]=4 5312 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000165156 [0,2,0,0,0,0|2,0,0]=4 5313 B13R1.522 CC(C)S(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765145 [0,2,0,0,0,0|2,0,0]=4 5314 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 270084a_100102631434_100020667864 [0,2,0,0,0,0|2,0,0]=4 5315 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000165035 [0,2,0,0,0,0|2,0,0]=4 5316 B13R1.522 CN(C)S(=O)(=O)c1ccc(cc1)O 274078a_100102631434_100020667864 [0,2,0,0,0,0|2,0,0]=4 5317 B13R1.1 CCN(CC=O)c1ccc(cc1)O 2230a_100011337800_200015260668 [0,2,0,0,0,0|2,0,0]=4 5318 B13R1.1 CCN(CC=O)c1ccc(cc1)O 269982a_100011337800_200015260668 [0,2,0,0,0,0|2,0,0]=4 5319 B13R1.1 CCN(CC=O)c1ccc(cc1)O 34a_100011337800_200009817547 [0,2,0,0,0,0|2,0,0]=4 5320 B13R1.1 CCN(COC)c1ccc(cc1)O 2230a_100011337800_100000766300 [0,2,0,0,0,0|2,0,0]=4 5321 B13R1.1 CCN(COC)c1ccc(cc1)O 269982a_100011337800_100000766300 [0,2,0,0,0,0|2,0,0]=4 5322 B13R1.706 CCN(C(=O)C)c1ccc(cc1)O 22a_100011337800_100000070787 [0,2,0,0,0,0|2,0,0]=4 5323 B13R1.706 COC(C(=O)C)c1ccc(cc1)Cl 1458a_100012350483_200000210301 [0,2,0,0,0,0|1,0,1]=4 5324 B13R1.706 COC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100012350483_200025704644 [0,2,0,0,0,0|1,0,1]=4 5325 B13R1.961 COC(OC)c1ccc(cc1F)O 271570a_203496583355_100010185892 [0,2,0,0,0,0|0,0,2]=4 5326 B13R1.17 C#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000753159 [0,2,0,0,0,0|2,0,0]=4 5327 B13R1.17 C#CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000753159 [0,2,0,0,0,0|2,0,0]=4 5328 B13R1.17 C#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000753159 [0,2,0,0,0,0|2,0,0]=4 5329 B13R1.17 C#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000753159 [0,2,0,0,0,0|2,0,0]=4 5330 B13R1.17 C#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000753159 [0,2,0,0,0,0|2,0,0]=4 5331 B13R1.17 C#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000753159 [0,2,0,0,0,0|1,0,0]=3 5332 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 11a_100000212058_100000185839 [0,2,0,0,0,0|2,0,0]=4 5333 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 1626a_100000212058_100000185839 [0,2,0,0,0,0|2,0,0]=4 5334 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 240690a_100000212058_100000185839 [0,2,0,0,0,0|2,0,0]=4 5335 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 527a_100000212058_100000185839 [0,2,0,0,0,0|2,0,0]=4 5336 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 11a_100000212058_100000188618 [0,2,0,0,0,0|2,0,0]=4 5337 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 1626a_100000212058_100000188618 [0,2,0,0,0,0|2,0,0]=4 5338 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 240690a_100000212058_100000188618 [0,2,0,0,0,0|2,0,0]=4 5339 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 527a_100000212058_100000188618 [0,2,0,0,0,0|2,0,0]=4 5340 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 11a_100000212058_100000210187 [0,2,0,0,0,0|2,0,0]=4 5341 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 1626a_100000212058_100000210187 [0,2,0,0,0,0|2,0,0]=4 5342 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 240690a_100000212058_100000210187 [0,2,0,0,0,0|2,0,0]=4 5343 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 527a_100000212058_100000210187 [0,2,0,0,0,0|2,0,0]=4 5344 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 11a_100000212058_100000187176 [0,2,0,0,0,0|2,0,0]=4 5345 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 1626a_100000212058_100000187176 [0,2,0,0,0,0|2,0,0]=4 5346 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 240690a_100000212058_100000187176 [0,2,0,0,0,0|2,0,0]=4 5347 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 527a_100000212058_100000187176 [0,2,0,0,0,0|2,0,0]=4 5348 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 11a_100000212058_100000187904 [0,2,0,0,0,0|2,0,0]=4 5349 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 1626a_100000212058_100000187904 [0,2,0,0,0,0|2,0,0]=4 5350 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 240690a_100000212058_100000187904 [0,2,0,0,0,0|2,0,0]=4 5351 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 527a_100000212058_100000187904 [0,2,0,0,0,0|2,0,0]=4 5352 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 240690a_100000212058_100000212099 [0,2,0,0,0,0|1,0,0]=3 5353 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 527a_100000212058_100000212099 [0,2,0,0,0,0|1,0,0]=3 5354 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)Br 1458a_100000185839_100102629194 [0,2,0,0,0,0|2,0,0]=4 5355 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)C 1458a_100000188618_100102629194 [0,2,0,0,0,0|2,0,0]=4 5356 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100102629194 [0,2,0,0,0,0|2,0,0]=4 5357 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)F 1458a_100000187176_100102629194 [0,2,0,0,0,0|2,0,0]=4 5358 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)I 1458a_100000187904_100102629194 [0,2,0,0,0,0|2,0,0]=4 5359 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)O 1458a_100000212099_100102629194 [0,2,0,0,0,0|1,0,0]=3 5360 B13R1.17 C=CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000754431 [0,2,0,0,0,0|2,0,0]=4 5361 B13R1.17 C=CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000754431 [0,2,0,0,0,0|2,0,0]=4 5362 B13R1.17 C=CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000754431 [0,2,0,0,0,0|2,0,0]=4 5363 B13R1.17 C=CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000754431 [0,2,0,0,0,0|2,0,0]=4 5364 B13R1.17 C=CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000754431 [0,2,0,0,0,0|2,0,0]=4 5365 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000754431 [0,2,0,0,0,0|1,0,0]=3 5366 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 271570a_203496583355_200012050250 [0,2,0,0,0,0|1,0,0]=3 5367 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 1626a_100020586998_100000185839 [0,2,0,0,0,0|2,0,0]=4 5368 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 240690a_100020586998_100000185839 [0,2,0,0,0,0|2,0,0]=4 5369 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 527a_100020586998_100000185839 [0,2,0,0,0,0|2,0,0]=4 5370 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 1626a_100020586998_100000188618 [0,2,0,0,0,0|2,0,0]=4 5371 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 240690a_100020586998_100000188618 [0,2,0,0,0,0|2,0,0]=4 5372 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 527a_100020586998_100000188618 [0,2,0,0,0,0|2,0,0]=4 5373 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 1626a_100020586998_100000210187 [0,2,0,0,0,0|2,0,0]=4 5374 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 240690a_100020586998_100000210187 [0,2,0,0,0,0|2,0,0]=4 5375 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 527a_100020586998_100000210187 [0,2,0,0,0,0|2,0,0]=4 5376 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 1626a_100020586998_100000187176 [0,2,0,0,0,0|2,0,0]=4 5377 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 240690a_100020586998_100000187176 [0,2,0,0,0,0|2,0,0]=4 5378 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 527a_100020586998_100000187176 [0,2,0,0,0,0|2,0,0]=4 5379 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 1626a_100020586998_100000187904 [0,2,0,0,0,0|2,0,0]=4 5380 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 240690a_100020586998_100000187904 [0,2,0,0,0,0|2,0,0]=4 5381 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 527a_100020586998_100000187904 [0,2,0,0,0,0|2,0,0]=4 5382 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 240690a_100020586998_100000212099 [0,2,0,0,0,0|1,0,0]=3 5383 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 527a_100020586998_100000212099 [0,2,0,0,0,0|1,0,0]=3 5384 B13R1.17 CC#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748600 [0,2,0,0,0,0|2,0,0]=4 5385 B13R1.17 CC#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000748600 [0,2,0,0,0,0|2,0,0]=4 5386 B13R1.17 CC#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748600 [0,2,0,0,0,0|2,0,0]=4 5387 B13R1.17 CC#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000748600 [0,2,0,0,0,0|2,0,0]=4 5388 B13R1.17 CC#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000748600 [0,2,0,0,0,0|2,0,0]=4 5389 B13R1.17 CC#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000748600 [0,2,0,0,0,0|1,0,0]=3 5390 B13R1.17 CC=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000070051 [0,2,0,0,0,0|2,0,0]=4 5391 B13R1.17 CC=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000070051 [0,2,0,0,0,0|2,0,0]=4 5392 B13R1.17 CC=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000070051 [0,2,0,0,0,0|2,0,0]=4 5393 B13R1.17 CC=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000070051 [0,2,0,0,0,0|2,0,0]=4 5394 B13R1.17 CC=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000070051 [0,2,0,0,0,0|2,0,0]=4 5395 B13R1.17 CC=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000070051 [0,2,0,0,0,0|1,0,0]=3 5396 B13R1.17 CC=NNC(=O)c1ccc(cc1)Br 4a_100000183614_200000210099 [0,2,0,0,0,0|2,0,0]=4 5397 B13R1.17 CC=NNC(=O)c1ccc(cc1)C 4a_100000189790_200000210099 [0,2,0,0,0,0|2,0,0]=4 5398 B13R1.17 CC=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_200000210099 [0,2,0,0,0,0|2,0,0]=4 5399 B13R1.17 CC=NNC(=O)c1ccc(cc1)F 4a_100000182866_200000210099 [0,2,0,0,0,0|2,0,0]=4 5400 B13R1.17 CC=NNC(=O)c1ccc(cc1)I 4a_100000189773_200000210099 [0,2,0,0,0,0|2,0,0]=4 5401 B13R1.17 CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210211 [0,2,0,0,0,0|2,0,0]=4 5402 B13R1.17 CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210211 [0,2,0,0,0,0|2,0,0]=4 5403 B13R1.17 CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210211 [0,2,0,0,0,0|2,0,0]=4 5404 B13R1.17 CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210211 [0,2,0,0,0,0|2,0,0]=4 5405 B13R1.17 CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210211 [0,2,0,0,0,0|2,0,0]=4 5406 B13R1.17 CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210211 [0,2,0,0,0,0|1,0,0]=3 5407 B13R1.17 CCCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011215321 [0,2,0,0,0,0|1,0,0]=3 5408 B13R1.17 CCCCS(=O)c1ccc(cc1)O 271570a_203496583355_100016336038 [0,2,0,0,0,0|2,0,0]=4 5409 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 11a_100020643023_100000185839 [0,2,0,0,0,0|2,0,0]=4 5410 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 1626a_100020643023_100000185839 [0,2,0,0,0,0|2,0,0]=4 5411 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 240690a_100020643023_100000185839 [0,2,0,0,0,0|2,0,0]=4 5412 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 527a_100020643023_100000185839 [0,2,0,0,0,0|2,0,0]=4 5413 B13R1.17 CCCNC(=O)c1ccc(cc1)C 11a_100020643023_100000188618 [0,2,0,0,0,0|2,0,0]=4 5414 B13R1.17 CCCNC(=O)c1ccc(cc1)C 1626a_100020643023_100000188618 [0,2,0,0,0,0|2,0,0]=4 5415 B13R1.17 CCCNC(=O)c1ccc(cc1)C 240690a_100020643023_100000188618 [0,2,0,0,0,0|2,0,0]=4 5416 B13R1.17 CCCNC(=O)c1ccc(cc1)C 527a_100020643023_100000188618 [0,2,0,0,0,0|2,0,0]=4 5417 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 11a_100020643023_100000210187 [0,2,0,0,0,0|2,0,0]=4 5418 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 1626a_100020643023_100000210187 [0,2,0,0,0,0|2,0,0]=4 5419 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 240690a_100020643023_100000210187 [0,2,0,0,0,0|2,0,0]=4 5420 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 527a_100020643023_100000210187 [0,2,0,0,0,0|2,0,0]=4 5421 B13R1.17 CCCNC(=O)c1ccc(cc1)F 11a_100020643023_100000187176 [0,2,0,0,0,0|2,0,0]=4 5422 B13R1.17 CCCNC(=O)c1ccc(cc1)F 1626a_100020643023_100000187176 [0,2,0,0,0,0|2,0,0]=4 5423 B13R1.17 CCCNC(=O)c1ccc(cc1)F 240690a_100020643023_100000187176 [0,2,0,0,0,0|2,0,0]=4 5424 B13R1.17 CCCNC(=O)c1ccc(cc1)F 527a_100020643023_100000187176 [0,2,0,0,0,0|2,0,0]=4 5425 B13R1.17 CCCNC(=O)c1ccc(cc1)I 11a_100020643023_100000187904 [0,2,0,0,0,0|2,0,0]=4 5426 B13R1.17 CCCNC(=O)c1ccc(cc1)I 1626a_100020643023_100000187904 [0,2,0,0,0,0|2,0,0]=4 5427 B13R1.17 CCCNC(=O)c1ccc(cc1)I 240690a_100020643023_100000187904 [0,2,0,0,0,0|2,0,0]=4 5428 B13R1.17 CCCNC(=O)c1ccc(cc1)I 527a_100020643023_100000187904 [0,2,0,0,0,0|2,0,0]=4 5429 B13R1.17 CCCNC(=O)c1ccc(cc1)O 240690a_100020643023_100000212099 [0,2,0,0,0,0|1,0,0]=3 5430 B13R1.17 CCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000152267 [0,2,0,0,0,0|1,0,0]=3 5431 B13R1.17 CCCNC(=O)c1ccc(cc1)O 527a_100020643023_100000212099 [0,2,0,0,0,0|1,0,0]=3 5432 B13R1.17 CCCNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781247 [0,2,0,0,0,0|2,0,0]=4 5433 B13R1.17 CCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000161739 [0,2,0,0,0,0|2,0,0]=4 5434 B13R1.17 CCNCC(=O)c1ccc(cc1)C 2230a_100015525214_100000211441 [0,2,0,0,0,0|2,0,0]=4 5435 B13R1.17 CCNN=C(C)c1ccc(cc1)O 4a_100000756455_100000185113 [0,2,0,0,0,0|2,0,0]=4 5436 B13R1.17 CCNNC(=O)c1ccc(cc1)Br 22a_100000756455_100000185839 [0,2,0,0,0,0|2,0,0]=4 5437 B13R1.17 CCNNC(=O)c1ccc(cc1)C 22a_100000756455_100000188618 [0,2,0,0,0,0|2,0,0]=4 5438 B13R1.17 CCNNC(=O)c1ccc(cc1)Cl 22a_100000756455_100000210187 [0,2,0,0,0,0|2,0,0]=4 5439 B13R1.17 CCNNC(=O)c1ccc(cc1)F 22a_100000756455_100000187176 [0,2,0,0,0,0|2,0,0]=4 5440 B13R1.17 CCNNC(=O)c1ccc(cc1)I 22a_100000756455_100000187904 [0,2,0,0,0,0|2,0,0]=4 5441 B13R1.17 CCNNC(=O)c1ccc(cc1)O 22a_100000756455_100000212099 [0,2,0,0,0,0|1,0,0]=3 5442 B13R1.17 CCOCC(=O)c1ccc(cc1)Br 34a_100121572206_100000188085 [0,2,0,0,0,0|1,0,0]=3 5443 B13R1.17 CCOCC(=O)c1ccc(cc1)C 34a_100121572206_100000211441 [0,2,0,0,0,0|1,0,0]=3 5444 B13R1.17 CCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210202 [0,2,0,0,0,0|1,0,0]=3 5445 B13R1.17 CCOCC(=O)c1ccc(cc1)I 34a_100121572206_100011216261 [0,2,0,0,0,0|1,0,0]=3 5446 B13R1.17 CCOCC(=O)c1ccc(cc1)O 34a_100121572206_100009814261 [0,2,0,0,0,0|0,0,0]=2 5447 B13R1.17 CCOCN(C)c1ccc(cc1)O 269982a_100000182112_100000739092 [0,2,0,0,0,0|2,0,0]=4 5448 B13R1.17 CCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210202 [0,2,0,0,0,0|1,1,0]=4 5449 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000210202_100000211441 [0,2,0,0,0,0|1,1,0]=4 5450 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210202 [0,2,0,0,0,0|1,1,0]=4 5451 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000210202_100000211071 [0,2,0,0,0,0|1,1,0]=4 5452 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210202 [0,2,0,0,0,0|1,1,0]=4 5453 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000210202_100000211279 [0,2,0,0,0,0|1,1,0]=4 5454 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210202 [0,2,0,0,0,0|1,1,0]=4 5455 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100000210202_100011216261 [0,2,0,0,0,0|1,1,0]=4 5456 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210202 [0,2,0,0,0,0|1,1,0]=4 5457 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100000210202_100009814261 [0,2,0,0,0,0|0,1,0]=3 5458 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210202 [0,2,0,0,0,0|0,1,0]=3 5459 B13R1.17 CNCCC(=O)c1ccc(cc1)Br 7a_106832991635_100011215963 [0,2,0,0,0,0|2,0,0]=4 5460 B13R1.17 CNCCC(=O)c1ccc(cc1)C 2230a_106832991635_100000701375 [0,2,0,0,0,0|2,0,0]=4 5461 B13R1.17 CNCCC(=O)c1ccc(cc1)C 7a_106832991635_100000701375 [0,2,0,0,0,0|2,0,0]=4 5462 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl 7a_106832991635_100011216492 [0,2,0,0,0,0|2,0,0]=4 5463 B13R1.17 CNCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211231 [0,2,0,0,0,0|2,0,0]=4 5464 B13R1.17 CNCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211231 [0,2,0,0,0,0|2,0,0]=4 5465 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [0,2,0,0,0,0|1,0,0]=3 5466 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [0,2,0,0,0,0|1,0,0]=3 5467 B13R1.17 COCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000233755 [0,2,0,0,0,0|1,0,0]=3 5468 B13R1.17 COCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000233755 [0,2,0,0,0,0|1,0,0]=3 5469 B13R1.17 COCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000233755 [0,2,0,0,0,0|1,0,0]=3 5470 B13R1.17 COCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000233755 [0,2,0,0,0,0|1,0,0]=3 5471 B13R1.17 COCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000233755 [0,2,0,0,0,0|1,0,0]=3 5472 B13R1.17 COCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000233755 [0,2,0,0,0,0|0,0,0]=2 5473 B13R1.17 COCCN(C)c1ccc(cc1)O 269982a_100000182112_100000233755 [0,2,0,0,0,0|2,0,0]=4 5474 B13R1.17 COCCN(C)c1ccc(cc1)O 34a_100000182112_100011201679 [0,2,0,0,0,0|2,0,0]=4 5475 B13R1.17 COCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000766300 [0,2,0,0,0,0|1,0,1]=4 5476 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000751147 [0,2,0,0,0,0|1,1,0]=4 5477 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_100011215963_200000210301 [0,2,0,0,0,0|1,1,0]=4 5478 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_200000210301_100011215963 [0,2,0,0,0,0|1,1,0]=4 5479 B13R1.17 CSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000751147 [0,2,0,0,0,0|1,1,0]=4 5480 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_100000701375_200000210301 [0,2,0,0,0,0|1,1,0]=4 5481 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_200000210301_100000701375 [0,2,0,0,0,0|1,1,0]=4 5482 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000751147 [0,2,0,0,0,0|1,1,0]=4 5483 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200000210301 [0,2,0,0,0,0|1,1,0]=4 5484 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_200000210301_100011216492 [0,2,0,0,0,0|1,1,0]=4 5485 B13R1.17 CSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000751147 [0,2,0,0,0,0|1,1,0]=4 5486 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_100000211231_200000210301 [0,2,0,0,0,0|1,1,0]=4 5487 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211231 [0,2,0,0,0,0|1,1,0]=4 5488 B13R1.17 CSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000751147 [0,2,0,0,0,0|1,1,0]=4 5489 B13R1.17 CSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000751147 [0,2,0,0,0,0|0,1,0]=3 5490 B13R1.17 CSCCC(=O)c1ccc(cc1)O 62a_200000210301_100009879949 [0,2,0,0,0,0|0,1,0]=3 5491 B13R1.17 Cc1ccc(cc1)C(=O)CCC#N 1458a_100000188618_100011215226 [0,2,0,0,0,0|2,0,0]=4 5492 B13R1.17 Cc1ccc(cc1)C(=O)CCCF 1458a_100000188618_100011934791 [0,2,0,0,0,0|2,0,0]=4 5493 B13R1.17 Cc1ccc(cc1)C(=O)CCCO 1458a_100000188618_100011215043 [0,2,0,0,0,0|2,0,0]=4 5494 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_100000701375_200025704644 [0,2,0,0,0,0|1,1,0]=4 5495 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_200025704644_100000701375 [0,2,0,0,0,0|1,1,0]=4 5496 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100000211441_100015361967 [0,2,0,0,0,0|1,1,0]=4 5497 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100015361967_100000211441 [0,2,0,0,0,0|1,1,0]=4 5498 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000188618 [0,2,0,0,0,0|2,0,0]=4 5499 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000188618 [0,2,0,0,0,0|2,0,0]=4 5500 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000188618 [0,2,0,0,0,0|2,0,0]=4 5501 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000188618 [0,2,0,0,0,0|2,0,0]=4 5502 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000188618 [0,2,0,0,0,0|2,0,0]=4 5503 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000188618 [0,2,0,0,0,0|2,0,0]=4 5504 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000188618 [0,2,0,0,0,0|2,0,0]=4 5505 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000188618 [0,2,0,0,0,0|2,0,0]=4 5506 B13R1.17 N#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215226 [0,2,0,0,0,0|2,0,0]=4 5507 B13R1.17 N#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215226 [0,2,0,0,0,0|2,0,0]=4 5508 B13R1.17 N#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215226 [0,2,0,0,0,0|2,0,0]=4 5509 B13R1.17 N#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215226 [0,2,0,0,0,0|2,0,0]=4 5510 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215226 [0,2,0,0,0,0|1,0,0]=3 5511 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100000689336 [0,2,0,0,0,0|1,0,0]=3 5512 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 1626a_100000734998_100000185839 [0,2,0,0,0,0|2,0,0]=4 5513 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 527a_100000734998_100000185839 [0,2,0,0,0,0|2,0,0]=4 5514 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 1626a_100000734998_100000210187 [0,2,0,0,0,0|2,0,0]=4 5515 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 527a_100000734998_100000210187 [0,2,0,0,0,0|2,0,0]=4 5516 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 1626a_100000734998_100000187176 [0,2,0,0,0,0|2,0,0]=4 5517 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 527a_100000734998_100000187176 [0,2,0,0,0,0|2,0,0]=4 5518 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 1626a_100000734998_100000187904 [0,2,0,0,0,0|2,0,0]=4 5519 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 527a_100000734998_100000187904 [0,2,0,0,0,0|2,0,0]=4 5520 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000752546 [0,2,0,0,0,0|1,0,0]=3 5521 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 527a_100000734998_100000212099 [0,2,0,0,0,0|1,0,0]=3 5522 B13R1.17 O=C(CCCF)c1ccc(cc1)Br 1458a_100000185839_100011934791 [0,2,0,0,0,0|2,0,0]=4 5523 B13R1.17 O=C(CCCF)c1ccc(cc1)Cl 1458a_100000210187_100011934791 [0,2,0,0,0,0|2,0,0]=4 5524 B13R1.17 O=C(CCCF)c1ccc(cc1)F 1458a_100000187176_100011934791 [0,2,0,0,0,0|2,0,0]=4 5525 B13R1.17 O=C(CCCF)c1ccc(cc1)I 1458a_100000187904_100011934791 [0,2,0,0,0,0|2,0,0]=4 5526 B13R1.17 O=C(CCCF)c1ccc(cc1)O 1458a_100000212099_100011934791 [0,2,0,0,0,0|1,0,0]=3 5527 B13R1.17 O=C(CCCO)c1ccc(cc1)Br 1458a_100000185839_100011215043 [0,2,0,0,0,0|2,0,0]=4 5528 B13R1.17 O=C(CCCO)c1ccc(cc1)Cl 1458a_100000210187_100011215043 [0,2,0,0,0,0|2,0,0]=4 5529 B13R1.17 O=C(CCCO)c1ccc(cc1)F 1458a_100000187176_100011215043 [0,2,0,0,0,0|2,0,0]=4 5530 B13R1.17 O=C(CCCO)c1ccc(cc1)I 1458a_100000187904_100011215043 [0,2,0,0,0,0|2,0,0]=4 5531 B13R1.17 O=C(CCCO)c1ccc(cc1)O 1458a_100000212099_100011215043 [0,2,0,0,0,0|1,0,0]=3 5532 B13R1.17 O=C(COCF)c1ccc(cc1)F 34a_100000246311_100015361967 [0,2,0,0,0,0|1,0,0]=3 5533 B13R1.17 O=C(CSCF)c1ccc(cc1)Br 62a_100000188085_100015361967 [0,2,0,0,0,0|1,1,0]=4 5534 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100000211071_100015361967 [0,2,0,0,0,0|1,1,0]=4 5535 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100015361967_100000211071 [0,2,0,0,0,0|1,1,0]=4 5536 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100000211279_100015361967 [0,2,0,0,0,0|1,1,0]=4 5537 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100015361967_100000211279 [0,2,0,0,0,0|1,1,0]=4 5538 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100011216261_100015361967 [0,2,0,0,0,0|1,1,0]=4 5539 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100015361967_100011216261 [0,2,0,0,0,0|1,1,0]=4 5540 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100009814261_100015361967 [0,2,0,0,0,0|0,1,0]=3 5541 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100015361967_100009814261 [0,2,0,0,0,0|0,1,0]=3 5542 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 11a_100000724931_100000185839 [0,2,0,0,0,0|2,0,0]=4 5543 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 1626a_100000724931_100000185839 [0,2,0,0,0,0|2,0,0]=4 5544 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 240690a_100000724931_100000185839 [0,2,0,0,0,0|2,0,0]=4 5545 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 527a_100000724931_100000185839 [0,2,0,0,0,0|2,0,0]=4 5546 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 11a_100000724931_100000210187 [0,2,0,0,0,0|2,0,0]=4 5547 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 1626a_100000724931_100000210187 [0,2,0,0,0,0|2,0,0]=4 5548 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 240690a_100000724931_100000210187 [0,2,0,0,0,0|2,0,0]=4 5549 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 527a_100000724931_100000210187 [0,2,0,0,0,0|2,0,0]=4 5550 B13R1.17 O=C(NCCF)c1ccc(cc1)F 11a_100000724931_100000187176 [0,2,0,0,0,0|2,0,0]=4 5551 B13R1.17 O=C(NCCF)c1ccc(cc1)F 1626a_100000724931_100000187176 [0,2,0,0,0,0|2,0,0]=4 5552 B13R1.17 O=C(NCCF)c1ccc(cc1)F 240690a_100000724931_100000187176 [0,2,0,0,0,0|2,0,0]=4 5553 B13R1.17 O=C(NCCF)c1ccc(cc1)F 527a_100000724931_100000187176 [0,2,0,0,0,0|2,0,0]=4 5554 B13R1.17 O=C(NCCF)c1ccc(cc1)I 11a_100000724931_100000187904 [0,2,0,0,0,0|2,0,0]=4 5555 B13R1.17 O=C(NCCF)c1ccc(cc1)I 1626a_100000724931_100000187904 [0,2,0,0,0,0|2,0,0]=4 5556 B13R1.17 O=C(NCCF)c1ccc(cc1)I 240690a_100000724931_100000187904 [0,2,0,0,0,0|2,0,0]=4 5557 B13R1.17 O=C(NCCF)c1ccc(cc1)I 527a_100000724931_100000187904 [0,2,0,0,0,0|2,0,0]=4 5558 B13R1.17 O=C(NCCF)c1ccc(cc1)O 240690a_100000724931_100000212099 [0,2,0,0,0,0|1,0,0]=3 5559 B13R1.17 O=C(NCCF)c1ccc(cc1)O 527a_100000724931_100000212099 [0,2,0,0,0,0|1,0,0]=3 5560 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 240690a_100000210304_100000185839 [0,2,0,0,0,0|2,0,0]=4 5561 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 527a_100000210304_100000185839 [0,2,0,0,0,0|2,0,0]=4 5562 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 240690a_100000210304_100000210187 [0,2,0,0,0,0|2,0,0]=4 5563 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 527a_100000210304_100000210187 [0,2,0,0,0,0|2,0,0]=4 5564 B13R1.17 O=C(NCCO)c1ccc(cc1)F 240690a_100000210304_100000187176 [0,2,0,0,0,0|2,0,0]=4 5565 B13R1.17 O=C(NCCO)c1ccc(cc1)F 527a_100000210304_100000187176 [0,2,0,0,0,0|2,0,0]=4 5566 B13R1.17 O=C(NCCO)c1ccc(cc1)I 240690a_100000210304_100000187904 [0,2,0,0,0,0|2,0,0]=4 5567 B13R1.17 O=C(NCCO)c1ccc(cc1)I 527a_100000210304_100000187904 [0,2,0,0,0,0|2,0,0]=4 5568 B13R1.17 O=C(NCCO)c1ccc(cc1)O 240690a_100000210304_100000212099 [0,2,0,0,0,0|1,0,0]=3 5569 B13R1.17 O=C(NCCO)c1ccc(cc1)O 271570a_203496583355_200000158904 [0,2,0,0,0,0|1,0,0]=3 5570 B13R1.17 O=C(NCCO)c1ccc(cc1)O 527a_100000210304_100000212099 [0,2,0,0,0,0|1,0,0]=3 5571 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_100011215963_200025704644 [0,2,0,0,0,0|1,1,0]=4 5572 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_200025704644_100011215963 [0,2,0,0,0,0|1,1,0]=4 5573 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200025704644 [0,2,0,0,0,0|1,1,0]=4 5574 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_200025704644_100011216492 [0,2,0,0,0,0|1,1,0]=4 5575 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_100000211231_200025704644 [0,2,0,0,0,0|1,1,0]=4 5576 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211231 [0,2,0,0,0,0|1,1,0]=4 5577 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)O 62a_200025704644_100009879949 [0,2,0,0,0,0|0,1,0]=3 5578 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748629 [0,2,0,0,0,0|2,0,0]=4 5579 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000748629 [0,2,0,0,0,0|2,0,0]=4 5580 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748629 [0,2,0,0,0,0|2,0,0]=4 5581 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000748629 [0,2,0,0,0,0|2,0,0]=4 5582 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000748629 [0,2,0,0,0,0|2,0,0]=4 5583 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000748629 [0,2,0,0,0,0|1,0,0]=3 5584 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)O 1458a_100000212099_100009893438 [0,2,0,0,0,0|1,0,1]=4 5585 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000070787_100000188085 [0,2,0,0,0,0|2,0,0]=4 5586 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C 1458a_100000070787_100000211441 [0,2,0,0,0,0|2,0,0]=4 5587 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000070787_100000211071 [0,2,0,0,0,0|2,0,0]=4 5588 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)F 1458a_100000070787_100000211279 [0,2,0,0,0,0|2,0,0]=4 5589 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)I 1458a_100000070787_100011216261 [0,2,0,0,0,0|2,0,0]=4 5590 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 1458a_100000070787_100009814261 [0,2,0,0,0,0|1,0,0]=3 5591 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100000184285 [0,2,0,0,0,0|1,0,0]=3 5592 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210624 [0,2,0,0,0,0|2,0,0]=4 5593 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210624 [0,2,0,0,0,0|2,0,0]=4 5594 B13R1.132 CC(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000210624 [0,2,0,0,0,0|2,0,0]=4 5595 B13R1.132 CC(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000210624 [0,2,0,0,0,0|2,0,0]=4 5596 B13R1.132 CC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000210624 [0,2,0,0,0,0|1,0,0]=3 5597 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 11a_100138425928_100000185839 [0,2,0,0,0,0|2,0,0]=4 5598 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 1626a_100138425928_100000185839 [0,2,0,0,0,0|2,0,0]=4 5599 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 240690a_100138425928_100000185839 [0,2,0,0,0,0|2,0,0]=4 5600 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 527a_100138425928_100000185839 [0,2,0,0,0,0|2,0,0]=4 5601 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 11a_100138425928_100000210187 [0,2,0,0,0,0|2,0,0]=4 5602 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 1626a_100138425928_100000210187 [0,2,0,0,0,0|2,0,0]=4 5603 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 240690a_100138425928_100000210187 [0,2,0,0,0,0|2,0,0]=4 5604 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 527a_100138425928_100000210187 [0,2,0,0,0,0|2,0,0]=4 5605 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 11a_100138425928_100000187176 [0,2,0,0,0,0|2,0,0]=4 5606 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 1626a_100138425928_100000187176 [0,2,0,0,0,0|2,0,0]=4 5607 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 240690a_100138425928_100000187176 [0,2,0,0,0,0|2,0,0]=4 5608 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 527a_100138425928_100000187176 [0,2,0,0,0,0|2,0,0]=4 5609 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 11a_100138425928_100000187904 [0,2,0,0,0,0|2,0,0]=4 5610 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 1626a_100138425928_100000187904 [0,2,0,0,0,0|2,0,0]=4 5611 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 240690a_100138425928_100000187904 [0,2,0,0,0,0|2,0,0]=4 5612 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 527a_100138425928_100000187904 [0,2,0,0,0,0|2,0,0]=4 5613 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 240690a_100138425928_100000212099 [0,2,0,0,0,0|1,0,0]=3 5614 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 271570a_203496583355_200000152628 [0,2,0,0,0,0|1,0,0]=3 5615 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 527a_100138425928_100000212099 [0,2,0,0,0,0|1,0,0]=3 5616 B13R1.132 CC(C)NC(=O)c1ccc(nc1)O 271570a_203496583355_100000157566 [0,2,0,0,0,0|2,0,0]=4 5617 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011218427 [0,2,0,0,0,0|2,0,0]=4 5618 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011218427 [0,2,0,0,0,0|2,0,0]=4 5619 B13R1.132 CC(O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011218427 [0,2,0,0,0,0|2,0,0]=4 5620 B13R1.132 CC(O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011218427 [0,2,0,0,0,0|2,0,0]=4 5621 B13R1.132 CC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218427 [0,2,0,0,0,0|1,0,0]=3 5622 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Br 269982a_100102631434_100000188085 [0,2,0,0,0,0|2,0,0]=4 5623 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Cl 269982a_100102631434_100000211071 [0,2,0,0,0,0|2,0,0]=4 5624 B13R1.132 CN(C)CC(=O)c1ccc(cc1)F 269982a_100102631434_100000211279 [0,2,0,0,0,0|2,0,0]=4 5625 B13R1.132 CN(C)CC(=O)c1ccc(cc1)I 269982a_100102631434_100011216261 [0,2,0,0,0,0|2,0,0]=4 5626 B13R1.132 CN(C)CC(=O)c1ccc(cc1)O 269982a_100102631434_100009814261 [0,2,0,0,0,0|1,0,0]=3 5627 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)C 1458a_100000188618_100000210624 [0,2,0,0,0,0|2,0,0]=4 5628 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)O 1458a_100000188618_100011218427 [0,2,0,0,0,0|2,0,0]=4 5629 B13R1.132 Cc1ccc(cc1)C(=O)CC(F)F 1458a_100000188618_100011934356 [0,2,0,0,0,0|2,0,0]=4 5630 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100000211441 [0,2,0,0,0,0|2,0,0]=4 5631 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100000211441 [0,2,0,0,0,0|2,0,0]=4 5632 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 11a_100138425928_100000188618 [0,2,0,0,0,0|2,0,0]=4 5633 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 1626a_100138425928_100000188618 [0,2,0,0,0,0|2,0,0]=4 5634 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 240690a_100138425928_100000188618 [0,2,0,0,0,0|2,0,0]=4 5635 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 527a_100138425928_100000188618 [0,2,0,0,0,0|2,0,0]=4 5636 B13R1.132 NC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000187820 [0,2,0,0,0,0|1,0,1]=4 5637 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Br 1458a_100000185839_100011934356 [0,2,0,0,0,0|2,0,0]=4 5638 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Cl 1458a_100000210187_100011934356 [0,2,0,0,0,0|2,0,0]=4 5639 B13R1.132 O=C(CC(F)F)c1ccc(cc1)F 1458a_100000187176_100011934356 [0,2,0,0,0,0|2,0,0]=4 5640 B13R1.132 O=C(CC(F)F)c1ccc(cc1)I 1458a_100000187904_100011934356 [0,2,0,0,0,0|2,0,0]=4 5641 B13R1.132 O=C(CC(F)F)c1ccc(cc1)O 1458a_100000212099_100011934356 [0,2,0,0,0,0|1,0,0]=3 5642 B13R1.132 O=C(C[N+](=O)[O-])c1ccc(cc1)O 1458a_100000212099_100000761209 [0,2,0,0,0,0|2,0,0]=4 5643 B13R1.132 O=C([O-])CC(=O)c1ccc(cc1)O 1458a_100000212099_100020667443 [0,2,0,0,0,0|1,0,1]=4 5644 B13R1.466 C#CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000184674 [0,2,0,0,0,0|1,0,1]=4 5645 B13R1.466 C#CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000184674 [0,2,0,0,0,0|1,0,1]=4 5646 B13R1.466 C#CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000184674 [0,2,0,0,0,0|1,0,1]=4 5647 B13R1.466 C#CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000184674 [0,2,0,0,0,0|1,0,1]=4 5648 B13R1.466 C#CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000184674 [0,2,0,0,0,0|1,0,1]=4 5649 B13R1.466 C#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000184674 [0,2,0,0,0,0|1,0,1]=4 5650 B13R1.466 C=CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210623 [0,2,0,0,0,0|1,0,1]=4 5651 B13R1.466 C=CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210623 [0,2,0,0,0,0|1,0,1]=4 5652 B13R1.466 C=CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210623 [0,2,0,0,0,0|1,0,1]=4 5653 B13R1.466 C=CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210623 [0,2,0,0,0,0|1,0,1]=4 5654 B13R1.466 C=CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210623 [0,2,0,0,0,0|1,0,1]=4 5655 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210623 [0,2,0,0,0,0|1,0,1]=4 5656 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210303 [0,2,0,0,0,0|2,0,0]=4 5657 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210303 [0,2,0,0,0,0|2,0,0]=4 5658 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210303 [0,2,0,0,0,0|2,0,0]=4 5659 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210303 [0,2,0,0,0,0|2,0,0]=4 5660 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210303 [0,2,0,0,0,0|2,0,0]=4 5661 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210303 [0,2,0,0,0,0|1,0,0]=3 5662 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210303 [0,2,0,0,0,0|2,0,0]=4 5663 B13R1.466 CCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210303 [0,2,0,0,0,0|2,0,0]=4 5664 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210303 [0,2,0,0,0,0|2,0,0]=4 5665 B13R1.466 CCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210303 [0,2,0,0,0,0|2,0,0]=4 5666 B13R1.466 CCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210303 [0,2,0,0,0,0|2,0,0]=4 5667 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210303 [0,2,0,0,0,0|1,0,0]=3 5668 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012345043 [0,2,0,0,0,0|1,0,0]=3 5669 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210303 [0,2,0,0,0,0|2,0,0]=4 5670 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210303 [0,2,0,0,0,0|2,0,0]=4 5671 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210303 [0,2,0,0,0,0|2,0,0]=4 5672 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210303 [0,2,0,0,0,0|2,0,0]=4 5673 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210303 [0,2,0,0,0,0|2,0,0]=4 5674 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210303 [0,2,0,0,0,0|1,0,0]=3 5675 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210303 [0,2,0,0,0,0|2,0,0]=4 5676 B13R1.466 CCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210303 [0,2,0,0,0,0|2,0,0]=4 5677 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210303 [0,2,0,0,0,0|2,0,0]=4 5678 B13R1.466 CCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210303 [0,2,0,0,0,0|2,0,0]=4 5679 B13R1.466 CCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210303 [0,2,0,0,0,0|2,0,0]=4 5680 B13R1.466 CCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210303 [0,2,0,0,0,0|1,0,0]=3 5681 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210303 [0,2,0,0,0,0|2,0,0]=4 5682 B13R1.466 CCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210303 [0,2,0,0,0,0|2,0,0]=4 5683 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210303 [0,2,0,0,0,0|2,0,0]=4 5684 B13R1.466 CCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210303 [0,2,0,0,0,0|2,0,0]=4 5685 B13R1.466 CCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210303 [0,2,0,0,0,0|2,0,0]=4 5686 B13R1.466 CCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210303 [0,2,0,0,0,0|1,0,0]=3 5687 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210303 [0,2,0,0,0,0|2,0,0]=4 5688 B13R1.466 CCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210303 [0,2,0,0,0,0|2,0,0]=4 5689 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210303 [0,2,0,0,0,0|2,0,0]=4 5690 B13R1.466 CCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210303 [0,2,0,0,0,0|2,0,0]=4 5691 B13R1.466 CCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210303 [0,2,0,0,0,0|2,0,0]=4 5692 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [0,2,0,0,0,0|1,0,0]=3 5693 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 11a_100015525214_100012339404 [0,2,0,0,0,0|2,0,0]=4 5694 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 240690a_100015525214_100012339404 [0,2,0,0,0,0|2,0,0]=4 5695 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 527a_100015525214_100012339404 [0,2,0,0,0,0|2,0,0]=4 5696 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 11a_100015525214_100000186397 [0,2,0,0,0,0|2,0,0]=4 5697 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 240690a_100015525214_100000186397 [0,2,0,0,0,0|2,0,0]=4 5698 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 527a_100015525214_100000186397 [0,2,0,0,0,0|2,0,0]=4 5699 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 11a_100015525214_100000691181 [0,2,0,0,0,0|2,0,0]=4 5700 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100015525214_100000691181 [0,2,0,0,0,0|2,0,0]=4 5701 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100015525214_100000691181 [0,2,0,0,0,0|2,0,0]=4 5702 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 11a_100015525214_100000760357 [0,2,0,0,0,0|2,0,0]=4 5703 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 240690a_100015525214_100000760357 [0,2,0,0,0,0|2,0,0]=4 5704 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 527a_100015525214_100000760357 [0,2,0,0,0,0|2,0,0]=4 5705 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 11a_100015525214_100000739115 [0,2,0,0,0,0|2,0,0]=4 5706 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 240690a_100015525214_100000739115 [0,2,0,0,0,0|2,0,0]=4 5707 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 527a_100015525214_100000739115 [0,2,0,0,0,0|2,0,0]=4 5708 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)O 240690a_100015525214_100000189672 [0,2,0,0,0,0|1,0,0]=3 5709 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 11a_100015525214_100000692631 [0,2,0,0,0,0|2,0,0]=4 5710 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 240690a_100015525214_100000692631 [0,2,0,0,0,0|2,0,0]=4 5711 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 527a_100015525214_100000692631 [0,2,0,0,0,0|2,0,0]=4 5712 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 11a_100015525214_100000210898 [0,2,0,0,0,0|2,0,0]=4 5713 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 240690a_100015525214_100000210898 [0,2,0,0,0,0|2,0,0]=4 5714 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 527a_100015525214_100000210898 [0,2,0,0,0,0|2,0,0]=4 5715 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 11a_100015525214_100000686306 [0,2,0,0,0,0|2,0,0]=4 5716 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 240690a_100015525214_100000686306 [0,2,0,0,0,0|2,0,0]=4 5717 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 527a_100015525214_100000686306 [0,2,0,0,0,0|2,0,0]=4 5718 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 11a_100015525214_100000751819 [0,2,0,0,0,0|2,0,0]=4 5719 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 240690a_100015525214_100000751819 [0,2,0,0,0,0|2,0,0]=4 5720 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 527a_100015525214_100000751819 [0,2,0,0,0,0|2,0,0]=4 5721 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 11a_100015525214_100000751300 [0,2,0,0,0,0|2,0,0]=4 5722 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 240690a_100015525214_100000751300 [0,2,0,0,0,0|2,0,0]=4 5723 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 527a_100015525214_100000751300 [0,2,0,0,0,0|2,0,0]=4 5724 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 240690a_100015525214_100000685612 [0,2,0,0,0,0|1,0,0]=3 5725 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357431 [0,2,0,0,0,0|1,0,0]=3 5726 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 11a_100015525214_100000687082 [0,2,0,0,0,0|2,0,0]=4 5727 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100015525214_100000687082 [0,2,0,0,0,0|2,0,0]=4 5728 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100015525214_100000687082 [0,2,0,0,0,0|2,0,0]=4 5729 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 11a_100015525214_100000751740 [0,2,0,0,0,0|2,0,0]=4 5730 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 240690a_100015525214_100000751740 [0,2,0,0,0,0|2,0,0]=4 5731 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 527a_100015525214_100000751740 [0,2,0,0,0,0|2,0,0]=4 5732 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100015525214_100000210401 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100015525214_100000210401 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100015525214_100000210401 [0,2,0,0,0,0|2,0,0]=4 5735 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 11a_100015525214_100000686462 [0,2,0,0,0,0|2,0,0]=4 5736 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 240690a_100015525214_100000686462 [0,2,0,0,0,0|2,0,0]=4 5737 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 527a_100015525214_100000686462 [0,2,0,0,0,0|2,0,0]=4 5738 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 11a_100015525214_100000684831 [0,2,0,0,0,0|2,0,0]=4 5739 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 240690a_100015525214_100000684831 [0,2,0,0,0,0|2,0,0]=4 5740 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 527a_100015525214_100000684831 [0,2,0,0,0,0|2,0,0]=4 5741 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100015525214_100000212196 [0,2,0,0,0,0|1,0,0]=3 5742 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 527a_100015525214_100000212196 [0,2,0,0,0,0|1,0,0]=3 5743 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 11a_100015525214_100000743946 [0,2,0,0,0,0|2,0,0]=4 5744 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 240690a_100015525214_100000743946 [0,2,0,0,0,0|2,0,0]=4 5745 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 527a_100015525214_100000743946 [0,2,0,0,0,0|2,0,0]=4 5746 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 11a_100015525214_100000212313 [0,2,0,0,0,0|2,0,0]=4 5747 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 240690a_100015525214_100000212313 [0,2,0,0,0,0|2,0,0]=4 5748 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 527a_100015525214_100000212313 [0,2,0,0,0,0|2,0,0]=4 5749 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 11a_100015525214_100000743183 [0,2,0,0,0,0|2,0,0]=4 5750 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 240690a_100015525214_100000743183 [0,2,0,0,0,0|2,0,0]=4 5751 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 527a_100015525214_100000743183 [0,2,0,0,0,0|2,0,0]=4 5752 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 11a_100015525214_100000209822 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 240690a_100015525214_100000209822 [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 527a_100015525214_100000209822 [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 11a_100015525214_100000062624 [0,2,0,0,0,0|2,0,0]=4 5756 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 240690a_100015525214_100000062624 [0,2,0,0,0,0|2,0,0]=4 5757 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 527a_100015525214_100000062624 [0,2,0,0,0,0|2,0,0]=4 5758 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 240690a_100015525214_100000185466 [0,2,0,0,0,0|1,0,0]=3 5759 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 527a_100015525214_100000185466 [0,2,0,0,0,0|1,0,0]=3 5760 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 11a_100015525214_100012343876 [0,2,0,0,0,0|2,0,0]=4 5761 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 240690a_100015525214_100012343876 [0,2,0,0,0,0|2,0,0]=4 5762 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 527a_100015525214_100012343876 [0,2,0,0,0,0|2,0,0]=4 5763 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 11a_100015525214_100000751299 [0,2,0,0,0,0|2,0,0]=4 5764 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 240690a_100015525214_100000751299 [0,2,0,0,0,0|2,0,0]=4 5765 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 527a_100015525214_100000751299 [0,2,0,0,0,0|2,0,0]=4 5766 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 11a_100015525214_100000739381 [0,2,0,0,0,0|2,0,0]=4 5767 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 240690a_100015525214_100000739381 [0,2,0,0,0,0|2,0,0]=4 5768 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 527a_100015525214_100000739381 [0,2,0,0,0,0|2,0,0]=4 5769 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 11a_100015525214_100000688015 [0,2,0,0,0,0|2,0,0]=4 5770 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 240690a_100015525214_100000688015 [0,2,0,0,0,0|2,0,0]=4 5771 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 527a_100015525214_100000688015 [0,2,0,0,0,0|2,0,0]=4 5772 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 11a_100015525214_100000725830 [0,2,0,0,0,0|2,0,0]=4 5773 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 240690a_100015525214_100000725830 [0,2,0,0,0,0|2,0,0]=4 5774 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 527a_100015525214_100000725830 [0,2,0,0,0,0|2,0,0]=4 5775 B13R1.466 CCNC(=O)c1ccc(c(c1)I)O 240690a_100015525214_100000037485 [0,2,0,0,0,0|1,0,0]=3 5776 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 240690a_100015525214_100000689001 [0,2,0,0,0,0|2,0,0]=4 5777 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 527a_100015525214_100000689001 [0,2,0,0,0,0|2,0,0]=4 5778 B13R1.466 CCNC(=O)c1ccc(c(c1)O)C 240690a_100015525214_100000233767 [0,2,0,0,0,0|2,0,0]=4 5779 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100015525214_100011933997 [0,2,0,0,0,0|2,0,0]=4 5780 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 527a_100015525214_100011933997 [0,2,0,0,0,0|2,0,0]=4 5781 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 240690a_100015525214_100000035894 [0,2,0,0,0,0|2,0,0]=4 5782 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359900 [0,2,0,0,0,0|2,0,0]=4 5783 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 527a_100015525214_100000035894 [0,2,0,0,0,0|2,0,0]=4 5784 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 240690a_100015525214_100000239334 [0,2,0,0,0,0|2,0,0]=4 5785 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 527a_100015525214_100000239334 [0,2,0,0,0,0|2,0,0]=4 5786 B13R1.466 CCOC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100009880029 [0,2,0,0,0,0|2,0,0]=4 5787 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294787 [0,2,0,0,0,0|0,0,0]=2 5788 B13R1.466 CCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100012229600 [0,2,0,0,0,0|0,0,0]=2 5789 B13R1.466 CCOC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_200012351148 [0,2,0,0,0,0|0,0,0]=2 5790 B13R1.466 CCOC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100011533738 [0,2,0,0,0,0|0,0,0]=2 5791 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O 271570a_203496583355_200011450955 [0,2,0,0,0,0|0,0,0]=2 5792 B13R1.466 CCOC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100012359631 [0,2,0,0,0,0|1,0,0]=3 5793 B13R1.466 CCOC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011934563 [0,2,0,0,0,0|1,0,0]=3 5794 B13R1.466 CCOC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100161115259 [0,2,0,0,0,0|1,0,0]=3 5795 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [0,2,0,0,0,0|0,0,0]=2 5796 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [0,2,0,0,0,0|0,0,0]=2 5797 B13R1.466 CCOC(=O)c1ccc(c(n1)O)C 271570a_203496583355_200009853511 [0,2,0,0,0,0|2,0,0]=4 5798 B13R1.466 CCOC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189761 [0,2,0,0,0,0|1,0,0]=3 5799 B13R1.466 CCOC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816805 [0,2,0,0,0,0|2,0,0]=4 5800 B13R1.466 CCOC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010004467 [0,2,0,0,0,0|1,0,0]=3 5801 B13R1.466 CCOC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010179890 [0,2,0,0,0,0|1,0,0]=3 5802 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 2230a_106832991635_100012346676 [0,2,0,0,0,0|2,0,0]=4 5803 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 34a_100102657272_100012346676 [0,2,0,0,0,0|2,0,0]=4 5804 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 7a_106832991635_100012346676 [0,2,0,0,0,0|2,0,0]=4 5805 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 2230a_106832991635_100011217175 [0,2,0,0,0,0|2,0,0]=4 5806 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 34a_100102657272_100011217175 [0,2,0,0,0,0|2,0,0]=4 5807 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 7a_106832991635_100011217175 [0,2,0,0,0,0|2,0,0]=4 5808 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 2230a_106832991635_100000183365 [0,2,0,0,0,0|2,0,0]=4 5809 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 7a_106832991635_100000183365 [0,2,0,0,0,0|2,0,0]=4 5810 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl 7a_106832991635_200011216723 [0,2,0,0,0,0|2,0,0]=4 5811 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 2230a_106832991635_200012349649 [0,2,0,0,0,0|2,0,0]=4 5812 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 34a_100102657272_200012349649 [0,2,0,0,0,0|2,0,0]=4 5813 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100000211430 [0,2,0,0,0,0|2,0,0]=4 5814 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100000211430 [0,2,0,0,0,0|2,0,0]=4 5815 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 2230a_106832991635_100000757878 [0,2,0,0,0,0|2,0,0]=4 5816 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 34a_100102657272_100000757878 [0,2,0,0,0,0|2,0,0]=4 5817 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 7a_106832991635_100000757878 [0,2,0,0,0,0|2,0,0]=4 5818 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)O 7a_106832991635_200010170092 [0,2,0,0,0,0|1,0,0]=3 5819 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 2230a_106832991635_100012361357 [0,2,0,0,0,0|2,0,0]=4 5820 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 34a_100102657272_100012361357 [0,2,0,0,0,0|2,0,0]=4 5821 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 7a_106832991635_100012361357 [0,2,0,0,0,0|2,0,0]=4 5822 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 2230a_106832991635_100011219196 [0,2,0,0,0,0|2,0,0]=4 5823 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 34a_100102657272_100011219196 [0,2,0,0,0,0|2,0,0]=4 5824 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 7a_106832991635_100011219196 [0,2,0,0,0,0|2,0,0]=4 5825 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 2230a_106832991635_100012351892 [0,2,0,0,0,0|2,0,0]=4 5826 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 34a_100102657272_100012351892 [0,2,0,0,0,0|2,0,0]=4 5827 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 7a_106832991635_100012351892 [0,2,0,0,0,0|2,0,0]=4 5828 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 2230a_106832991635_100000183380 [0,2,0,0,0,0|2,0,0]=4 5829 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 34a_100102657272_100000183380 [0,2,0,0,0,0|2,0,0]=4 5830 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 7a_106832991635_100000183380 [0,2,0,0,0,0|2,0,0]=4 5831 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [0,2,0,0,0,0|1,0,0]=3 5832 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Br 22a_100016993582_100012339404 [0,2,0,0,0,0|2,0,0]=4 5833 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)C 22a_100016993582_100000186397 [0,2,0,0,0,0|2,0,0]=4 5834 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Cl 22a_100016993582_100000691181 [0,2,0,0,0,0|2,0,0]=4 5835 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)F 22a_100016993582_100000760357 [0,2,0,0,0,0|2,0,0]=4 5836 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)I 22a_100016993582_100000739115 [0,2,0,0,0,0|2,0,0]=4 5837 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)O 22a_100016993582_100000189672 [0,2,0,0,0,0|1,0,0]=3 5838 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Br 22a_100016993582_100000692631 [0,2,0,0,0,0|2,0,0]=4 5839 B13R1.466 CNNC(=O)c1ccc(c(c1)C)C 22a_100016993582_100000210898 [0,2,0,0,0,0|2,0,0]=4 5840 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Cl 22a_100016993582_100000686306 [0,2,0,0,0,0|2,0,0]=4 5841 B13R1.466 CNNC(=O)c1ccc(c(c1)C)F 22a_100016993582_100000751819 [0,2,0,0,0,0|2,0,0]=4 5842 B13R1.466 CNNC(=O)c1ccc(c(c1)C)I 22a_100016993582_100000751300 [0,2,0,0,0,0|2,0,0]=4 5843 B13R1.466 CNNC(=O)c1ccc(c(c1)C)O 22a_100016993582_100000685612 [0,2,0,0,0,0|1,0,0]=3 5844 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Br 22a_100016993582_100000687082 [0,2,0,0,0,0|2,0,0]=4 5845 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)C 22a_100016993582_100000751740 [0,2,0,0,0,0|2,0,0]=4 5846 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100016993582_100000210401 [0,2,0,0,0,0|2,0,0]=4 5847 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)F 22a_100016993582_100000686462 [0,2,0,0,0,0|2,0,0]=4 5848 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)I 22a_100016993582_100000684831 [0,2,0,0,0,0|2,0,0]=4 5849 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)O 22a_100016993582_100000212196 [0,2,0,0,0,0|1,0,0]=3 5850 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Br 22a_100016993582_100000743946 [0,2,0,0,0,0|2,0,0]=4 5851 B13R1.466 CNNC(=O)c1ccc(c(c1)F)C 22a_100016993582_100000212313 [0,2,0,0,0,0|2,0,0]=4 5852 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Cl 22a_100016993582_100000743183 [0,2,0,0,0,0|2,0,0]=4 5853 B13R1.466 CNNC(=O)c1ccc(c(c1)F)F 22a_100016993582_100000209822 [0,2,0,0,0,0|2,0,0]=4 5854 B13R1.466 CNNC(=O)c1ccc(c(c1)F)I 22a_100016993582_100000062624 [0,2,0,0,0,0|2,0,0]=4 5855 B13R1.466 CNNC(=O)c1ccc(c(c1)F)O 22a_100016993582_100000185466 [0,2,0,0,0,0|1,0,0]=3 5856 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Br 22a_100016993582_100012343876 [0,2,0,0,0,0|2,0,0]=4 5857 B13R1.466 CNNC(=O)c1ccc(c(c1)I)C 22a_100016993582_100000751299 [0,2,0,0,0,0|2,0,0]=4 5858 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Cl 22a_100016993582_100000739381 [0,2,0,0,0,0|2,0,0]=4 5859 B13R1.466 CNNC(=O)c1ccc(c(c1)I)F 22a_100016993582_100000688015 [0,2,0,0,0,0|2,0,0]=4 5860 B13R1.466 CNNC(=O)c1ccc(c(c1)I)I 22a_100016993582_100000725830 [0,2,0,0,0,0|2,0,0]=4 5861 B13R1.466 CNNC(=O)c1ccc(c(c1)I)O 22a_100016993582_100000037485 [0,2,0,0,0,0|1,0,0]=3 5862 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Br 22a_100016993582_100000689001 [0,2,0,0,0,0|2,0,0]=4 5863 B13R1.466 CNNC(=O)c1ccc(c(c1)O)C 22a_100016993582_100000233767 [0,2,0,0,0,0|2,0,0]=4 5864 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Cl 22a_100016993582_100011933997 [0,2,0,0,0,0|2,0,0]=4 5865 B13R1.466 CNNC(=O)c1ccc(c(c1)O)F 22a_100016993582_100000035894 [0,2,0,0,0,0|2,0,0]=4 5866 B13R1.466 CNNC(=O)c1ccc(c(c1)O)I 22a_100016993582_100000239334 [0,2,0,0,0,0|2,0,0]=4 5867 B13R1.466 COCC(=O)c1ccc(c(c1)Br)C 34a_100138415774_100012346676 [0,2,0,0,0,0|1,0,0]=3 5868 B13R1.466 COCC(=O)c1ccc(c(c1)Br)F 34a_100138415774_100011217175 [0,2,0,0,0,0|1,0,0]=3 5869 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)Br 34a_100138415774_200012349649 [0,2,0,0,0,0|1,0,0]=3 5870 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200000210301 [0,2,0,0,0,0|1,0,0]=3 5871 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)F 34a_100138415774_100000757878 [0,2,0,0,0,0|1,0,0]=3 5872 B13R1.466 COCC(=O)c1ccc(c(c1)F)Br 34a_100138415774_100012361357 [0,2,0,0,0,0|1,0,0]=3 5873 B13R1.466 COCC(=O)c1ccc(c(c1)F)C 34a_100138415774_100011219196 [0,2,0,0,0,0|1,0,0]=3 5874 B13R1.466 COCC(=O)c1ccc(c(c1)F)Cl 34a_100138415774_100012351892 [0,2,0,0,0,0|1,0,0]=3 5875 B13R1.466 COCC(=O)c1ccc(c(c1)F)F 34a_100138415774_100000183380 [0,2,0,0,0,0|1,0,0]=3 5876 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)C 62a_100012346676_200000210301 [0,2,0,0,0,0|1,1,0]=4 5877 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)C 62a_200000210301_100012346676 [0,2,0,0,0,0|1,1,0]=4 5878 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)F 62a_100011217175_200000210301 [0,2,0,0,0,0|1,1,0]=4 5879 B13R1.466 CSCC(=O)c1ccc(c(c1)Br)F 62a_200000210301_100011217175 [0,2,0,0,0,0|1,1,0]=4 5880 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_100000183365_200000210301 [0,2,0,0,0,0|1,1,0]=4 5881 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_200000210301_100000183365 [0,2,0,0,0,0|1,1,0]=4 5882 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200000210301_200011216723 [0,2,0,0,0,0|1,1,0]=4 5883 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_200000210301 [0,2,0,0,0,0|1,1,0]=4 5884 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Br 62a_200000210301_200012349649 [0,2,0,0,0,0|1,1,0]=4 5885 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Br 62a_200012349649_200000210301 [0,2,0,0,0,0|1,1,0]=4 5886 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200000210301 [0,2,0,0,0,0|1,1,0]=4 5887 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_200000210301_100000211430 [0,2,0,0,0,0|1,1,0]=4 5888 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)F 62a_100000757878_200000210301 [0,2,0,0,0,0|1,1,0]=4 5889 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)F 62a_200000210301_100000757878 [0,2,0,0,0,0|1,1,0]=4 5890 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200000210301_200010170092 [0,2,0,0,0,0|0,1,0]=3 5891 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200000210301 [0,2,0,0,0,0|0,1,0]=3 5892 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Br 62a_100012361357_200000210301 [0,2,0,0,0,0|1,1,0]=4 5893 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Br 62a_200000210301_100012361357 [0,2,0,0,0,0|1,1,0]=4 5894 B13R1.466 CSCC(=O)c1ccc(c(c1)F)C 62a_100011219196_200000210301 [0,2,0,0,0,0|1,1,0]=4 5895 B13R1.466 CSCC(=O)c1ccc(c(c1)F)C 62a_200000210301_100011219196 [0,2,0,0,0,0|1,1,0]=4 5896 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200000210301 [0,2,0,0,0,0|1,1,0]=4 5897 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_200000210301_100012351892 [0,2,0,0,0,0|1,1,0]=4 5898 B13R1.466 CSCC(=O)c1ccc(c(c1)F)F 62a_100000183380_200000210301 [0,2,0,0,0,0|1,1,0]=4 5899 B13R1.466 CSCC(=O)c1ccc(c(c1)F)F 62a_200000210301_100000183380 [0,2,0,0,0,0|1,1,0]=4 5900 B13R1.466 CSCC(=O)c1ccc(c(c1)O)O 62a_200000210301_100000183813 [0,2,0,0,0,0|0,1,0]=3 5901 B13R1.466 Cc1cc(ccc1Br)C(=O)CCF 1458a_100000692631_100011217306 [0,2,0,0,0,0|2,0,0]=4 5902 B13R1.466 Cc1cc(ccc1Br)C(=O)CCO 1458a_100000692631_100000211926 [0,2,0,0,0,0|2,0,0]=4 5903 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCF 1458a_100000686306_100011217306 [0,2,0,0,0,0|2,0,0]=4 5904 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCO 1458a_100000686306_100000211926 [0,2,0,0,0,0|2,0,0]=4 5905 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200011216723_200025704644 [0,2,0,0,0,0|1,1,0]=4 5906 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200025704644_200011216723 [0,2,0,0,0,0|1,1,0]=4 5907 B13R1.466 Cc1cc(ccc1F)C(=O)CCF 1458a_100000751819_100011217306 [0,2,0,0,0,0|2,0,0]=4 5908 B13R1.466 Cc1cc(ccc1F)C(=O)CCO 1458a_100000751819_100000211926 [0,2,0,0,0,0|2,0,0]=4 5909 B13R1.466 Cc1cc(ccc1I)C(=O)CCF 1458a_100000751300_100011217306 [0,2,0,0,0,0|2,0,0]=4 5910 B13R1.466 Cc1cc(ccc1I)C(=O)CCO 1458a_100000751300_100000211926 [0,2,0,0,0,0|2,0,0]=4 5911 B13R1.466 Cc1cc(ccc1O)C(=O)CC#N 1458a_100000685612_100011214920 [0,2,0,0,0,0|1,0,1]=4 5912 B13R1.466 Cc1cc(ccc1O)C(=O)CCF 1458a_100000685612_100011217306 [0,2,0,0,0,0|1,0,0]=3 5913 B13R1.466 Cc1cc(ccc1O)C(=O)CCO 1458a_100000685612_100000211926 [0,2,0,0,0,0|1,0,0]=3 5914 B13R1.466 Cc1ccc(cc1Br)C(=O)CCF 1458a_100000186397_100011217306 [0,2,0,0,0,0|2,0,0]=4 5915 B13R1.466 Cc1ccc(cc1Br)C(=O)CCO 1458a_100000186397_100000211926 [0,2,0,0,0,0|2,0,0]=4 5916 B13R1.466 Cc1ccc(cc1Br)C(=O)CS[13CH3] 62a_100012346676_200025704644 [0,2,0,0,0,0|1,1,0]=4 5917 B13R1.466 Cc1ccc(cc1Br)C(=O)CS[13CH3] 62a_200025704644_100012346676 [0,2,0,0,0,0|1,1,0]=4 5918 B13R1.466 Cc1ccc(cc1C)C(=O)CCF 1458a_100000210898_100011217306 [0,2,0,0,0,0|2,0,0]=4 5919 B13R1.466 Cc1ccc(cc1C)C(=O)CCO 1458a_100000210898_100000211926 [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_100000183365_200025704644 [0,2,0,0,0,0|1,1,0]=4 5921 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_200025704644_100000183365 [0,2,0,0,0,0|1,1,0]=4 5922 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCF 1458a_100000751740_100011217306 [0,2,0,0,0,0|2,0,0]=4 5923 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCO 1458a_100000751740_100000211926 [0,2,0,0,0,0|2,0,0]=4 5924 B13R1.466 Cc1ccc(cc1F)C(=O)CCF 1458a_100000212313_100011217306 [0,2,0,0,0,0|2,0,0]=4 5925 B13R1.466 Cc1ccc(cc1F)C(=O)CCO 1458a_100000212313_100000211926 [0,2,0,0,0,0|2,0,0]=4 5926 B13R1.466 Cc1ccc(cc1F)C(=O)CS[13CH3] 62a_100011219196_200025704644 [0,2,0,0,0,0|1,1,0]=4 5927 B13R1.466 Cc1ccc(cc1F)C(=O)CS[13CH3] 62a_200025704644_100011219196 [0,2,0,0,0,0|1,1,0]=4 5928 B13R1.466 Cc1ccc(cc1I)C(=O)CCF 1458a_100000751299_100011217306 [0,2,0,0,0,0|2,0,0]=4 5929 B13R1.466 Cc1ccc(cc1I)C(=O)CCO 1458a_100000751299_100000211926 [0,2,0,0,0,0|2,0,0]=4 5930 B13R1.466 Cc1ccc(cc1O)C(=O)CCF 1458a_100000233767_100011217306 [0,2,0,0,0,0|2,0,0]=4 5931 B13R1.466 Cc1ccc(cc1O)C(=O)CCO 1458a_100000233767_100000211926 [0,2,0,0,0,0|2,0,0]=4 5932 B13R1.466 N#CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100011214920 [0,2,0,0,0,0|1,0,1]=4 5933 B13R1.466 N#CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100011214920 [0,2,0,0,0,0|1,0,1]=4 5934 B13R1.466 N#CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100011214920 [0,2,0,0,0,0|1,0,1]=4 5935 B13R1.466 N#CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100011214920 [0,2,0,0,0,0|1,0,1]=4 5936 B13R1.466 N#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011214920 [0,2,0,0,0,0|1,0,1]=4 5937 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Br 1458a_100012339404_100011217306 [0,2,0,0,0,0|2,0,0]=4 5938 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011217306 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)F 1458a_100000760357_100011217306 [0,2,0,0,0,0|2,0,0]=4 5940 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)I 1458a_100000739115_100011217306 [0,2,0,0,0,0|2,0,0]=4 5941 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011217306 [0,2,0,0,0,0|1,0,0]=3 5942 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011217306 [0,2,0,0,0,0|2,0,0]=4 5943 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011217306 [0,2,0,0,0,0|2,0,0]=4 5944 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)F 1458a_100000686462_100011217306 [0,2,0,0,0,0|2,0,0]=4 5945 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)I 1458a_100000684831_100011217306 [0,2,0,0,0,0|2,0,0]=4 5946 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011217306 [0,2,0,0,0,0|1,0,0]=3 5947 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Br 1458a_100000743946_100011217306 [0,2,0,0,0,0|2,0,0]=4 5948 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Cl 1458a_100000743183_100011217306 [0,2,0,0,0,0|2,0,0]=4 5949 B13R1.466 O=C(CCF)c1ccc(c(c1)F)F 1458a_100000209822_100011217306 [0,2,0,0,0,0|2,0,0]=4 5950 B13R1.466 O=C(CCF)c1ccc(c(c1)F)I 1458a_100000062624_100011217306 [0,2,0,0,0,0|2,0,0]=4 5951 B13R1.466 O=C(CCF)c1ccc(c(c1)F)O 1458a_100000185466_100011217306 [0,2,0,0,0,0|1,0,0]=3 5952 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Br 1458a_100012343876_100011217306 [0,2,0,0,0,0|2,0,0]=4 5953 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Cl 1458a_100000739381_100011217306 [0,2,0,0,0,0|2,0,0]=4 5954 B13R1.466 O=C(CCF)c1ccc(c(c1)I)F 1458a_100000688015_100011217306 [0,2,0,0,0,0|2,0,0]=4 5955 B13R1.466 O=C(CCF)c1ccc(c(c1)I)I 1458a_100000725830_100011217306 [0,2,0,0,0,0|2,0,0]=4 5956 B13R1.466 O=C(CCF)c1ccc(c(c1)I)O 1458a_100000037485_100011217306 [0,2,0,0,0,0|1,0,0]=3 5957 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011217306 [0,2,0,0,0,0|2,0,0]=4 5958 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011217306 [0,2,0,0,0,0|2,0,0]=4 5959 B13R1.466 O=C(CCF)c1ccc(c(c1)O)F 1458a_100000035894_100011217306 [0,2,0,0,0,0|2,0,0]=4 5960 B13R1.466 O=C(CCF)c1ccc(c(c1)O)I 1458a_100000239334_100011217306 [0,2,0,0,0,0|2,0,0]=4 5961 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [0,2,0,0,0,0|1,0,0]=3 5962 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Br 1458a_100012339404_100000211926 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000211926 [0,2,0,0,0,0|2,0,0]=4 5964 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)F 1458a_100000760357_100000211926 [0,2,0,0,0,0|2,0,0]=4 5965 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)I 1458a_100000739115_100000211926 [0,2,0,0,0,0|2,0,0]=4 5966 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000211926 [0,2,0,0,0,0|1,0,0]=3 5967 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000211926 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000211926 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)F 1458a_100000686462_100000211926 [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)I 1458a_100000684831_100000211926 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000211926 [0,2,0,0,0,0|1,0,0]=3 5972 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Br 1458a_100000743946_100000211926 [0,2,0,0,0,0|2,0,0]=4 5973 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Cl 1458a_100000743183_100000211926 [0,2,0,0,0,0|2,0,0]=4 5974 B13R1.466 O=C(CCO)c1ccc(c(c1)F)F 1458a_100000209822_100000211926 [0,2,0,0,0,0|2,0,0]=4 5975 B13R1.466 O=C(CCO)c1ccc(c(c1)F)I 1458a_100000062624_100000211926 [0,2,0,0,0,0|2,0,0]=4 5976 B13R1.466 O=C(CCO)c1ccc(c(c1)F)O 1458a_100000185466_100000211926 [0,2,0,0,0,0|1,0,0]=3 5977 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Br 1458a_100012343876_100000211926 [0,2,0,0,0,0|2,0,0]=4 5978 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Cl 1458a_100000739381_100000211926 [0,2,0,0,0,0|2,0,0]=4 5979 B13R1.466 O=C(CCO)c1ccc(c(c1)I)F 1458a_100000688015_100000211926 [0,2,0,0,0,0|2,0,0]=4 5980 B13R1.466 O=C(CCO)c1ccc(c(c1)I)I 1458a_100000725830_100000211926 [0,2,0,0,0,0|2,0,0]=4 5981 B13R1.466 O=C(CCO)c1ccc(c(c1)I)O 1458a_100000037485_100000211926 [0,2,0,0,0,0|1,0,0]=3 5982 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000211926 [0,2,0,0,0,0|2,0,0]=4 5983 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000211926 [0,2,0,0,0,0|2,0,0]=4 5984 B13R1.466 O=C(CCO)c1ccc(c(c1)O)F 1458a_100000035894_100000211926 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.466 O=C(CCO)c1ccc(c(c1)O)I 1458a_100000239334_100000211926 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [0,2,0,0,0,0|1,0,0]=3 5987 B13R1.466 [13CH3]OCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200025704644 [0,2,0,0,0,0|1,0,0]=3 5988 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Br)F 62a_100011217175_200025704644 [0,2,0,0,0,0|1,1,0]=4 5989 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Br)F 62a_200025704644_100011217175 [0,2,0,0,0,0|1,1,0]=4 5990 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Br 62a_200012349649_200025704644 [0,2,0,0,0,0|1,1,0]=4 5991 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Br 62a_200025704644_200012349649 [0,2,0,0,0,0|1,1,0]=4 5992 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200025704644 [0,2,0,0,0,0|1,1,0]=4 5993 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_200025704644_100000211430 [0,2,0,0,0,0|1,1,0]=4 5994 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)F 62a_100000757878_200025704644 [0,2,0,0,0,0|1,1,0]=4 5995 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)F 62a_200025704644_100000757878 [0,2,0,0,0,0|1,1,0]=4 5996 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200025704644 [0,2,0,0,0,0|0,1,0]=3 5997 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200025704644_200010170092 [0,2,0,0,0,0|0,1,0]=3 5998 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Br 62a_100012361357_200025704644 [0,2,0,0,0,0|1,1,0]=4 5999 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Br 62a_200025704644_100012361357 [0,2,0,0,0,0|1,1,0]=4 6000 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200025704644 [0,2,0,0,0,0|1,1,0]=4 6001 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_200025704644_100012351892 [0,2,0,0,0,0|1,1,0]=4 6002 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)F 62a_100000183380_200025704644 [0,2,0,0,0,0|1,1,0]=4 6003 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)F 62a_200025704644_100000183380 [0,2,0,0,0,0|1,1,0]=4 6004 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)O)O 62a_200025704644_100000183813 [0,2,0,0,0,0|0,1,0]=3 6005 B13R1.1511 C#CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000184674 [0,2,0,0,0,0|1,0,1]=4 6006 B13R1.1511 C#CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000184674 [0,2,0,0,0,0|1,0,1]=4 6007 B13R1.1511 C#CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000184674 [0,2,0,0,0,0|1,0,1]=4 6008 B13R1.1511 C#CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000184674 [0,2,0,0,0,0|1,0,1]=4 6009 B13R1.1511 C#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000184674 [0,2,0,0,0,0|1,0,1]=4 6010 B13R1.1511 C=CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210623 [0,2,0,0,0,0|1,0,1]=4 6011 B13R1.1511 C=CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210623 [0,2,0,0,0,0|1,0,1]=4 6012 B13R1.1511 C=CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210623 [0,2,0,0,0,0|1,0,1]=4 6013 B13R1.1511 C=CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210623 [0,2,0,0,0,0|1,0,1]=4 6014 B13R1.1511 C=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210623 [0,2,0,0,0,0|1,0,1]=4 6015 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210303 [0,2,0,0,0,0|2,0,0]=4 6016 B13R1.1511 CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210303 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210303 [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.1511 CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210303 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.1511 CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210303 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.1511 CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210303 [0,2,0,0,0,0|1,0,0]=3 6021 B13R1.1511 CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210303 [0,2,0,0,0,0|2,0,0]=4 6022 B13R1.1511 CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210303 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.1511 CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210303 [0,2,0,0,0,0|2,0,0]=4 6024 B13R1.1511 CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210303 [0,2,0,0,0,0|2,0,0]=4 6025 B13R1.1511 CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210303 [0,2,0,0,0,0|2,0,0]=4 6026 B13R1.1511 CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210303 [0,2,0,0,0,0|1,0,0]=3 6027 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210303 [0,2,0,0,0,0|2,0,0]=4 6028 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210303 [0,2,0,0,0,0|2,0,0]=4 6029 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210303 [0,2,0,0,0,0|2,0,0]=4 6030 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210303 [0,2,0,0,0,0|2,0,0]=4 6031 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210303 [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210303 [0,2,0,0,0,0|1,0,0]=3 6033 B13R1.1511 CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210303 [0,2,0,0,0,0|2,0,0]=4 6034 B13R1.1511 CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210303 [0,2,0,0,0,0|2,0,0]=4 6035 B13R1.1511 CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210303 [0,2,0,0,0,0|2,0,0]=4 6036 B13R1.1511 CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210303 [0,2,0,0,0,0|2,0,0]=4 6037 B13R1.1511 CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210303 [0,2,0,0,0,0|2,0,0]=4 6038 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210303 [0,2,0,0,0,0|1,0,0]=3 6039 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012345046 [0,2,0,0,0,0|1,0,0]=3 6040 B13R1.1511 CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210303 [0,2,0,0,0,0|2,0,0]=4 6041 B13R1.1511 CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210303 [0,2,0,0,0,0|2,0,0]=4 6042 B13R1.1511 CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210303 [0,2,0,0,0,0|2,0,0]=4 6043 B13R1.1511 CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210303 [0,2,0,0,0,0|2,0,0]=4 6044 B13R1.1511 CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210303 [0,2,0,0,0,0|2,0,0]=4 6045 B13R1.1511 CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210303 [0,2,0,0,0,0|2,0,0]=4 6046 B13R1.1511 CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210303 [0,2,0,0,0,0|2,0,0]=4 6047 B13R1.1511 CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210303 [0,2,0,0,0,0|2,0,0]=4 6048 B13R1.1511 CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210303 [0,2,0,0,0,0|2,0,0]=4 6049 B13R1.1511 CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210303 [0,2,0,0,0,0|1,0,0]=3 6050 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 11a_100015525214_100000762965 [0,2,0,0,0,0|2,0,0]=4 6051 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 240690a_100015525214_100000762965 [0,2,0,0,0,0|2,0,0]=4 6052 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 527a_100015525214_100000762965 [0,2,0,0,0,0|2,0,0]=4 6053 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 11a_100015525214_100000685072 [0,2,0,0,0,0|2,0,0]=4 6054 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 240690a_100015525214_100000685072 [0,2,0,0,0,0|2,0,0]=4 6055 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 527a_100015525214_100000685072 [0,2,0,0,0,0|2,0,0]=4 6056 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 11a_100015525214_100000766353 [0,2,0,0,0,0|2,0,0]=4 6057 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 240690a_100015525214_100000766353 [0,2,0,0,0,0|2,0,0]=4 6058 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 527a_100015525214_100000766353 [0,2,0,0,0,0|2,0,0]=4 6059 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 11a_100015525214_100000212304 [0,2,0,0,0,0|2,0,0]=4 6060 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 240690a_100015525214_100000212304 [0,2,0,0,0,0|2,0,0]=4 6061 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 527a_100015525214_100000212304 [0,2,0,0,0,0|2,0,0]=4 6062 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 11a_100015525214_100012360512 [0,2,0,0,0,0|2,0,0]=4 6063 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 240690a_100015525214_100012360512 [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 527a_100015525214_100012360512 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 240690a_100015525214_100012344906 [0,2,0,0,0,0|1,0,0]=3 6066 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 527a_100015525214_100012344906 [0,2,0,0,0,0|1,0,0]=3 6067 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 11a_100015525214_100000741311 [0,2,0,0,0,0|2,0,0]=4 6068 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 240690a_100015525214_100000741311 [0,2,0,0,0,0|2,0,0]=4 6069 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 527a_100015525214_100000741311 [0,2,0,0,0,0|2,0,0]=4 6070 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 11a_100015525214_100000211164 [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 240690a_100015525214_100000211164 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 527a_100015525214_100000211164 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 11a_100015525214_100000688705 [0,2,0,0,0,0|2,0,0]=4 6074 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 240690a_100015525214_100000688705 [0,2,0,0,0,0|2,0,0]=4 6075 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 527a_100015525214_100000688705 [0,2,0,0,0,0|2,0,0]=4 6076 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 11a_100015525214_100000686989 [0,2,0,0,0,0|2,0,0]=4 6077 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 240690a_100015525214_100000686989 [0,2,0,0,0,0|2,0,0]=4 6078 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 527a_100015525214_100000686989 [0,2,0,0,0,0|2,0,0]=4 6079 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 11a_100015525214_100010189873 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 240690a_100015525214_100010189873 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 527a_100015525214_100010189873 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 240690a_100015525214_100000692822 [0,2,0,0,0,0|1,0,0]=3 6083 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 527a_100015525214_100000692822 [0,2,0,0,0,0|1,0,0]=3 6084 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 11a_100015525214_100000741628 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 240690a_100015525214_100000741628 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 527a_100015525214_100000741628 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 11a_100015525214_100000766932 [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 240690a_100015525214_100000766932 [0,2,0,0,0,0|2,0,0]=4 6089 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 527a_100015525214_100000766932 [0,2,0,0,0,0|2,0,0]=4 6090 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 11a_100015525214_100000185840 [0,2,0,0,0,0|2,0,0]=4 6091 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015525214_100000185840 [0,2,0,0,0,0|2,0,0]=4 6092 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 527a_100015525214_100000185840 [0,2,0,0,0,0|2,0,0]=4 6093 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 11a_100015525214_100000211397 [0,2,0,0,0,0|2,0,0]=4 6094 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 240690a_100015525214_100000211397 [0,2,0,0,0,0|2,0,0]=4 6095 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 527a_100015525214_100000211397 [0,2,0,0,0,0|2,0,0]=4 6096 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 11a_100015525214_100000751301 [0,2,0,0,0,0|2,0,0]=4 6097 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 240690a_100015525214_100000751301 [0,2,0,0,0,0|2,0,0]=4 6098 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 527a_100015525214_100000751301 [0,2,0,0,0,0|2,0,0]=4 6099 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 240690a_100015525214_100000702456 [0,2,0,0,0,0|1,0,0]=3 6100 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 527a_100015525214_100000702456 [0,2,0,0,0,0|1,0,0]=3 6101 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 11a_100015525214_100000214689 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 240690a_100015525214_100000214689 [0,2,0,0,0,0|2,0,0]=4 6103 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 527a_100015525214_100000214689 [0,2,0,0,0,0|2,0,0]=4 6104 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 11a_100015525214_100000766033 [0,2,0,0,0,0|2,0,0]=4 6105 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 240690a_100015525214_100000766033 [0,2,0,0,0,0|2,0,0]=4 6106 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 527a_100015525214_100000766033 [0,2,0,0,0,0|2,0,0]=4 6107 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 11a_100015525214_100000212326 [0,2,0,0,0,0|2,0,0]=4 6108 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 240690a_100015525214_100000212326 [0,2,0,0,0,0|2,0,0]=4 6109 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 527a_100015525214_100000212326 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 11a_100015525214_100000211022 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 240690a_100015525214_100000211022 [0,2,0,0,0,0|2,0,0]=4 6112 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 527a_100015525214_100000211022 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 11a_100015525214_100000037189 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 240690a_100015525214_100000037189 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 527a_100015525214_100000037189 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 240690a_100015525214_100000689029 [0,2,0,0,0,0|1,0,0]=3 6117 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215476 [0,2,0,0,0,0|1,0,0]=3 6118 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 527a_100015525214_100000689029 [0,2,0,0,0,0|1,0,0]=3 6119 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 11a_100015525214_100000751167 [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 240690a_100015525214_100000751167 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 527a_100015525214_100000751167 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 11a_100015525214_100009999607 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 240690a_100015525214_100009999607 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 527a_100015525214_100009999607 [0,2,0,0,0,0|2,0,0]=4 6125 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 11a_100015525214_100000739380 [0,2,0,0,0,0|2,0,0]=4 6126 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 240690a_100015525214_100000739380 [0,2,0,0,0,0|2,0,0]=4 6127 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 527a_100015525214_100000739380 [0,2,0,0,0,0|2,0,0]=4 6128 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 11a_100015525214_100000739341 [0,2,0,0,0,0|2,0,0]=4 6129 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 240690a_100015525214_100000739341 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 527a_100015525214_100000739341 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 240690a_100015525214_100000744433 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 527a_100015525214_100000744433 [0,2,0,0,0,0|2,0,0]=4 6133 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 240690a_100015525214_100000212137 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 527a_100015525214_100000212137 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 11a_100015525214_100000188622 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 240690a_100015525214_100000188622 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 527a_100015525214_100000188622 [0,2,0,0,0,0|2,0,0]=4 6138 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 240690a_100015525214_100000746061 [0,2,0,0,0,0|2,0,0]=4 6139 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203945 [0,2,0,0,0,0|2,0,0]=4 6140 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 527a_100015525214_100000746061 [0,2,0,0,0,0|2,0,0]=4 6141 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 240690a_100015525214_100000091984 [0,2,0,0,0,0|2,0,0]=4 6142 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 527a_100015525214_100000091984 [0,2,0,0,0,0|2,0,0]=4 6143 B13R1.1511 CCOC(=O)c1ccc(cc1C)O 271570a_203496583355_100011327926 [0,2,0,0,0,0|0,0,0]=2 6144 B13R1.1511 CCOC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060723 [0,2,0,0,0,0|0,0,0]=2 6145 B13R1.1511 CCOC(=O)c1ccc(cc1F)O 271570a_203496583355_100010244673 [0,2,0,0,0,0|0,0,0]=2 6146 B13R1.1511 CCOC(=O)c1ccc(cc1O)C 271570a_203496583355_200012185120 [0,2,0,0,0,0|1,0,0]=3 6147 B13R1.1511 CCOC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047509 [0,2,0,0,0,0|1,0,0]=3 6148 B13R1.1511 CCOC(=O)c1ccc(cc1O)F 271570a_203496583355_100011206307 [0,2,0,0,0,0|1,0,0]=3 6149 B13R1.1511 CCOC(=O)c1ccc(nc1C)O 271570a_203496583355_100000106303 [0,2,0,0,0,0|1,0,0]=3 6150 B13R1.1511 CCOC(=O)c1cnc(nc1C)O 271570a_203496583355_100000693866 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.1511 CCOC(=O)c1ncc(cc1C)O 271570a_203496583355_100010201522 [0,2,0,0,0,0|1,0,0]=3 6152 B13R1.1511 CCOC(=O)c1ncc(cc1N)O 271570a_203496583355_100010230144 [0,2,0,0,0,0|1,0,0]=3 6153 B13R1.1511 CCOC(=O)c1ncc(cc1O)O 271570a_203496583355_100016103240 [0,2,0,0,0,0|1,0,0]=3 6154 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 34a_100102657272_100012361341 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.1511 CNCC(=O)c1ccc(cc1Br)F 7a_106832991635_100012361341 [0,2,0,0,0,0|2,0,0]=4 6156 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 2230a_106832991635_100000229959 [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 34a_100102657272_100000229959 [0,2,0,0,0,0|2,0,0]=4 6158 B13R1.1511 CNCC(=O)c1ccc(cc1C)C 7a_106832991635_100000229959 [0,2,0,0,0,0|2,0,0]=4 6159 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100011218845 [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 2230a_106832991635_100012056422 [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)F 34a_100102657272_100012056422 [0,2,0,0,0,0|2,0,0]=4 6162 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 34a_100102657272_200012361339 [0,2,0,0,0,0|2,0,0]=4 6163 B13R1.1511 CNCC(=O)c1ccc(cc1F)Br 7a_106832991635_200012361339 [0,2,0,0,0,0|2,0,0]=4 6164 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 34a_100102657272_100012351891 [0,2,0,0,0,0|2,0,0]=4 6165 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 7a_106832991635_100012351891 [0,2,0,0,0,0|2,0,0]=4 6166 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 34a_100102657272_100000229962 [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.1511 CNCC(=O)c1ccc(cc1F)F 7a_106832991635_100000229962 [0,2,0,0,0,0|2,0,0]=4 6168 B13R1.1511 CNCC(=O)c1ccc(cc1O)F 34a_100102657272_100009817053 [0,2,0,0,0,0|2,0,0]=4 6169 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 34a_100102657272_100009814262 [0,2,0,0,0,0|1,0,0]=3 6170 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 7a_106832991635_100009814262 [0,2,0,0,0,0|1,0,0]=3 6171 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Br 22a_100016993582_100000762965 [0,2,0,0,0,0|2,0,0]=4 6172 B13R1.1511 CNNC(=O)c1ccc(cc1Br)C 22a_100016993582_100000685072 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Cl 22a_100016993582_100000766353 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.1511 CNNC(=O)c1ccc(cc1Br)F 22a_100016993582_100000212304 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.1511 CNNC(=O)c1ccc(cc1Br)I 22a_100016993582_100012360512 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.1511 CNNC(=O)c1ccc(cc1Br)O 22a_100016993582_100012344906 [0,2,0,0,0,0|1,0,0]=3 6177 B13R1.1511 CNNC(=O)c1ccc(cc1C)Br 22a_100016993582_100000741311 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.1511 CNNC(=O)c1ccc(cc1C)C 22a_100016993582_100000211164 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.1511 CNNC(=O)c1ccc(cc1C)Cl 22a_100016993582_100000688705 [0,2,0,0,0,0|2,0,0]=4 6180 B13R1.1511 CNNC(=O)c1ccc(cc1C)F 22a_100016993582_100000686989 [0,2,0,0,0,0|2,0,0]=4 6181 B13R1.1511 CNNC(=O)c1ccc(cc1C)I 22a_100016993582_100010189873 [0,2,0,0,0,0|2,0,0]=4 6182 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Br 22a_100016993582_100000741628 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)C 22a_100016993582_100000766932 [0,2,0,0,0,0|2,0,0]=4 6184 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Cl 22a_100016993582_100000185840 [0,2,0,0,0,0|2,0,0]=4 6185 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)F 22a_100016993582_100000211397 [0,2,0,0,0,0|2,0,0]=4 6186 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)I 22a_100016993582_100000751301 [0,2,0,0,0,0|2,0,0]=4 6187 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)O 22a_100016993582_100000702456 [0,2,0,0,0,0|1,0,0]=3 6188 B13R1.1511 CNNC(=O)c1ccc(cc1F)Br 22a_100016993582_100000214689 [0,2,0,0,0,0|2,0,0]=4 6189 B13R1.1511 CNNC(=O)c1ccc(cc1F)C 22a_100016993582_100000766033 [0,2,0,0,0,0|2,0,0]=4 6190 B13R1.1511 CNNC(=O)c1ccc(cc1F)Cl 22a_100016993582_100000212326 [0,2,0,0,0,0|2,0,0]=4 6191 B13R1.1511 CNNC(=O)c1ccc(cc1F)F 22a_100016993582_100000211022 [0,2,0,0,0,0|2,0,0]=4 6192 B13R1.1511 CNNC(=O)c1ccc(cc1F)I 22a_100016993582_100000037189 [0,2,0,0,0,0|2,0,0]=4 6193 B13R1.1511 CNNC(=O)c1ccc(cc1F)O 22a_100016993582_100000689029 [0,2,0,0,0,0|1,0,0]=3 6194 B13R1.1511 CNNC(=O)c1ccc(cc1I)Br 22a_100016993582_100000751167 [0,2,0,0,0,0|2,0,0]=4 6195 B13R1.1511 CNNC(=O)c1ccc(cc1I)C 22a_100016993582_100009999607 [0,2,0,0,0,0|2,0,0]=4 6196 B13R1.1511 CNNC(=O)c1ccc(cc1I)Cl 22a_100016993582_100000739380 [0,2,0,0,0,0|2,0,0]=4 6197 B13R1.1511 CNNC(=O)c1ccc(cc1I)F 22a_100016993582_100000739341 [0,2,0,0,0,0|2,0,0]=4 6198 B13R1.1511 CNNC(=O)c1ccc(cc1O)Br 22a_100016993582_100000744433 [0,2,0,0,0,0|2,0,0]=4 6199 B13R1.1511 CNNC(=O)c1ccc(cc1O)C 22a_100016993582_100000212137 [0,2,0,0,0,0|2,0,0]=4 6200 B13R1.1511 CNNC(=O)c1ccc(cc1O)Cl 22a_100016993582_100000188622 [0,2,0,0,0,0|2,0,0]=4 6201 B13R1.1511 CNNC(=O)c1ccc(cc1O)F 22a_100016993582_100000746061 [0,2,0,0,0,0|2,0,0]=4 6202 B13R1.1511 CNNC(=O)c1ccc(cc1O)I 22a_100016993582_100000091984 [0,2,0,0,0,0|2,0,0]=4 6203 B13R1.1511 CNNC(=O)c1ccc(cc1O)O 22a_100016993582_100000212172 [0,2,0,0,0,0|1,0,0]=3 6204 B13R1.1511 COCC(=O)c1ccc(cc1Br)F 34a_100138415774_100012361341 [0,2,0,0,0,0|1,0,0]=3 6205 B13R1.1511 COCC(=O)c1ccc(cc1C)C 34a_100138415774_100000229959 [0,2,0,0,0,0|1,0,0]=3 6206 B13R1.1511 COCC(=O)c1ccc(cc1Cl)F 34a_100138415774_100012056422 [0,2,0,0,0,0|1,0,0]=3 6207 B13R1.1511 COCC(=O)c1ccc(cc1F)Br 34a_100138415774_200012361339 [0,2,0,0,0,0|1,0,0]=3 6208 B13R1.1511 COCC(=O)c1ccc(cc1F)Cl 34a_100138415774_100012351891 [0,2,0,0,0,0|1,0,0]=3 6209 B13R1.1511 COCC(=O)c1ccc(cc1F)F 34a_100138415774_100000229962 [0,2,0,0,0,0|1,0,0]=3 6210 B13R1.1511 COCC(=O)c1ccc(cc1O)F 34a_100138415774_100009817053 [0,2,0,0,0,0|1,0,0]=3 6211 B13R1.1511 COCC(=O)c1ccc(cc1O)O 34a_100138415774_100009814262 [0,2,0,0,0,0|0,0,0]=2 6212 B13R1.1511 COCN(C)c1ccc(cc1C)O 269982a_100161107805_100000766300 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.1511 CSCC(=O)c1ccc(cc1Br)F 62a_100012361341_200000210301 [0,2,0,0,0,0|1,1,0]=4 6214 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_100000229959_200000210301 [0,2,0,0,0,0|1,1,0]=4 6215 B13R1.1511 CSCC(=O)c1ccc(cc1C)C 62a_200000210301_100000229959 [0,2,0,0,0,0|1,1,0]=4 6216 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200000210301 [0,2,0,0,0,0|1,1,0]=4 6217 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200000210301 [0,2,0,0,0,0|1,1,0]=4 6218 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)F 62a_200000210301_100012056422 [0,2,0,0,0,0|1,1,0]=4 6219 B13R1.1511 CSCC(=O)c1ccc(cc1F)Br 62a_200012361339_200000210301 [0,2,0,0,0,0|1,1,0]=4 6220 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200000210301 [0,2,0,0,0,0|1,1,0]=4 6221 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_200000210301_100012351891 [0,2,0,0,0,0|1,1,0]=4 6222 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_100000229962_200000210301 [0,2,0,0,0,0|1,1,0]=4 6223 B13R1.1511 CSCC(=O)c1ccc(cc1F)F 62a_200000210301_100000229962 [0,2,0,0,0,0|1,1,0]=4 6224 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_100009817053_200000210301 [0,2,0,0,0,0|1,1,0]=4 6225 B13R1.1511 CSCC(=O)c1ccc(cc1O)F 62a_200000210301_100009817053 [0,2,0,0,0,0|1,1,0]=4 6226 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_100009814262_200000210301 [0,2,0,0,0,0|0,1,0]=3 6227 B13R1.1511 CSCC(=O)c1ccc(cc1O)O 62a_200000210301_100009814262 [0,2,0,0,0,0|0,1,0]=3 6228 B13R1.1511 Cc1cc(ccc1C(=O)CC#N)O 1458a_100000692822_100011214920 [0,2,0,0,0,0|1,0,1]=4 6229 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Br 1458a_100000741311_100011217306 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Cl 1458a_100000688705_100011217306 [0,2,0,0,0,0|2,0,0]=4 6231 B13R1.1511 Cc1cc(ccc1C(=O)CCF)F 1458a_100000686989_100011217306 [0,2,0,0,0,0|2,0,0]=4 6232 B13R1.1511 Cc1cc(ccc1C(=O)CCF)I 1458a_100010189873_100011217306 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.1511 Cc1cc(ccc1C(=O)CCF)O 1458a_100000692822_100011217306 [0,2,0,0,0,0|1,0,0]=3 6234 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Br 1458a_100000741311_100000211926 [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Cl 1458a_100000688705_100000211926 [0,2,0,0,0,0|2,0,0]=4 6236 B13R1.1511 Cc1cc(ccc1C(=O)CCO)F 1458a_100000686989_100000211926 [0,2,0,0,0,0|2,0,0]=4 6237 B13R1.1511 Cc1cc(ccc1C(=O)CCO)I 1458a_100010189873_100000211926 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.1511 Cc1cc(ccc1C(=O)CCO)O 1458a_100000692822_100000211926 [0,2,0,0,0,0|1,0,0]=3 6239 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCF 1458a_100000685072_100011217306 [0,2,0,0,0,0|2,0,0]=4 6240 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCO 1458a_100000685072_100000211926 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCF 1458a_100000211164_100011217306 [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCO 1458a_100000211164_100000211926 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_100000229959_200025704644 [0,2,0,0,0,0|1,1,0]=4 6244 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CS[13CH3] 62a_200025704644_100000229959 [0,2,0,0,0,0|1,1,0]=4 6245 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCF 1458a_100000766932_100011217306 [0,2,0,0,0,0|2,0,0]=4 6246 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCO 1458a_100000766932_100000211926 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCF 1458a_100000766033_100011217306 [0,2,0,0,0,0|2,0,0]=4 6248 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCO 1458a_100000766033_100000211926 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCF 1458a_100009999607_100011217306 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCO 1458a_100009999607_100000211926 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCF 1458a_100000212137_100011217306 [0,2,0,0,0,0|2,0,0]=4 6252 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCO 1458a_100000212137_100000211926 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.1511 N#CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011214920 [0,2,0,0,0,0|1,0,1]=4 6254 B13R1.1511 N#CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011214920 [0,2,0,0,0,0|1,0,1]=4 6255 B13R1.1511 N#CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011214920 [0,2,0,0,0,0|1,0,1]=4 6256 B13R1.1511 N#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011214920 [0,2,0,0,0,0|1,0,1]=4 6257 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Br 1458a_100000762965_100011217306 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011217306 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.1511 O=C(CCF)c1ccc(cc1Br)F 1458a_100000212304_100011217306 [0,2,0,0,0,0|2,0,0]=4 6260 B13R1.1511 O=C(CCF)c1ccc(cc1Br)I 1458a_100012360512_100011217306 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.1511 O=C(CCF)c1ccc(cc1Br)O 1458a_100012344906_100011217306 [0,2,0,0,0,0|1,0,0]=3 6262 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011217306 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011217306 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)F 1458a_100000211397_100011217306 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)I 1458a_100000751301_100011217306 [0,2,0,0,0,0|2,0,0]=4 6266 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)O 1458a_100000702456_100011217306 [0,2,0,0,0,0|1,0,0]=3 6267 B13R1.1511 O=C(CCF)c1ccc(cc1F)Br 1458a_100000214689_100011217306 [0,2,0,0,0,0|2,0,0]=4 6268 B13R1.1511 O=C(CCF)c1ccc(cc1F)Cl 1458a_100000212326_100011217306 [0,2,0,0,0,0|2,0,0]=4 6269 B13R1.1511 O=C(CCF)c1ccc(cc1F)F 1458a_100000211022_100011217306 [0,2,0,0,0,0|2,0,0]=4 6270 B13R1.1511 O=C(CCF)c1ccc(cc1F)I 1458a_100000037189_100011217306 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.1511 O=C(CCF)c1ccc(cc1F)O 1458a_100000689029_100011217306 [0,2,0,0,0,0|1,0,0]=3 6272 B13R1.1511 O=C(CCF)c1ccc(cc1I)Br 1458a_100000751167_100011217306 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.1511 O=C(CCF)c1ccc(cc1I)Cl 1458a_100000739380_100011217306 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.1511 O=C(CCF)c1ccc(cc1I)F 1458a_100000739341_100011217306 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.1511 O=C(CCF)c1ccc(cc1O)Br 1458a_100000744433_100011217306 [0,2,0,0,0,0|2,0,0]=4 6276 B13R1.1511 O=C(CCF)c1ccc(cc1O)Cl 1458a_100000188622_100011217306 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.1511 O=C(CCF)c1ccc(cc1O)F 1458a_100000746061_100011217306 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.1511 O=C(CCF)c1ccc(cc1O)I 1458a_100000091984_100011217306 [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.1511 O=C(CCF)c1ccc(cc1O)O 1458a_100000212172_100011217306 [0,2,0,0,0,0|1,0,0]=3 6280 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Br 1458a_100000762965_100000211926 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000211926 [0,2,0,0,0,0|2,0,0]=4 6282 B13R1.1511 O=C(CCO)c1ccc(cc1Br)F 1458a_100000212304_100000211926 [0,2,0,0,0,0|2,0,0]=4 6283 B13R1.1511 O=C(CCO)c1ccc(cc1Br)I 1458a_100012360512_100000211926 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.1511 O=C(CCO)c1ccc(cc1Br)O 1458a_100012344906_100000211926 [0,2,0,0,0,0|1,0,0]=3 6285 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000211926 [0,2,0,0,0,0|2,0,0]=4 6286 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000211926 [0,2,0,0,0,0|2,0,0]=4 6287 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)F 1458a_100000211397_100000211926 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)I 1458a_100000751301_100000211926 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)O 1458a_100000702456_100000211926 [0,2,0,0,0,0|1,0,0]=3 6290 B13R1.1511 O=C(CCO)c1ccc(cc1F)Br 1458a_100000214689_100000211926 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.1511 O=C(CCO)c1ccc(cc1F)Cl 1458a_100000212326_100000211926 [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.1511 O=C(CCO)c1ccc(cc1F)F 1458a_100000211022_100000211926 [0,2,0,0,0,0|2,0,0]=4 6293 B13R1.1511 O=C(CCO)c1ccc(cc1F)I 1458a_100000037189_100000211926 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.1511 O=C(CCO)c1ccc(cc1F)O 1458a_100000689029_100000211926 [0,2,0,0,0,0|1,0,0]=3 6295 B13R1.1511 O=C(CCO)c1ccc(cc1I)Br 1458a_100000751167_100000211926 [0,2,0,0,0,0|2,0,0]=4 6296 B13R1.1511 O=C(CCO)c1ccc(cc1I)Cl 1458a_100000739380_100000211926 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.1511 O=C(CCO)c1ccc(cc1I)F 1458a_100000739341_100000211926 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.1511 O=C(CCO)c1ccc(cc1O)Br 1458a_100000744433_100000211926 [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.1511 O=C(CCO)c1ccc(cc1O)Cl 1458a_100000188622_100000211926 [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.1511 O=C(CCO)c1ccc(cc1O)F 1458a_100000746061_100000211926 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.1511 O=C(CCO)c1ccc(cc1O)I 1458a_100000091984_100000211926 [0,2,0,0,0,0|2,0,0]=4 6302 B13R1.1511 O=C(CCO)c1ccc(cc1O)O 1458a_100000212172_100000211926 [0,2,0,0,0,0|1,0,0]=3 6303 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Br)F 62a_100012361341_200025704644 [0,2,0,0,0,0|1,1,0]=4 6304 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200025704644 [0,2,0,0,0,0|1,1,0]=4 6305 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_100012056422_200025704644 [0,2,0,0,0,0|1,1,0]=4 6306 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)F 62a_200025704644_100012056422 [0,2,0,0,0,0|1,1,0]=4 6307 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Br 62a_200012361339_200025704644 [0,2,0,0,0,0|1,1,0]=4 6308 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200025704644 [0,2,0,0,0,0|1,1,0]=4 6309 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_200025704644_100012351891 [0,2,0,0,0,0|1,1,0]=4 6310 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_100000229962_200025704644 [0,2,0,0,0,0|1,1,0]=4 6311 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)F 62a_200025704644_100000229962 [0,2,0,0,0,0|1,1,0]=4 6312 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_100009817053_200025704644 [0,2,0,0,0,0|1,1,0]=4 6313 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)F 62a_200025704644_100009817053 [0,2,0,0,0,0|1,1,0]=4 6314 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_100009814262_200025704644 [0,2,0,0,0,0|0,1,0]=3 6315 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1O)O 62a_200025704644_100009814262 [0,2,0,0,0,0|0,1,0]=3 6316 B13R1.163 CC(=C(C)c1ccc(cc1Br)O)C 271570a_200000049429_100000701344 [0,2,0,0,0,0|2,0,0]=4 6317 B13R1.163 CC(=C(C)c1ccc(cc1C)O)C 271570a_200000049429_100000729255 [0,2,0,0,0,0|2,0,0]=4 6318 B13R1.163 CC(=C(C)c1ccc(cc1Cl)O)C 271570a_200000049429_100000047559 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.163 CC(=C(C)c1ccc(cc1F)O)C 271570a_200000049429_100000755031 [0,2,0,0,0,0|2,0,0]=4 6320 B13R1.163 CC(=C(C)c1ccc(cc1N)O)C 271570a_200000049429_100011999798 [0,2,0,0,0,0|2,0,0]=4 6321 B13R1.163 CC(=C(C)c1ccc(cc1O)O)C 271570a_200000049429_100009813921 [0,2,0,0,0,0|2,0,0]=4 6322 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210206 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210206 [0,2,0,0,0,0|2,0,0]=4 6324 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210206 [0,2,0,0,0,0|2,0,0]=4 6325 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210206 [0,2,0,0,0,0|2,0,0]=4 6326 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210206 [0,2,0,0,0,0|1,0,0]=3 6327 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210206 [0,2,0,0,0,0|2,0,0]=4 6328 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210206 [0,2,0,0,0,0|2,0,0]=4 6329 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210206 [0,2,0,0,0,0|2,0,0]=4 6330 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210206 [0,2,0,0,0,0|2,0,0]=4 6331 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210206 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.163 CC(C)C(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210206 [0,2,0,0,0,0|2,0,0]=4 6333 B13R1.163 CC(C)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210206 [0,2,0,0,0,0|2,0,0]=4 6334 B13R1.163 CC(C)C(=O)c1ccc(cc1F)F 1458a_100000211022_100000210206 [0,2,0,0,0,0|2,0,0]=4 6335 B13R1.163 CC(C)C(=O)c1ccc(cc1F)I 1458a_100000037189_100000210206 [0,2,0,0,0,0|2,0,0]=4 6336 B13R1.163 CC(C)C(=O)c1ccc(cc1F)O 1458a_100000689029_100000210206 [0,2,0,0,0,0|1,0,0]=3 6337 B13R1.163 CC(C)C(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210206 [0,2,0,0,0,0|2,0,0]=4 6338 B13R1.163 CC(C)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210206 [0,2,0,0,0,0|2,0,0]=4 6339 B13R1.163 CC(C)C(=O)c1ccc(cc1I)F 1458a_100000739341_100000210206 [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.163 CC(C)C(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210206 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.163 CC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210206 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.163 CC(C)C(=O)c1ccc(cc1O)F 1458a_100000746061_100000210206 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.163 CC(C)C(=O)c1ccc(cc1O)I 1458a_100000091984_100000210206 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.163 CC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_100000210206 [0,2,0,0,0,0|1,0,0]=3 6345 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 11a_100102631434_100000762965 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 1626a_100102631434_100000762965 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 240690a_100102631434_100000762965 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Br 527a_100102631434_100000762965 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 11a_100102631434_100000766353 [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100102631434_100000766353 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100102631434_100000766353 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)Cl 527a_100102631434_100000766353 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 11a_100102631434_100000212304 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 1626a_100102631434_100000212304 [0,2,0,0,0,0|2,0,0]=4 6355 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 240690a_100102631434_100000212304 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)F 527a_100102631434_100000212304 [0,2,0,0,0,0|2,0,0]=4 6357 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 11a_100102631434_100012360512 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 1626a_100102631434_100012360512 [0,2,0,0,0,0|2,0,0]=4 6359 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 240690a_100102631434_100012360512 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)I 527a_100102631434_100012360512 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)O 240690a_100102631434_100012344906 [0,2,0,0,0,0|1,0,0]=3 6362 B13R1.163 CN(C)C(=O)c1ccc(cc1Br)O 527a_100102631434_100012344906 [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 11a_100102631434_100000741628 [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 1626a_100102631434_100000741628 [0,2,0,0,0,0|2,0,0]=4 6365 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 240690a_100102631434_100000741628 [0,2,0,0,0,0|2,0,0]=4 6366 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Br 527a_100102631434_100000741628 [0,2,0,0,0,0|2,0,0]=4 6367 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100102631434_100000185840 [0,2,0,0,0,0|2,0,0]=4 6368 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100102631434_100000185840 [0,2,0,0,0,0|2,0,0]=4 6369 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100102631434_100000185840 [0,2,0,0,0,0|2,0,0]=4 6370 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100102631434_100000185840 [0,2,0,0,0,0|2,0,0]=4 6371 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 11a_100102631434_100000211397 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 1626a_100102631434_100000211397 [0,2,0,0,0,0|2,0,0]=4 6373 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 240690a_100102631434_100000211397 [0,2,0,0,0,0|2,0,0]=4 6374 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)F 527a_100102631434_100000211397 [0,2,0,0,0,0|2,0,0]=4 6375 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 11a_100102631434_100000751301 [0,2,0,0,0,0|2,0,0]=4 6376 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 1626a_100102631434_100000751301 [0,2,0,0,0,0|2,0,0]=4 6377 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 240690a_100102631434_100000751301 [0,2,0,0,0,0|2,0,0]=4 6378 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)I 527a_100102631434_100000751301 [0,2,0,0,0,0|2,0,0]=4 6379 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)O 240690a_100102631434_100000702456 [0,2,0,0,0,0|1,0,0]=3 6380 B13R1.163 CN(C)C(=O)c1ccc(cc1Cl)O 527a_100102631434_100000702456 [0,2,0,0,0,0|1,0,0]=3 6381 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 11a_100102631434_100000214689 [0,2,0,0,0,0|2,0,0]=4 6382 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 1626a_100102631434_100000214689 [0,2,0,0,0,0|2,0,0]=4 6383 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 240690a_100102631434_100000214689 [0,2,0,0,0,0|2,0,0]=4 6384 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Br 527a_100102631434_100000214689 [0,2,0,0,0,0|2,0,0]=4 6385 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 11a_100102631434_100000212326 [0,2,0,0,0,0|2,0,0]=4 6386 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 1626a_100102631434_100000212326 [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 240690a_100102631434_100000212326 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.163 CN(C)C(=O)c1ccc(cc1F)Cl 527a_100102631434_100000212326 [0,2,0,0,0,0|2,0,0]=4 6389 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 11a_100102631434_100000211022 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 1626a_100102631434_100000211022 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 240690a_100102631434_100000211022 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.163 CN(C)C(=O)c1ccc(cc1F)F 527a_100102631434_100000211022 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 11a_100102631434_100000037189 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 1626a_100102631434_100000037189 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 240690a_100102631434_100000037189 [0,2,0,0,0,0|2,0,0]=4 6396 B13R1.163 CN(C)C(=O)c1ccc(cc1F)I 527a_100102631434_100000037189 [0,2,0,0,0,0|2,0,0]=4 6397 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 240690a_100102631434_100000689029 [0,2,0,0,0,0|1,0,0]=3 6398 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 271570a_203496583355_200000216859 [0,2,0,0,0,0|1,0,0]=3 6399 B13R1.163 CN(C)C(=O)c1ccc(cc1F)O 527a_100102631434_100000689029 [0,2,0,0,0,0|1,0,0]=3 6400 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 11a_100102631434_100000751167 [0,2,0,0,0,0|2,0,0]=4 6401 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 1626a_100102631434_100000751167 [0,2,0,0,0,0|2,0,0]=4 6402 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 240690a_100102631434_100000751167 [0,2,0,0,0,0|2,0,0]=4 6403 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Br 527a_100102631434_100000751167 [0,2,0,0,0,0|2,0,0]=4 6404 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 11a_100102631434_100000739380 [0,2,0,0,0,0|2,0,0]=4 6405 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 1626a_100102631434_100000739380 [0,2,0,0,0,0|2,0,0]=4 6406 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 240690a_100102631434_100000739380 [0,2,0,0,0,0|2,0,0]=4 6407 B13R1.163 CN(C)C(=O)c1ccc(cc1I)Cl 527a_100102631434_100000739380 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 11a_100102631434_100000739341 [0,2,0,0,0,0|2,0,0]=4 6409 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 1626a_100102631434_100000739341 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 240690a_100102631434_100000739341 [0,2,0,0,0,0|2,0,0]=4 6411 B13R1.163 CN(C)C(=O)c1ccc(cc1I)F 527a_100102631434_100000739341 [0,2,0,0,0,0|2,0,0]=4 6412 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Br 240690a_100102631434_100000744433 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Br 527a_100102631434_100000744433 [0,2,0,0,0,0|2,0,0]=4 6414 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 11a_100102631434_100000188622 [0,2,0,0,0,0|2,0,0]=4 6415 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 240690a_100102631434_100000188622 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.163 CN(C)C(=O)c1ccc(cc1O)Cl 527a_100102631434_100000188622 [0,2,0,0,0,0|2,0,0]=4 6417 B13R1.163 CN(C)C(=O)c1ccc(cc1O)F 240690a_100102631434_100000746061 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.163 CN(C)C(=O)c1ccc(cc1O)F 527a_100102631434_100000746061 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.163 CN(C)C(=O)c1ccc(cc1O)I 240690a_100102631434_100000091984 [0,2,0,0,0,0|2,0,0]=4 6420 B13R1.163 CN(C)C(=O)c1ccc(cc1O)I 527a_100102631434_100000091984 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)Br 1458a_100000741311_100000210206 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)Cl 1458a_100000688705_100000210206 [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)F 1458a_100000686989_100000210206 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)I 1458a_100010189873_100000210206 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)O 1458a_100000692822_100000210206 [0,2,0,0,0,0|1,0,0]=3 6426 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 11a_100102631434_100000741311 [0,2,0,0,0,0|2,0,0]=4 6427 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 1626a_100102631434_100000741311 [0,2,0,0,0,0|2,0,0]=4 6428 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 240690a_100102631434_100000741311 [0,2,0,0,0,0|2,0,0]=4 6429 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Br 527a_100102631434_100000741311 [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 11a_100102631434_100000688705 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 1626a_100102631434_100000688705 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 240690a_100102631434_100000688705 [0,2,0,0,0,0|2,0,0]=4 6433 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)Cl 527a_100102631434_100000688705 [0,2,0,0,0,0|2,0,0]=4 6434 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 11a_100102631434_100000686989 [0,2,0,0,0,0|2,0,0]=4 6435 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 1626a_100102631434_100000686989 [0,2,0,0,0,0|2,0,0]=4 6436 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 240690a_100102631434_100000686989 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)F 527a_100102631434_100000686989 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 11a_100102631434_100010189873 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 1626a_100102631434_100010189873 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 240690a_100102631434_100010189873 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)I 527a_100102631434_100010189873 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)O 240690a_100102631434_100000692822 [0,2,0,0,0,0|1,0,0]=3 6443 B13R1.163 Cc1cc(ccc1C(=O)N(C)C)O 527a_100102631434_100000692822 [0,2,0,0,0,0|1,0,0]=3 6444 B13R1.163 Cc1ccc(c(c1)Br)C(=O)C(C)C 1458a_100000685072_100000210206 [0,2,0,0,0,0|2,0,0]=4 6445 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 11a_100102631434_100000685072 [0,2,0,0,0,0|2,0,0]=4 6446 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 1626a_100102631434_100000685072 [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 240690a_100102631434_100000685072 [0,2,0,0,0,0|2,0,0]=4 6448 B13R1.163 Cc1ccc(c(c1)Br)C(=O)N(C)C 527a_100102631434_100000685072 [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.163 Cc1ccc(c(c1)C)C(=O)C(C)C 1458a_100000211164_100000210206 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 11a_100102631434_100000211164 [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 1626a_100102631434_100000211164 [0,2,0,0,0,0|2,0,0]=4 6452 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 240690a_100102631434_100000211164 [0,2,0,0,0,0|2,0,0]=4 6453 B13R1.163 Cc1ccc(c(c1)C)C(=O)N(C)C 527a_100102631434_100000211164 [0,2,0,0,0,0|2,0,0]=4 6454 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)C(C)C 1458a_100000766932_100000210206 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 11a_100102631434_100000766932 [0,2,0,0,0,0|2,0,0]=4 6456 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 1626a_100102631434_100000766932 [0,2,0,0,0,0|2,0,0]=4 6457 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 240690a_100102631434_100000766932 [0,2,0,0,0,0|2,0,0]=4 6458 B13R1.163 Cc1ccc(c(c1)Cl)C(=O)N(C)C 527a_100102631434_100000766932 [0,2,0,0,0,0|2,0,0]=4 6459 B13R1.163 Cc1ccc(c(c1)F)C(=O)C(C)C 1458a_100000766033_100000210206 [0,2,0,0,0,0|2,0,0]=4 6460 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 11a_100102631434_100000766033 [0,2,0,0,0,0|2,0,0]=4 6461 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 1626a_100102631434_100000766033 [0,2,0,0,0,0|2,0,0]=4 6462 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 240690a_100102631434_100000766033 [0,2,0,0,0,0|2,0,0]=4 6463 B13R1.163 Cc1ccc(c(c1)F)C(=O)N(C)C 527a_100102631434_100000766033 [0,2,0,0,0,0|2,0,0]=4 6464 B13R1.163 Cc1ccc(c(c1)I)C(=O)C(C)C 1458a_100009999607_100000210206 [0,2,0,0,0,0|2,0,0]=4 6465 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 11a_100102631434_100009999607 [0,2,0,0,0,0|2,0,0]=4 6466 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 1626a_100102631434_100009999607 [0,2,0,0,0,0|2,0,0]=4 6467 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 240690a_100102631434_100009999607 [0,2,0,0,0,0|2,0,0]=4 6468 B13R1.163 Cc1ccc(c(c1)I)C(=O)N(C)C 527a_100102631434_100009999607 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.163 Cc1ccc(c(c1)O)C(=O)C(C)C 1458a_100000212137_100000210206 [0,2,0,0,0,0|2,0,0]=4 6470 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 1626a_100102631434_100000212137 [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 240690a_100102631434_100000212137 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.163 Cc1ccc(c(c1)O)C(=O)N(C)C 527a_100102631434_100000212137 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.510 CC(=C(C)c1ccc(c(c1)Br)O)C 271570a_200000049429_100012361655 [0,2,0,0,0,0|2,0,0]=4 6474 B13R1.510 CC(=C(C)c1ccc(c(c1)C)O)C 271570a_200000049429_100000186361 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.510 CC(=C(C)c1ccc(c(c1)Cl)O)C 271570a_200000049429_100012360047 [0,2,0,0,0,0|2,0,0]=4 6476 B13R1.510 CC(=C(C)c1ccc(c(c1)F)O)C 271570a_200000049429_100000185481 [0,2,0,0,0,0|2,0,0]=4 6477 B13R1.510 CC(=C(C)c1ccc(c(c1)N)O)C 271570a_200000049429_100000752626 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.510 CC(=C(C)c1ccc(c(c1)O)O)C 271570a_200000049429_100009813601 [0,2,0,0,0,0|2,0,0]=4 6479 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210206 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210206 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210206 [0,2,0,0,0,0|2,0,0]=4 6482 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210206 [0,2,0,0,0,0|2,0,0]=4 6483 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210206 [0,2,0,0,0,0|1,0,0]=3 6484 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210206 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210206 [0,2,0,0,0,0|2,0,0]=4 6486 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210206 [0,2,0,0,0,0|2,0,0]=4 6487 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210206 [0,2,0,0,0,0|2,0,0]=4 6488 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210206 [0,2,0,0,0,0|1,0,0]=3 6489 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210206 [0,2,0,0,0,0|2,0,0]=4 6490 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210206 [0,2,0,0,0,0|2,0,0]=4 6491 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210206 [0,2,0,0,0,0|2,0,0]=4 6492 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210206 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210206 [0,2,0,0,0,0|1,0,0]=3 6494 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210206 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210206 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210206 [0,2,0,0,0,0|2,0,0]=4 6497 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210206 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210206 [0,2,0,0,0,0|1,0,0]=3 6499 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210206 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210206 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210206 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210206 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [0,2,0,0,0,0|1,0,0]=3 6504 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 11a_100102631434_100012339404 [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 1626a_100102631434_100012339404 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 240690a_100102631434_100012339404 [0,2,0,0,0,0|2,0,0]=4 6507 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Br 527a_100102631434_100012339404 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 11a_100102631434_100000691181 [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 1626a_100102631434_100000691181 [0,2,0,0,0,0|2,0,0]=4 6510 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 240690a_100102631434_100000691181 [0,2,0,0,0,0|2,0,0]=4 6511 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)Cl 527a_100102631434_100000691181 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 11a_100102631434_100000760357 [0,2,0,0,0,0|2,0,0]=4 6513 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 1626a_100102631434_100000760357 [0,2,0,0,0,0|2,0,0]=4 6514 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 240690a_100102631434_100000760357 [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)F 527a_100102631434_100000760357 [0,2,0,0,0,0|2,0,0]=4 6516 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 11a_100102631434_100000739115 [0,2,0,0,0,0|2,0,0]=4 6517 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 1626a_100102631434_100000739115 [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 240690a_100102631434_100000739115 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)I 527a_100102631434_100000739115 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Br)O 240690a_100102631434_100000189672 [0,2,0,0,0,0|1,0,0]=3 6521 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 11a_100102631434_100000687082 [0,2,0,0,0,0|2,0,0]=4 6522 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 1626a_100102631434_100000687082 [0,2,0,0,0,0|2,0,0]=4 6523 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 240690a_100102631434_100000687082 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Br 527a_100102631434_100000687082 [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 11a_100102631434_100000210401 [0,2,0,0,0,0|2,0,0]=4 6526 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100102631434_100000210401 [0,2,0,0,0,0|2,0,0]=4 6527 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 240690a_100102631434_100000210401 [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)Cl 527a_100102631434_100000210401 [0,2,0,0,0,0|2,0,0]=4 6529 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 11a_100102631434_100000686462 [0,2,0,0,0,0|2,0,0]=4 6530 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 1626a_100102631434_100000686462 [0,2,0,0,0,0|2,0,0]=4 6531 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 240690a_100102631434_100000686462 [0,2,0,0,0,0|2,0,0]=4 6532 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)F 527a_100102631434_100000686462 [0,2,0,0,0,0|2,0,0]=4 6533 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 11a_100102631434_100000684831 [0,2,0,0,0,0|2,0,0]=4 6534 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 1626a_100102631434_100000684831 [0,2,0,0,0,0|2,0,0]=4 6535 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 240690a_100102631434_100000684831 [0,2,0,0,0,0|2,0,0]=4 6536 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)I 527a_100102631434_100000684831 [0,2,0,0,0,0|2,0,0]=4 6537 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)O 240690a_100102631434_100000212196 [0,2,0,0,0,0|1,0,0]=3 6538 B13R1.510 CN(C)C(=O)c1ccc(c(c1)Cl)O 527a_100102631434_100000212196 [0,2,0,0,0,0|1,0,0]=3 6539 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 11a_100102631434_100000743946 [0,2,0,0,0,0|2,0,0]=4 6540 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 1626a_100102631434_100000743946 [0,2,0,0,0,0|2,0,0]=4 6541 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 240690a_100102631434_100000743946 [0,2,0,0,0,0|2,0,0]=4 6542 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Br 527a_100102631434_100000743946 [0,2,0,0,0,0|2,0,0]=4 6543 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 11a_100102631434_100000743183 [0,2,0,0,0,0|2,0,0]=4 6544 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 1626a_100102631434_100000743183 [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 240690a_100102631434_100000743183 [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)Cl 527a_100102631434_100000743183 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 11a_100102631434_100000209822 [0,2,0,0,0,0|2,0,0]=4 6548 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 1626a_100102631434_100000209822 [0,2,0,0,0,0|2,0,0]=4 6549 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 240690a_100102631434_100000209822 [0,2,0,0,0,0|2,0,0]=4 6550 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)F 527a_100102631434_100000209822 [0,2,0,0,0,0|2,0,0]=4 6551 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 11a_100102631434_100000062624 [0,2,0,0,0,0|2,0,0]=4 6552 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 1626a_100102631434_100000062624 [0,2,0,0,0,0|2,0,0]=4 6553 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 240690a_100102631434_100000062624 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)I 527a_100102631434_100000062624 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)O 240690a_100102631434_100000185466 [0,2,0,0,0,0|1,0,0]=3 6556 B13R1.510 CN(C)C(=O)c1ccc(c(c1)F)O 527a_100102631434_100000185466 [0,2,0,0,0,0|1,0,0]=3 6557 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 11a_100102631434_100012343876 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 1626a_100102631434_100012343876 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 240690a_100102631434_100012343876 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Br 527a_100102631434_100012343876 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 11a_100102631434_100000739381 [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 1626a_100102631434_100000739381 [0,2,0,0,0,0|2,0,0]=4 6563 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 240690a_100102631434_100000739381 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)Cl 527a_100102631434_100000739381 [0,2,0,0,0,0|2,0,0]=4 6565 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 11a_100102631434_100000688015 [0,2,0,0,0,0|2,0,0]=4 6566 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 1626a_100102631434_100000688015 [0,2,0,0,0,0|2,0,0]=4 6567 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 240690a_100102631434_100000688015 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)F 527a_100102631434_100000688015 [0,2,0,0,0,0|2,0,0]=4 6569 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 11a_100102631434_100000725830 [0,2,0,0,0,0|2,0,0]=4 6570 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 1626a_100102631434_100000725830 [0,2,0,0,0,0|2,0,0]=4 6571 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 240690a_100102631434_100000725830 [0,2,0,0,0,0|2,0,0]=4 6572 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)I 527a_100102631434_100000725830 [0,2,0,0,0,0|2,0,0]=4 6573 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)O 1626a_100102631434_100000037485 [0,2,0,0,0,0|1,0,0]=3 6574 B13R1.510 CN(C)C(=O)c1ccc(c(c1)I)O 240690a_100102631434_100000037485 [0,2,0,0,0,0|1,0,0]=3 6575 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Br 240690a_100102631434_100000689001 [0,2,0,0,0,0|2,0,0]=4 6576 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Br 527a_100102631434_100000689001 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Cl 240690a_100102631434_100011933997 [0,2,0,0,0,0|2,0,0]=4 6578 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100102631434_100011933997 [0,2,0,0,0,0|2,0,0]=4 6579 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)F 240690a_100102631434_100000035894 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)F 527a_100102631434_100000035894 [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 1626a_100102631434_100000239334 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 240690a_100102631434_100000239334 [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.510 CN(C)C(=O)c1ccc(c(c1)O)I 527a_100102631434_100000239334 [0,2,0,0,0,0|2,0,0]=4 6584 B13R1.510 Cc1cc(ccc1Br)C(=O)C(C)C 1458a_100000692631_100000210206 [0,2,0,0,0,0|2,0,0]=4 6585 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 11a_100102631434_100000692631 [0,2,0,0,0,0|2,0,0]=4 6586 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 1626a_100102631434_100000692631 [0,2,0,0,0,0|2,0,0]=4 6587 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 240690a_100102631434_100000692631 [0,2,0,0,0,0|2,0,0]=4 6588 B13R1.510 Cc1cc(ccc1Br)C(=O)N(C)C 527a_100102631434_100000692631 [0,2,0,0,0,0|2,0,0]=4 6589 B13R1.510 Cc1cc(ccc1Cl)C(=O)C(C)C 1458a_100000686306_100000210206 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 11a_100102631434_100000686306 [0,2,0,0,0,0|2,0,0]=4 6591 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 1626a_100102631434_100000686306 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 240690a_100102631434_100000686306 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.510 Cc1cc(ccc1Cl)C(=O)N(C)C 527a_100102631434_100000686306 [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.510 Cc1cc(ccc1F)C(=O)C(C)C 1458a_100000751819_100000210206 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 11a_100102631434_100000751819 [0,2,0,0,0,0|2,0,0]=4 6596 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 1626a_100102631434_100000751819 [0,2,0,0,0,0|2,0,0]=4 6597 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 240690a_100102631434_100000751819 [0,2,0,0,0,0|2,0,0]=4 6598 B13R1.510 Cc1cc(ccc1F)C(=O)N(C)C 527a_100102631434_100000751819 [0,2,0,0,0,0|2,0,0]=4 6599 B13R1.510 Cc1cc(ccc1I)C(=O)C(C)C 1458a_100000751300_100000210206 [0,2,0,0,0,0|2,0,0]=4 6600 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 11a_100102631434_100000751300 [0,2,0,0,0,0|2,0,0]=4 6601 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 1626a_100102631434_100000751300 [0,2,0,0,0,0|2,0,0]=4 6602 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 240690a_100102631434_100000751300 [0,2,0,0,0,0|2,0,0]=4 6603 B13R1.510 Cc1cc(ccc1I)C(=O)N(C)C 527a_100102631434_100000751300 [0,2,0,0,0,0|2,0,0]=4 6604 B13R1.510 Cc1cc(ccc1O)C(=O)C(C)C 1458a_100000685612_100000210206 [0,2,0,0,0,0|1,0,0]=3 6605 B13R1.510 Cc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000685612 [0,2,0,0,0,0|1,0,0]=3 6606 B13R1.510 Cc1ccc(cc1Br)C(=O)C(C)C 1458a_100000186397_100000210206 [0,2,0,0,0,0|2,0,0]=4 6607 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 11a_100102631434_100000186397 [0,2,0,0,0,0|2,0,0]=4 6608 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 1626a_100102631434_100000186397 [0,2,0,0,0,0|2,0,0]=4 6609 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 240690a_100102631434_100000186397 [0,2,0,0,0,0|2,0,0]=4 6610 B13R1.510 Cc1ccc(cc1Br)C(=O)N(C)C 527a_100102631434_100000186397 [0,2,0,0,0,0|2,0,0]=4 6611 B13R1.510 Cc1ccc(cc1C)C(=O)C(C)C 1458a_100000210898_100000210206 [0,2,0,0,0,0|2,0,0]=4 6612 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 11a_100102631434_100000210898 [0,2,0,0,0,0|2,0,0]=4 6613 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 1626a_100102631434_100000210898 [0,2,0,0,0,0|2,0,0]=4 6614 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 240690a_100102631434_100000210898 [0,2,0,0,0,0|2,0,0]=4 6615 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 527a_100102631434_100000210898 [0,2,0,0,0,0|2,0,0]=4 6616 B13R1.510 Cc1ccc(cc1Cl)C(=O)C(C)C 1458a_100000751740_100000210206 [0,2,0,0,0,0|2,0,0]=4 6617 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 11a_100102631434_100000751740 [0,2,0,0,0,0|2,0,0]=4 6618 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 1626a_100102631434_100000751740 [0,2,0,0,0,0|2,0,0]=4 6619 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 240690a_100102631434_100000751740 [0,2,0,0,0,0|2,0,0]=4 6620 B13R1.510 Cc1ccc(cc1Cl)C(=O)N(C)C 527a_100102631434_100000751740 [0,2,0,0,0,0|2,0,0]=4 6621 B13R1.510 Cc1ccc(cc1F)C(=O)C(C)C 1458a_100000212313_100000210206 [0,2,0,0,0,0|2,0,0]=4 6622 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 11a_100102631434_100000212313 [0,2,0,0,0,0|2,0,0]=4 6623 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 1626a_100102631434_100000212313 [0,2,0,0,0,0|2,0,0]=4 6624 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 240690a_100102631434_100000212313 [0,2,0,0,0,0|2,0,0]=4 6625 B13R1.510 Cc1ccc(cc1F)C(=O)N(C)C 527a_100102631434_100000212313 [0,2,0,0,0,0|2,0,0]=4 6626 B13R1.510 Cc1ccc(cc1I)C(=O)C(C)C 1458a_100000751299_100000210206 [0,2,0,0,0,0|2,0,0]=4 6627 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 11a_100102631434_100000751299 [0,2,0,0,0,0|2,0,0]=4 6628 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 1626a_100102631434_100000751299 [0,2,0,0,0,0|2,0,0]=4 6629 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 240690a_100102631434_100000751299 [0,2,0,0,0,0|2,0,0]=4 6630 B13R1.510 Cc1ccc(cc1I)C(=O)N(C)C 527a_100102631434_100000751299 [0,2,0,0,0,0|2,0,0]=4 6631 B13R1.510 Cc1ccc(cc1O)C(=O)C(C)C 1458a_100000233767_100000210206 [0,2,0,0,0,0|2,0,0]=4 6632 B13R1.510 Cc1ccc(cc1O)C(=O)N(C)C 240690a_100102631434_100000233767 [0,2,0,0,0,0|2,0,0]=4 6633 B13R1.525 CC(C)(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000701730 [0,2,0,0,0,0|1,0,0]=3 6634 B13R1.525 O=C(c1ccc(cc1)O)C(F)(F)F 1458a_100000212099_200000243211 [0,2,0,0,0,0|2,0,0]=4 6635 B13R1.525 O=C(c1ccc(cc1)O)C(F)(F)F 271570a_203496583355_100000740926 [0,2,0,0,0,0|2,0,0]=4 6636 B13R1.49 C#Cc1cc(ccc1C)C(=O)CC 1458a_200012278110_100000210202 [0,2,0,0,0,0|2,0,0]=4 6637 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 11a_106832991635_200012278110 [0,2,0,0,0,0|2,0,0]=4 6638 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 1626a_100102657272_200012278110 [0,2,0,0,0,0|2,0,0]=4 6639 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 527a_100102657272_200012278110 [0,2,0,0,0,0|2,0,0]=4 6640 B13R1.49 C=Cc1cc(ccc1Br)C(=O)OC 271570a_100011290941_100012349818 [0,2,0,0,0,0|1,0,0]=3 6641 B13R1.49 C=Cc1cc(ccc1C)C(=O)OC 271570a_100011290941_100011218856 [0,2,0,0,0,0|1,0,0]=3 6642 B13R1.49 C=Cc1cc(ccc1Cl)C(=O)OC 271570a_100011290941_100011294800 [0,2,0,0,0,0|1,0,0]=3 6643 B13R1.49 C=Cc1cc(ccc1F)C(=O)CC 271570a_100011290941_100011216493 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.49 C=Cc1cc(ccc1F)C(=O)NC 271570a_100011290941_200012359898 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.49 C=Cc1cc(ccc1F)C(=O)OC 271570a_100011290941_100000722584 [0,2,0,0,0,0|1,0,0]=3 6646 B13R1.49 C=Cc1cc(ccc1N)C(=O)OC 271570a_100011290941_100000187552 [0,2,0,0,0,0|1,0,0]=3 6647 B13R1.49 C=Cc1cc(ccc1O)C(=O)OC 271570a_100011290941_100000216328 [0,2,0,0,0,0|0,0,0]=2 6648 B13R1.49 C=Cc1cc(cnc1Cl)C(=O)OC 271570a_100011290941_100010188758 [0,2,0,0,0,0|2,0,0]=4 6649 B13R1.49 C=Cc1cc(cnc1F)C(=O)OC 271570a_100011290941_100000117919 [0,2,0,0,0,0|2,0,0]=4 6650 B13R1.49 C=Cc1cc(cnc1N)C(=O)OC 271570a_100011290941_100009816800 [0,2,0,0,0,0|2,0,0]=4 6651 B13R1.49 C=Cc1cc(cnc1O)C(=O)OC 271570a_100011290941_100010109663 [0,2,0,0,0,0|1,0,0]=3 6652 B13R1.49 C=Cc1cc(coc1=O)C(=O)OC 271570a_100011290941_100009812866 [0,2,0,0,0,0|1,0,1]=4 6653 B13R1.49 C=Cc1cc(ncc1C)C(=O)OC 271570a_100011290941_100000065005 [0,2,0,0,0,0|2,0,0]=4 6654 B13R1.49 C=Cc1nc(ccc1C)C(=O)OC 271570a_100011290941_100010143800 [0,2,0,0,0,0|2,0,0]=4 6655 B13R1.49 C=Cc1nc(ccc1F)C(=O)OC 271570a_100011290941_100010189626 [0,2,0,0,0,0|2,0,0]=4 6656 B13R1.49 C=Cc1nc(ccc1O)C(=O)OC 271570a_100011290941_200009815348 [0,2,0,0,0,0|1,0,0]=3 6657 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_100000210202 [0,2,0,0,0,0|2,0,0]=4 6658 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_100000210202 [0,2,0,0,0,0|2,0,0]=4 6659 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_100000210202 [0,2,0,0,0,0|2,0,0]=4 6660 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_100000210202 [0,2,0,0,0,0|1,0,0]=3 6661 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Br 1458a_100010152358_100000210202 [0,2,0,0,0,0|2,0,0]=4 6662 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210202 [0,2,0,0,0,0|2,0,0]=4 6663 B13R1.49 CCC(=O)c1ccc(c(c1)CC)F 1458a_100009883079_100000210202 [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.49 CCC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_100000210202 [0,2,0,0,0,0|2,0,0]=4 6665 B13R1.49 CCC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_100000210202 [0,2,0,0,0,0|2,0,0]=4 6666 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [0,2,0,0,0,0|2,0,0]=4 6667 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [0,2,0,0,0,0|2,0,0]=4 6668 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [0,2,0,0,0,0|2,0,0]=4 6669 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [0,2,0,0,0,0|2,0,0]=4 6670 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [0,2,0,0,0,0|2,0,0]=4 6671 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [0,2,0,0,0,0|1,0,0]=3 6672 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_100011216493_200000210301 [0,2,0,0,0,0|2,0,0]=4 6673 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100011216493 [0,2,0,0,0,0|2,0,0]=4 6674 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_100011216493_200025704644 [0,2,0,0,0,0|2,0,0]=4 6675 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011216493 [0,2,0,0,0,0|2,0,0]=4 6676 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 11a_106832991635_100010152358 [0,2,0,0,0,0|2,0,0]=4 6677 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 1626a_100102657272_100010152358 [0,2,0,0,0,0|2,0,0]=4 6678 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 240690a_100102657272_100010152358 [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 527a_100102657272_100010152358 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 11a_106832991635_100000102533 [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 1626a_100102657272_100000102533 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 240690a_100102657272_100000102533 [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 527a_100102657272_100000102533 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.49 CCc1cc(ccc1F)C(=O)NC 11a_106832991635_100009883079 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.49 CCc1cc(ccc1F)C(=O)NC 1626a_100102657272_100009883079 [0,2,0,0,0,0|2,0,0]=4 6686 B13R1.49 CCc1cc(ccc1F)C(=O)NC 240690a_100102657272_100009883079 [0,2,0,0,0,0|2,0,0]=4 6687 B13R1.49 CCc1cc(ccc1F)C(=O)NC 527a_100102657272_100009883079 [0,2,0,0,0,0|2,0,0]=4 6688 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 11a_106832991635_100010253904 [0,2,0,0,0,0|2,0,0]=4 6689 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 1626a_100102657272_100010253904 [0,2,0,0,0,0|2,0,0]=4 6690 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 240690a_100102657272_100010253904 [0,2,0,0,0,0|2,0,0]=4 6691 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Br 527a_100102657272_100010253904 [0,2,0,0,0,0|2,0,0]=4 6692 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 11a_106832991635_100000696165 [0,2,0,0,0,0|2,0,0]=4 6693 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100102657272_100000696165 [0,2,0,0,0,0|2,0,0]=4 6694 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 240690a_100102657272_100000696165 [0,2,0,0,0,0|2,0,0]=4 6695 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)Cl 527a_100102657272_100000696165 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)F 11a_106832991635_100000697239 [0,2,0,0,0,0|2,0,0]=4 6697 B13R1.49 CNC(=O)c1ccc(c(c1)C#N)F 1626a_100102657272_100000697239 [0,2,0,0,0,0|2,0,0]=4 6698 B13R1.49 CNC(=O)c1ccc(c(c1)CO)Br 1626a_100102657272_100010218026 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.49 CNC(=O)c1ccc(c(c1)CO)Br 240690a_100102657272_100010218026 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.49 CNC(=O)c1ccc(c(c1)CO)F 1626a_100102657272_100011803322 [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.49 CNC(=O)c1ccc(c(c1)CO)F 240690a_100102657272_100011803322 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 2230a_100000737617_200000210301 [0,2,0,0,0,0|2,0,0]=4 6703 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 34a_100000737617_200000210301 [0,2,0,0,0,0|2,0,0]=4 6704 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 7a_100000737617_200000210301 [0,2,0,0,0,0|2,0,0]=4 6705 B13R1.49 CNC(=O)c1ccc(c(c1)NC)Cl 34a_100000740709_200000210301 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 27a_100102657272_200012359898 [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 34a_100011295210_200000210301 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_100000737617_200025704644 [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 34a_100000737617_200025704644 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 7a_100000737617_200025704644 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])Cl 34a_100000740709_200025704644 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])F 34a_100011295210_200025704644 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 11a_106832991635_100011934951 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 1626a_100102657272_100011934951 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 240690a_100102657272_100011934951 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 527a_100102657272_100011934951 [0,2,0,0,0,0|2,0,0]=4 6717 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 11a_106832991635_100000212341 [0,2,0,0,0,0|2,0,0]=4 6718 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 1626a_100102657272_100000212341 [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 240690a_100102657272_100000212341 [0,2,0,0,0,0|2,0,0]=4 6720 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 527a_100102657272_100000212341 [0,2,0,0,0,0|2,0,0]=4 6721 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 11a_106832991635_100000181799 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 1626a_100102657272_100000181799 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 240690a_100102657272_100000181799 [0,2,0,0,0,0|2,0,0]=4 6724 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 527a_100102657272_100000181799 [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 11a_106832991635_100000757635 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 1626a_100102657272_100000757635 [0,2,0,0,0,0|2,0,0]=4 6727 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 240690a_100102657272_100000757635 [0,2,0,0,0,0|2,0,0]=4 6728 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 527a_100102657272_100000757635 [0,2,0,0,0,0|2,0,0]=4 6729 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 11a_106832991635_100012356290 [0,2,0,0,0,0|2,0,0]=4 6730 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 1626a_100102657272_100012356290 [0,2,0,0,0,0|2,0,0]=4 6731 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 240690a_100102657272_100012356290 [0,2,0,0,0,0|2,0,0]=4 6732 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 527a_100102657272_100012356290 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [0,2,0,0,0,0|1,0,0]=3 6734 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200000210301_200012359898 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200012359898_200000210301 [0,2,0,0,0,0|2,0,0]=4 6736 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200012359898_200025704644 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_200012359898 [0,2,0,0,0,0|2,0,0]=4 6738 B13R1.49 CNc1cc(cnc1F)C(=O)OC 27a_100102657272_100000117919 [0,2,0,0,0,0|2,0,0]=4 6739 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_100000065005_200000210301 [0,2,0,0,0,0|2,0,0]=4 6740 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_200000210301_100000065005 [0,2,0,0,0,0|2,0,0]=4 6741 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_100000065005_200025704644 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_200025704644_100000065005 [0,2,0,0,0,0|2,0,0]=4 6743 B13R1.49 COC(=O)c1cc(c(cn1)O)OC 271570a_203496583355_100010136178 [0,2,0,0,0,0|1,0,0]=3 6744 B13R1.49 COC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010150795 [0,2,0,0,0,0|0,0,0]=2 6745 B13R1.49 COC(=O)c1ccc(c(c1)C=O)O 271570a_203496583355_100012274322 [0,2,0,0,0,0|0,0,0]=2 6746 B13R1.49 COC(=O)c1ccc(c(c1)CO)O 271570a_203496583355_100010201863 [0,2,0,0,0,0|0,0,0]=2 6747 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [0,2,0,0,0,0|1,0,0]=3 6748 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [0,2,0,0,0,0|1,0,0]=3 6749 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [0,2,0,0,0,0|1,0,0]=3 6750 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [0,2,0,0,0,0|1,0,0]=3 6751 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [0,2,0,0,0,0|1,0,0]=3 6752 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [0,2,0,0,0,0|1,0,0]=3 6753 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [0,2,0,0,0,0|1,0,0]=3 6754 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [0,2,0,0,0,0|1,0,0]=3 6755 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [0,2,0,0,0,0|1,0,0]=3 6756 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [0,2,0,0,0,0|1,0,0]=3 6757 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [0,2,0,0,0,0|1,0,0]=3 6758 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [0,2,0,0,0,0|1,0,0]=3 6759 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [0,2,0,0,0,0|0,0,0]=2 6760 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [0,2,0,0,0,0|1,0,0]=3 6761 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [0,2,0,0,0,0|1,0,0]=3 6762 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [0,2,0,0,0,0|1,0,0]=3 6763 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [0,2,0,0,0,0|1,0,0]=3 6764 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [0,2,0,0,0,0|1,0,0]=3 6765 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [0,2,0,0,0,0|1,0,0]=3 6766 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [0,2,0,0,0,0|1,0,0]=3 6767 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [0,2,0,0,0,0|1,0,0]=3 6768 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [0,2,0,0,0,0|1,0,0]=3 6769 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [0,2,0,0,0,0|1,0,0]=3 6770 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [0,2,0,0,0,0|1,0,0]=3 6771 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [0,2,0,0,0,0|1,0,0]=3 6772 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_100012349818_200000210301 [0,2,0,0,0,0|1,0,0]=3 6773 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_200000210301_100012349818 [0,2,0,0,0,0|1,0,0]=3 6774 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_100000723194_200000210301 [0,2,0,0,0,0|1,0,0]=3 6775 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100000723194 [0,2,0,0,0,0|1,0,0]=3 6776 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_100011294800_200000210301 [0,2,0,0,0,0|1,0,0]=3 6777 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_200000210301_100011294800 [0,2,0,0,0,0|1,0,0]=3 6778 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_100000722584_200000210301 [0,2,0,0,0,0|1,0,0]=3 6779 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100000722584 [0,2,0,0,0,0|1,0,0]=3 6780 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_100000187552_200000210301 [0,2,0,0,0,0|1,0,0]=3 6781 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_200000210301_100000187552 [0,2,0,0,0,0|1,0,0]=3 6782 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [0,2,0,0,0,0|0,0,0]=2 6783 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [0,2,0,0,0,0|0,0,0]=2 6784 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100012349818_200025704644 [0,2,0,0,0,0|1,0,0]=3 6785 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012349818 [0,2,0,0,0,0|1,0,0]=3 6786 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_100000723194_200025704644 [0,2,0,0,0,0|1,0,0]=3 6787 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100000723194 [0,2,0,0,0,0|1,0,0]=3 6788 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_100011294800_200025704644 [0,2,0,0,0,0|1,0,0]=3 6789 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011294800 [0,2,0,0,0,0|1,0,0]=3 6790 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000722584_200025704644 [0,2,0,0,0,0|1,0,0]=3 6791 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000722584 [0,2,0,0,0,0|1,0,0]=3 6792 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_100000187552_200025704644 [0,2,0,0,0,0|1,0,0]=3 6793 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100000187552 [0,2,0,0,0,0|1,0,0]=3 6794 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [0,2,0,0,0,0|0,0,0]=2 6795 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [0,2,0,0,0,0|0,0,0]=2 6796 B13R1.49 COC(=O)c1ccc(c(n1)C#N)O 271570a_203496583355_100010187627 [0,2,0,0,0,0|1,0,0]=3 6797 B13R1.49 COC(=O)c1ccc(c(n1)OC)O 271570a_203496583355_100010189641 [0,2,0,0,0,0|1,0,0]=3 6798 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_100010143800_200000210301 [0,2,0,0,0,0|2,0,0]=4 6799 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_200000210301_100010143800 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.49 COC(=O)c1ccc(c(n1)SC)F 62a_100010189626_200000210301 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.49 COC(=O)c1ccc(c(n1)SC)F 62a_200000210301_100010189626 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200000210301_200009815348 [0,2,0,0,0,0|1,0,0]=3 6803 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200009815348_200000210301 [0,2,0,0,0,0|1,0,0]=3 6804 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_100010143800_200025704644 [0,2,0,0,0,0|2,0,0]=4 6805 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_200025704644_100010143800 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])F 62a_100010189626_200025704644 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])F 62a_200025704644_100010189626 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200009815348_200025704644 [0,2,0,0,0,0|1,0,0]=3 6809 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200025704644_200009815348 [0,2,0,0,0,0|1,0,0]=3 6810 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 34a_100009840551_200000210301 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 7a_100009840551_200000210301 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 34a_100010999399_200000210301 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 7a_100010999399_200000210301 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 34a_100009857207_200000210301 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 7a_100009857207_200000210301 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.49 COC(=O)c1cnc(c(c1)OC)O 271570a_203496583355_100010074909 [0,2,0,0,0,0|1,0,0]=3 6817 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 34a_100009840551_200025704644 [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 7a_100009840551_200025704644 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 34a_100010999399_200025704644 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 7a_100010999399_200025704644 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 34a_100009857207_200025704644 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 7a_100009857207_200025704644 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.49 COC(=O)c1cnc(c(c1)SC)Cl 62a_100010188758_200000210301 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.49 COC(=O)c1cnc(c(c1)SC)Cl 62a_200000210301_100010188758 [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.49 COC(=O)c1cnc(c(c1)SC)F 62a_100000117919_200000210301 [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.49 COC(=O)c1cnc(c(c1)SC)F 62a_200000210301_100000117919 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.49 COC(=O)c1cnc(c(c1)SC)N 62a_100009816800_200000210301 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.49 COC(=O)c1cnc(c(c1)SC)N 62a_200000210301_100009816800 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_100010109663_200000210301 [0,2,0,0,0,0|1,0,0]=3 6830 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_200000210301_100010109663 [0,2,0,0,0,0|1,0,0]=3 6831 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])Cl 62a_100010188758_200025704644 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])Cl 62a_200025704644_100010188758 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])F 62a_100000117919_200025704644 [0,2,0,0,0,0|2,0,0]=4 6834 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])F 62a_200025704644_100000117919 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])N 62a_100009816800_200025704644 [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])N 62a_200025704644_100009816800 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_100010109663_200025704644 [0,2,0,0,0,0|1,0,0]=3 6838 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_200025704644_100010109663 [0,2,0,0,0,0|1,0,0]=3 6839 B13R1.49 COC(=O)c1coc(=O)c(c1)SC 62a_100009812866_200000210301 [0,2,0,0,0,0|1,0,1]=4 6840 B13R1.49 COC(=O)c1coc(=O)c(c1)SC 62a_200000210301_100009812866 [0,2,0,0,0,0|1,0,1]=4 6841 B13R1.49 COC(=O)c1coc(=O)c(c1)S[13CH3] 62a_100009812866_200025704644 [0,2,0,0,0,0|1,0,1]=4 6842 B13R1.49 COC(=O)c1coc(=O)c(c1)S[13CH3] 62a_200025704644_100009812866 [0,2,0,0,0,0|1,0,1]=4 6843 B13R1.49 COc1cc(ccc1O)C(=O)CF 1458a_100000687070_100015361967 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.49 N#Cc1cc(ccc1O)C(=O)CF 1458a_100009875055_100015361967 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.1807 CCC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_100000210202 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_100000210202 [0,2,0,0,0,0|2,0,0]=4 6847 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210202 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_100000210202 [0,2,0,0,0,0|2,0,0]=4 6849 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_100000210202 [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_100000210202 [0,2,0,0,0,0|2,0,0]=4 6851 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_100000210202 [0,2,0,0,0,0|2,0,0]=4 6852 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210202 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_100000210202 [0,2,0,0,0,0|2,0,0]=4 6854 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210202 [0,2,0,0,0,0|2,0,0]=4 6855 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210202 [0,2,0,0,0,0|2,0,0]=4 6856 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_100000210202 [0,2,0,0,0,0|2,0,0]=4 6857 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_100000210202 [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_100000210202 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210202 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210202 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210202 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_100000210202 [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210202 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210202 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_100000210202 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_100000210202 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_100000210202 [0,2,0,0,0,0|2,0,0]=4 6868 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210202 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_100000210202 [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210202 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_100000210202 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_100000210202 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_100000210202 [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_100000210202 [0,2,0,0,0,0|2,0,0]=4 6875 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210202 [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210202 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210202 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210202 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210202 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_100000210202 [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_100000210202 [0,2,0,0,0,0|2,0,0]=4 6882 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_100000210202 [0,2,0,0,0,0|2,0,0]=4 6883 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_100000210202 [0,2,0,0,0,0|2,0,0]=4 6884 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_100000210202 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.1807 CCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210202 [0,2,0,0,0,0|1,0,0]=3 6886 B13R1.1807 CCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210202 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.1807 CCC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_100000210202 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.1807 CCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210202 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000210202 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210202 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.1807 CCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210202 [0,2,0,0,0,0|2,0,0]=4 6892 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210202 [0,2,0,0,0,0|2,0,0]=4 6893 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210202 [0,2,0,0,0,0|2,0,0]=4 6894 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000210202 [0,2,0,0,0,0|2,0,0]=4 6895 B13R1.1807 CCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210202 [0,2,0,0,0,0|1,0,0]=3 6896 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 11a_106832991635_200012355688 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 1626a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 240690a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 527a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 11a_106832991635_100010204433 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 1626a_100102657272_100010204433 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 240690a_100102657272_100010204433 [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 527a_100102657272_100010204433 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 11a_106832991635_100012921620 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 1626a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6906 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 527a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 11a_106832991635_100000685074 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 1626a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 240690a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 527a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 11a_106832991635_100000695896 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 1626a_100102657272_100000695896 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 240690a_100102657272_100000695896 [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 527a_100102657272_100000695896 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 11a_106832991635_100012344525 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 1626a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 240690a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 527a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 11a_106832991635_100012920494 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 1626a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 240690a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 527a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6924 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 11a_106832991635_100011216168 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 1626a_100102657272_100011216168 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 240690a_100102657272_100011216168 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 527a_100102657272_100011216168 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 11a_106832991635_100000723791 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 1626a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 240690a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 527a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 11a_106832991635_100010439669 [0,2,0,0,0,0|2,0,0]=4 6933 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6934 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6936 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 11a_106832991635_200010768543 [0,2,0,0,0,0|2,0,0]=4 6937 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 1626a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6938 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 240690a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 527a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 11a_106832991635_100000724332 [0,2,0,0,0,0|2,0,0]=4 6941 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 1626a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 240690a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6943 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 527a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 11a_106832991635_100000062099 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 1626a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 240690a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 527a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 11a_106832991635_100013328184 [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 1626a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6950 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 240690a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6951 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 527a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6952 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_106832991635_100000246132 [0,2,0,0,0,0|2,0,0]=4 6953 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 1626a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6954 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6955 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 11a_106832991635_100000724438 [0,2,0,0,0,0|2,0,0]=4 6957 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 1626a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6958 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6959 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 527a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6960 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 11a_106832991635_100013033594 [0,2,0,0,0,0|2,0,0]=4 6961 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 1626a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 11a_106832991635_100009857485 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 1626a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 240690a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 527a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_106832991635_100011934218 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6971 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 11a_106832991635_100000212284 [0,2,0,0,0,0|2,0,0]=4 6973 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6974 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6975 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 11a_106832991635_100000687843 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 1626a_100102657272_100000687843 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 240690a_100102657272_100000687843 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 527a_100102657272_100000687843 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 11a_106832991635_100025704182 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 1626a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 240690a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 527a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 11a_106832991635_100012920486 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 1626a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 240690a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 527a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 11a_106832991635_200011217225 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 1626a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 240690a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 527a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 11a_106832991635_100012354683 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 1626a_100102657272_100012354683 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 240690a_100102657272_100012354683 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 527a_100102657272_100012354683 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 11a_106832991635_100012347732 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 1626a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 527a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 11a_106832991635_100012024349 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 1626a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 240690a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 527a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 11a_106832991635_100012920545 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 1626a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 240690a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 7007 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 527a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 11a_106832991635_100012180961 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 1626a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 7010 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 240690a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 527a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 7012 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 11a_106832991635_100000686409 [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 1626a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 240690a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 527a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)O 240690a_100102657272_100009839767 [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 11a_106832991635_100011217226 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 527a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 11a_106832991635_100011217469 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 11a_106832991635_100000690020 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 1626a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 240690a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 527a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 11a_106832991635_100012920488 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 1626a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 240690a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 527a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 11a_106832991635_100000718434 [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 1626a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 240690a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 527a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7037 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 11a_106832991635_100000767126 [0,2,0,0,0,0|2,0,0]=4 7038 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 1626a_100102657272_100000767126 [0,2,0,0,0,0|2,0,0]=4 7039 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 240690a_100102657272_100000767126 [0,2,0,0,0,0|2,0,0]=4 7040 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 527a_100102657272_100000767126 [0,2,0,0,0,0|2,0,0]=4 7041 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 11a_106832991635_100011997751 [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 1626a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7043 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 240690a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7044 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 527a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 11a_106832991635_100000687535 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 1626a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 240690a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 527a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 11a_106832991635_100000691139 [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 1626a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 240690a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 527a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 240690a_100102657272_200009924051 [0,2,0,0,0,0|1,0,0]=3 7054 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 527a_100102657272_200009924051 [0,2,0,0,0,0|1,0,0]=3 7055 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_200107972064 [0,2,0,0,0,0|1,0,0]=3 7056 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 11a_106832991635_100010184404 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 1626a_100102657272_100010184404 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 240690a_100102657272_100010184404 [0,2,0,0,0,0|2,0,0]=4 7059 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 527a_100102657272_100010184404 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 11a_106832991635_100000688017 [0,2,0,0,0,0|2,0,0]=4 7061 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 1626a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 240690a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 527a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 240690a_100102657272_100010827371 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 527a_100102657272_100010827371 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 240690a_100102657272_100010233826 [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 527a_100102657272_100010233826 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 240690a_100102657272_100009831561 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 527a_100102657272_100009831561 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100102657272_200009814723 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 527a_100102657272_200009814723 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 240690a_100102657272_100010188153 [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 527a_100102657272_100010188153 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 240690a_100102657272_100009910333 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 527a_100102657272_100009910333 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 240690a_100102657272_100012182723 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 527a_100102657272_100012182723 [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.1807 CNC(=O)c1cc(c(cc1O)O)Br 527a_100102657272_100009813906 [0,2,0,0,0,0|1,0,0]=3 7079 B13R1.1807 COC(=O)c1cc(c(cc1C)C)O 271570a_203496583355_200012360129 [0,2,0,0,0,0|1,0,0]=3 7080 B13R1.1807 COC(=O)c1cc(c(cc1C)F)O 271570a_203496583355_100013328185 [0,2,0,0,0,0|1,0,0]=3 7081 B13R1.1807 COC(=O)c1cc(c(cc1C)N)O 271570a_203496583355_100010236254 [0,2,0,0,0,0|1,0,0]=3 7082 B13R1.1807 COC(=O)c1cc(c(cc1C)O)F 271570a_203496583355_100010291504 [0,2,0,0,0,0|0,0,0]=2 7083 B13R1.1807 COC(=O)c1cc(c(cc1Cl)C)O 271570a_203496583355_100014124666 [0,2,0,0,0,0|1,0,0]=3 7084 B13R1.1807 COC(=O)c1cc(c(cc1Cl)N)O 271570a_203496583355_100010204190 [0,2,0,0,0,0|1,0,0]=3 7085 B13R1.1807 COC(=O)c1cc(c(cc1F)C)O 271570a_203496583355_100012920548 [0,2,0,0,0,0|1,0,0]=3 7086 B13R1.1807 COC(=O)c1cc(c(cc1F)Cl)O 271570a_203496583355_100012920370 [0,2,0,0,0,0|1,0,0]=3 7087 B13R1.1807 COC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100000718433 [0,2,0,0,0,0|1,0,0]=3 7088 B13R1.1807 COC(=O)c1cc(c(cc1F)N)O 271570a_203496583355_100010764354 [0,2,0,0,0,0|1,0,0]=3 7089 B13R1.1807 COC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010769226 [0,2,0,0,0,0|0,0,0]=2 7090 B13R1.1807 COC(=O)c1cc(c(cc1F)O)N 271570a_203496583355_100000760059 [0,2,0,0,0,0|0,0,0]=2 7091 B13R1.1807 COC(=O)c1cc(c(cc1N)C)O 271570a_203496583355_100010892302 [0,2,0,0,0,0|1,0,0]=3 7092 B13R1.1807 COC(=O)c1cc(c(cc1N)Cl)O 271570a_203496583355_100010253894 [0,2,0,0,0,0|1,0,0]=3 7093 B13R1.1807 COC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100000699149 [0,2,0,0,0,0|1,0,0]=3 7094 B13R1.1807 COC(=O)c1cc(c(cc1N)O)F 271570a_203496583355_100000724440 [0,2,0,0,0,0|0,0,0]=2 7095 B13R1.1807 COC(=O)c1cc(c(cc1O)Br)F 271570a_203496583355_100014686389 [0,2,0,0,0,0|1,0,0]=3 7096 B13R1.1807 COC(=O)c1cc(c(cc1O)C)F 271570a_203496583355_100015763395 [0,2,0,0,0,0|1,0,0]=3 7097 B13R1.1807 COC(=O)c1cc(c(cc1O)C)N 271570a_203496583355_100000730709 [0,2,0,0,0,0|1,0,0]=3 7098 B13R1.1807 COC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_100010233952 [0,2,0,0,0,0|1,0,0]=3 7099 B13R1.1807 COC(=O)c1cc(c(cc1O)Cl)Br 271570a_203496583355_200012920379 [0,2,0,0,0,0|1,0,0]=3 7100 B13R1.1807 COC(=O)c1cc(c(cc1O)F)C 271570a_203496583355_100015451887 [0,2,0,0,0,0|1,0,0]=3 7101 B13R1.1807 COC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100010195689 [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.1807 COC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100010371811 [0,2,0,0,0,0|1,0,0]=3 7103 B13R1.1807 COC(=O)c1cc(c(cc1O)N)F 271570a_203496583355_100010764352 [0,2,0,0,0,0|1,0,0]=3 7104 B13R1.1807 COC(=O)c1cc(c(cc1O)N)O 271570a_203496583355_100010075205 [0,2,0,0,0,0|1,0,0]=3 7105 B13R1.1807 COC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_100010760826 [0,2,0,0,0,0|0,0,0]=2 7106 B13R1.1807 COC(=O)c1cc(c(nc1C)N)O 271570a_203496583355_200020932694 [0,2,0,0,0,0|2,0,0]=4 7107 B13R1.1807 COC(=O)c1cc(c(nc1C)O)O 271570a_203496583355_100000729808 [0,2,0,0,0,0|1,0,0]=3 7108 B13R1.1807 COC(=O)c1cc(c(nc1O)C)F 271570a_203496583355_100011155941 [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.1807 O=C(CF)c1cc(c(cc1F)O)Cl 1458a_200009924051_100015361967 [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.1807 O=C(CF)c1cc(c(cc1O)O)Br 1458a_100009813906_100015361967 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.1808 CCC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_100000210202 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.1808 CCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210202 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.1808 CCC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_100000210202 [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210202 [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210202 [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_100000210202 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100000210202 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_100000210202 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210202 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_100000210202 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [0,2,0,0,0,0|1,0,0]=3 7122 B13R1.1808 CCC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_100000210202 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.1808 CCC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_100000210202 [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_100000210202 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210202 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210202 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_100000210202 [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100000210202 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_100000210202 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.1808 CCC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_100000210202 [0,2,0,0,0,0|2,0,0]=4 7131 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_100000210202 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_100000210202 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210202 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_100000210202 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_100000210202 [0,2,0,0,0,0|2,0,0]=4 7136 B13R1.1808 CCC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_100000210202 [0,2,0,0,0,0|1,0,0]=3 7137 B13R1.1808 CCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210202 [0,2,0,0,0,0|2,0,0]=4 7138 B13R1.1808 CCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210202 [0,2,0,0,0,0|2,0,0]=4 7139 B13R1.1808 CCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210202 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.1808 CCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000210202 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.1808 CCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000210202 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [0,2,0,0,0,0|1,0,0]=3 7143 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 11a_106832991635_100012356454 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 1626a_100102657272_100012356454 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 240690a_100102657272_100012356454 [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.1808 CNC(=O)c1ccc(c(c1Br)F)F 527a_100102657272_100012356454 [0,2,0,0,0,0|2,0,0]=4 7147 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 240690a_100102657272_100016068111 [0,2,0,0,0,0|2,0,0]=4 7148 B13R1.1808 CNC(=O)c1ccc(c(c1Br)O)Br 527a_100102657272_100016068111 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 11a_106832991635_100000061971 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 1626a_100102657272_100000061971 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 240690a_100102657272_100000061971 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.1808 CNC(=O)c1ccc(c(c1C)F)F 527a_100102657272_100000061971 [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_106832991635_100010208263 [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100102657272_100010208263 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100102657272_100010208263 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100102657272_100010208263 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 11a_106832991635_100010074829 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100102657272_100010074829 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100102657272_100010074829 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100102657272_100010074829 [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 11a_106832991635_100000061447 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 1626a_100102657272_100000061447 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 240690a_100102657272_100000061447 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)C)F 527a_100102657272_100000061447 [0,2,0,0,0,0|2,0,0]=4 7165 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 11a_106832991635_200012347731 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 1626a_100102657272_200012347731 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 240690a_100102657272_200012347731 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)Br 527a_100102657272_200012347731 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 11a_106832991635_100010209669 [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 1626a_100102657272_100010209669 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 240690a_100102657272_100010209669 [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)Cl)F 527a_100102657272_100010209669 [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 11a_106832991635_200010192171 [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100102657272_200010192171 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100102657272_200010192171 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100102657272_200010192171 [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 11a_106832991635_100009888510 [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 1626a_100102657272_100009888510 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 240690a_100102657272_100009888510 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)F)F 527a_100102657272_100009888510 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)O)O 240690a_100102657272_100009910189 [0,2,0,0,0,0|1,0,0]=3 7182 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 11a_106832991635_200016032200 [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 1626a_100102657272_200016032200 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 240690a_100102657272_200016032200 [0,2,0,0,0,0|2,0,0]=4 7185 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)Br 527a_100102657272_200016032200 [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 11a_106832991635_100010204296 [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 1626a_100102657272_100010204296 [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 240690a_100102657272_100010204296 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.1808 CNC(=O)c1ccc(c(c1F)Br)F 527a_100102657272_100010204296 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 11a_106832991635_100000722919 [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 1626a_100102657272_100000722919 [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 240690a_100102657272_100000722919 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Br 527a_100102657272_100000722919 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 11a_106832991635_100010768504 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 1626a_100102657272_100010768504 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 240690a_100102657272_100010768504 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 527a_100102657272_100010768504 [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 11a_106832991635_100012183103 [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 1626a_100102657272_100012183103 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 240690a_100102657272_100012183103 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)Cl 527a_100102657272_100012183103 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 11a_106832991635_100000067293 [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 1626a_100102657272_100000067293 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 240690a_100102657272_100000067293 [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)F 527a_100102657272_100000067293 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 11a_106832991635_100000719840 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 1626a_100102657272_100000719840 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 240690a_100102657272_100000719840 [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)Br 527a_100102657272_100000719840 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 11a_106832991635_100000722910 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 1626a_100102657272_100000722910 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 240690a_100102657272_100000722910 [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)C 527a_100102657272_100000722910 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 11a_106832991635_100000034381 [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 1626a_100102657272_100000034381 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 240690a_100102657272_100000034381 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.1808 CNC(=O)c1ccc(c(c1F)Cl)F 527a_100102657272_100000034381 [0,2,0,0,0,0|2,0,0]=4 7218 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 11a_106832991635_100009816880 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 1626a_100102657272_100009816880 [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 240690a_100102657272_100009816880 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Br 527a_100102657272_100009816880 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 11a_106832991635_100011219789 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 1626a_100102657272_100011219789 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 240690a_100102657272_100011219789 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)C 527a_100102657272_100011219789 [0,2,0,0,0,0|2,0,0]=4 7226 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 11a_106832991635_100000085317 [0,2,0,0,0,0|2,0,0]=4 7227 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 1626a_100102657272_100000085317 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 240690a_100102657272_100000085317 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)Cl 527a_100102657272_100000085317 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 11a_106832991635_100000766628 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 1626a_100102657272_100000766628 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 240690a_100102657272_100000766628 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)F 527a_100102657272_100000766628 [0,2,0,0,0,0|2,0,0]=4 7234 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 11a_106832991635_100010177778 [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 1626a_100102657272_100010177778 [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 240690a_100102657272_100010177778 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)I 527a_100102657272_100010177778 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.1808 CNC(=O)c1ccc(c(c1F)F)O 240690a_100102657272_100000036740 [0,2,0,0,0,0|1,0,0]=3 7239 B13R1.1808 CNC(=O)c1ccc(c(c1F)O)F 240690a_100102657272_100000084588 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 11a_106832991635_100010188221 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 1626a_100102657272_100010188221 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 240690a_100102657272_100010188221 [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 527a_100102657272_100010188221 [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 240690a_100102657272_100000742916 [0,2,0,0,0,0|2,0,0]=4 7245 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 527a_100102657272_100000742916 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)Br 240690a_100102657272_100010761495 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)Br 527a_100102657272_100010761495 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.1808 CNC(=O)c1ccc(c(c1O)F)F 240690a_100102657272_100011799213 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [0,2,0,0,0,0|0,0,0]=2 7250 B13R1.1808 COC(=O)c1ccc(c(c1C)F)O 271570a_203496583355_100010291505 [0,2,0,0,0,0|0,0,0]=2 7251 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [0,2,0,0,0,0|1,0,0]=3 7252 B13R1.1808 COC(=O)c1ccc(c(c1C)O)N 271570a_203496583355_100010764323 [0,2,0,0,0,0|1,0,0]=3 7253 B13R1.1808 COC(=O)c1ccc(c(c1C)O)O 271570a_203496583355_100010889012 [0,2,0,0,0,0|0,0,0]=2 7254 B13R1.1808 COC(=O)c1ccc(c(c1Cl)O)N 271570a_203496583355_200016031531 [0,2,0,0,0,0|1,0,0]=3 7255 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [0,2,0,0,0,0|0,0,0]=2 7256 B13R1.1808 COC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010982024 [0,2,0,0,0,0|0,0,0]=2 7257 B13R1.1808 COC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100000697099 [0,2,0,0,0,0|1,0,0]=3 7258 B13R1.1808 COC(=O)c1ccc(c(c1F)O)O 271570a_203496583355_100011096176 [0,2,0,0,0,0|0,0,0]=2 7259 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [0,2,0,0,0,0|0,0,0]=2 7260 B13R1.1808 COC(=O)c1ccc(c(c1N)F)O 271570a_203496583355_100022009169 [0,2,0,0,0,0|0,0,0]=2 7261 B13R1.1808 COC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_100010710315 [0,2,0,0,0,0|1,0,0]=3 7262 B13R1.1808 COC(=O)c1ccc(c(c1O)F)O 271570a_203496583355_100011092008 [0,2,0,0,0,0|0,0,0]=2 7263 B13R1.1808 O=C(CF)c1ccc(c(c1Cl)O)O 1458a_100009910189_100015361967 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.1808 O=C(CF)c1ccc(c(c1F)F)O 1458a_100000036740_100015361967 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.1808 O=C(CF)c1ccc(c(c1O)O)O 1458a_100000037941_100015361967 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_100000210202 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_100000210202 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100000210202 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210202 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_100000210202 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210202 [0,2,0,0,0,0|1,0,0]=3 7272 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210202 [0,2,0,0,0,0|1,0,0]=3 7273 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_100000210202 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_100000210202 [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_100000210202 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_100000210202 [0,2,0,0,0,0|2,0,0]=4 7277 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_100000210202 [0,2,0,0,0,0|2,0,0]=4 7278 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210202 [0,2,0,0,0,0|1,0,0]=3 7279 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100000210202 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_100000210202 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100000210202 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100000210202 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_100000210202 [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_100000210202 [0,2,0,0,0,0|2,0,0]=4 7285 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210202 [0,2,0,0,0,0|1,0,0]=3 7286 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210202 [0,2,0,0,0,0|1,0,0]=3 7287 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_100000210202 [0,2,0,0,0,0|2,0,0]=4 7288 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_100000210202 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100000210202 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_100000210202 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_100000210202 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210202 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210202 [0,2,0,0,0,0|1,0,0]=3 7294 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_100000210202 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_100000210202 [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210202 [0,2,0,0,0,0|1,0,0]=3 7297 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210202 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210202 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210202 [0,2,0,0,0,0|1,0,0]=3 7300 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 11a_106832991635_100000187602 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 1626a_100102657272_100000187602 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 240690a_100102657272_100000187602 [0,2,0,0,0,0|2,0,0]=4 7303 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)Br 527a_100102657272_100000187602 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 11a_106832991635_200012347618 [0,2,0,0,0,0|2,0,0]=4 7305 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 1626a_100102657272_200012347618 [0,2,0,0,0,0|2,0,0]=4 7306 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 240690a_100102657272_200012347618 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)C)F 527a_100102657272_200012347618 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 11a_106832991635_200012920480 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100102657272_200012920480 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100102657272_200012920480 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100102657272_200012920480 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 11a_106832991635_100010291025 [0,2,0,0,0,0|2,0,0]=4 7313 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100102657272_100010291025 [0,2,0,0,0,0|2,0,0]=4 7314 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100102657272_100010291025 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100102657272_100010291025 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 11a_106832991635_100010259547 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 1626a_100102657272_100010259547 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 240690a_100102657272_100010259547 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)F)F 527a_100102657272_100010259547 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100102657272_100000692688 [0,2,0,0,0,0|1,0,0]=3 7321 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100102657272_100000692688 [0,2,0,0,0,0|1,0,0]=3 7322 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100102657272_200009992764 [0,2,0,0,0,0|1,0,0]=3 7323 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 11a_106832991635_100000700660 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 1626a_100102657272_100000700660 [0,2,0,0,0,0|2,0,0]=4 7325 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 240690a_100102657272_100000700660 [0,2,0,0,0,0|2,0,0]=4 7326 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Br)C 527a_100102657272_100000700660 [0,2,0,0,0,0|2,0,0]=4 7327 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 11a_106832991635_100000075298 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 1626a_100102657272_100000075298 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 240690a_100102657272_100000075298 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 527a_100102657272_100000075298 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 11a_106832991635_100000102532 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100102657272_100000102532 [0,2,0,0,0,0|2,0,0]=4 7333 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100102657272_100000102532 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100102657272_100000102532 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 11a_106832991635_100000741972 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 1626a_100102657272_100000741972 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 240690a_100102657272_100000741972 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)F)C 527a_100102657272_100000741972 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 11a_106832991635_100010769667 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 1626a_100102657272_100010769667 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 240690a_100102657272_100010769667 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)I)C 527a_100102657272_100010769667 [0,2,0,0,0,0|2,0,0]=4 7343 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)O)C 240690a_100102657272_100011219978 [0,2,0,0,0,0|1,0,0]=3 7344 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)O)C 527a_100102657272_100011219978 [0,2,0,0,0,0|1,0,0]=3 7345 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 11a_106832991635_100012354307 [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 1626a_100102657272_100012354307 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Br)Cl 240690a_100102657272_100012354307 [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 11a_106832991635_100012356007 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 1626a_100102657272_100012356007 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 240690a_100102657272_100012356007 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)C)Cl 527a_100102657272_100012356007 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 11a_106832991635_100012339221 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100102657272_100012339221 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100102657272_100012339221 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100102657272_100012339221 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 11a_106832991635_200010244527 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100102657272_200010244527 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100102657272_200010244527 [0,2,0,0,0,0|2,0,0]=4 7359 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100102657272_200010244527 [0,2,0,0,0,0|2,0,0]=4 7360 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 11a_106832991635_100011934374 [0,2,0,0,0,0|2,0,0]=4 7361 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 1626a_100102657272_100011934374 [0,2,0,0,0,0|2,0,0]=4 7362 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)Cl 240690a_100102657272_100011934374 [0,2,0,0,0,0|2,0,0]=4 7363 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 11a_106832991635_100000068011 [0,2,0,0,0,0|2,0,0]=4 7364 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 1626a_100102657272_100000068011 [0,2,0,0,0,0|2,0,0]=4 7365 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 240690a_100102657272_100000068011 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)F)F 527a_100102657272_100000068011 [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100102657272_100000184433 [0,2,0,0,0,0|1,0,0]=3 7368 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100102657272_100000184433 [0,2,0,0,0,0|1,0,0]=3 7369 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100102657272_200000078382 [0,2,0,0,0,0|1,0,0]=3 7370 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 11a_106832991635_100010078405 [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 1626a_100102657272_100010078405 [0,2,0,0,0,0|2,0,0]=4 7372 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 240690a_100102657272_100010078405 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Br)F 527a_100102657272_100010078405 [0,2,0,0,0,0|2,0,0]=4 7374 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 11a_106832991635_100000055762 [0,2,0,0,0,0|2,0,0]=4 7375 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 1626a_100102657272_100000055762 [0,2,0,0,0,0|2,0,0]=4 7376 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 240690a_100102657272_100000055762 [0,2,0,0,0,0|2,0,0]=4 7377 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)C)F 527a_100102657272_100000055762 [0,2,0,0,0,0|2,0,0]=4 7378 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 11a_106832991635_100000104779 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100102657272_100000104779 [0,2,0,0,0,0|2,0,0]=4 7380 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100102657272_100000104779 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100102657272_100000104779 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 11a_106832991635_100000061453 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 1626a_100102657272_100000061453 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 240690a_100102657272_100000061453 [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)C 527a_100102657272_100000061453 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 11a_106832991635_100000751656 [0,2,0,0,0,0|2,0,0]=4 7387 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 1626a_100102657272_100000751656 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 240690a_100102657272_100000751656 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)F 527a_100102657272_100000751656 [0,2,0,0,0,0|2,0,0]=4 7390 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)F)O 240690a_100102657272_200000081825 [0,2,0,0,0,0|2,0,0]=4 7391 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)O)F 240690a_100102657272_100000766045 [0,2,0,0,0,0|1,0,0]=3 7392 B13R1.2678 CNC(=O)c1cc(c(c(c1)F)O)F 527a_100102657272_100000766045 [0,2,0,0,0,0|1,0,0]=3 7393 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 11a_106832991635_100012344050 [0,2,0,0,0,0|2,0,0]=4 7394 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 1626a_100102657272_100012344050 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 240690a_100102657272_100012344050 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)C)F 527a_100102657272_100012344050 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 11a_106832991635_100000033816 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 1626a_100102657272_100000033816 [0,2,0,0,0,0|2,0,0]=4 7399 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)I)I 527a_100102657272_100000033816 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 1626a_100102657272_100000034356 [0,2,0,0,0,0|1,0,0]=3 7401 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 240690a_100102657272_100000034356 [0,2,0,0,0,0|1,0,0]=3 7402 B13R1.2678 CNC(=O)c1cc(c(c(c1)I)O)I 527a_100102657272_100000034356 [0,2,0,0,0,0|1,0,0]=3 7403 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100102657272_100009812877 [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100102657272_100000031928 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 527a_100102657272_100000031928 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100102657272_100000074654 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.2678 COC(=O)c1cc(c(=O)n(c1)C)O 271570a_203496583355_200010887340 [0,2,0,0,0,0|1,0,1]=4 7408 B13R1.2678 COC(=O)c1cc(c(c(c1)Br)O)Cl 271570a_203496583355_100012361296 [0,2,0,0,0,0|0,0,0]=2 7409 B13R1.2678 COC(=O)c1cc(c(c(c1)C)O)C 271570a_203496583355_100010209423 [0,2,0,0,0,0|0,0,0]=2 7410 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)C)O 271570a_203496583355_100012360618 [0,2,0,0,0,0|1,0,0]=3 7411 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)O)O 271570a_203496583355_100135280131 [0,2,0,0,0,0|0,0,0]=2 7412 B13R1.2678 COC(=O)c1cc(c(c(c1)F)C)O 271570a_203496583355_100012920391 [0,2,0,0,0,0|1,0,0]=3 7413 B13R1.2678 COC(=O)c1cc(c(c(c1)F)F)O 271570a_203496583355_100010189562 [0,2,0,0,0,0|1,0,0]=3 7414 B13R1.2678 COC(=O)c1cc(c(c(c1)F)N)O 271570a_203496583355_100010170820 [0,2,0,0,0,0|1,0,0]=3 7415 B13R1.2678 COC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_200010155432 [0,2,0,0,0,0|0,0,0]=2 7416 B13R1.2678 COC(=O)c1cc(c(c(c1)O)C)N 271570a_203496583355_100012353609 [0,2,0,0,0,0|1,0,0]=3 7417 B13R1.2678 COC(=O)c1cc(c(c(c1)O)F)N 271570a_203496583355_200010713629 [0,2,0,0,0,0|1,0,0]=3 7418 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)C 271570a_203496583355_100010177015 [0,2,0,0,0,0|1,0,0]=3 7419 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)N 271570a_203496583355_100010128412 [0,2,0,0,0,0|1,0,0]=3 7420 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)N 271570a_203496583355_100010372079 [0,2,0,0,0,0|0,0,0]=2 7421 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_100010192586 [0,2,0,0,0,0|0,0,0]=2 7422 B13R1.2678 Cc1cc(cc(c1O)C)C(=O)CF 1458a_100011219978_100015361967 [0,2,0,0,0,0|2,0,0]=4 7423 B13R1.2678 O=C(CF)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100015361967 [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.2678 O=C(CF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100015361967 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.2678 O=C(CF)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100015361967 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.2678 O=C(CF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100015361967 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.2678 O=C(CF)c1cc(c(c(c1)F)O)F 1458a_100000766045_100015361967 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.2678 O=C(CF)c1cc(c(c(c1)I)O)I 1458a_100000034356_100015361967 [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.2678 O=C(CF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100015361967 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.2065 C=Cc1cc(ccc1C(=O)CC)C 271570a_100011290941_200012349623 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.2065 C=Cc1cc(ccc1C(=O)NC)F 271570a_100011290941_200000206206 [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)Br 271570a_100011290941_100000701758 [0,2,0,0,0,0|1,0,0]=3 7433 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)C 271570a_100011290941_100012340597 [0,2,0,0,0,0|1,0,0]=3 7434 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)Cl 271570a_100011290941_100000047510 [0,2,0,0,0,0|1,0,0]=3 7435 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)F 271570a_100011290941_100000204356 [0,2,0,0,0,0|1,0,0]=3 7436 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)N 271570a_100011290941_100009998378 [0,2,0,0,0,0|1,0,0]=3 7437 B13R1.2065 C=Cc1cc(ccc1C(=O)OC)O 271570a_100011290941_100010150825 [0,2,0,0,0,0|0,0,0]=2 7438 B13R1.2065 C=Cc1cc(cnc1C(=O)OC)C 271570a_100011290941_100010167497 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.2065 C=Cc1cc(cnc1C(=O)OC)F 271570a_100011290941_100010189631 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.2065 C=Cc1cc(ncc1C(=O)OC)C 271570a_100011290941_100011998247 [0,2,0,0,0,0|2,0,0]=4 7441 B13R1.2065 C=Cc1nc(ccc1C(=O)OC)C 271570a_100011290941_100000054099 [0,2,0,0,0,0|2,0,0]=4 7442 B13R1.2065 C=Cc1nc(ccc1C(=O)OC)N 271570a_100011290941_100009865240 [0,2,0,0,0,0|2,0,0]=4 7443 B13R1.2065 C=Cc1nc(ccc1C(=O)OC)O 271570a_100011290941_100016008356 [0,2,0,0,0,0|1,0,0]=3 7444 B13R1.2065 CCC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210202 [0,2,0,0,0,0|2,0,0]=4 7445 B13R1.2065 CCC(=O)c1ccc(cc1C#N)C 1458a_200012184421_100000210202 [0,2,0,0,0,0|2,0,0]=4 7446 B13R1.2065 CCC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210202 [0,2,0,0,0,0|2,0,0]=4 7447 B13R1.2065 CCC(=O)c1ccc(cc1CC)Br 1458a_200012349896_100000210202 [0,2,0,0,0,0|2,0,0]=4 7448 B13R1.2065 CCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210202 [0,2,0,0,0,0|2,0,0]=4 7449 B13R1.2065 CCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210202 [0,2,0,0,0,0|2,0,0]=4 7450 B13R1.2065 CCC(=O)c1ccc(cc1NC)C 27a_100102657272_200012349623 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.2065 CCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000210202 [0,2,0,0,0,0|2,0,0]=4 7452 B13R1.2065 CCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000210202 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.2065 CCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210202 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.2065 CCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000210202 [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.2065 CCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000210202 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.2065 CCC(=O)c1ccc(cc1SC)C 62a_200000210301_200012349623 [0,2,0,0,0,0|2,0,0]=4 7457 B13R1.2065 CCC(=O)c1ccc(cc1SC)C 62a_200012349623_200000210301 [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.2065 CCC(=O)c1ccc(cc1S[13CH3])C 62a_200012349623_200025704644 [0,2,0,0,0,0|2,0,0]=4 7459 B13R1.2065 CCC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_200012349623 [0,2,0,0,0,0|2,0,0]=4 7460 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 11a_106832991635_200012349896 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 1626a_100102657272_200012349896 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 240690a_100102657272_200012349896 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.2065 CCc1cc(ccc1C(=O)NC)Br 527a_100102657272_200012349896 [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.2065 CNC(=O)c1ccc(cc1C#N)Br 11a_106832991635_100012349539 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.2065 CNC(=O)c1ccc(cc1C#N)Br 240690a_100102657272_100012349539 [0,2,0,0,0,0|2,0,0]=4 7466 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 1626a_100102657272_200012184421 [0,2,0,0,0,0|2,0,0]=4 7467 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 240690a_100102657272_200012184421 [0,2,0,0,0,0|2,0,0]=4 7468 B13R1.2065 CNC(=O)c1ccc(cc1C#N)C 527a_100102657272_200012184421 [0,2,0,0,0,0|2,0,0]=4 7469 B13R1.2065 CNC(=O)c1ccc(cc1C#N)F 11a_106832991635_100012002388 [0,2,0,0,0,0|2,0,0]=4 7470 B13R1.2065 CNC(=O)c1ccc(cc1C#N)F 1626a_100102657272_100012002388 [0,2,0,0,0,0|2,0,0]=4 7471 B13R1.2065 CNC(=O)c1ccc(cc1CO)F 1626a_100102657272_100013035055 [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.2065 CNC(=O)c1ccc(cc1CO)F 240690a_100102657272_100013035055 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.2065 CNC(=O)c1ccc(cc1NC)Cl 34a_100000742614_200000210301 [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.2065 CNC(=O)c1ccc(cc1NC)F 27a_100102657272_200000206206 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.2065 CNC(=O)c1ccc(cc1N[13CH3])Cl 34a_100000742614_200025704644 [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 11a_106832991635_100000748230 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 1626a_100102657272_100000748230 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 240690a_100102657272_100000748230 [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.2065 CNC(=O)c1ccc(cc1OC)Br 527a_100102657272_100000748230 [0,2,0,0,0,0|2,0,0]=4 7480 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 11a_106832991635_100000217210 [0,2,0,0,0,0|2,0,0]=4 7481 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 1626a_100102657272_100000217210 [0,2,0,0,0,0|2,0,0]=4 7482 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 240690a_100102657272_100000217210 [0,2,0,0,0,0|2,0,0]=4 7483 B13R1.2065 CNC(=O)c1ccc(cc1OC)C 527a_100102657272_100000217210 [0,2,0,0,0,0|2,0,0]=4 7484 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 11a_106832991635_100000217211 [0,2,0,0,0,0|2,0,0]=4 7485 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 1626a_100102657272_100000217211 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 240690a_100102657272_100000217211 [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.2065 CNC(=O)c1ccc(cc1OC)Cl 527a_100102657272_100000217211 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 11a_106832991635_100000239970 [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 1626a_100102657272_100000239970 [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 240690a_100102657272_100000239970 [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.2065 CNC(=O)c1ccc(cc1OC)F 527a_100102657272_100000239970 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 11a_106832991635_100012353712 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 1626a_100102657272_100012353712 [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 240690a_100102657272_100012353712 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.2065 CNC(=O)c1ccc(cc1OC)I 527a_100102657272_100012353712 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.2065 CNC(=O)c1ccc(cc1OC)N 34a_100000223174_200000210301 [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.2065 CNC(=O)c1ccc(cc1OC)N 7a_100000223174_200000210301 [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.2065 CNC(=O)c1ccc(cc1O[13CH3])N 34a_100000223174_200025704644 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.2065 CNC(=O)c1ccc(cc1O[13CH3])N 7a_100000223174_200025704644 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.2065 CNC(=O)c1ccc(cc1SC)F 62a_200000206206_200000210301 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.2065 CNC(=O)c1ccc(cc1SC)F 62a_200000210301_200000206206 [0,2,0,0,0,0|2,0,0]=4 7502 B13R1.2065 CNC(=O)c1ccc(cc1S[13CH3])F 62a_200000206206_200025704644 [0,2,0,0,0,0|2,0,0]=4 7503 B13R1.2065 CNC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_200000206206 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.2065 CNc1cc(ccc1C(=O)OC)O 271570a_203496583355_200160487225 [0,2,0,0,0,0|0,0,0]=2 7505 B13R1.2065 CNc1cc(ncc1C(=O)OC)C 27a_100102657272_100011998247 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.2065 COC(=O)c1ccc(cc1C#N)O 271570a_203496583355_100010150794 [0,2,0,0,0,0|0,0,0]=2 7507 B13R1.2065 COC(=O)c1ccc(cc1C=O)O 271570a_203496583355_100010732994 [0,2,0,0,0,0|0,0,0]=2 7508 B13R1.2065 COC(=O)c1ccc(cc1OC)Br 34a_100000699699_200000210301 [0,2,0,0,0,0|1,0,0]=3 7509 B13R1.2065 COC(=O)c1ccc(cc1OC)Br 7a_100000699699_200000210301 [0,2,0,0,0,0|1,0,0]=3 7510 B13R1.2065 COC(=O)c1ccc(cc1OC)C 34a_100000148187_200000210301 [0,2,0,0,0,0|1,0,0]=3 7511 B13R1.2065 COC(=O)c1ccc(cc1OC)C 7a_100000148187_200000210301 [0,2,0,0,0,0|1,0,0]=3 7512 B13R1.2065 COC(=O)c1ccc(cc1OC)Cl 34a_100000151441_200000210301 [0,2,0,0,0,0|1,0,0]=3 7513 B13R1.2065 COC(=O)c1ccc(cc1OC)Cl 7a_100000151441_200000210301 [0,2,0,0,0,0|1,0,0]=3 7514 B13R1.2065 COC(=O)c1ccc(cc1OC)F 34a_100011216117_200000210301 [0,2,0,0,0,0|1,0,0]=3 7515 B13R1.2065 COC(=O)c1ccc(cc1OC)F 7a_100011216117_200000210301 [0,2,0,0,0,0|1,0,0]=3 7516 B13R1.2065 COC(=O)c1ccc(cc1OC)I 7a_100000062286_200000210301 [0,2,0,0,0,0|1,0,0]=3 7517 B13R1.2065 COC(=O)c1ccc(cc1OC)N 34a_100000718744_200000210301 [0,2,0,0,0,0|1,0,0]=3 7518 B13R1.2065 COC(=O)c1ccc(cc1OC)N 7a_100000718744_200000210301 [0,2,0,0,0,0|1,0,0]=3 7519 B13R1.2065 COC(=O)c1ccc(cc1OC)O 271570a_203496583355_100000708095 [0,2,0,0,0,0|0,0,0]=2 7520 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Br 34a_100000699699_200025704644 [0,2,0,0,0,0|1,0,0]=3 7521 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Br 7a_100000699699_200025704644 [0,2,0,0,0,0|1,0,0]=3 7522 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 34a_100000148187_200025704644 [0,2,0,0,0,0|1,0,0]=3 7523 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 7a_100000148187_200025704644 [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Cl 34a_100000151441_200025704644 [0,2,0,0,0,0|1,0,0]=3 7525 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])Cl 7a_100000151441_200025704644 [0,2,0,0,0,0|1,0,0]=3 7526 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])F 34a_100011216117_200025704644 [0,2,0,0,0,0|1,0,0]=3 7527 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])F 7a_100011216117_200025704644 [0,2,0,0,0,0|1,0,0]=3 7528 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])I 7a_100000062286_200025704644 [0,2,0,0,0,0|1,0,0]=3 7529 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])N 34a_100000718744_200025704644 [0,2,0,0,0,0|1,0,0]=3 7530 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])N 7a_100000718744_200025704644 [0,2,0,0,0,0|1,0,0]=3 7531 B13R1.2065 COC(=O)c1ccc(cc1SC)Br 62a_100000701758_200000210301 [0,2,0,0,0,0|1,0,0]=3 7532 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_100012340597_200000210301 [0,2,0,0,0,0|1,0,0]=3 7533 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_200000210301_100012340597 [0,2,0,0,0,0|1,0,0]=3 7534 B13R1.2065 COC(=O)c1ccc(cc1SC)Cl 62a_100000047510_200000210301 [0,2,0,0,0,0|1,0,0]=3 7535 B13R1.2065 COC(=O)c1ccc(cc1SC)Cl 62a_200000210301_100000047510 [0,2,0,0,0,0|1,0,0]=3 7536 B13R1.2065 COC(=O)c1ccc(cc1SC)F 62a_100000204356_200000210301 [0,2,0,0,0,0|1,0,0]=3 7537 B13R1.2065 COC(=O)c1ccc(cc1SC)F 62a_200000210301_100000204356 [0,2,0,0,0,0|1,0,0]=3 7538 B13R1.2065 COC(=O)c1ccc(cc1SC)N 62a_100009998378_200000210301 [0,2,0,0,0,0|1,0,0]=3 7539 B13R1.2065 COC(=O)c1ccc(cc1SC)N 62a_200000210301_100010150747 [0,2,0,0,0,0|1,0,0]=3 7540 B13R1.2065 COC(=O)c1ccc(cc1SC)O 62a_100010150825_200000210301 [0,2,0,0,0,0|0,0,0]=2 7541 B13R1.2065 COC(=O)c1ccc(cc1SC)O 62a_200000210301_100010150825 [0,2,0,0,0,0|0,0,0]=2 7542 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Br 62a_100000701758_200025704644 [0,2,0,0,0,0|1,0,0]=3 7543 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_100012340597_200025704644 [0,2,0,0,0,0|1,0,0]=3 7544 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_100012340597 [0,2,0,0,0,0|1,0,0]=3 7545 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Cl 62a_100000047510_200025704644 [0,2,0,0,0,0|1,0,0]=3 7546 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])Cl 62a_200025704644_100000047510 [0,2,0,0,0,0|1,0,0]=3 7547 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])F 62a_100000204356_200025704644 [0,2,0,0,0,0|1,0,0]=3 7548 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])F 62a_200025704644_100000204356 [0,2,0,0,0,0|1,0,0]=3 7549 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])N 62a_100009998378_200025704644 [0,2,0,0,0,0|1,0,0]=3 7550 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])N 62a_200025704644_100010150747 [0,2,0,0,0,0|1,0,0]=3 7551 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])O 62a_100010150825_200025704644 [0,2,0,0,0,0|0,0,0]=2 7552 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])O 62a_200025704644_100010150825 [0,2,0,0,0,0|0,0,0]=2 7553 B13R1.2065 COC(=O)c1ccc(nc1OC)O 271570a_203496583355_100000703831 [0,2,0,0,0,0|1,0,0]=3 7554 B13R1.2065 COC(=O)c1ccc(nc1SC)C 62a_100000054099_200000210301 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.2065 COC(=O)c1ccc(nc1SC)C 62a_200000210301_100000054099 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.2065 COC(=O)c1ccc(nc1SC)N 62a_100009865240_200000210301 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.2065 COC(=O)c1ccc(nc1SC)N 62a_200000210301_100009865240 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])C 62a_100000054099_200025704644 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])C 62a_200025704644_100000054099 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])N 62a_100009865240_200025704644 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])N 62a_200025704644_100009865240 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.2065 COC(=O)c1cnc(cc1OC)O 271570a_203496583355_100010062786 [0,2,0,0,0,0|1,0,0]=3 7563 B13R1.2065 COC(=O)c1cnc(cc1SC)C 62a_100011998247_200000210301 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.2065 COC(=O)c1cnc(cc1SC)C 62a_200000210301_100011998247 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.2065 COC(=O)c1cnc(cc1SC)Cl 62a_100010734300_200000210301 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.2065 COC(=O)c1cnc(cc1SC)Cl 62a_200000210301_100010734300 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.2065 COC(=O)c1cnc(cc1S[13CH3])C 62a_100011998247_200025704644 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.2065 COC(=O)c1cnc(cc1S[13CH3])C 62a_200025704644_100011998247 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.2065 COC(=O)c1cnc(cc1S[13CH3])Cl 62a_100010734300_200025704644 [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.2065 COC(=O)c1cnc(cc1S[13CH3])Cl 62a_200025704644_100010734300 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.2065 COC(=O)c1ncc(cc1OC)Br 34a_100010071521_200000210301 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.2065 COC(=O)c1ncc(cc1OC)Br 7a_100010071521_200000210301 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.2065 COC(=O)c1ncc(cc1OC)O 271570a_203496583355_100010254911 [0,2,0,0,0,0|1,0,0]=3 7574 B13R1.2065 COC(=O)c1ncc(cc1O[13CH3])Br 34a_100010071521_200025704644 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.2065 COC(=O)c1ncc(cc1O[13CH3])Br 7a_100010071521_200025704644 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.2065 COC(=O)c1ncc(cc1SC)C 62a_100010167497_200000210301 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.2065 COC(=O)c1ncc(cc1SC)C 62a_200000210301_100010167497 [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.2065 COC(=O)c1ncc(cc1SC)F 62a_100010189631_200000210301 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.2065 COC(=O)c1ncc(cc1SC)F 62a_200000210301_100010189631 [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.2065 COC(=O)c1ncc(cc1S[13CH3])C 62a_100010167497_200025704644 [0,2,0,0,0,0|2,0,0]=4 7581 B13R1.2065 COC(=O)c1ncc(cc1S[13CH3])C 62a_200025704644_100010167497 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.2065 COC(=O)c1ncc(cc1S[13CH3])F 62a_100010189631_200025704644 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.2065 COC(=O)c1ncc(cc1S[13CH3])F 62a_200025704644_100010189631 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100000210202 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_100000210202 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.4656 CCC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_100000210202 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.4656 CCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210202 [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_100000210202 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_100000210202 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.4656 CCC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_100000210202 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.4656 CCC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_100000210202 [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.4656 CCC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_100000210202 [0,2,0,0,0,0|2,0,0]=4 7593 B13R1.4656 CCC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_100000210202 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.4656 CCC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_100000210202 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.4656 CCC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_100000210202 [0,2,0,0,0,0|1,0,0]=3 7596 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_100000210202 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100000210202 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100000210202 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_100000210202 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100000210202 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100000210202 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_100000210202 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_100000210202 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100000210202 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.4656 CCC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100000210202 [0,2,0,0,0,0|1,0,0]=3 7606 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_100000210202 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_100000210202 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.4656 CCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000210202 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.4656 CCC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_100000210202 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.4656 CCC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_100000210202 [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.4656 CCC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_100000210202 [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.4656 CCC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_100000210202 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.4656 CCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000210202 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.4656 CCC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_100000210202 [0,2,0,0,0,0|1,0,0]=3 7615 B13R1.4656 CCC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_100000210202 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.4656 CCC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_100000210202 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.4656 CCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000210202 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.4656 CCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000210202 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.4656 CCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000210202 [0,2,0,0,0,0|1,0,0]=3 7620 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 11a_106832991635_100011217931 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 240690a_100102657272_100011217931 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)Br 527a_100102657272_100011217931 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 11a_106832991635_100009813784 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 1626a_100102657272_100009813784 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 240690a_100102657272_100009813784 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Br)F 527a_100102657272_100009813784 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 11a_106832991635_100010768510 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 1626a_100102657272_100010768510 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 240690a_100102657272_100010768510 [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.4656 CNC(=O)c1c(cc(cc1Br)C)F 527a_100102657272_100010768510 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 11a_106832991635_100010244364 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100102657272_100010244364 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100102657272_100010244364 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.4656 CNC(=O)c1c(cc(cc1Br)Cl)F 527a_100102657272_100010244364 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 11a_106832991635_200015320377 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 1626a_100102657272_200015320377 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 240690a_100102657272_200015320377 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)Br 527a_100102657272_200015320377 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 11a_106832991635_100010204434 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 1626a_100102657272_100010204434 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 240690a_100102657272_100010204434 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)C 527a_100102657272_100010204434 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 11a_106832991635_100013316034 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 1626a_100102657272_100013316034 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 240690a_100102657272_100013316034 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.4656 CNC(=O)c1c(cc(cc1Br)F)F 527a_100102657272_100013316034 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 11a_106832991635_100000739581 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 1626a_100102657272_100000739581 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.4656 CNC(=O)c1c(cc(cc1C)Br)C 240690a_100102657272_100000739581 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 11a_106832991635_100000211658 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 1626a_100102657272_100000211658 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.4656 CNC(=O)c1c(cc(cc1C)C)C 240690a_100102657272_100000211658 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 11a_106832991635_100000088873 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 1626a_100102657272_100000088873 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.4656 CNC(=O)c1c(cc(cc1C)Cl)C 240690a_100102657272_100000088873 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 11a_106832991635_100012017201 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 1626a_100102657272_100012017201 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.4656 CNC(=O)c1c(cc(cc1C)F)C 240690a_100102657272_100012017201 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.4656 CNC(=O)c1c(cc(cc1C)O)C 240690a_100102657272_100000066486 [0,2,0,0,0,0|1,0,0]=3 7660 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 11a_106832991635_100000698028 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 1626a_100102657272_100000698028 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)C 240690a_100102657272_100000698028 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 11a_106832991635_100012360385 [0,2,0,0,0,0|2,0,0]=4 7664 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 1626a_100102657272_100012360385 [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)Cl 240690a_100102657272_100012360385 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 11a_106832991635_100010078411 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 1626a_100102657272_100010078411 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 240690a_100102657272_100010078411 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Br)F 527a_100102657272_100010078411 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 11a_106832991635_100009989429 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 1626a_100102657272_100009989429 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 240690a_100102657272_100009989429 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)C)Cl 527a_100102657272_100009989429 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_106832991635_100011215713 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100102657272_100011215713 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100102657272_100011215713 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 11a_106832991635_100010068318 [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100102657272_100010068318 [0,2,0,0,0,0|2,0,0]=4 7679 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100102657272_100010068318 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100102657272_100010068318 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 11a_106832991635_100000703918 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 1626a_100102657272_100000703918 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)Cl 240690a_100102657272_100000703918 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 11a_106832991635_100000119028 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 1626a_100102657272_100000119028 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 240690a_100102657272_100000119028 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)F)F 527a_100102657272_100000119028 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 11a_106832991635_100010740244 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 1626a_100102657272_100010740244 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 240690a_100102657272_100010740244 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)I)Cl 527a_100102657272_100010740244 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.4656 CNC(=O)c1c(cc(cc1Cl)O)Cl 240690a_100102657272_100010423397 [0,2,0,0,0,0|1,0,0]=3 7693 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 11a_106832991635_100000708665 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 1626a_100102657272_100000708665 [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 240690a_100102657272_100000708665 [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)C 527a_100102657272_100000708665 [0,2,0,0,0,0|2,0,0]=4 7697 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 11a_106832991635_100000766946 [0,2,0,0,0,0|2,0,0]=4 7698 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 1626a_100102657272_100000766946 [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 240690a_100102657272_100000766946 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)F 527a_100102657272_100000766946 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.4656 CNC(=O)c1c(cc(cc1F)Br)O 527a_100102657272_200015963038 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 11a_106832991635_100009878570 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 1626a_100102657272_100009878570 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 240690a_100102657272_100009878570 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.4656 CNC(=O)c1c(cc(cc1F)C)F 527a_100102657272_100009878570 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 11a_106832991635_100010768517 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 1626a_100102657272_100010768517 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 240690a_100102657272_100010768517 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)C 527a_100102657272_100010768517 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 11a_106832991635_100000062413 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 1626a_100102657272_100000062413 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 240690a_100102657272_100000062413 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.4656 CNC(=O)c1c(cc(cc1F)Cl)F 527a_100102657272_100000062413 [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 11a_106832991635_100000751013 [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 1626a_100102657272_100000751013 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 240690a_100102657272_100000751013 [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)F 527a_100102657272_100000751013 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)O 240690a_100102657272_100000746385 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.4656 CNC(=O)c1c(cc(cc1F)F)O 527a_100102657272_100000746385 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.4656 CNC(=O)c1c(cc(cc1F)O)F 240690a_100102657272_100000038755 [0,2,0,0,0,0|1,0,0]=3 7721 B13R1.4656 CNC(=O)c1c(cc(cc1F)O)F 527a_100102657272_100000038755 [0,2,0,0,0,0|1,0,0]=3 7722 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 11a_106832991635_200010371430 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 1626a_100102657272_200010371430 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 240690a_100102657272_200010371430 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.4656 CNC(=O)c1c(cc(cc1I)C)I 527a_100102657272_200010371430 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 11a_106832991635_200010371433 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 1626a_100102657272_200010371433 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 240690a_100102657272_200010371433 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.4656 CNC(=O)c1c(cc(cc1I)F)C 527a_100102657272_200010371433 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.4656 CNC(=O)c1c(cc(cc1O)C)O 527a_100102657272_100000036929 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.4656 CNC(=O)c1c(cc(cc1O)O)O 527a_100102657272_100000040092 [0,2,0,0,0,0|1,0,0]=3 7732 B13R1.4656 COC(=O)c1c(cc(cc1C)O)C 271570a_203496583355_100009831683 [0,2,0,0,0,0|0,0,0]=2 7733 B13R1.4656 COC(=O)c1c(cc(cc1F)C)O 271570a_203496583355_100015667323 [0,2,0,0,0,0|1,0,0]=3 7734 B13R1.4656 COC(=O)c1c(cc(cc1F)F)O 271570a_203496583355_100010009842 [0,2,0,0,0,0|1,0,0]=3 7735 B13R1.4656 COC(=O)c1c(cc(cc1F)O)C 271570a_203496583355_100010761470 [0,2,0,0,0,0|0,0,0]=2 7736 B13R1.4656 COC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100012350779 [0,2,0,0,0,0|0,0,0]=2 7737 B13R1.4656 COC(=O)c1c(cc(cc1F)O)N 271570a_203496583355_100015466354 [0,2,0,0,0,0|0,0,0]=2 7738 B13R1.4656 COC(=O)c1c(cc(cc1F)O)O 271570a_203496583355_100010889199 [0,2,0,0,0,0|0,0,0]=2 7739 B13R1.4656 COC(=O)c1c(cc(nc1C)O)C 271570a_203496583355_100009881562 [0,2,0,0,0,0|1,0,0]=3 7740 B13R1.4656 COC(=O)c1c(cc(nc1O)C)C 271570a_203496583355_100000019986 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.4656 Cc1cc(cc(c1C(=O)CF)C)O 1458a_100000066486_100015361967 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.4656 Cc1cc(cc(c1C(=O)CF)O)O 1458a_200000061528_100015361967 [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.4656 O=C(CF)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100015361967 [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.4656 O=C(CF)c1c(cc(cc1F)O)F 1458a_100000038755_100015361967 [0,2,0,0,0,0|2,0,0]=4 7745 B11R1.39 COC(=O)Cc1ccc(s1)O 271570a_203496583355_100012028946 [0,0,1,1,0,0|1,0,1]=4 7746 B11R1.37 C=Cc1ccc(cc1OC)Br 271570a_100011290941_100010245111 [0,0,1,1,0,0|2,0,0]=4 7747 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [0,0,1,1,0,0|2,0,0]=4 7748 B11R1.37 C=Cc1ccc(cc1OC)Cl 271570a_100011290941_100000050115 [0,0,1,1,0,0|2,0,0]=4 7749 B11R1.37 C=Cc1ccc(cc1OC)F 271570a_100011290941_100000757151 [0,0,1,1,0,0|2,0,0]=4 7750 B11R1.37 C=Cc1ccc(cc1OC)N 271570a_100011290941_100000765947 [0,0,1,1,0,0|2,0,0]=4 7751 B11R1.37 C=Cc1ccc(cc1OC)O 271570a_100011290941_100011827694 [0,0,1,1,0,0|1,0,0]=3 7752 B11R1.37 C=Cc1ccc(nc1OC)C 271570a_100011290941_100010138632 [0,0,1,1,0,0|2,0,0]=4 7753 B11R1.37 C=Cc1ccc(nc1OC)N 271570a_100011290941_100010187630 [0,0,1,1,0,0|2,0,0]=4 7754 B11R1.37 COc1cc(ccc1C=O)O 271570a_203496583355_100000697075 [0,0,1,1,0,0|2,0,0]=4 7755 B11R1.37 COc1nc(ccc1C=O)O 271570a_203496583355_100009864722 [0,0,1,1,0,0|2,0,0]=4 7756 B11R1.278 C=Cc1ccc(c(c1C)C)O 271570a_100011290941_100012353674 [0,0,1,1,0,0|2,0,0]=4 7757 B11R1.278 C=Cc1ccc(c(c1F)C)O 271570a_100011290941_100010390934 [0,0,1,1,0,0|2,0,0]=4 7758 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [1,0,0,1,0,0|1,0,1]=4 7759 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [1,0,0,1,0,0|1,0,1]=4 7760 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,1,0,0|1,0,0]=3 7761 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,0,0,1,0,0|1,0,1]=4 7762 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,0,0,1,0,0|2,0,0]=4 7763 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,0,0,1,0,0|2,0,0]=4 7764 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,0,0,1,0,0|1,0,1]=4 7765 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,0,0,1,0,0|0,0,1]=3 7766 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,1,0,0|2,0,0]=4 7767 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,0,0,1,0,0|2,0,0]=4 7768 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,0,0,1,0,0|2,0,0]=4 7769 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,0,0,1,0,0|2,0,0]=4 7770 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,0,0,1,0,0|2,0,0]=4 7771 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,0,0,1,0,0|0,1,1]=4 7772 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,0,0,1,0,0|1,1,0]=4 7773 B11R2.36 Oc1ccc2nonc2c1 271570a_203496583355_100009814275 [1,0,0,1,0,0|2,0,0]=4 7774 B11R2.66 O=C1OCc2c1sc(c2)O 271570a_203496583355_100010986393 [0,0,0,1,1,0|1,0,0]=3 7775 B13R2.43 CCc1cc2cc(ccc2o1)O 271570a_203496583355_200010233821 [0,0,0,1,0,1|2,0,0]=4 7776 B13R2.43 CCc1nc2cc(ccc2o1)O 271570a_203496583355_100009817032 [0,0,0,1,0,1|2,0,0]=4 7777 B13R2.43 CNc1nc2ccc(cc2s1)O 271570a_203496583355_100012351673 [0,0,0,1,0,1|1,1,0]=4 7778 B13R2.43 CNc1nc2ccc(cc2s1)O 27a_100102657272_100010063415 [0,0,0,1,0,1|1,1,0]=4 7779 B13R2.43 CSc1nc2cc(ccc2s1)O 271570a_203496583355_200010003198 [0,0,0,1,0,1|1,1,0]=4 7780 B13R2.43 CSc1nc2ccc(cc2s1)O 271570a_203496583355_100010193624 [0,0,0,1,0,1|0,2,0]=4 7781 B13R2.43 CSc1nc2ccc(cc2s1)O 62a_200000210301_100010063415 [0,0,0,1,0,1|0,2,0]=4 7782 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)O 62a_200025704644_100010063415 [0,0,0,1,0,1|0,2,0]=4 7783 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,0,0,1,0,1|1,0,0]=3 7784 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [0,0,0,1,0,1|1,0,0]=3 7785 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,0,0,1,0,1|2,0,0]=4 7786 B13R2.3028 Cc1nc2ccc(cc2n1C)O 271570a_203496583355_200010218347 [0,0,0,1,0,1|2,0,0]=4 7787 B13R2.3028 Cn1c(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100010393459 [0,0,0,1,0,1|1,0,0]=3 7788 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [0,0,0,1,0,1|2,0,0]=4 7789 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,0,0,1,0,1|1,0,0]=3 7790 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,0,0,1,0,1|1,0,0]=3 7791 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,0,0,1,0,1|1,0,0]=3 7792 B13R2.3683 O=C1CCc2cc(cnc2N1)O 271570a_203496583355_100010162403 [0,0,0,1,0,1|2,0,0]=4 7793 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,0,0,1,0,1|2,0,0]=4 7794 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,0,0,1,0,1|2,0,0]=4 7795 B13R2.3683 O=C1CSc2cc(ccc2N1)O 271570a_203496583355_100011830382 [0,0,0,1,0,1|2,0,0]=4 7796 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,0,0,1,0,1|1,0,0]=3 7797 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,0,0,1,0,1|1,0,0]=3 7798 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,0,0,1,0,1|0,0,0]=2 7799 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,0,0,1,0,1|1,0,1]=4 7800 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,0,0,1,0,1|1,0,1]=4 7801 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,0,0,1,0,1|2,0,0]=4 7802 B13R2.1139 CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210202 [0,1,0,1,0,0|2,0,0]=4 7803 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 11a_106832991635_100000137882 [0,1,0,1,0,0|2,0,0]=4 7804 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 1626a_100102657272_100000137882 [0,1,0,1,0,0|2,0,0]=4 7805 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 240690a_100102657272_100000137882 [0,1,0,1,0,0|2,0,0]=4 7806 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 527a_100102657272_100000137882 [0,1,0,1,0,0|2,0,0]=4 7807 B13R2.2130 C=Cc1ccc2c(c1)CCC2=O 271570a_100011290941_100000737041 [0,1,0,1,0,0|2,0,0]=4 7808 B13R2.2130 C=Cc1ccc2c(c1)CNC2=O 271570a_100011290941_100000692135 [0,1,0,1,0,0|2,0,0]=4 7809 B13R2.2130 C=Cc1ccc2c(c1)COC2=O 271570a_100011290941_100009816608 [0,1,0,1,0,0|1,0,0]=3 7810 B13R2.2130 COc1ccc2c(c1)CCC2=O 34a_100000708912_200000210301 [0,1,0,1,0,0|1,0,0]=3 7811 B13R2.2130 COc1ccc2c(c1)CCC2=O 7a_100000708912_200000210301 [0,1,0,1,0,0|1,0,0]=3 7812 B13R2.2130 COc1ccc2c(c1)CNC2=O 34a_100000098542_200000210301 [0,1,0,1,0,0|1,0,0]=3 7813 B13R2.2130 COc1ccc2c(c1)COC2=O 7a_100000044543_200000210301 [0,1,0,1,0,0|0,0,0]=2 7814 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_100000737041_200000210301 [0,1,0,1,0,0|1,1,0]=4 7815 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_200000210301_100000737041 [0,1,0,1,0,0|1,1,0]=4 7816 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_100000692135_200000210301 [0,1,0,1,0,0|1,1,0]=4 7817 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_200000210301_100000692135 [0,1,0,1,0,0|1,1,0]=4 7818 B13R2.2130 CSc1ccc2c(c1)COC2=O 62a_100009816608_200000210301 [0,1,0,1,0,0|0,1,0]=3 7819 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 34a_100000708912_200025704644 [0,1,0,1,0,0|1,0,0]=3 7820 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 7a_100000708912_200025704644 [0,1,0,1,0,0|1,0,0]=3 7821 B13R2.2130 [13CH3]Oc1ccc2c(c1)CNC2=O 34a_100000098542_200025704644 [0,1,0,1,0,0|1,0,0]=3 7822 B13R2.2130 [13CH3]Oc1ccc2c(c1)COC2=O 7a_100000044543_200025704644 [0,1,0,1,0,0|0,0,0]=2 7823 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_100000737041_200025704644 [0,1,0,1,0,0|1,1,0]=4 7824 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_200025704644_100000737041 [0,1,0,1,0,0|1,1,0]=4 7825 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_100000692135_200025704644 [0,1,0,1,0,0|1,1,0]=4 7826 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_200025704644_100000692135 [0,1,0,1,0,0|1,1,0]=4 7827 B13R2.2130 [13CH3]Sc1ccc2c(c1)COC2=O 62a_100009816608_200025704644 [0,1,0,1,0,0|0,1,0]=3 7828 B13R2.2986 Oc1ccc(cc1)C2(COC2)O 271570a_203496583355_100010074357 [0,1,0,1,0,0|0,0,2]=4 7829 B13R2.12 Brc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000752885 [0,1,0,1,0,0|2,0,0]=4 7830 B13R2.12 Brc1ccc(cc1)C2=COCC2 271570a_100000118173_100000752885 [0,1,0,1,0,0|2,0,0]=4 7831 B13R2.12 Cc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000186775 [0,1,0,1,0,0|2,0,0]=4 7832 B13R2.12 Cc1ccc(cc1)C2=COCC2 271570a_100000118173_100000186775 [0,1,0,1,0,0|2,0,0]=4 7833 B13R2.12 Clc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000755918 [0,1,0,1,0,0|2,0,0]=4 7834 B13R2.12 Clc1ccc(cc1)C2=COCC2 271570a_100000118173_100000755918 [0,1,0,1,0,0|2,0,0]=4 7835 B13R2.12 Fc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000211213 [0,1,0,1,0,0|2,0,0]=4 7836 B13R2.12 Fc1ccc(cc1)C2=COCC2 271570a_100000118173_100000211213 [0,1,0,1,0,0|2,0,0]=4 7837 B13R2.12 Nc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000185761 [0,1,0,1,0,0|2,0,0]=4 7838 B13R2.12 Nc1ccc(cc1)C2=COCC2 271570a_100000118173_100000185761 [0,1,0,1,0,0|2,0,0]=4 7839 B13R2.12 Oc1ccc(cc1)C2=CCCC2 271570a_100000089523_100000185759 [0,1,0,1,0,0|2,0,0]=4 7840 B13R2.12 Oc1ccc(cc1)C2=CCCC2 271570a_203496583355_200010223205 [0,1,0,1,0,0|2,0,0]=4 7841 B13R2.12 Oc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000185759 [0,1,0,1,0,0|1,0,0]=3 7842 B13R2.12 Oc1ccc(cc1)C2=COCC2 271570a_100000118173_100000185759 [0,1,0,1,0,0|1,0,0]=3 7843 B13R2.12 Oc1ccc(cc1)C2=NCCO2 271570a_203496583355_100009812740 [0,1,0,1,0,0|1,0,0]=3 7844 B13R2.12 Oc1ccc(cc1)C2=NOCC2 271570a_203496583355_100010889492 [0,1,0,1,0,0|1,0,0]=3 7845 B13R2.12 Oc1ccc(cc1)C2OCCO2 271570a_203496583355_100009813560 [0,1,0,1,0,0|0,0,2]=4 7846 B13R2.12 Oc1ccc(cc1)c2ccco2 271570a_100000750936_100000185759 [0,1,0,1,0,0|1,0,1]=4 7847 B13R2.12 Oc1ccc(cc1)c2ccco2 271570a_100015205159_100009814098 [0,1,0,1,0,0|1,0,1]=4 7848 B13R2.12 Oc1ccc(cc1)c2ccno2 271570a_203496583355_100011216027 [0,1,0,1,0,0|1,0,1]=4 7849 B13R2.12 Oc1ccc(cc1)c2ccoc2 271570a_100011218838_100000185759 [0,1,0,1,0,0|1,0,1]=4 7850 B13R2.12 Oc1ccc(cc1)c2ccoc2 271570a_100015205159_100011215275 [0,1,0,1,0,0|1,0,1]=4 7851 B13R2.12 Oc1ccc(cc1)c2ccon2 271570a_203496583355_200011934941 [0,1,0,1,0,0|1,0,1]=4 7852 B13R2.12 Oc1ccc(cc1)c2cnco2 271570a_100015205159_100020591547 [0,1,0,1,0,0|1,0,1]=4 7853 B13R2.12 Oc1ccc(cc1)c2cnco2 271570a_203496583355_100009814239 [0,1,0,1,0,0|1,0,1]=4 7854 B13R2.12 Oc1ccc(cc1)c2cnoc2 271570a_100015205159_100009815712 [0,1,0,1,0,0|2,0,0]=4 7855 B13R2.12 Oc1ccc(cc1)c2ncco2 271570a_100015205159_100011787736 [0,1,0,1,0,0|1,0,1]=4 7856 B13R2.12 Oc1ccc(cc1)c2ncco2 271570a_203496583355_200010153272 [0,1,0,1,0,0|1,0,1]=4 7857 B13R2.12 Oc1ccc(cc1)c2ncon2 271570a_203496583355_100000756724 [0,1,0,1,0,0|1,0,1]=4 7858 B13R2.12 Oc1ccc(cc1)c2nnco2 271570a_203496583355_100000179025 [0,1,0,1,0,0|1,0,1]=4 7859 B13R2.12 Oc1ccc(nc1)C2=CCOC2 271570a_100009872500_100000685995 [0,1,0,1,0,0|2,0,0]=4 7860 B13R2.12 Oc1ccc(nc1)C2=COCC2 271570a_100000118173_100000685995 [0,1,0,1,0,0|2,0,0]=4 7861 B13R2.662 COc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010742842 [0,1,0,1,0,0|1,0,0]=3 7862 B13R2.662 O=Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009817233 [0,1,0,1,0,0|2,0,0]=4 7863 B13R2.520 C=C(c1ccc(cc1)O)C2CC2 271570a_100010895485_100000185759 [0,1,0,1,0,0|2,0,0]=4 7864 B13R2.520 O=C(c1ccc(cc1)O)C2CC2 271570a_203496583355_100000764646 [0,1,0,1,0,0|1,0,0]=3 7865 B13R2.520 O=S(c1ccc(cc1)O)C2CC2 271570a_203496583355_103551703186 [0,1,0,1,0,0|2,0,0]=4 7866 B13R2.5179 O=C1CCCc2c1ccc(c2)O 271570a_203496583355_100000688402 [0,1,0,1,0,0|1,0,0]=3 7867 B13R2.5179 O=C1CCCc2c1ccc(n2)O 271570a_203496583355_100000089724 [0,1,0,1,0,0|2,0,0]=4 7868 B13R2.5179 O=C1CCNc2c1ccc(c2)O 271570a_203496583355_100010157303 [0,1,0,1,0,0|1,0,0]=3 7869 B13R2.5179 O=C1CCNc2c1ccc(n2)O 271570a_203496583355_100010209495 [0,1,0,1,0,0|2,0,0]=4 7870 B13R2.5179 O=C1CCOc2c1ccc(c2)O 271570a_203496583355_100000696939 [0,1,0,1,0,0|1,0,0]=3 7871 B13R2.5179 O=C1CCOc2c1ncc(c2)O 271570a_203496583355_100011092978 [0,1,0,1,0,0|2,0,0]=4 7872 B13R2.5179 O=C1CCSc2c1ccc(c2)O 271570a_203496583355_100010688399 [0,1,0,1,0,0|1,0,0]=3 7873 B13R2.5179 O=C1NCCc2c1ccc(c2)O 271570a_203496583355_100009817313 [0,1,0,1,0,0|1,0,0]=3 7874 B13R2.5179 O=C1NCCc2c1ccc(n2)O 271570a_203496583355_100009858568 [0,1,0,1,0,0|2,0,0]=4 7875 B13R2.5179 O=c1[nH]cnc2c1ccc(c2)O 271570a_203496583355_100000230960 [0,1,0,1,0,0|1,0,1]=4 7876 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [0,1,0,1,0,0|1,0,1]=4 7877 B13R2.5187 Cc1nn(c2c1ccc(c2)O)C 271570a_203496583355_100010255092 [0,1,0,1,0,0|2,0,0]=4 7878 B13R2.5187 Cn1[nH]c(=O)c2c1cc(cc2)O 271570a_203496583355_100011014602 [0,1,0,1,0,0|1,0,0]=3 7879 B13R2.5187 Cn1nc(c2c1cc(cc2)O)N 271570a_203496583355_100010244983 [0,1,0,1,0,0|2,0,0]=4 7880 B13R2.5187 O=C1CC(=O)c2c1ccc(c2)O 271570a_203496583355_100009997049 [0,1,0,1,0,0|1,0,1]=4 7881 B13R2.5187 O=C1NC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185758 [0,1,0,1,0,0|1,0,1]=4 7882 B13R2.5187 O=C1OC(=O)c2c1cc(cn2)O 271570a_203496583355_100010218301 [0,1,0,1,0,0|1,0,1]=4 7883 B13R2.5187 O=C1OC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185860 [0,1,0,1,0,0|0,0,1]=3 7884 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,1,0,1,0,0|1,0,0]=3 7885 B13R2.5190 CN1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010161043 [0,1,0,1,0,0|1,0,0]=3 7886 B13R2.5190 CN1Cc2cc(cnc2C1=O)O 271570a_203496583355_100010258542 [0,1,0,1,0,0|2,0,0]=4 7887 B13R2.5190 Cc1c2ccc(cc2nn1C)O 271570a_203496583355_100010247116 [0,1,0,1,0,0|2,0,0]=4 7888 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,1,0,1,0,0|2,0,0]=4 7889 B13R2.5180 Cc1c(ccc2c1CCC2=O)O 271570a_203496583355_100010133460 [0,1,0,1,0,0|1,0,0]=3 7890 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [0,1,0,1,0,0|0,0,0]=2 7891 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,1,0,1,0,0|2,0,0]=4 7892 B13R2.5180 O=C1CCc2c1ccc(c2F)O 271570a_203496583355_100010133455 [0,1,0,1,0,0|1,0,0]=3 7893 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,1,0,1,0,0|2,0,0]=4 7894 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010133461 [0,1,0,1,0,0|2,0,0]=4 7895 B13R2.11634 Cc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010010902 [0,1,0,1,0,0|1,0,0]=3 7896 B13R2.11634 Nc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010080117 [0,1,0,1,0,0|2,0,0]=4 7897 B13R2.11634 O=C1CCc2c1cc(c(c2)F)O 271570a_203496583355_100010010871 [0,1,0,1,0,0|2,0,0]=4 7898 B13R2.11634 O=C1CCc2c1cc(c(c2)O)F 271570a_203496583355_100010010804 [0,1,0,1,0,0|1,0,0]=3 7899 B13R2.11642 Cc1cc(cc2c1C(=O)CC2)O 271570a_203496583355_100000721622 [0,1,0,1,0,0|1,0,0]=3 7900 B13R2.11642 Cc1cc(cc2c1C(=O)NC2)O 271570a_203496583355_200010764723 [0,1,0,1,0,0|1,0,0]=3 7901 B13R2.11642 O=C1CCc2c1c(cc(c2)F)O 271570a_203496583355_100010079923 [0,1,0,1,0,0|2,0,0]=4 7902 B13R2.11642 O=C1CCc2c1c(cc(c2)O)F 271570a_203496583355_100010125705 [0,1,0,1,0,0|1,0,0]=3 7903 B13R2.11642 O=C1CCc2c1c(cc(c2)O)O 271570a_203496583355_200010214548 [0,1,0,1,0,0|1,0,0]=3 7904 B13R2.11642 O=C1NCc2c1c(cc(c2)O)F 271570a_203496583355_100010161078 [0,1,0,1,0,0|1,0,0]=3 7905 B9R1.7 COCc1cc(cs1)O 271570a_203496583355_100011542528 [1,0,0,0,1,0|1,0,1]=4 7906 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [1,0,0,0,1,0|1,0,0]=3 7907 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [1,0,0,0,1,0|1,0,0]=3 7908 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [1,0,0,0,1,0|1,0,0]=3 7909 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [1,0,0,0,1,0|1,0,0]=3 7910 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [1,0,0,0,1,0|2,0,0]=4 7911 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [1,0,0,0,1,0|1,0,0]=3 7912 B9R1.35 CC(=O)c1nc(cs1)O 271570a_203496583355_100010231720 [1,0,0,0,1,0|2,0,0]=4 7913 B9R1.35 CC(=O)c1ncc(s1)O 271570a_203496583355_100000693680 [1,0,0,0,1,0|2,0,0]=4 7914 B9R1.35 CC(=O)n1cc(cn1)O 271570a_203496583355_100010205889 [1,0,0,0,1,0|2,0,0]=4 7915 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [1,0,0,0,1,0|2,0,0]=4 7916 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [1,0,0,0,1,0|2,0,0]=4 7917 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [1,0,0,0,1,0|2,0,0]=4 7918 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [1,0,0,0,1,0|2,0,0]=4 7919 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [1,0,0,0,1,0|2,0,0]=4 7920 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [1,0,0,0,0,1|1,0,1]=4 7921 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [1,0,0,0,0,1|1,0,1]=4 7922 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [1,0,0,0,0,1|1,0,1]=4 7923 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [1,0,0,0,0,1|1,0,1]=4 7924 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [1,0,0,0,0,1|1,0,1]=4 7925 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [1,0,0,0,0,1|1,0,1]=4 7926 B11R1.40 CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210202 [1,0,0,0,0,1|2,0,0]=4 7927 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [1,0,0,0,0,1|1,0,0]=3 7928 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000210414_100000721315 [1,0,0,0,0,1|2,0,0]=4 7929 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000233486_100000210202 [1,0,0,0,0,1|2,0,0]=4 7930 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000210414_100000733263 [1,0,0,0,0,1|2,0,0]=4 7931 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000737805_100000210202 [1,0,0,0,0,1|2,0,0]=4 7932 B11R1.40 CCC(=O)Cc1ccncc1 1458a_100000210414_100000705612 [1,0,0,0,0,1|2,0,0]=4 7933 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [1,0,0,0,0,1|1,0,0]=3 7934 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [1,0,0,0,0,1|1,0,0]=3 7935 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [1,0,0,0,0,1|1,0,0]=3 7936 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [1,0,0,0,0,1|1,0,0]=3 7937 B11R1.40 CNC(=O)C[n+]1ccccc1 11a_106832991635_200000086051 [1,0,0,0,0,1|2,0,0]=4 7938 B11R1.40 CNC(=O)C[n+]1ccccc1 240690a_100102657272_200000086051 [1,0,0,0,0,1|2,0,0]=4 7939 B11R1.40 CNC(=O)C[n+]1ccccc1 527a_100102657272_200000086051 [1,0,0,0,0,1|2,0,0]=4 7940 B11R1.40 CNC(=O)Cc1ccccn1 11a_106832991635_100000233486 [1,0,0,0,0,1|2,0,0]=4 7941 B11R1.40 CNC(=O)Cc1cccnc1 11a_106832991635_100000737805 [1,0,0,0,0,1|2,0,0]=4 7942 B11R1.40 CNC(=O)Cc1cccnc1 240690a_100102657272_100000737805 [1,0,0,0,0,1|2,0,0]=4 7943 B11R1.40 CNC(=O)Cc1cccnc1 527a_100102657272_100000737805 [1,0,0,0,0,1|2,0,0]=4 7944 B11R1.40 CNC(=O)Cc1ccncc1 11a_106832991635_100011201483 [1,0,0,0,0,1|2,0,0]=4 7945 B11R1.40 CNC(=O)Cc1ccncc1 240690a_100102657272_100011201483 [1,0,0,0,0,1|2,0,0]=4 7946 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [1,0,0,0,0,1|1,0,0]=3 7947 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [1,0,0,0,0,1|1,0,1]=4 7948 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [1,0,0,0,0,1|1,0,1]=4 7949 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [1,0,0,0,0,1|1,0,1]=4 7950 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [1,0,0,0,0,1|1,0,1]=4 7951 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [1,0,0,0,0,1|1,0,1]=4 7952 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [1,0,0,0,0,1|2,0,0]=4 7953 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [1,0,0,0,0,1|2,0,0]=4 7954 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [1,0,0,0,0,1|2,0,0]=4 7955 B13R1.14 C#CC(=O)CCc1ccc(cc1)O 1458a_100000211873_100009816426 [0,0,0,0,0,2|1,0,1]=4 7956 B13R1.14 C=CC(=O)CCc1ccc(cc1)O 1458a_100000185746_100009816426 [0,0,0,0,0,2|1,0,1]=4 7957 B13R1.14 C=CC(=O)NCc1ccc(cc1)O 240690a_100000185549_200121576911 [0,0,0,0,0,2|1,0,1]=4 7958 B13R1.14 CCC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_100000210202 [0,0,0,0,0,2|2,0,0]=4 7959 B13R1.14 CCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000210202 [0,0,0,0,0,2|2,0,0]=4 7960 B13R1.14 CCC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_100000210202 [0,0,0,0,0,2|2,0,0]=4 7961 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_100000210202 [0,0,0,0,0,2|2,0,0]=4 7962 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Br 6a_100000186029_100000211110 [0,0,0,0,0,2|2,0,0]=4 7963 B13R1.14 CCC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_100000210202 [0,0,0,0,0,2|2,0,0]=4 7964 B13R1.14 CCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000210202 [0,0,0,0,0,2|2,0,0]=4 7965 B13R1.14 CCC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_100000210202 [0,0,0,0,0,2|2,0,0]=4 7966 B13R1.14 CCC(=O)C=Cc1ccc(cc1)F 6a_100000210084_100000211110 [0,0,0,0,0,2|2,0,0]=4 7967 B13R1.14 CCC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_100000210202 [0,0,0,0,0,2|2,0,0]=4 7968 B13R1.14 CCC(=O)C=Cc1ccc(cc1)I 6a_100000188517_100000211110 [0,0,0,0,0,2|2,0,0]=4 7969 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000210414_100011740612 [0,0,0,0,0,2|2,0,0]=4 7970 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000210202 [0,0,0,0,0,2|2,0,0]=4 7971 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000210414_100011713686 [0,0,0,0,0,2|2,0,0]=4 7972 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000210202 [0,0,0,0,0,2|2,0,0]=4 7973 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000210414_100011713675 [0,0,0,0,0,2|2,0,0]=4 7974 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210202 [0,0,0,0,0,2|2,0,0]=4 7975 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000210202 [0,0,0,0,0,2|2,0,0]=4 7976 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000210414_100011217392 [0,0,0,0,0,2|2,0,0]=4 7977 B13R1.14 CCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000210202 [0,0,0,0,0,2|2,0,0]=4 7978 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000210414_100009816426 [0,0,0,0,0,2|1,0,0]=3 7979 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210202 [0,0,0,0,0,2|1,0,0]=3 7980 B13R1.14 CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210202 [0,0,0,0,0,2|2,0,0]=4 7981 B13R1.14 CCC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747405 [0,0,0,0,0,2|2,0,0]=4 7982 B13R1.14 CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210202 [0,0,0,0,0,2|2,0,0]=4 7983 B13R1.14 CCC(=O)COc1ccc(cc1)C 7a_100000210336_100000747405 [0,0,0,0,0,2|2,0,0]=4 7984 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210202 [0,0,0,0,0,2|2,0,0]=4 7985 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747405 [0,0,0,0,0,2|2,0,0]=4 7986 B13R1.14 CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210202 [0,0,0,0,0,2|2,0,0]=4 7987 B13R1.14 CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210202 [0,0,0,0,0,2|2,0,0]=4 7988 B13R1.14 CCC(=O)COc1ccc(cc1)I 7a_100000212066_100000747405 [0,0,0,0,0,2|2,0,0]=4 7989 B13R1.14 CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210202 [0,0,0,0,0,2|1,0,0]=3 7990 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000210202 [0,0,0,0,0,2|2,0,0]=4 7991 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000747405_100000752885 [0,0,0,0,0,2|2,0,0]=4 7992 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747405 [0,0,0,0,0,2|2,0,0]=4 7993 B13R1.14 CCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000210202 [0,0,0,0,0,2|2,0,0]=4 7994 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747405 [0,0,0,0,0,2|2,0,0]=4 7995 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000747405_100000186775 [0,0,0,0,0,2|2,0,0]=4 7996 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210202 [0,0,0,0,0,2|2,0,0]=4 7997 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000747405_100000755918 [0,0,0,0,0,2|2,0,0]=4 7998 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747405 [0,0,0,0,0,2|2,0,0]=4 7999 B13R1.14 CCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000210202 [0,0,0,0,0,2|2,0,0]=4 8000 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747405 [0,0,0,0,0,2|2,0,0]=4 8001 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000747405_100000211213 [0,0,0,0,0,2|2,0,0]=4 8002 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747405 [0,0,0,0,0,2|2,0,0]=4 8003 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000747405_100000185761 [0,0,0,0,0,2|2,0,0]=4 8004 B13R1.14 CCC(=O)CSc1ccc(cc1)O 62a_100000747405_100000185759 [0,0,0,0,0,2|1,0,0]=3 8005 B13R1.14 CCC(=O)CSc1ccc(cn1)O 62a_100000685995_100000747405 [0,0,0,0,0,2|2,0,0]=4 8006 B13R1.14 CCC(=O)CSc1ccc(cn1)O 62a_100000747405_100000744096 [0,0,0,0,0,2|2,0,0]=4 8007 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000210414 [0,0,0,0,0,2|2,0,0]=4 8008 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000210414 [0,0,0,0,0,2|2,0,0]=4 8009 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000210414 [0,0,0,0,0,2|2,0,0]=4 8010 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000210414 [0,0,0,0,0,2|2,0,0]=4 8011 B13R1.14 CCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000210414 [0,0,0,0,0,2|2,0,0]=4 8012 B13R1.14 CCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000210414 [0,0,0,0,0,2|2,0,0]=4 8013 B13R1.14 CCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000210414 [0,0,0,0,0,2|2,0,0]=4 8014 B13R1.14 CCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000210414 [0,0,0,0,0,2|2,0,0]=4 8015 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000210414 [0,0,0,0,0,2|2,0,0]=4 8016 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000210414 [0,0,0,0,0,2|2,0,0]=4 8017 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000210414 [0,0,0,0,0,2|2,0,0]=4 8018 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000210414 [0,0,0,0,0,2|2,0,0]=4 8019 B13R1.14 CCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000210414 [0,0,0,0,0,2|2,0,0]=4 8020 B13R1.14 CCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000210414 [0,0,0,0,0,2|2,0,0]=4 8021 B13R1.14 CCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000210414 [0,0,0,0,0,2|2,0,0]=4 8022 B13R1.14 CCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000210414 [0,0,0,0,0,2|2,0,0]=4 8023 B13R1.14 CCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000210414 [0,0,0,0,0,2|2,0,0]=4 8024 B13R1.14 CCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000210414 [0,0,0,0,0,2|2,0,0]=4 8025 B13R1.14 CCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000210414 [0,0,0,0,0,2|2,0,0]=4 8026 B13R1.14 CCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000210414 [0,0,0,0,0,2|2,0,0]=4 8027 B13R1.14 CCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210414 [0,0,0,0,0,2|1,0,0]=3 8028 B13R1.14 CCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000210414 [0,0,0,0,0,2|1,0,0]=3 8029 B13R1.14 CCC(=O)NCc1ccc(cn1)O 240690a_100020605196_100000210414 [0,0,0,0,0,2|2,0,0]=4 8030 B13R1.14 CCC(=O)NCc1ccc(nc1)O 11a_100000757128_100000210414 [0,0,0,0,0,2|2,0,0]=4 8031 B13R1.14 CCC(=O)NCc1ccc(nc1)O 240690a_100000757128_100000210414 [0,0,0,0,0,2|2,0,0]=4 8032 B13R1.14 CCC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000210414 [0,0,0,0,0,2|2,0,0]=4 8033 B13R1.14 CCC(=O)NNc1ccc(cc1)C 22a_100000683527_100000210414 [0,0,0,0,0,2|2,0,0]=4 8034 B13R1.14 CCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000210414 [0,0,0,0,0,2|2,0,0]=4 8035 B13R1.14 CCC(=O)NNc1ccc(cc1)F 22a_100000728448_100000210414 [0,0,0,0,0,2|2,0,0]=4 8036 B13R1.14 CCC(=O)NNc1ccc(cc1)I 22a_100016988836_100000210414 [0,0,0,0,0,2|2,0,0]=4 8037 B13R1.14 CNC(=O)C#Cc1ccc(cc1)Cl 240690a_100102657272_100011892723 [0,0,0,0,0,2|2,0,0]=4 8038 B13R1.14 CNC(=O)C#Cc1ccc(cc1)F 240690a_100102657272_100000238512 [0,0,0,0,0,2|2,0,0]=4 8039 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br 11a_106832991635_100016267368 [0,0,0,0,0,2|2,0,0]=4 8040 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Br 1626a_100102657272_100016267368 [0,0,0,0,0,2|2,0,0]=4 8041 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 11a_106832991635_100000716854 [0,0,0,0,0,2|2,0,0]=4 8042 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 1626a_100102657272_100000716854 [0,0,0,0,0,2|2,0,0]=4 8043 B13R1.14 CNC(=O)C=Cc1ccc(cc1)C 240690a_100102657272_100000716854 [0,0,0,0,0,2|2,0,0]=4 8044 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 11a_106832991635_100000184863 [0,0,0,0,0,2|2,0,0]=4 8045 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 1626a_100102657272_100000184863 [0,0,0,0,0,2|2,0,0]=4 8046 B13R1.14 CNC(=O)C=Cc1ccc(cc1)Cl 240690a_100102657272_100000184863 [0,0,0,0,0,2|2,0,0]=4 8047 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 11a_106832991635_100000182136 [0,0,0,0,0,2|2,0,0]=4 8048 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 1626a_100102657272_100000182136 [0,0,0,0,0,2|2,0,0]=4 8049 B13R1.14 CNC(=O)C=Cc1ccc(cc1)F 240690a_100102657272_100000182136 [0,0,0,0,0,2|2,0,0]=4 8050 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 11a_106832991635_100102526154 [0,0,0,0,0,2|2,0,0]=4 8051 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 1626a_100102657272_100102526154 [0,0,0,0,0,2|2,0,0]=4 8052 B13R1.14 CNC(=O)C=Cc1ccc(cc1)I 240690a_100102657272_100102526154 [0,0,0,0,0,2|2,0,0]=4 8053 B13R1.14 CNC(=O)C=Cc1ccc(cc1)O 240690a_100102657272_100016269017 [0,0,0,0,0,2|1,0,0]=3 8054 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 11a_106832991635_100000217147 [0,0,0,0,0,2|2,0,0]=4 8055 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 1626a_100102657272_100000217147 [0,0,0,0,0,2|2,0,0]=4 8056 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 240690a_100102657272_100000217147 [0,0,0,0,0,2|2,0,0]=4 8057 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 527a_100102657272_100000217147 [0,0,0,0,0,2|2,0,0]=4 8058 B13R1.14 CNC(=O)CCc1ccc(cc1)C 11a_106832991635_100000234883 [0,0,0,0,0,2|2,0,0]=4 8059 B13R1.14 CNC(=O)CCc1ccc(cc1)C 1626a_100102657272_100000234883 [0,0,0,0,0,2|2,0,0]=4 8060 B13R1.14 CNC(=O)CCc1ccc(cc1)C 240690a_100102657272_100000234883 [0,0,0,0,0,2|2,0,0]=4 8061 B13R1.14 CNC(=O)CCc1ccc(cc1)C 527a_100102657272_100000234883 [0,0,0,0,0,2|2,0,0]=4 8062 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 11a_106832991635_100000235379 [0,0,0,0,0,2|2,0,0]=4 8063 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 1626a_100102657272_100000235379 [0,0,0,0,0,2|2,0,0]=4 8064 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 240690a_100102657272_100000235379 [0,0,0,0,0,2|2,0,0]=4 8065 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 527a_100102657272_100000235379 [0,0,0,0,0,2|2,0,0]=4 8066 B13R1.14 CNC(=O)CCc1ccc(cc1)F 11a_106832991635_100000198493 [0,0,0,0,0,2|2,0,0]=4 8067 B13R1.14 CNC(=O)CCc1ccc(cc1)F 1626a_100102657272_100000198493 [0,0,0,0,0,2|2,0,0]=4 8068 B13R1.14 CNC(=O)CCc1ccc(cc1)F 240690a_100102657272_100000198493 [0,0,0,0,0,2|2,0,0]=4 8069 B13R1.14 CNC(=O)CCc1ccc(cc1)F 527a_100102657272_100000198493 [0,0,0,0,0,2|2,0,0]=4 8070 B13R1.14 CNC(=O)CCc1ccc(cc1)I 11a_106832991635_100011217499 [0,0,0,0,0,2|2,0,0]=4 8071 B13R1.14 CNC(=O)CCc1ccc(cc1)I 1626a_100102657272_100011217499 [0,0,0,0,0,2|2,0,0]=4 8072 B13R1.14 CNC(=O)CCc1ccc(cc1)I 240690a_100102657272_100011217499 [0,0,0,0,0,2|2,0,0]=4 8073 B13R1.14 CNC(=O)CCc1ccc(cc1)I 527a_100102657272_100011217499 [0,0,0,0,0,2|2,0,0]=4 8074 B13R1.14 CNC(=O)CCc1ccc(cc1)O 240690a_100102657272_100000742835 [0,0,0,0,0,2|1,0,0]=3 8075 B13R1.14 CNC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010273138 [0,0,0,0,0,2|1,0,0]=3 8076 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183359 [0,0,0,0,0,2|2,0,0]=4 8077 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000183359 [0,0,0,0,0,2|2,0,0]=4 8078 B13R1.14 CNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000183359 [0,0,0,0,0,2|2,0,0]=4 8079 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183359 [0,0,0,0,0,2|2,0,0]=4 8080 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000183359 [0,0,0,0,0,2|2,0,0]=4 8081 B13R1.14 CNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000183359 [0,0,0,0,0,2|2,0,0]=4 8082 B13R1.14 CNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000183359 [0,0,0,0,0,2|2,0,0]=4 8083 B13R1.14 CNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000183359 [0,0,0,0,0,2|1,0,0]=3 8084 B13R1.14 CNC(=O)COc1ccc(cc1)Br 11a_106832991635_100000182358 [0,0,0,0,0,2|2,0,0]=4 8085 B13R1.14 CNC(=O)COc1ccc(cc1)Br 1626a_100102657272_100000182358 [0,0,0,0,0,2|2,0,0]=4 8086 B13R1.14 CNC(=O)COc1ccc(cc1)Br 240690a_100102657272_100000182358 [0,0,0,0,0,2|2,0,0]=4 8087 B13R1.14 CNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183359 [0,0,0,0,0,2|2,0,0]=4 8088 B13R1.14 CNC(=O)COc1ccc(cc1)Br 527a_100102657272_100000182358 [0,0,0,0,0,2|2,0,0]=4 8089 B13R1.14 CNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183359 [0,0,0,0,0,2|2,0,0]=4 8090 B13R1.14 CNC(=O)COc1ccc(cc1)C 11a_106832991635_100000182360 [0,0,0,0,0,2|2,0,0]=4 8091 B13R1.14 CNC(=O)COc1ccc(cc1)C 1626a_100102657272_100000182360 [0,0,0,0,0,2|2,0,0]=4 8092 B13R1.14 CNC(=O)COc1ccc(cc1)C 240690a_100102657272_100000182360 [0,0,0,0,0,2|2,0,0]=4 8093 B13R1.14 CNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183359 [0,0,0,0,0,2|2,0,0]=4 8094 B13R1.14 CNC(=O)COc1ccc(cc1)C 527a_100102657272_100000182360 [0,0,0,0,0,2|2,0,0]=4 8095 B13R1.14 CNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183359 [0,0,0,0,0,2|2,0,0]=4 8096 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 11a_106832991635_100016990877 [0,0,0,0,0,2|2,0,0]=4 8097 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 1626a_100102657272_100016990877 [0,0,0,0,0,2|2,0,0]=4 8098 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 240690a_100102657272_100016990877 [0,0,0,0,0,2|2,0,0]=4 8099 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183359 [0,0,0,0,0,2|2,0,0]=4 8100 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 527a_100102657272_100016990877 [0,0,0,0,0,2|2,0,0]=4 8101 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183359 [0,0,0,0,0,2|2,0,0]=4 8102 B13R1.14 CNC(=O)COc1ccc(cc1)F 11a_106832991635_100000184765 [0,0,0,0,0,2|2,0,0]=4 8103 B13R1.14 CNC(=O)COc1ccc(cc1)F 1626a_100102657272_100000184765 [0,0,0,0,0,2|2,0,0]=4 8104 B13R1.14 CNC(=O)COc1ccc(cc1)F 240690a_100102657272_100000184765 [0,0,0,0,0,2|2,0,0]=4 8105 B13R1.14 CNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183359 [0,0,0,0,0,2|2,0,0]=4 8106 B13R1.14 CNC(=O)COc1ccc(cc1)F 527a_100102657272_100000184765 [0,0,0,0,0,2|2,0,0]=4 8107 B13R1.14 CNC(=O)COc1ccc(cc1)I 11a_106832991635_100000184369 [0,0,0,0,0,2|2,0,0]=4 8108 B13R1.14 CNC(=O)COc1ccc(cc1)I 1626a_100102657272_100000184369 [0,0,0,0,0,2|2,0,0]=4 8109 B13R1.14 CNC(=O)COc1ccc(cc1)I 240690a_100102657272_100000184369 [0,0,0,0,0,2|2,0,0]=4 8110 B13R1.14 CNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183359 [0,0,0,0,0,2|2,0,0]=4 8111 B13R1.14 CNC(=O)COc1ccc(cc1)I 527a_100102657272_100000184369 [0,0,0,0,0,2|2,0,0]=4 8112 B13R1.14 CNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183359 [0,0,0,0,0,2|2,0,0]=4 8113 B13R1.14 CNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183359 [0,0,0,0,0,2|2,0,0]=4 8114 B13R1.14 CNC(=O)COc1ccc(cc1)O 240690a_100102657272_100000031633 [0,0,0,0,0,2|1,0,0]=3 8115 B13R1.14 CNC(=O)COc1ccc(cc1)O 271570a_203496583355_200000150405 [0,0,0,0,0,2|1,0,0]=3 8116 B13R1.14 CNC(=O)COc1ccc(cc1)O 527a_100102657272_100000031633 [0,0,0,0,0,2|1,0,0]=3 8117 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 11a_106832991635_100000179496 [0,0,0,0,0,2|2,0,0]=4 8118 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 1626a_100102657272_100000179496 [0,0,0,0,0,2|2,0,0]=4 8119 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 240690a_100102657272_100000179496 [0,0,0,0,0,2|2,0,0]=4 8120 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 527a_100102657272_100000179496 [0,0,0,0,0,2|2,0,0]=4 8121 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000183359_100000752885 [0,0,0,0,0,2|2,0,0]=4 8122 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183359 [0,0,0,0,0,2|2,0,0]=4 8123 B13R1.14 CNC(=O)CSc1ccc(cc1)C 11a_106832991635_100000179497 [0,0,0,0,0,2|2,0,0]=4 8124 B13R1.14 CNC(=O)CSc1ccc(cc1)C 1626a_100102657272_100000179497 [0,0,0,0,0,2|2,0,0]=4 8125 B13R1.14 CNC(=O)CSc1ccc(cc1)C 240690a_100102657272_100000179497 [0,0,0,0,0,2|2,0,0]=4 8126 B13R1.14 CNC(=O)CSc1ccc(cc1)C 527a_100102657272_100000179497 [0,0,0,0,0,2|2,0,0]=4 8127 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000183359_100000186775 [0,0,0,0,0,2|2,0,0]=4 8128 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183359 [0,0,0,0,0,2|2,0,0]=4 8129 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 11a_106832991635_100000178402 [0,0,0,0,0,2|2,0,0]=4 8130 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 1626a_100102657272_100000178402 [0,0,0,0,0,2|2,0,0]=4 8131 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 240690a_100102657272_100000178402 [0,0,0,0,0,2|2,0,0]=4 8132 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 527a_100102657272_100000178402 [0,0,0,0,0,2|2,0,0]=4 8133 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000183359_100000755918 [0,0,0,0,0,2|2,0,0]=4 8134 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183359 [0,0,0,0,0,2|2,0,0]=4 8135 B13R1.14 CNC(=O)CSc1ccc(cc1)F 11a_106832991635_100000691584 [0,0,0,0,0,2|2,0,0]=4 8136 B13R1.14 CNC(=O)CSc1ccc(cc1)F 1626a_100102657272_100000691584 [0,0,0,0,0,2|2,0,0]=4 8137 B13R1.14 CNC(=O)CSc1ccc(cc1)F 240690a_100102657272_100000691584 [0,0,0,0,0,2|2,0,0]=4 8138 B13R1.14 CNC(=O)CSc1ccc(cc1)F 527a_100102657272_100000691584 [0,0,0,0,0,2|2,0,0]=4 8139 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000183359_100000211213 [0,0,0,0,0,2|2,0,0]=4 8140 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183359 [0,0,0,0,0,2|2,0,0]=4 8141 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000183359_100000185761 [0,0,0,0,0,2|2,0,0]=4 8142 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183359 [0,0,0,0,0,2|2,0,0]=4 8143 B13R1.14 CNC(=O)CSc1ccc(cc1)O 62a_100000183359_100000185759 [0,0,0,0,0,2|1,0,0]=3 8144 B13R1.14 CNC(=O)CSc1ccc(cn1)O 62a_100000183359_100000744096 [0,0,0,0,0,2|2,0,0]=4 8145 B13R1.14 CNC(=O)CSc1ccc(cn1)O 62a_100000685995_100000183359 [0,0,0,0,0,2|2,0,0]=4 8146 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_106832991635 [0,0,0,0,0,2|2,0,0]=4 8147 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100102657272_100000174875 [0,0,0,0,0,2|2,0,0]=4 8148 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100102657272 [0,0,0,0,0,2|2,0,0]=4 8149 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100102657272_100000174875 [0,0,0,0,0,2|2,0,0]=4 8150 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100102657272 [0,0,0,0,0,2|2,0,0]=4 8151 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_106832991638_100000174875 [0,0,0,0,0,2|2,0,0]=4 8152 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100000174908_106832991635 [0,0,0,0,0,2|2,0,0]=4 8153 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100102657272_100000174908 [0,0,0,0,0,2|2,0,0]=4 8154 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100102657272 [0,0,0,0,0,2|2,0,0]=4 8155 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100102657272_100000174908 [0,0,0,0,0,2|2,0,0]=4 8156 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_100000174908_100102657272 [0,0,0,0,0,2|2,0,0]=4 8157 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_106832991638_100000174908 [0,0,0,0,0,2|2,0,0]=4 8158 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_106832991635 [0,0,0,0,0,2|2,0,0]=4 8159 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100102657272_100000174871 [0,0,0,0,0,2|2,0,0]=4 8160 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100102657272 [0,0,0,0,0,2|2,0,0]=4 8161 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100102657272_100000174871 [0,0,0,0,0,2|2,0,0]=4 8162 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 512a_106832991638_100000174871 [0,0,0,0,0,2|2,0,0]=4 8163 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100000174882_106832991635 [0,0,0,0,0,2|2,0,0]=4 8164 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100102657272_100000174882 [0,0,0,0,0,2|2,0,0]=4 8165 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100102657272 [0,0,0,0,0,2|2,0,0]=4 8166 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100102657272_100000174882 [0,0,0,0,0,2|2,0,0]=4 8167 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_100000174882_100102657272 [0,0,0,0,0,2|2,0,0]=4 8168 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_106832991638_100000174882 [0,0,0,0,0,2|2,0,0]=4 8169 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100016989417_106832991635 [0,0,0,0,0,2|2,0,0]=4 8170 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100102657272_100016989417 [0,0,0,0,0,2|2,0,0]=4 8171 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100102657272 [0,0,0,0,0,2|2,0,0]=4 8172 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100102657272_100016989417 [0,0,0,0,0,2|2,0,0]=4 8173 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_100016989417_100102657272 [0,0,0,0,0,2|2,0,0]=4 8174 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_106832991638_100016989417 [0,0,0,0,0,2|2,0,0]=4 8175 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100000185549_106832991635 [0,0,0,0,0,2|1,0,0]=3 8176 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100102657272_100000185549 [0,0,0,0,0,2|1,0,0]=3 8177 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100102657272 [0,0,0,0,0,2|1,0,0]=3 8178 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100102657272_100000185549 [0,0,0,0,0,2|1,0,0]=3 8179 B13R1.14 CNC(=O)NCc1ccc(cc1)O 512a_106832991638_100000185549 [0,0,0,0,0,2|1,0,0]=3 8180 B13R1.14 CNC(=O)NCc1ccc(cn1)O 2708a_100020605196_106832991635 [0,0,0,0,0,2|2,0,0]=4 8181 B13R1.14 CNC(=O)NCc1ccc(cn1)O 2708a_100102657272_100020605196 [0,0,0,0,0,2|2,0,0]=4 8182 B13R1.14 CNC(=O)NCc1ccc(cn1)O 273464a_100020605196_100102657272 [0,0,0,0,0,2|2,0,0]=4 8183 B13R1.14 CNC(=O)NCc1ccc(cn1)O 273464a_100102657272_100020605196 [0,0,0,0,0,2|2,0,0]=4 8184 B13R1.14 CNC(=O)NCc1ccc(cn1)O 512a_106832991638_100020605196 [0,0,0,0,0,2|2,0,0]=4 8185 B13R1.14 CNC(=O)NCc1ccc(nc1)O 2708a_100000757128_106832991635 [0,0,0,0,0,2|2,0,0]=4 8186 B13R1.14 CNC(=O)NCc1ccc(nc1)O 2708a_100102657272_100000757128 [0,0,0,0,0,2|2,0,0]=4 8187 B13R1.14 CNC(=O)NCc1ccc(nc1)O 273464a_100000757128_100102657272 [0,0,0,0,0,2|2,0,0]=4 8188 B13R1.14 CNC(=O)NCc1ccc(nc1)O 273464a_100102657272_100000757128 [0,0,0,0,0,2|2,0,0]=4 8189 B13R1.14 CNC(=O)NCc1ccc(nc1)O 512a_106832991638_100000757128 [0,0,0,0,0,2|2,0,0]=4 8190 B13R1.14 CNC(=O)NNc1ccc(cc1)Br 273464a_100102657272_100000735608 [0,0,0,0,0,2|2,0,0]=4 8191 B13R1.14 CNC(=O)NNc1ccc(cc1)Br 512a_106832991638_100000735608 [0,0,0,0,0,2|2,0,0]=4 8192 B13R1.14 CNC(=O)NNc1ccc(cc1)C 273464a_100102657272_100000683527 [0,0,0,0,0,2|2,0,0]=4 8193 B13R1.14 CNC(=O)NNc1ccc(cc1)C 512a_106832991638_100000683527 [0,0,0,0,0,2|2,0,0]=4 8194 B13R1.14 CNC(=O)NNc1ccc(cc1)Cl 273464a_100102657272_100000683521 [0,0,0,0,0,2|2,0,0]=4 8195 B13R1.14 CNC(=O)NNc1ccc(cc1)Cl 512a_106832991638_100000683521 [0,0,0,0,0,2|2,0,0]=4 8196 B13R1.14 CNC(=O)NNc1ccc(cc1)F 273464a_100102657272_100000728448 [0,0,0,0,0,2|2,0,0]=4 8197 B13R1.14 CNC(=O)NNc1ccc(cc1)F 512a_106832991638_100000728448 [0,0,0,0,0,2|2,0,0]=4 8198 B13R1.14 CNC(=O)NNc1ccc(cc1)I 273464a_100102657272_100016988836 [0,0,0,0,0,2|2,0,0]=4 8199 B13R1.14 CNC(=O)NNc1ccc(cc1)I 512a_106832991638_100016988836 [0,0,0,0,0,2|2,0,0]=4 8200 B13R1.14 COC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_100000148628 [0,0,0,0,0,2|0,0,0]=2 8201 B13R1.14 COC(=O)C#Cc1ccc(cc1)O 271570a_203496583355_100012100070 [0,0,0,0,0,2|0,0,0]=2 8202 B13R1.14 COC(=O)CCc1ccc(cc1)O 271570a_203496583355_100012357364 [0,0,0,0,0,2|0,0,0]=2 8203 B13R1.14 COC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747449 [0,0,0,0,0,2|1,0,0]=3 8204 B13R1.14 COC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000747449 [0,0,0,0,0,2|1,0,0]=3 8205 B13R1.14 COC(=O)CNc1ccc(cc1)C 34a_100000124888_100000747449 [0,0,0,0,0,2|1,0,0]=3 8206 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747449 [0,0,0,0,0,2|1,0,0]=3 8207 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000747449 [0,0,0,0,0,2|1,0,0]=3 8208 B13R1.14 COC(=O)CNc1ccc(cc1)F 34a_100000185862_100000747449 [0,0,0,0,0,2|1,0,0]=3 8209 B13R1.14 COC(=O)CNc1ccc(cc1)I 34a_100000185761_100000747449 [0,0,0,0,0,2|1,0,0]=3 8210 B13R1.14 COC(=O)CNc1ccc(cc1)O 34a_100000185829_100000747449 [0,0,0,0,0,2|0,0,0]=2 8211 B13R1.14 COC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000747449 [0,0,0,0,0,2|1,0,1]=4 8212 B13R1.14 COC(=O)COc1ccc(cc1)Br 34a_100000185759_100000747449 [0,0,0,0,0,2|1,0,0]=3 8213 B13R1.14 COC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747449 [0,0,0,0,0,2|1,0,0]=3 8214 B13R1.14 COC(=O)COc1ccc(cc1)C 34a_100000210336_100000747449 [0,0,0,0,0,2|1,0,0]=3 8215 B13R1.14 COC(=O)COc1ccc(cc1)C 7a_100000210336_100000747449 [0,0,0,0,0,2|1,0,0]=3 8216 B13R1.14 COC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000747449 [0,0,0,0,0,2|1,0,0]=3 8217 B13R1.14 COC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747449 [0,0,0,0,0,2|1,0,0]=3 8218 B13R1.14 COC(=O)COc1ccc(cc1)F 34a_100000210339_100000747449 [0,0,0,0,0,2|1,0,0]=3 8219 B13R1.14 COC(=O)COc1ccc(cc1)I 34a_100000212066_100000747449 [0,0,0,0,0,2|1,0,0]=3 8220 B13R1.14 COC(=O)COc1ccc(cc1)I 7a_100000212066_100000747449 [0,0,0,0,0,2|1,0,0]=3 8221 B13R1.14 COC(=O)COc1ccc(cc1)N 34a_100000185829_100000747449 [0,0,0,0,0,2|1,0,0]=3 8222 B13R1.14 COC(=O)COc1ccc(cc1)O 271570a_203496583355_100000149925 [0,0,0,0,0,2|0,0,0]=2 8223 B13R1.14 COC(=O)COc1ccc(cn1)C 34a_100000759353_100000747449 [0,0,0,0,0,2|2,0,0]=4 8224 B13R1.14 COC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000747449 [0,0,0,0,0,2|2,0,0]=4 8225 B13R1.14 COC(=O)COc1ccc(cn1)F 34a_100000742473_100000747449 [0,0,0,0,0,2|2,0,0]=4 8226 B13R1.14 COC(=O)COc1ccc(cn1)N 34a_100000729260_100000747449 [0,0,0,0,0,2|2,0,0]=4 8227 B13R1.14 COC(=O)COc1ccc(nc1)Br 34a_100000685995_100000747449 [0,0,0,0,0,2|2,0,0]=4 8228 B13R1.14 COC(=O)COc1ccc(nc1)Br 7a_100000685995_100000747449 [0,0,0,0,0,2|2,0,0]=4 8229 B13R1.14 COC(=O)COc1ccc(nc1)C 34a_100000745506_100000747449 [0,0,0,0,0,2|2,0,0]=4 8230 B13R1.14 COC(=O)COc1ccc(nc1)C 7a_100000745506_100000747449 [0,0,0,0,0,2|2,0,0]=4 8231 B13R1.14 COC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000747449 [0,0,0,0,0,2|2,0,0]=4 8232 B13R1.14 COC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000747449 [0,0,0,0,0,2|2,0,0]=4 8233 B13R1.14 COC(=O)COc1ccc(nc1)F 34a_100000688820_100000747449 [0,0,0,0,0,2|2,0,0]=4 8234 B13R1.14 COC(=O)COc1ccc(nc1)F 7a_100000688820_100000747449 [0,0,0,0,0,2|2,0,0]=4 8235 B13R1.14 COC(=O)COc1ccc(nc1)I 34a_100000687607_100000747449 [0,0,0,0,0,2|2,0,0]=4 8236 B13R1.14 COC(=O)COc1ccc(nc1)I 7a_100000687607_100000747449 [0,0,0,0,0,2|2,0,0]=4 8237 B13R1.14 COC(=O)COc1ccc(nc1)N 34a_100015188713_100000747449 [0,0,0,0,0,2|2,0,0]=4 8238 B13R1.14 COC(=O)COc1ccc(nc1)N 7a_100015188713_100000747449 [0,0,0,0,0,2|2,0,0]=4 8239 B13R1.14 COC(=O)COc1ccc(nc1)O 271570a_203496583355_100010870986 [0,0,0,0,0,2|1,0,0]=3 8240 B13R1.14 COC(=O)CSc1cc[n+](cc1)[O-] 62a_100000747449_100000039755 [0,0,0,0,0,2|1,0,1]=4 8241 B13R1.14 COC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000747449 [0,0,0,0,0,2|1,0,1]=4 8242 B13R1.14 COC(=O)CSc1ccc(=O)[nH]c1 62a_100000747449_100000212171 [0,0,0,0,0,2|1,0,1]=4 8243 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000747449_100000752885 [0,0,0,0,0,2|1,0,0]=3 8244 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747449 [0,0,0,0,0,2|1,0,0]=3 8245 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747449 [0,0,0,0,0,2|1,0,0]=3 8246 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000747449_100000186775 [0,0,0,0,0,2|1,0,0]=3 8247 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000747449_100000755918 [0,0,0,0,0,2|1,0,0]=3 8248 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747449 [0,0,0,0,0,2|1,0,0]=3 8249 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747449 [0,0,0,0,0,2|1,0,0]=3 8250 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000747449_100000211213 [0,0,0,0,0,2|1,0,0]=3 8251 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747449 [0,0,0,0,0,2|1,0,0]=3 8252 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000747449_100000185761 [0,0,0,0,0,2|1,0,0]=3 8253 B13R1.14 COC(=O)CSc1ccc(cc1)O 62a_100000747449_100000185759 [0,0,0,0,0,2|0,0,0]=2 8254 B13R1.14 COC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000747449 [0,0,0,0,0,2|2,0,0]=4 8255 B13R1.14 COC(=O)CSc1ccc(cn1)Br 62a_100000747449_100000686858 [0,0,0,0,0,2|2,0,0]=4 8256 B13R1.14 COC(=O)CSc1ccc(cn1)C 62a_100000747449_100000754016 [0,0,0,0,0,2|2,0,0]=4 8257 B13R1.14 COC(=O)CSc1ccc(cn1)C 62a_100011192072_100000747449 [0,0,0,0,0,2|2,0,0]=4 8258 B13R1.14 COC(=O)CSc1ccc(cn1)Cl 62a_100000747449_100011356976 [0,0,0,0,0,2|2,0,0]=4 8259 B13R1.14 COC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000747449 [0,0,0,0,0,2|2,0,0]=4 8260 B13R1.14 COC(=O)CSc1ccc(cn1)F 62a_100000744514_100000747449 [0,0,0,0,0,2|2,0,0]=4 8261 B13R1.14 COC(=O)CSc1ccc(cn1)F 62a_100000747449_100000744514 [0,0,0,0,0,2|2,0,0]=4 8262 B13R1.14 COC(=O)CSc1ccc(cn1)N 62a_100000737798_100000747449 [0,0,0,0,0,2|2,0,0]=4 8263 B13R1.14 COC(=O)CSc1ccc(cn1)N 62a_100000747449_100000737798 [0,0,0,0,0,2|2,0,0]=4 8264 B13R1.14 COC(=O)CSc1ccc(cn1)O 62a_100000685995_100000747449 [0,0,0,0,0,2|1,0,0]=3 8265 B13R1.14 COC(=O)CSc1ccc(cn1)O 62a_100000747449_100000744096 [0,0,0,0,0,2|1,0,0]=3 8266 B13R1.14 COC(=O)CSc1ccc(nc1)Br 62a_100000747449_100009814638 [0,0,0,0,0,2|2,0,0]=4 8267 B13R1.14 COC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000747449 [0,0,0,0,0,2|2,0,0]=4 8268 B13R1.14 COC(=O)CSc1ccc(nc1)C 62a_100000747449_100000751577 [0,0,0,0,0,2|2,0,0]=4 8269 B13R1.14 COC(=O)CSc1ccc(nc1)C 62a_100000751577_100000747449 [0,0,0,0,0,2|2,0,0]=4 8270 B13R1.14 COC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000747449 [0,0,0,0,0,2|2,0,0]=4 8271 B13R1.14 COC(=O)CSc1ccc(nc1)Cl 62a_100000747449_100000034144 [0,0,0,0,0,2|2,0,0]=4 8272 B13R1.14 COC(=O)CSc1ccc(nc1)F 62a_100000042367_100000747449 [0,0,0,0,0,2|2,0,0]=4 8273 B13R1.14 COC(=O)CSc1ccc(nc1)F 62a_100000747449_100000042367 [0,0,0,0,0,2|2,0,0]=4 8274 B13R1.14 COC(=O)CSc1ccc(nc1)N 62a_100000187370_100000747449 [0,0,0,0,0,2|2,0,0]=4 8275 B13R1.14 COC(=O)CSc1ccc(nc1)N 62a_100000747449_100000187370 [0,0,0,0,0,2|2,0,0]=4 8276 B13R1.14 COC(=O)CSc1cnc(cn1)O 62a_100000747449_100015839800 [0,0,0,0,0,2|2,0,0]=4 8277 B13R1.14 COC(=O)CSc1cnc(cn1)O 62a_100011934580_100000747449 [0,0,0,0,0,2|2,0,0]=4 8278 B13R1.14 COC(=O)CSc1ncc(cn1)O 62a_100000730009_100000747449 [0,0,0,0,0,2|2,0,0]=4 8279 B13R1.14 COC(=O)CSc1ncc(cn1)O 62a_100000747449_100000092845 [0,0,0,0,0,2|2,0,0]=4 8280 B13R1.14 NNC(=O)COc1ccc(cc1)O 271570a_203496583355_100000182278 [0,0,0,0,0,2|2,0,0]=4 8281 B13R1.14 O=C(CF)CCc1ccc(cc1)O 1458a_100000742835_100015361967 [0,0,0,0,0,2|2,0,0]=4 8282 B13R1.14 O=C(CF)COc1ccc(cc1)O 1458a_100000031633_100015361967 [0,0,0,0,0,2|2,0,0]=4 8283 B13R1.14 O=C(CO)CCc1ccc(cc1)O 1458a_100000210174_100009816426 [0,0,0,0,0,2|2,0,0]=4 8284 B13R1.14 O=C(CO)NCc1ccc(cc1)O 240690a_100000185549_100000210174 [0,0,0,0,0,2|2,0,0]=4 8285 B13R1.14 O=C(CO)NCc1ccc(cc1)O 527a_100000185549_100000210174 [0,0,0,0,0,2|2,0,0]=4