0 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [0,0,0,0,0,0|1,0,2]=3 1 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,0,0,0,0,0|1,0,2]=3 18 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,0,0,0,0,0|1,0,2]=3 19 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,0,0,0,0,0|4,0,0]=4 46 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,0,0,0,0,0|4,0,0]=4 47 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,0,0,0,0,0|4,0,0]=4 48 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,0,0,0,0,0|3,0,0]=3 51 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 59 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,0,0,0,0,0|4,0,0]=4 60 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 61 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 62 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,0,0,0,0,0|2,0,0]=2 70 B11R1.22 CN(CF)c1ccc(cc1)Br 269982a_100000219623_100015361967 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.22 CN(CF)c1ccc(cc1)Br 34a_100000219623_100015361967 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.22 CN(CF)c1ccc(cc1)Cl 269982a_100020629279_100015361967 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.22 CN(CF)c1ccc(cc1)Cl 34a_100020629279_100015361967 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.22 CN(CF)c1ccc(cc1)F 269982a_100000219829_100015361967 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.22 CN(CF)c1ccc(cc1)F 34a_100000219829_100015361967 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.22 CN(CF)c1ccc(cc1)I 269982a_100000743151_100015361967 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.22 CN(CF)c1ccc(cc1)I 34a_100000743151_100015361967 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [0,0,0,0,0,0|3,0,0]=3 80 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,0,0,0,0,0|2,0,2]=4 81 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,0,0,0,0,0|2,0,2]=4 82 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,0,0,0,0,0|2,0,2]=4 83 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,0,0,0,0,0|4,0,0]=4 86 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,0,0,0,0,0|4,0,0]=4 90 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,0,0,0,0,0|4,0,0]=4 91 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,0,0,0,0,0|4,0,0]=4 92 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,0,0,0,0,0|4,0,0]=4 93 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,0,0,0,0,0|4,0,0]=4 94 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,0,0,0,0,0|4,0,0]=4 95 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,0,0,0,0,0|4,0,0]=4 97 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,0,0,0,0,0|4,0,0]=4 98 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,0,0,0,0,0|3,0,0]=3 99 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,0,0,0,0,0|4,0,0]=4 100 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,0,0,0,0,0|4,0,0]=4 102 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,0,0,0,0,0|3,0,0]=3 103 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,0,0,0,0,0|4,0,0]=4 105 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,0,0,0,0,0|4,0,0]=4 107 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,0,0,0,0,0|4,0,0]=4 108 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,0,0,0,0,0|2,0,2]=4 109 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,0,0,0,0,0|4,0,0]=4 110 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,0,0,0,0,0|4,0,0]=4 111 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,0,0,0,0,0|4,0,0]=4 112 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,0,0,0,0,0|4,0,0]=4 114 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,0,0,0,0,0|4,0,0]=4 115 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,0,0,0,0,0|4,0,0]=4 116 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,0,0,0,0,0|4,0,0]=4 117 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,0,0,0,0,0|3,0,0]=3 118 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,0,0,0,0,0|4,0,0]=4 119 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,0,0,0,0,0|4,0,0]=4 120 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,0,0,0,0,0|4,0,0]=4 121 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,0,0,0,0,0|4,0,0]=4 122 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,0,0,0,0,0|4,0,0]=4 123 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,0,0,0,0,0|4,0,0]=4 124 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,0,0,0,0,0|4,0,0]=4 125 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,0,0,0,0,0|4,0,0]=4 126 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,0,0,0,0,0|4,0,0]=4 127 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,0,0,0,0,0|4,0,0]=4 128 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,0,0,0,0,0|4,0,0]=4 129 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,0,0,0,0,0|4,0,0]=4 130 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,0,0,0,0,0|4,0,0]=4 131 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,0,0,0,0,0|4,0,0]=4 132 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,0,0,0,0,0|4,0,0]=4 135 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,0,0,0,0,0|4,0,0]=4 136 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,0,0,0,0,0|3,0,0]=3 137 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,0,0,0,0,0|4,0,0]=4 138 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,0,0,0,0,0|4,0,0]=4 139 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,0,0,0,0,0|2,0,2]=4 140 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,0,0,0,0,0|4,0,0]=4 141 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,0,0,0,0,0|4,0,0]=4 142 B11R1.22 Cc1ccc(cc1)N(C)CF 269982a_100000219977_100015361967 [0,0,0,0,0,0|4,0,0]=4 143 B11R1.22 Cc1ccc(cc1)N(C)CF 34a_100000219977_100015361967 [0,0,0,0,0,0|4,0,0]=4 144 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,0,0,0,0,0|0,0,4]=4 149 B11R1.22 N#CC(N)c1ccc(cc1)O 271570a_203496583355_106722365845 [0,0,0,0,0,0|1,0,2]=3 150 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [0,0,0,0,0,0|2,0,0]=2 151 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,0,0,0,0,0|0,0,2]=2 152 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [0,0,0,0,0,0|0,0,0]=0 153 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,0,0,0,0,0|1,0,2]=3 154 B11R1.22 NNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781063 [0,0,0,0,0,0|2,0,2]=4 155 B11R1.22 NNC(=O)c1ccc(nc1)O 271570a_203496583355_100000189807 [0,0,0,0,0,0|2,0,2]=4 156 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,0,0,0,0,0|2,0,2]=4 157 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,0,0,0,0,0|2,0,2]=4 158 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,0,0,0,0,0|2,0,2]=4 159 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,0,0,0,0,0|2,0,2]=4 160 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,0,0,0,0,0|1,0,2]=3 161 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,0,0,0,0,0|1,0,2]=3 162 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,0,0,0,0,0|1,0,3]=4 163 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,0,0,0,0,0|1,0,0]=1 164 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,0,0,0,0,0|4,0,0]=4 165 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,0,0,0,0,0|4,0,0]=4 167 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,0,0,0,0,0|4,0,0]=4 168 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,0,0,0,0,0|1,0,2]=4 169 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,0,0,0,0,0|1,0,2]=4 170 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,0,0,0,0,0|1,0,2]=4 171 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,0,0,0,0,0|1,0,0]=2 172 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,0,0,0,0,0|2,0,0]=3 181 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,0,0,0,0,0|2,0,0]=3 182 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,0,0,0,0,0|2,0,0]=3 194 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [1,0,0,0,0,0|3,0,0]=4 196 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,0,0,0,0,0|2,0,0]=3 207 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,0,0,0,0,0|2,0,0]=3 208 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [1,0,0,0,0,0|3,0,0]=4 210 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,0,0,0,0,0|3,0,0]=4 213 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,0,0,0,0,0|3,0,0]=4 214 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,0,0,0,0,0|3,0,0]=4 216 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,0,0,0,0,0|3,0,0]=4 217 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,0,0,0,0,0|3,0,0]=4 218 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,0,0,0,0,0|3,0,0]=4 219 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,0,0,0,0,0|3,0,0]=4 220 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,0,0,0,0,0|3,0,0]=4 232 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,0,0,0,0,0|3,0,0]=4 234 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,0,0,0,0,0|3,0,0]=4 235 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,0,0,0,0,0|3,0,0]=4 238 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,0,0,0,0,0|3,0,0]=4 239 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,0,0,0,0,0|3,0,0]=4 242 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,0,0,0,0,0|3,0,0]=4 244 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,0,0,0,0,0|3,0,0]=4 246 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,0,0,0,0,0|2,0,0]=3 248 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,0,0,0,0,0|2,0,0]=3 249 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,0,0,0,0,0|3,0,0]=4 253 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,0,0,0,0,0|3,0,0]=4 254 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,0,0,0,0,0|3,0,0]=4 256 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,0,0,0,0,0|3,0,0]=4 258 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,0,0,0,0,0|2,0,0]=3 268 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,0,0,0,0,0|3,0,0]=4 269 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,0,0,0,0,0|3,0,0]=4 270 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,0,0,0,0,0|3,0,0]=4 271 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,0,0,0,0,0|3,0,0]=4 272 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,0,0,0,0,0|3,0,0]=4 273 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,0,0,0,0,0|3,0,0]=4 274 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,0,0,0,0,0|3,0,0]=4 275 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,0,0,0,0,0|3,0,0]=4 276 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,0,0,0,0,0|3,0,0]=4 277 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,0,0,0,0,0|3,0,0]=4 278 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [1,0,0,0,0,0|3,0,0]=4 279 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,0,0,0,0,0|3,0,0]=4 280 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,0,0,0,0,0|3,0,0]=4 281 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,0,0,0,0,0|3,0,0]=4 282 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,0,0,0,0,0|3,0,0]=4 285 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [1,0,0,0,0,0|3,0,0]=4 286 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [1,0,0,0,0,0|3,0,0]=4 287 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [1,0,0,0,0,0|3,0,0]=4 288 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [1,0,0,0,0,0|3,0,0]=4 289 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [1,0,0,0,0,0|3,0,0]=4 290 B10R1.1 FCNc1ccc(cc1)Br 34a_100000210018_100015361967 [1,0,0,0,0,0|3,0,0]=4 291 B10R1.1 FCNc1ccc(cc1)Cl 34a_100000210052_100015361967 [1,0,0,0,0,0|3,0,0]=4 292 B10R1.1 FCNc1ccc(cc1)F 34a_100000185862_100015361967 [1,0,0,0,0,0|3,0,0]=4 293 B10R1.1 FCNc1ccc(cc1)I 34a_100000185761_100015361967 [1,0,0,0,0,0|3,0,0]=4 294 B10R1.1 FCOc1ccc(cc1)Br 34a_100000185759_100015361967 [1,0,0,0,0,0|3,0,0]=4 295 B10R1.1 FCOc1ccc(cc1)Br 7a_100000185759_100015361967 [1,0,0,0,0,0|3,0,0]=4 296 B10R1.1 FCOc1ccc(cc1)Cl 34a_100000210216_100015361967 [1,0,0,0,0,0|3,0,0]=4 297 B10R1.1 FCOc1ccc(cc1)Cl 7a_100000210216_100015361967 [1,0,0,0,0,0|3,0,0]=4 298 B10R1.1 FCOc1ccc(cc1)F 34a_100000210339_100015361967 [1,0,0,0,0,0|3,0,0]=4 299 B10R1.1 FCOc1ccc(cc1)I 34a_100000212066_100015361967 [1,0,0,0,0,0|3,0,0]=4 300 B10R1.1 FCOc1ccc(cc1)I 7a_100000212066_100015361967 [1,0,0,0,0,0|3,0,0]=4 301 B10R1.1 FCSc1ccc(cc1)Br 62a_100000752885_100015361967 [1,0,0,0,0,0|3,0,0]=4 302 B10R1.1 FCSc1ccc(cc1)Br 62a_100015361967_100000752885 [1,0,0,0,0,0|3,0,0]=4 303 B10R1.1 FCSc1ccc(cc1)Cl 62a_100000755918_100015361967 [1,0,0,0,0,0|3,0,0]=4 304 B10R1.1 FCSc1ccc(cc1)Cl 62a_100015361967_100000755918 [1,0,0,0,0,0|3,0,0]=4 305 B10R1.1 FCSc1ccc(cc1)F 62a_100000211213_100015361967 [1,0,0,0,0,0|3,0,0]=4 306 B10R1.1 FCSc1ccc(cc1)F 62a_100015361967_100000211213 [1,0,0,0,0,0|3,0,0]=4 307 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,0,0,0,0,0|0,0,2]=3 308 B10R1.1 N#CCc1ccc(cn1)O 271570a_203496583355_100011824422 [1,0,0,0,0,0|1,0,2]=4 309 B10R1.1 N#CCc1ccc(nc1)O 271570a_203496583355_100000703598 [1,0,0,0,0,0|1,0,2]=4 310 B10R1.1 N#CNc1ccc(cc1)O 271570a_203496583355_100011685341 [1,0,0,0,0,0|1,0,2]=4 311 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,0,0,0,0,0|0,0,0]=1 312 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,0,0,0,0,0|1,0,0]=2 313 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [1,0,0,0,0,0|2,0,0]=3 314 B10R1.1 Nc1ccc(cc1)OCF 34a_100000185829_100015361967 [1,0,0,0,0,0|3,0,0]=4 315 B10R1.1 Nc1ccc(cc1)SCF 62a_100000185761_100015361967 [1,0,0,0,0,0|3,0,0]=4 316 B10R1.1 Nc1ccc(cc1)SCF 62a_100015361967_100000185761 [1,0,0,0,0,0|3,0,0]=4 317 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,0,0,0,0,0|1,0,1]=3 318 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,0,0,0,0,0|1,0,0]=2 319 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [1,0,0,0,0,0|2,0,0]=3 320 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [1,0,0,0,0,0|2,0,0]=3 321 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,0,0,0,0,0|1,0,2]=4 322 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [1,0,0,0,0,0|2,0,0]=3 323 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [1,0,0,0,0,0|2,0,0]=3 324 B10R1.1 Oc1ccc(nc1)SCF 62a_100000685995_100015361967 [1,0,0,0,0,0|3,0,0]=4 325 B10R1.1 Oc1ccc(nc1)SCF 62a_100015361967_100000744096 [1,0,0,0,0,0|3,0,0]=4 326 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,0,0,0,0,0|3,0,0]=4 329 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,0,0,0,0,0|3,0,0]=4 330 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,0,0,0,0,0|3,0,0]=4 331 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,0,0,0,0,0|3,0,0]=4 332 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,0,0,0,0,0|3,0,0]=4 333 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,0,0,0,0,0|2,0,0]=3 335 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,0,0,0,0,0|3,0,0]=4 336 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,0,0,0,0,0|3,0,0]=4 337 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,0,0,0,0,0|3,0,0]=4 338 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,0,0,0,0,0|3,0,0]=4 340 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,0,0,0,0,0|3,0,0]=4 352 B10R1.1 [N-]=[N+]=Nc1ccc(cc1)O 271570a_203496583355_100000735661 [1,0,0,0,0,0|2,0,1]=4 353 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,0,0,0,0,0|2,0,1]=4 354 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,0,0,0,0,0|2,0,1]=4 355 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,0,0,0,0,0|2,0,1]=4 356 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,0,0,0,0,0|2,0,1]=4 357 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,0,0,0,0,0|2,0,1]=4 358 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,0,0,0,0,0|1,0,1]=3 359 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,0,0,0,0,0|1,0,1]=3 360 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,0,0,0,0,0|2,0,1]=4 361 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,0,0,0,0,0|1,0,2]=4 362 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,0,0,0,0,0|1,0,2]=4 363 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,0,0,0,0,0|1,0,2]=4 364 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,0,0,0,0,0|1,0,2]=4 365 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,0,0,0,0,0|1,0,2]=4 366 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,0,0,0,0,0|0,0,2]=3 367 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,0,0,0,0,0|0,0,2]=3 368 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,0,0,0,0,0|1,0,2]=4 369 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,0,0,0,0,0|1,0,2]=4 370 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,0,0,0,0,0|1,0,0]=2 371 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.13 CC(C)c1cnc(nc1)O 271570a_203496583355_100000102307 [1,0,0,0,0,0|3,0,0]=4 374 B10R1.13 CC(C)c1ncc(cn1)O 271570a_203496583355_200009814916 [1,0,0,0,0,0|3,0,0]=4 375 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [1,0,0,0,0,0|2,0,0]=3 376 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,0,0,0,0,0|0,0,0]=1 377 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [1,0,0,0,0,0|1,0,0]=2 378 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [1,0,0,0,0,0|1,0,0]=2 379 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 380 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 381 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [1,0,0,0,0,0|3,0,0]=4 382 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 384 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [1,0,0,0,0,0|3,0,0]=4 385 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 386 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 387 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [1,0,0,0,0,0|3,0,0]=4 388 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 389 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 390 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,0,0,0,0,0|2,0,0]=3 392 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,0,0,0,0,0|2,0,0]=3 394 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 397 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [1,0,0,0,0,0|3,0,0]=4 402 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [1,0,0,0,0,0|3,0,0]=4 405 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 406 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 407 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,0,0,0,0,0|2,0,0]=3 409 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,0,0,0,0,0|2,0,0]=3 410 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,0,0,0,0,0|1,0,1]=3 411 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,0,0,0,0,0|1,0,0]=2 412 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,0,0,0,0,0|1,0,0]=2 413 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,0,0,0,0,0|1,0,2]=4 415 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 417 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,0,0,0,0,0|3,0,0]=4 418 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,0,0,0,0,0|3,0,0]=4 421 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,0,0,0,0,0|0,0,2]=3 422 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,0,0,0,0,0|1,0,2]=4 423 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,0,0,0,0,0|1,0,2]=4 424 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [1,0,0,0,0,0|2,0,0]=3 425 B10R1.13 OB(O)c1ccc(cn1)O 271570a_203496583355_200010198023 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.13 OB(O)c1ccc(nc1)O 271570a_203496583355_100000688115 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [1,0,0,0,0,0|2,0,0]=3 428 B10R1.13 Oc1ccc(cn1)C(F)F 271570a_203496583355_100000720607 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.13 Oc1ccc(nc1)C(F)F 271570a_203496583355_100010253924 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,0,0,0,0,0|1,0,2]=4 431 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,0,0,0,0,0|1,0,2]=4 432 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,0,0,0,0,0|1,0,2]=4 433 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,0,0,0,0,0|1,0,2]=4 434 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,0,0,0,0,0|0,0,2]=3 435 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,0,0,0,0,0|3,0,0]=4 436 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,0,0,0,0,0|3,0,0]=4 437 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,0,0,0,0,0|1,0,2]=4 438 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 445 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 446 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 447 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,0,0,0,0,0|3,0,0]=4 448 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,0,0,0,0,0|3,0,0]=4 450 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,0,0,0,0,0|3,0,0]=4 451 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,0,0,0,0,0|3,0,0]=4 452 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,0,0,0,0,0|3,0,0]=4 453 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,0,0,0,0,0|3,0,0]=4 454 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,0,0,0,0,0|3,0,0]=4 456 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,0,0,0,0,0|3,0,0]=4 457 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,0,0,0,0,0|3,0,0]=4 458 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,0,0,0,0,0|3,0,0]=4 459 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,0,0,0,0,0|3,0,0]=4 460 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,0,0,0,0,0|3,0,0]=4 461 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,0,0,0,0,0|3,0,0]=4 462 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,0,0,0,0,0|1,0,2]=4 463 B12R1.5 C=Cc1ccc(cc1)C(=O)CN 271570a_100011290941_100000017248 [0,1,0,0,0,0|1,0,2]=4 464 B12R1.5 C=Cc1ccc(cc1)C(C)CC 271570a_100011290941_100011221364 [0,1,0,0,0,0|3,0,0]=4 465 B12R1.5 C=Cc1ccc(cc1)C(N)CO 271570a_100011290941_100000734186 [0,1,0,0,0,0|3,0,0]=4 466 B12R1.5 C=Cc1ccc(cc1)C(O)CC 271570a_100011290941_100000246506 [0,1,0,0,0,0|2,0,0]=3 467 B12R1.5 C=Cc1ccc(cc1)C(O)CN 271570a_100011290941_100020626992 [0,1,0,0,0,0|1,0,0]=2 468 B12R1.5 C=Cc1ccc(cc1)C(O)CO 271570a_100011290941_200012355997 [0,1,0,0,0,0|2,0,0]=3 469 B12R1.5 C=Cc1ccc(cc1)[C@@H](N)CC 271570a_100011290941_100025736560 [0,1,0,0,0,0|3,0,0]=4 470 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [0,1,0,0,0,0|1,0,0]=2 471 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,1,0,0,0,0|1,0,2]=4 472 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,1,0,0,0,0|1,0,2]=4 473 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,1,0,0,0,0|1,0,2]=4 474 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,1,0,0,0,0|1,0,2]=4 475 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,1,0,0,0,0|1,0,2]=4 476 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,1,0,0,0,0|1,0,2]=4 477 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [0,1,0,0,0,0|3,0,0]=4 478 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [0,1,0,0,0,0|3,0,0]=4 479 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [0,1,0,0,0,0|3,0,0]=4 480 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [0,1,0,0,0,0|3,0,0]=4 481 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [0,1,0,0,0,0|3,0,0]=4 482 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [0,1,0,0,0,0|3,0,0]=4 483 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [0,1,0,0,0,0|2,0,0]=3 484 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [0,1,0,0,0,0|2,0,0]=3 485 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [0,1,0,0,0,0|2,0,0]=3 486 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [0,1,0,0,0,0|2,0,0]=3 487 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [0,1,0,0,0,0|2,1,0]=4 488 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [0,1,0,0,0,0|2,1,0]=4 489 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [0,1,0,0,0,0|2,1,0]=4 490 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [0,1,0,0,0,0|2,1,0]=4 491 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [0,1,0,0,0,0|2,0,0]=3 492 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [0,1,0,0,0,0|2,0,0]=3 493 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_100000246506_200000210301 [0,1,0,0,0,0|1,1,0]=3 494 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_200000210301_100000246506 [0,1,0,0,0,0|1,1,0]=3 495 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_100000246506_200025704644 [0,1,0,0,0,0|1,1,0]=3 496 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000246506 [0,1,0,0,0,0|1,1,0]=3 497 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [0,1,0,0,0,0|3,0,0]=4 498 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [0,1,0,0,0,0|3,0,0]=4 499 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [0,1,0,0,0,0|3,0,0]=4 500 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_100025736560_200000210301 [0,1,0,0,0,0|2,1,0]=4 501 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_200000210301_100025736560 [0,1,0,0,0,0|2,1,0]=4 502 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_100025736560_200025704644 [0,1,0,0,0,0|2,1,0]=4 503 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100025736560 [0,1,0,0,0,0|2,1,0]=4 504 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [0,1,0,0,0,0|3,0,0]=4 509 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,1,0,0,0,0|1,0,2]=4 510 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,1,0,0,0,0|1,0,2]=4 511 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,1,0,0,0,0|1,0,2]=4 512 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,1,0,0,0,0|1,0,2]=4 513 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,1,0,0,0,0|1,0,2]=4 514 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [0,1,0,0,0,0|1,0,2]=4 515 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [0,1,0,0,0,0|1,0,0]=2 516 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [0,1,0,0,0,0|3,0,0]=4 517 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [0,1,0,0,0,0|3,0,0]=4 518 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [0,1,0,0,0,0|3,0,0]=4 519 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [0,1,0,0,0,0|3,0,0]=4 520 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [0,1,0,0,0,0|3,0,0]=4 521 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [0,1,0,0,0,0|3,0,0]=4 522 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [0,1,0,0,0,0|0,0,0]=1 523 B12R1.5 COc1ccc(cc1)N(C)CF 269982a_100000220023_100015361967 [0,1,0,0,0,0|3,0,0]=4 524 B12R1.5 COc1ccc(cc1)N(C)CF 34a_100000220023_100015361967 [0,1,0,0,0,0|3,0,0]=4 525 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_100000017248_200000210301 [0,1,0,0,0,0|0,1,2]=4 527 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_200000210301_100000017248 [0,1,0,0,0,0|0,1,2]=4 528 B12R1.5 CSc1ccc(cc1)C(N)CO 62a_100000734186_200000210301 [0,1,0,0,0,0|2,1,0]=4 529 B12R1.5 CSc1ccc(cc1)C(N)CO 62a_200000210301_100000734186 [0,1,0,0,0,0|2,1,0]=4 530 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_100020626992_200000210301 [0,1,0,0,0,0|0,1,0]=2 531 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_200000210301_100020626992 [0,1,0,0,0,0|0,1,0]=2 532 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200000210301_200012355997 [0,1,0,0,0,0|1,1,0]=3 533 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200012355997_200000210301 [0,1,0,0,0,0|1,1,0]=3 534 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,1,0,0,0,0|1,0,2]=4 535 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,1,0,0,0,0|1,0,2]=4 536 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,1,0,0,0,0|1,0,2]=4 537 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,1,0,0,0,0|1,0,2]=4 538 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,1,0,0,0,0|1,0,2]=4 539 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [0,1,0,0,0,0|1,0,2]=4 540 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [0,1,0,0,0,0|0,0,0]=1 541 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_100000017248_200025704644 [0,1,0,0,0,0|0,1,2]=4 542 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_200025704644_100000017248 [0,1,0,0,0,0|0,1,2]=4 543 B12R1.5 [13CH3]Sc1ccc(cc1)C(N)CO 62a_100000734186_200025704644 [0,1,0,0,0,0|2,1,0]=4 544 B12R1.5 [13CH3]Sc1ccc(cc1)C(N)CO 62a_200025704644_100000734186 [0,1,0,0,0,0|2,1,0]=4 545 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_100020626992_200025704644 [0,1,0,0,0,0|0,1,0]=2 546 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_200025704644_100020626992 [0,1,0,0,0,0|0,1,0]=2 547 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200012355997_200025704644 [0,1,0,0,0,0|1,1,0]=3 548 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200025704644_200012355997 [0,1,0,0,0,0|1,1,0]=3 549 B12R1.9 CC(C)(C#N)c1ccc(cc1)O 271570a_203496583355_100000740055 [0,1,0,0,0,0|1,0,2]=4 550 B12R1.9 CC(C)(C=O)c1ccc(cc1)O 271570a_203496583355_100010228009 [0,1,0,0,0,0|2,0,1]=4 551 B12R1.9 CCC(F)(F)c1ccc(cc1)O 271570a_203496583355_100010208532 [0,1,0,0,0,0|2,0,0]=3 552 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,1,0,0,0,0|2,0,1]=4 553 B12R1.9 NNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000183514 [0,1,0,0,0,0|2,0,1]=4 554 B12R1.12 C#CC(OC)c1ccc(cc1)Cl 34a_100011470666_200000210301 [0,1,0,0,0,0|2,0,1]=4 555 B12R1.12 C#CC(OC)c1ccc(cc1)Cl 7a_100011470666_200000210301 [0,1,0,0,0,0|2,0,1]=4 556 B12R1.12 C#CC(O[13CH3])c1ccc(cc1)Cl 34a_100011470666_200025704644 [0,1,0,0,0,0|2,0,1]=4 557 B12R1.12 C#CC(O[13CH3])c1ccc(cc1)Cl 7a_100011470666_200025704644 [0,1,0,0,0,0|2,0,1]=4 558 B12R1.12 CCC(NC)c1ccc(cc1)Br 269862a_106832991636_100000211647 [0,1,0,0,0,0|3,0,0]=4 559 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [0,1,0,0,0,0|3,0,0]=4 560 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [0,1,0,0,0,0|3,0,0]=4 561 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [0,1,0,0,0,0|3,0,0]=4 562 B12R1.12 CCC(NC)c1ccc(cc1)Cl 269862a_106832991636_100000210983 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.12 CCC(NC)c1ccc(cc1)F 2230a_100011191751_200000210301 [0,1,0,0,0,0|3,0,0]=4 564 B12R1.12 CCC(NC)c1ccc(cc1)F 269862a_106832991636_100000211089 [0,1,0,0,0,0|3,0,0]=4 565 B12R1.12 CCC(NC)c1ccc(cc1)F 34a_100011191751_200000210301 [0,1,0,0,0,0|3,0,0]=4 566 B12R1.12 CCC(NC)c1ccc(cc1)I 269862a_106832991636_100000763097 [0,1,0,0,0,0|3,0,0]=4 567 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [0,1,0,0,0,0|2,0,0]=3 568 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [0,1,0,0,0,0|2,0,0]=3 569 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [0,1,0,0,0,0|3,0,0]=4 571 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 2230a_100011191751_200025704644 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 34a_100011191751_200025704644 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [0,1,0,0,0,0|2,0,0]=3 574 B12R1.12 CCC(OC)c1ccc(cc1)Br 34a_100000246506_200000210301 [0,1,0,0,0,0|2,0,0]=3 575 B12R1.12 CCC(OC)c1ccc(cc1)Br 7a_100000246506_200000210301 [0,1,0,0,0,0|2,0,0]=3 576 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [0,1,0,0,0,0|2,0,0]=3 577 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [0,1,0,0,0,0|2,0,0]=3 578 B12R1.12 CCC(OC)c1ccc(cc1)Cl 34a_100000246471_200000210301 [0,1,0,0,0,0|2,0,0]=3 579 B12R1.12 CCC(OC)c1ccc(cc1)Cl 7a_100000246471_200000210301 [0,1,0,0,0,0|2,0,0]=3 580 B12R1.12 CCC(OC)c1ccc(cc1)F 34a_100000246474_200000210301 [0,1,0,0,0,0|2,0,0]=3 581 B12R1.12 CCC(OC)c1ccc(cc1)F 7a_100000246474_200000210301 [0,1,0,0,0,0|2,0,0]=3 582 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 34a_100000246506_200025704644 [0,1,0,0,0,0|2,0,0]=3 583 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 7a_100000246506_200025704644 [0,1,0,0,0,0|2,0,0]=3 584 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [0,1,0,0,0,0|2,0,0]=3 585 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [0,1,0,0,0,0|2,0,0]=3 586 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 34a_100000246471_200025704644 [0,1,0,0,0,0|2,0,0]=3 587 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 7a_100000246471_200025704644 [0,1,0,0,0,0|2,0,0]=3 588 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 34a_100000246474_200025704644 [0,1,0,0,0,0|2,0,0]=3 589 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 7a_100000246474_200025704644 [0,1,0,0,0,0|2,0,0]=3 590 B12R1.12 CCN(CC)c1ccc(cc1)O 2230a_100011337800_100000210202 [0,1,0,0,0,0|3,0,0]=4 591 B12R1.12 CCN(CC)c1ccc(cc1)O 269982a_100011337800_100000204670 [0,1,0,0,0,0|3,0,0]=4 592 B12R1.12 CCN(CC)c1ccc(cc1)O 271570a_203496583355_100011216415 [0,1,0,0,0,0|3,0,0]=4 593 B12R1.12 CCN(CC)c1ccc(cc1)O 34a_100011337800_100000210202 [0,1,0,0,0,0|3,0,0]=4 594 B12R1.12 CCN(CF)c1ccc(cc1)O 269982a_100011337800_100015361967 [0,1,0,0,0,0|3,0,0]=4 595 B12R1.12 CCN(CF)c1ccc(cc1)O 34a_100011337800_100015361967 [0,1,0,0,0,0|3,0,0]=4 596 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 2230a_100025736560_200000210301 [0,1,0,0,0,0|3,0,0]=4 597 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 34a_100025736560_200000210301 [0,1,0,0,0,0|3,0,0]=4 598 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 2230a_100015186824_200000210301 [0,1,0,0,0,0|3,0,0]=4 599 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 34a_100015186824_200000210301 [0,1,0,0,0,0|3,0,0]=4 600 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100025736560_200025704644 [0,1,0,0,0,0|3,0,0]=4 601 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 34a_100025736560_200025704644 [0,1,0,0,0,0|3,0,0]=4 602 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015186824_200025704644 [0,1,0,0,0,0|3,0,0]=4 603 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 34a_100015186824_200025704644 [0,1,0,0,0,0|3,0,0]=4 604 B12R1.12 CNC(CO)c1ccc(cc1)Br 2230a_100000734186_200000210301 [0,1,0,0,0,0|3,0,0]=4 605 B12R1.12 CNC(CO)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,1,0,0,0,0|3,0,0]=4 606 B12R1.12 CNC(CO)c1ccc(cc1)F 2230a_100000705410_200000210301 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.12 CNC(CO)c1ccc(cc1)F 34a_100000705410_200000210301 [0,1,0,0,0,0|3,0,0]=4 608 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_200000210301 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_200000210301 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200000210301 [0,1,0,0,0,0|3,0,0]=4 611 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,1,0,0,0,0|3,0,0]=4 612 B12R1.12 COC(CCl)c1ccc(cc1)Cl 34a_200011996143_200000210301 [0,1,0,0,0,0|2,0,0]=3 613 B12R1.12 COC(CCl)c1ccc(cc1)Cl 7a_200011996143_200000210301 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.12 COC(CN)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,1,0,0,0,0|1,0,0]=2 615 B12R1.12 COC(CN)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,1,0,0,0,0|1,0,0]=2 616 B12R1.12 COC(OC)c1ccc(cc1)O 271570a_203496583355_100009813454 [0,1,0,0,0,0|2,0,0]=3 617 B12R1.12 COC(OC)c1ccc(cn1)O 271570a_203496583355_100010270258 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 34a_200009814964_200000210301 [0,1,0,0,0,0|1,0,2]=4 619 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 7a_200009814964_200000210301 [0,1,0,0,0,0|1,0,2]=4 620 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200000210301 [0,1,0,0,0,0|2,0,0]=3 621 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200000210301 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 34a_200009814964_200025704644 [0,1,0,0,0,0|1,0,2]=4 623 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 7a_200009814964_200025704644 [0,1,0,0,0,0|1,0,2]=4 624 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 2230a_100009818840_200025704644 [0,1,0,0,0,0|3,0,0]=4 625 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 34a_100009818840_200025704644 [0,1,0,0,0,0|3,0,0]=4 626 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 2230a_100000734186_200025704644 [0,1,0,0,0,0|3,0,0]=4 627 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,1,0,0,0,0|3,0,0]=4 628 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 2230a_100000705410_200025704644 [0,1,0,0,0,0|3,0,0]=4 629 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 34a_100000705410_200025704644 [0,1,0,0,0,0|3,0,0]=4 630 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200025704644 [0,1,0,0,0,0|3,0,0]=4 631 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,1,0,0,0,0|3,0,0]=4 632 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 34a_200011996143_200025704644 [0,1,0,0,0,0|2,0,0]=3 633 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 7a_200011996143_200025704644 [0,1,0,0,0,0|2,0,0]=3 634 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,1,0,0,0,0|1,0,0]=2 635 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,1,0,0,0,0|1,0,0]=2 636 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200025704644 [0,1,0,0,0,0|2,0,0]=3 637 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200025704644 [0,1,0,0,0,0|2,0,0]=3 638 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,1,0,0,0,0|1,0,2]=4 639 B12R1.16 C#CCN(C)c1ccc(cc1)O 34a_100000182112_100000184674 [0,1,0,0,0,0|3,0,0]=4 640 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,1,0,0,0,0|1,0,2]=4 641 B12R1.16 C=CCC(O)c1ccc(cc1)O 271570a_203496583355_100011466436 [0,1,0,0,0,0|1,0,0]=2 642 B12R1.16 C=CCN(C)c1ccc(cc1)O 269982a_100000182112_100000210623 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.16 C=CCN(C)c1ccc(cc1)O 34a_100000182112_100015514636 [0,1,0,0,0,0|3,0,0]=4 644 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [0,1,0,0,0,0|1,0,0]=2 645 B12R1.16 CC(OCF)c1ccc(cc1)Br 34a_100000745893_100015361967 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.16 CC(OCF)c1ccc(cc1)Br 7a_100000745893_100015361967 [0,1,0,0,0,0|3,0,0]=4 647 B12R1.16 CC(OCF)c1ccc(cc1)F 34a_100000181323_100015361967 [0,1,0,0,0,0|3,0,0]=4 648 B12R1.16 CC(OCF)c1ccc(cc1)F 7a_100000181323_100015361967 [0,1,0,0,0,0|3,0,0]=4 649 B12R1.16 CC(OCF)c1ccc(cc1)N 34a_100011216399_100015361967 [0,1,0,0,0,0|3,0,0]=4 650 B12R1.16 CC(SCF)c1ccc(cc1)Br 62a_100000755118_100015361967 [0,1,0,0,0,0|3,0,0]=4 651 B12R1.16 CC(SCF)c1ccc(cc1)Br 62a_100015361967_100000755118 [0,1,0,0,0,0|3,0,0]=4 652 B12R1.16 CC(SCF)c1ccc(cc1)Cl 62a_100000684792_100015361967 [0,1,0,0,0,0|3,0,0]=4 653 B12R1.16 CC(SCF)c1ccc(cc1)Cl 62a_100015361967_100000684792 [0,1,0,0,0,0|3,0,0]=4 654 B12R1.16 CC(SCF)c1ccc(cc1)F 62a_100000743420_100015361967 [0,1,0,0,0,0|3,0,0]=4 655 B12R1.16 CC(SCF)c1ccc(cc1)F 62a_100015361967_100000743420 [0,1,0,0,0,0|3,0,0]=4 656 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,1,0,0,0,0|1,0,2]=4 657 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,1,0,0,0,0|1,0,2]=4 658 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [0,1,0,0,0,0|1,0,0]=2 659 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [0,1,0,0,0,0|3,0,0]=4 660 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [0,1,0,0,0,0|3,0,0]=4 661 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,1,0,0,0,0|1,0,2]=4 662 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,1,0,0,0,0|1,0,2]=4 663 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,1,0,0,0,0|1,0,2]=4 664 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [0,1,0,0,0,0|3,0,0]=4 665 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [0,1,0,0,0,0|3,0,0]=4 666 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,1,0,0,0,0|3,0,0]=4 667 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,1,0,0,0,0|3,0,0]=4 668 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [0,1,0,0,0,0|3,0,0]=4 669 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [0,1,0,0,0,0|3,0,0]=4 670 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [0,1,0,0,0,0|3,0,0]=4 671 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [0,1,0,0,0,0|3,0,0]=4 672 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [0,1,0,0,0,0|3,0,0]=4 673 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [0,1,0,0,0,0|3,0,0]=4 674 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [0,1,0,0,0,0|3,0,0]=4 675 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [0,1,0,0,0,0|3,0,0]=4 676 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [0,1,0,0,0,0|2,0,0]=3 677 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [0,1,0,0,0,0|3,0,0]=4 678 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,1,0,0,0,0|3,0,0]=4 679 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,1,0,0,0,0|3,0,0]=4 680 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [0,1,0,0,0,0|3,0,0]=4 681 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [0,1,0,0,0,0|3,0,0]=4 682 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,1,0,0,0,0|1,0,2]=4 683 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [0,1,0,0,0,0|3,0,0]=4 685 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [0,1,0,0,0,0|3,0,0]=4 686 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,1,0,0,0,0|3,0,0]=4 687 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [0,1,0,0,0,0|3,0,0]=4 688 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [0,1,0,0,0,0|3,0,0]=4 689 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [0,1,0,0,0,0|3,0,0]=4 690 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [0,1,0,0,0,0|3,0,0]=4 691 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [0,1,0,0,0,0|3,0,0]=4 692 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [0,1,0,0,0,0|3,0,0]=4 693 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,1,0,0,0,0|3,0,0]=4 694 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,1,0,0,0,0|3,0,0]=4 695 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000210202_100000755118 [0,1,0,0,0,0|3,0,0]=4 696 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000755118_100000210202 [0,1,0,0,0,0|3,0,0]=4 697 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [0,1,0,0,0,0|3,0,0]=4 698 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [0,1,0,0,0,0|3,0,0]=4 699 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000210202_100000684792 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210202 [0,1,0,0,0,0|3,0,0]=4 701 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000210202_100000743420 [0,1,0,0,0,0|3,0,0]=4 702 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000743420_100000210202 [0,1,0,0,0,0|3,0,0]=4 703 B12R1.16 CN(CC#N)c1ccc(cc1)O 269982a_100000182112_100011214920 [0,1,0,0,0,0|2,0,1]=4 704 B12R1.16 CN(CC=O)c1ccc(cc1)O 269982a_100000182112_200015260668 [0,1,0,0,0,0|3,0,0]=4 705 B12R1.16 CN(CC=O)c1ccc(cc1)O 34a_100000182112_200009817547 [0,1,0,0,0,0|3,0,0]=4 706 B12R1.16 CN(CCF)c1ccc(cc1)O 269982a_100000182112_100011217306 [0,1,0,0,0,0|3,0,0]=4 707 B12R1.16 CN(CCF)c1ccc(cc1)O 34a_100000182112_100011217306 [0,1,0,0,0,0|3,0,0]=4 708 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [0,1,0,0,0,0|3,0,0]=4 709 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [0,1,0,0,0,0|3,0,0]=4 710 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [0,1,0,0,0,0|1,0,2]=4 711 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [0,1,0,0,0,0|1,0,2]=4 712 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [0,1,0,0,0,0|1,0,2]=4 713 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [0,1,0,0,0,0|1,0,2]=4 714 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [0,1,0,0,0,0|1,0,2]=4 715 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [0,1,0,0,0,0|1,0,2]=4 716 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [0,1,0,0,0,0|1,0,2]=4 717 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [0,1,0,0,0,0|1,0,2]=4 718 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [0,1,0,0,0,0|1,0,2]=4 719 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,1,0,0,0,0|0,0,2]=3 720 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,1,0,0,0,0|0,0,2]=3 721 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [0,1,0,0,0,0|1,0,0]=2 722 B12R1.16 CNCC(O)c1ccc(cc1)Br 2230a_100020626992_200000210301 [0,1,0,0,0,0|1,0,0]=2 723 B12R1.16 CNCC(O)c1ccc(cc1)Br 34a_100020626992_200000210301 [0,1,0,0,0,0|1,0,0]=2 724 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [0,1,0,0,0,0|1,0,0]=2 725 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [0,1,0,0,0,0|1,0,0]=2 726 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_200000210301 [0,1,0,0,0,0|1,0,0]=2 727 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_106832991635_200011996143 [0,1,0,0,0,0|1,0,0]=2 728 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100000736658_200000210301 [0,1,0,0,0,0|1,0,0]=2 729 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100102657272_200011996143 [0,1,0,0,0,0|1,0,0]=2 730 B12R1.16 CNCC(O)c1ccc(cc1)Cl 7a_106832991635_200011996143 [0,1,0,0,0,0|1,0,0]=2 731 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [0,1,0,0,0,0|0,0,0]=1 732 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 2230a_106832991635_100000720402 [0,1,0,0,0,0|1,0,0]=2 733 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 34a_100102657272_100000720402 [0,1,0,0,0,0|1,0,0]=2 734 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 7a_106832991635_100000720402 [0,1,0,0,0,0|1,0,0]=2 735 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,1,0,0,0,0|1,0,2]=4 736 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,1,0,0,0,0|1,0,2]=4 737 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,1,0,0,0,0|1,0,2]=4 738 B12R1.16 COCC(N)c1ccc(cc1)Br 34a_100000734186_200000210301 [0,1,0,0,0,0|3,0,0]=4 739 B12R1.16 COCC(N)c1ccc(cc1)F 34a_100000705410_200000210301 [0,1,0,0,0,0|3,0,0]=4 740 B12R1.16 COCC(O)c1ccc(cc1)Cl 34a_100138415774_200011996143 [0,1,0,0,0,0|2,0,0]=3 741 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [0,1,0,0,0,0|3,0,0]=4 742 B12R1.16 COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200000210301 [0,1,0,0,0,0|3,0,0]=4 743 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [0,1,0,0,0,0|3,0,0]=4 744 B12R1.16 COC[C@H](O)c1ccc(cc1)F 34a_100138415774_100000720402 [0,1,0,0,0,0|2,0,0]=3 745 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,1,0,0,0,0|1,0,2]=4 746 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,1,0,0,0,0|1,0,2]=4 747 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200000210301_200011996143 [0,1,0,0,0,0|2,0,0]=3 748 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200011996143_200000210301 [0,1,0,0,0,0|2,0,0]=3 749 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [0,1,0,0,0,0|3,0,0]=4 750 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [0,1,0,0,0,0|3,0,0]=4 751 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_200000210301 [0,1,0,0,0,0|2,0,0]=3 752 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_200000210301_100000720402 [0,1,0,0,0,0|2,0,0]=3 753 B12R1.16 C[C@@H](NCF)c1ccc(cc1)Cl 34a_100015205461_100015361967 [0,1,0,0,0,0|3,0,0]=4 754 B12R1.16 C[C@H](NCF)c1ccc(cc1)F 34a_100025705893_100015361967 [0,1,0,0,0,0|3,0,0]=4 755 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 34a_100011852131_100015361967 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.16 C[C@H](OCF)c1ccc(cc1)Cl 7a_100011852131_100015361967 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100011261388_100015361967 [0,1,0,0,0,0|3,0,0]=4 758 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100015361967_100011261388 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [0,1,0,0,0,0|1,0,0]=2 760 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [0,1,0,0,0,0|1,0,0]=2 761 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCF 34a_100016988085_100015361967 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,1,0,0,0,0|3,0,0]=4 764 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [0,1,0,0,0,0|3,0,0]=4 765 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,1,0,0,0,0|0,0,3]=4 766 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,1,0,0,0,0|0,0,3]=4 767 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [0,1,0,0,0,0|2,0,0]=3 768 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,1,0,0,0,0|1,0,2]=4 769 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,1,0,0,0,0|1,0,2]=4 770 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 2230a_100020626992_200025704644 [0,1,0,0,0,0|1,0,0]=2 771 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 34a_100020626992_200025704644 [0,1,0,0,0,0|1,0,0]=2 772 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 2230a_100000736658_200025704644 [0,1,0,0,0,0|1,0,0]=2 773 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 34a_100000736658_200025704644 [0,1,0,0,0,0|1,0,0]=2 774 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [0,1,0,0,0,0|0,0,0]=1 775 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)Br 34a_100000734186_200025704644 [0,1,0,0,0,0|3,0,0]=4 776 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)F 34a_100000705410_200025704644 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.16 [13CH3]OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200025704644 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,1,0,0,0,0|1,0,2]=4 779 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,1,0,0,0,0|1,0,2]=4 780 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200011996143_200025704644 [0,1,0,0,0,0|2,0,0]=3 781 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200025704644_200011996143 [0,1,0,0,0,0|2,0,0]=3 782 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_100000720402_200025704644 [0,1,0,0,0,0|2,0,0]=3 783 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_200025704644_100000720402 [0,1,0,0,0,0|2,0,0]=3 784 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 34a_217856618577_100000210202 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 7a_217856618577_100000210202 [0,1,0,0,0,0|3,0,0]=4 786 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 34a_217856618577_100015361967 [0,1,0,0,0,0|3,0,0]=4 787 B12R1.16 [2H]C(OCF)c1ccc(cc1)F 7a_217856618577_100015361967 [0,1,0,0,0,0|3,0,0]=4 788 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,1,0,0,0,0|2,0,1]=4 789 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [0,1,0,0,0,0|2,0,1]=4 790 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [0,1,0,0,0,0|2,0,1]=4 791 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,1,0,0,0,0|1,0,1]=3 792 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [0,1,0,0,0,0|2,0,1]=4 793 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [0,1,0,0,0,0|2,0,1]=4 794 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,1,0,0,0,0|2,0,1]=4 795 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,1,0,0,0,0|1,0,2]=4 796 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,1,0,0,0,0|1,0,2]=4 797 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [0,1,0,0,0,0|3,0,0]=4 798 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,1,0,0,0,0|2,0,1]=4 800 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [0,1,0,0,0,0|2,0,1]=4 802 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,1,0,0,0,0|0,0,3]=4 803 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [0,1,0,0,0,0|2,0,1]=4 804 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [0,1,0,0,0,0|2,0,1]=4 805 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,1,0,0,0,0|1,0,1]=3 806 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [0,1,0,0,0,0|2,0,1]=4 807 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,1,0,0,0,0|1,0,2]=4 808 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,1,0,0,0,0|1,0,2]=4 809 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,1,0,0,0,0|1,0,2]=4 810 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,1,0,0,0,0|1,0,2]=4 811 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,1,0,0,0,0|1,0,2]=4 812 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,1,0,0,0,0|1,0,2]=4 813 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,1,0,0,0,0|1,0,2]=4 814 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [0,1,0,0,0,0|3,0,0]=4 815 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,1,0,0,0,0|3,0,0]=4 816 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [0,1,0,0,0,0|3,0,0]=4 817 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [0,1,0,0,0,0|3,0,0]=4 818 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,1,0,0,0,0|1,0,2]=4 819 B12R1.367 Cc1cc(ccc1O)C(=O)NN 271570a_203496583355_100012339724 [0,1,0,0,0,0|1,0,2]=4 820 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,1,0,0,0,0|0,0,2]=3 821 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,1,0,0,0,0|1,0,2]=4 822 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,1,0,0,0,0|1,0,2]=4 823 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,1,0,0,0,0|1,0,2]=4 824 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,1,0,0,0,0|1,0,2]=4 825 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,1,0,0,0,0|1,0,2]=4 826 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,1,0,0,0,0|1,0,2]=4 827 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,1,0,0,0,0|1,0,2]=4 828 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,1,0,0,0,0|1,0,2]=4 829 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,1,0,0,0,0|1,0,2]=4 830 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,1,0,0,0,0|1,0,2]=4 831 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,1,0,0,0,0|1,0,2]=4 832 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,1,0,0,0,0|1,0,2]=4 833 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [0,1,0,0,0,0|3,0,0]=4 834 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [0,1,0,0,0,0|3,0,0]=4 835 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,1,0,0,0,0|1,0,2]=4 836 B12R1.1703 Cc1cc(ccc1N(C)CF)O 269982a_100161107805_100015361967 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.1703 Cc1cc(ccc1N(C)CF)O 34a_100161107805_100015361967 [0,1,0,0,0,0|3,0,0]=4 838 B12R1.1703 Cc1cc(ccc1[C@H](N)CO)O 271570a_203496583355_100138412551 [0,1,0,0,0,0|2,0,0]=3 839 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,1,0,0,0,0|1,0,2]=4 840 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,1,0,0,0,0|1,0,2]=4 841 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,1,0,0,0,0|1,0,2]=4 842 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,1,0,0,0,0|1,0,2]=4 843 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [0,0,0,1,0,0|1,0,0]=2 844 B12R2.290 NC1(CC1)c2ccc(cc2)O 271570a_203496583355_100000742681 [0,0,0,1,0,0|2,0,0]=3 845 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [0,0,0,1,0,0|3,0,0]=4 846 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,0,0,1,0,0|1,0,2]=4 847 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [0,0,0,1,0,0|2,0,1]=4 848 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,0,0,1,0,0|2,0,1]=4 849 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [0,0,0,1,0,0|2,0,0]=3 850 B12R2.612 NC1COc2c1ccc(c2)O 271570a_203496583355_100020628175 [0,0,0,1,0,0|2,0,0]=3 851 B12R2.612 Nc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100009816878 [0,0,0,1,0,0|2,0,1]=4 852 B12R2.612 Nc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100011934401 [0,0,0,1,0,0|2,0,1]=4 853 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,0,0,1,0,0|1,0,2]=4 854 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,0,0,1,0,0|1,0,2]=4 855 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,0,0,1,0,0|1,0,2]=4 856 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,0,0,1,0,0|1,0,0]=2 857 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [0,0,0,1,0,0|2,0,1]=4 858 B12R2.612 Oc1n[nH]c2c1ccc(c2)Br 271570a_203496583355_100010186045 [0,0,0,1,0,0|2,0,1]=4 859 B12R2.612 Oc1n[nH]c2c1ccc(c2)Cl 271570a_203496583355_100000049627 [0,0,0,1,0,0|2,0,1]=4 860 B12R2.612 Oc1n[nH]c2c1ccc(c2)F 271570a_203496583355_100000049990 [0,0,0,1,0,0|2,0,1]=4 861 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [0,0,0,1,0,0|2,0,0]=3 862 B12R2.2302 Oc1ccc(cc1)C2COC2 271570a_203496583355_100010732642 [0,0,0,1,0,0|2,0,0]=3 863 B12R1.49 C#CC(C)Nc1ccc(cc1)O 34a_100000185829_200000035995 [0,0,0,0,0,1|2,0,1]=4 864 B12R1.49 C#CC(C)Sc1ccc(cc1)O 62a_200000035995_100000185759 [0,0,0,0,0,1|2,0,1]=4 865 B12R1.49 C=CC(C)Sc1ccc(cc1)O 62a_100011215867_100000185759 [0,0,0,0,0,1|2,0,1]=4 866 B12R1.49 CC(C#N)Sc1ccc(cc1)O 62a_100000703298_100000185759 [0,0,0,0,0,1|1,0,2]=4 867 B12R1.49 CC(CO)Nc1ccc(cc1)Br 2230a_100000210018_100012180447 [0,0,0,0,0,1|3,0,0]=4 868 B12R1.49 CC(CO)Nc1ccc(cc1)Br 34a_100000210018_100012180447 [0,0,0,0,0,1|3,0,0]=4 869 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 2230a_100000210052_100012180447 [0,0,0,0,0,1|3,0,0]=4 870 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 34a_100000210052_100012180447 [0,0,0,0,0,1|3,0,0]=4 871 B12R1.49 CC(CO)Nc1ccc(cc1)F 34a_100000185862_100012180447 [0,0,0,0,0,1|3,0,0]=4 872 B12R1.49 CC(CO)Nc1ccc(cc1)I 34a_100000185761_100012180447 [0,0,0,0,0,1|3,0,0]=4 873 B12R1.49 CC(CO)Nc1ccc(cc1)O 34a_100000185829_100012180447 [0,0,0,0,0,1|2,0,0]=3 874 B12R1.49 CC(CO)Oc1ccc(cc1)Br 34a_100000185759_100012180447 [0,0,0,0,0,1|3,0,0]=4 875 B12R1.49 CC(CO)Oc1ccc(cc1)Br 7a_100000185759_100012180447 [0,0,0,0,0,1|3,0,0]=4 876 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 34a_100000210216_100012180447 [0,0,0,0,0,1|3,0,0]=4 877 B12R1.49 CC(CO)Oc1ccc(cc1)Cl 7a_100000210216_100012180447 [0,0,0,0,0,1|3,0,0]=4 878 B12R1.49 CC(CO)Oc1ccc(cc1)F 34a_100000210339_100012180447 [0,0,0,0,0,1|3,0,0]=4 879 B12R1.49 CC(CO)Oc1ccc(cc1)I 34a_100000212066_100012180447 [0,0,0,0,0,1|3,0,0]=4 880 B12R1.49 CC(CO)Oc1ccc(cc1)I 7a_100000212066_100012180447 [0,0,0,0,0,1|3,0,0]=4 881 B12R1.49 CC(CO)Oc1ccc(cc1)N 34a_100000185829_100012180447 [0,0,0,0,0,1|3,0,0]=4 882 B12R1.49 CC(CO)Sc1ccc(cc1)Br 62a_100012180447_100000752885 [0,0,0,0,0,1|3,0,0]=4 883 B12R1.49 CC(CO)Sc1ccc(cc1)Cl 62a_100012180447_100000755918 [0,0,0,0,0,1|3,0,0]=4 884 B12R1.49 CC(CO)Sc1ccc(cc1)F 62a_100012180447_100000211213 [0,0,0,0,0,1|3,0,0]=4 885 B12R1.49 CC(CO)Sc1ccc(cc1)N 62a_100012180447_100000185761 [0,0,0,0,0,1|3,0,0]=4 886 B12R1.49 CC(CO)Sc1ccc(cc1)O 62a_100012180447_100000185759 [0,0,0,0,0,1|2,0,0]=3 887 B12R1.49 CC(CO)Sc1ccc(cn1)O 62a_100012180447_100000744096 [0,0,0,0,0,1|3,0,0]=4 888 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,0,0,0,0,1|3,0,0]=4 889 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,0,0,0,0,1|3,0,0]=4 890 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,0,0,0,0,1|1,0,2]=4 891 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,0,0,0,0,1|1,0,2]=4 892 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,0,0,0,0,1|1,0,2]=4 893 B12R1.49 CCC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000758301 [0,0,0,0,0,1|3,0,0]=4 894 B12R1.49 CCC(C)Nc1ccc(cc1)Br 34a_100000210018_100011215416 [0,0,0,0,0,1|3,0,0]=4 895 B12R1.49 CCC(C)Nc1ccc(cc1)C 34a_100000124888_100011215416 [0,0,0,0,0,1|3,0,0]=4 896 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000758301 [0,0,0,0,0,1|3,0,0]=4 897 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 34a_100000210052_100011215416 [0,0,0,0,0,1|3,0,0]=4 898 B12R1.49 CCC(C)Nc1ccc(cc1)F 34a_100000185862_100011215416 [0,0,0,0,0,1|3,0,0]=4 899 B12R1.49 CCC(C)Nc1ccc(cc1)I 34a_100000185761_100011215416 [0,0,0,0,0,1|3,0,0]=4 900 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [0,0,0,0,0,1|2,0,0]=3 901 B12R1.49 CCC(C)Oc1ccc(cc1)Br 34a_100000185759_100011215416 [0,0,0,0,0,1|3,0,0]=4 902 B12R1.49 CCC(C)Oc1ccc(cc1)Br 7a_100000185759_100000758301 [0,0,0,0,0,1|3,0,0]=4 903 B12R1.49 CCC(C)Oc1ccc(cc1)C 34a_100000210336_100011215416 [0,0,0,0,0,1|3,0,0]=4 904 B12R1.49 CCC(C)Oc1ccc(cc1)C 7a_100000210336_100000758301 [0,0,0,0,0,1|3,0,0]=4 905 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 34a_100000210216_100011215416 [0,0,0,0,0,1|3,0,0]=4 906 B12R1.49 CCC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000758301 [0,0,0,0,0,1|3,0,0]=4 907 B12R1.49 CCC(C)Oc1ccc(cc1)F 34a_100000210339_100011215416 [0,0,0,0,0,1|3,0,0]=4 908 B12R1.49 CCC(C)Oc1ccc(cc1)I 34a_100000212066_100011215416 [0,0,0,0,0,1|3,0,0]=4 909 B12R1.49 CCC(C)Oc1ccc(cc1)I 7a_100000212066_100000758301 [0,0,0,0,0,1|3,0,0]=4 910 B12R1.49 CCC(C)Oc1ccc(cc1)N 34a_100000185829_100011215416 [0,0,0,0,0,1|3,0,0]=4 911 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000752885_100000758301 [0,0,0,0,0,1|3,0,0]=4 912 B12R1.49 CCC(C)Sc1ccc(cc1)Br 62a_100000758301_100000752885 [0,0,0,0,0,1|3,0,0]=4 913 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000186775_100000758301 [0,0,0,0,0,1|3,0,0]=4 914 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000758301_100000186775 [0,0,0,0,0,1|3,0,0]=4 915 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000758301 [0,0,0,0,0,1|3,0,0]=4 916 B12R1.49 CCC(C)Sc1ccc(cc1)Cl 62a_100000758301_100000755918 [0,0,0,0,0,1|3,0,0]=4 917 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000211213_100000758301 [0,0,0,0,0,1|3,0,0]=4 918 B12R1.49 CCC(C)Sc1ccc(cc1)F 62a_100000758301_100000211213 [0,0,0,0,0,1|3,0,0]=4 919 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000185761_100000758301 [0,0,0,0,0,1|3,0,0]=4 920 B12R1.49 CCC(C)Sc1ccc(cc1)N 62a_100000758301_100000185761 [0,0,0,0,0,1|3,0,0]=4 921 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [0,0,0,0,0,1|2,0,0]=3 922 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000685995_100000758301 [0,0,0,0,0,1|3,0,0]=4 923 B12R1.49 CCC(C)Sc1ccc(cn1)O 62a_100000758301_100000744096 [0,0,0,0,0,1|3,0,0]=4 924 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [0,0,0,0,0,1|3,0,0]=4 925 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [0,0,0,0,0,1|3,0,0]=4 926 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [0,0,0,0,0,1|3,0,0]=4 927 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [0,0,0,0,0,1|3,0,0]=4 928 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [0,0,0,0,0,1|3,0,0]=4 929 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,0,0,0,0,1|3,0,0]=4 930 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,0,0,0,0,1|3,0,0]=4 931 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,0,0,0,0,1|3,0,0]=4 932 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [0,0,0,0,0,1|3,0,0]=4 933 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100000752885_100016084084 [0,0,0,0,0,1|3,0,0]=4 934 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Br 62a_100016084084_100000752885 [0,0,0,0,0,1|3,0,0]=4 935 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100000755918_100016084084 [0,0,0,0,0,1|3,0,0]=4 936 B12R1.49 C[C@H](CO)Sc1ccc(cc1)Cl 62a_100016084084_100000755918 [0,0,0,0,0,1|3,0,0]=4 937 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100000211213_100016084084 [0,0,0,0,0,1|3,0,0]=4 938 B12R1.49 C[C@H](CO)Sc1ccc(cc1)F 62a_100016084084_100000211213 [0,0,0,0,0,1|3,0,0]=4 939 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100000185761_100016084084 [0,0,0,0,0,1|3,0,0]=4 940 B12R1.49 C[C@H](CO)Sc1ccc(cc1)N 62a_100016084084_100000185761 [0,0,0,0,0,1|3,0,0]=4 941 B12R1.49 C[C@H](CO)Sc1ccc(cc1)O 62a_100016084084_100000185759 [0,0,0,0,0,1|2,0,0]=3 942 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100000685995_100016084084 [0,0,0,0,0,1|3,0,0]=4 943 B12R1.49 C[C@H](CO)Sc1ccc(cn1)O 62a_100016084084_100000744096 [0,0,0,0,0,1|3,0,0]=4 944 B12R1.49 Cc1ccc(cc1)NC(C)CO 34a_100000124888_100012180447 [0,0,0,0,0,1|3,0,0]=4 945 B12R1.49 Cc1ccc(cc1)OC(C)CO 34a_100000210336_100012180447 [0,0,0,0,0,1|3,0,0]=4 946 B12R1.49 Cc1ccc(cc1)OC(C)CO 7a_100000210336_100012180447 [0,0,0,0,0,1|3,0,0]=4 947 B12R1.49 Cc1ccc(cc1)SC(C)CO 62a_100012180447_100000186775 [0,0,0,0,0,1|3,0,0]=4 948 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100000186775_100016084084 [0,0,0,0,0,1|3,0,0]=4 949 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000186775 [0,0,0,0,0,1|3,0,0]=4 950 B12R1.49 N#CC(F)Sc1ccc(cc1)O 62a_200000117898_100000185759 [0,0,0,0,0,1|1,0,2]=4 951 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,0,0,0,0,1|1,0,2]=4 952 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,0,0,0,0,1|1,0,2]=4 953 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [2,0,0,0,0,0|0,0,2]=4 954 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [2,0,0,0,0,0|0,0,0]=2 955 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [2,0,0,0,0,0|1,0,0]=3 956 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [2,0,0,0,0,0|1,0,0]=3 957 B9R1.1 CCc1cnc(nc1)O 271570a_203496583355_100000033099 [2,0,0,0,0,0|2,0,0]=4 958 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [2,0,0,0,0,0|2,0,0]=4 959 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [2,0,0,0,0,0|2,0,0]=4 960 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [2,0,0,0,0,0|2,0,0]=4 961 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [2,0,0,0,0,0|2,0,0]=4 962 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [2,0,0,0,0,0|2,0,0]=4 963 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [2,0,0,0,0,0|2,0,0]=4 964 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [2,0,0,0,0,0|2,0,0]=4 965 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [2,0,0,0,0,0|1,0,0]=3 966 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [2,0,0,0,0,0|1,0,0]=3 967 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [2,0,0,0,0,0|2,0,0]=4 968 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [2,0,0,0,0,0|2,0,0]=4 969 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [2,0,0,0,0,0|2,0,0]=4 970 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [2,0,0,0,0,0|2,0,0]=4 971 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [2,0,0,0,0,0|2,0,0]=4 972 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [2,0,0,0,0,0|2,0,0]=4 973 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [2,0,0,0,0,0|2,0,0]=4 974 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [2,0,0,0,0,0|2,0,0]=4 975 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [2,0,0,0,0,0|2,0,0]=4 976 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [2,0,0,0,0,0|2,0,0]=4 977 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [2,0,0,0,0,0|2,0,0]=4 978 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [2,0,0,0,0,0|2,0,0]=4 979 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [2,0,0,0,0,0|1,0,0]=3 980 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [2,0,0,0,0,0|2,0,0]=4 981 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [2,0,0,0,0,0|2,0,0]=4 982 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [2,0,0,0,0,0|2,0,0]=4 983 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [2,0,0,0,0,0|2,0,0]=4 984 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [2,0,0,0,0,0|2,0,0]=4 985 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [2,0,0,0,0,0|2,0,0]=4 986 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [2,0,0,0,0,0|2,0,0]=4 987 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [2,0,0,0,0,0|2,0,0]=4 988 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [2,0,0,0,0,0|2,0,0]=4 989 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [2,0,0,0,0,0|2,0,0]=4 990 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [2,0,0,0,0,0|2,0,0]=4 991 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [2,0,0,0,0,0|2,0,0]=4 992 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [2,0,0,0,0,0|1,0,0]=3 993 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [2,0,0,0,0,0|1,0,0]=3 994 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [2,0,0,0,0,0|2,0,0]=4 995 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [2,0,0,0,0,0|2,0,0]=4 996 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [2,0,0,0,0,0|2,0,0]=4 997 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [2,0,0,0,0,0|2,0,0]=4 998 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [2,0,0,0,0,0|2,0,0]=4 999 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [2,0,0,0,0,0|2,0,0]=4 1000 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [2,0,0,0,0,0|2,0,0]=4 1001 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [2,0,0,0,0,0|2,0,0]=4 1002 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [2,0,0,0,0,0|2,0,0]=4 1003 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [2,0,0,0,0,0|0,0,2]=4 1004 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [2,0,0,0,0,0|0,0,0]=2 1005 B9R1.1 NCc1ccc(cn1)O 271570a_203496583355_100015188789 [2,0,0,0,0,0|1,0,0]=3 1006 B9R1.1 NCc1ccc(nc1)O 271570a_203496583355_100009817727 [2,0,0,0,0,0|1,0,0]=3 1007 B9R1.1 NCc1ncc(cn1)O 271570a_203496583355_200016993442 [2,0,0,0,0,0|2,0,0]=4 1008 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [2,0,0,0,0,0|1,0,0]=3 1009 B9R1.1 NNc1ccc(cn1)O 271570a_203496583355_100000750576 [2,0,0,0,0,0|2,0,0]=4 1010 B9R1.1 NNc1ccc(nc1)O 271570a_203496583355_100000119030 [2,0,0,0,0,0|2,0,0]=4 1011 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [2,0,0,0,0,0|0,0,2]=4 1012 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [2,0,0,0,0,0|0,0,0]=2 1013 B9R1.1 OCc1ccc(cn1)O 271570a_203496583355_100000754261 [2,0,0,0,0,0|1,0,0]=3 1014 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [2,0,0,0,0,0|1,0,0]=3 1015 B9R1.1 OCc1cnc(cn1)O 271570a_203496583355_100012002382 [2,0,0,0,0,0|2,0,0]=4 1016 B9R1.1 OCc1cnc(nc1)O 271570a_203496583355_100009855073 [2,0,0,0,0,0|2,0,0]=4 1017 B9R1.1 OCc1ncc(cn1)O 271570a_203496583355_100009867226 [2,0,0,0,0,0|2,0,0]=4 1018 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [2,0,0,0,0,0|1,0,0]=3 1019 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [2,0,0,0,0,0|2,0,0]=4 1020 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [2,0,0,0,0,0|2,0,0]=4 1021 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [2,0,0,0,0,0|2,0,0]=4 1022 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [2,0,0,0,0,0|2,0,0]=4 1023 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [2,0,0,0,0,0|2,0,0]=4 1024 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [2,0,0,0,0,0|2,0,0]=4 1025 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [2,0,0,0,0,0|1,0,0]=3 1026 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [2,0,0,0,0,0|2,0,0]=4 1027 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [2,0,0,0,0,0|2,0,0]=4 1028 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [2,0,0,0,0,0|2,0,0]=4 1029 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [2,0,0,0,0,0|2,0,0]=4 1030 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [2,0,0,0,0,0|2,0,0]=4 1031 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [2,0,0,0,0,0|2,0,0]=4 1032 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [2,0,0,0,0,0|2,0,0]=4 1033 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [2,0,0,0,0,0|2,0,0]=4 1034 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [2,0,0,0,0,0|2,0,0]=4 1035 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [2,0,0,0,0,0|2,0,0]=4 1036 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [2,0,0,0,0,0|2,0,0]=4 1037 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [2,0,0,0,0,0|2,0,0]=4 1038 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [2,0,0,0,0,0|2,0,0]=4 1039 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [2,0,0,0,0,0|2,0,0]=4 1040 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [2,0,0,0,0,0|2,0,0]=4 1041 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [2,0,0,0,0,0|2,0,0]=4 1042 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [2,0,0,0,0,0|1,0,0]=3 1043 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [2,0,0,0,0,0|2,0,0]=4 1044 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [2,0,0,0,0,0|2,0,0]=4 1045 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [2,0,0,0,0,0|2,0,0]=4 1046 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1047 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1048 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [2,0,0,0,0,0|2,0,0]=4 1049 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [2,0,0,0,0,0|2,0,0]=4 1050 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|2,0,0]=4 1051 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 1052 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|2,0,0]=4 1053 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|2,0,0]=4 1054 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 1055 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|2,0,0]=4 1056 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|2,0,0]=4 1057 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 1058 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|2,0,0]=4 1059 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 1060 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|2,0,0]=4 1061 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|2,0,0]=4 1062 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [2,0,0,0,0,0|2,0,0]=4 1063 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 1064 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 1065 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [2,0,0,0,0,0|2,0,0]=4 1066 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [2,0,0,0,0,0|2,0,0]=4 1067 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 1068 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 1069 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 1070 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 1071 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|2,0,0]=4 1072 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|2,0,0]=4 1073 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [2,0,0,0,0,0|1,0,1]=4 1074 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [2,0,0,0,0,0|0,0,2]=4 1075 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1076 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1077 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1078 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1079 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1080 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1081 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [2,0,0,0,0,0|0,0,2]=4 1082 B11R1.1 C#CCNc1ccc(cc1)O 34a_100000185829_100000184674 [1,1,0,0,0,0|1,0,1]=4 1083 B11R1.1 C#CCSc1ccc(cc1)O 62a_100000038162_100000185759 [1,1,0,0,0,0|1,0,1]=4 1084 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [1,1,0,0,0,0|1,0,1]=4 1085 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [1,1,0,0,0,0|1,0,1]=4 1086 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [1,1,0,0,0,0|1,0,1]=4 1087 B11R1.1 CCCCc1ccc(cc1)Br 271570a_100020621405_100000752885 [1,1,0,0,0,0|2,0,0]=4 1088 B11R1.1 CCCCc1ccc(cc1)C 271570a_100020621405_100000186775 [1,1,0,0,0,0|2,0,0]=4 1089 B11R1.1 CCCCc1ccc(cc1)Cl 271570a_100020621405_100000755918 [1,1,0,0,0,0|2,0,0]=4 1090 B11R1.1 CCCCc1ccc(cc1)F 271570a_100020621405_100000211213 [1,1,0,0,0,0|2,0,0]=4 1091 B11R1.1 CCCCc1ccc(cc1)N 271570a_100020621405_100000185761 [1,1,0,0,0,0|2,0,0]=4 1092 B11R1.1 CCCCc1ccc(cc1)O 271570a_100020621405_100000185759 [1,1,0,0,0,0|1,0,0]=3 1093 B11R1.1 CCCCc1ccc(cc1)O 271570a_203496583355_100011215597 [1,1,0,0,0,0|1,0,0]=3 1094 B11R1.1 CCCCc1ccc(cn1)O 271570a_100020621405_100000685995 [1,1,0,0,0,0|2,0,0]=4 1095 B11R1.1 CCCNc1ccc(cc1)Br 2230a_100000210018_100000210303 [1,1,0,0,0,0|2,0,0]=4 1096 B11R1.1 CCCNc1ccc(cc1)Br 34a_100000210018_100000210303 [1,1,0,0,0,0|2,0,0]=4 1097 B11R1.1 CCCNc1ccc(cc1)C 34a_100000124888_100000210303 [1,1,0,0,0,0|2,0,0]=4 1098 B11R1.1 CCCNc1ccc(cc1)Cl 2230a_100000210052_100000210303 [1,1,0,0,0,0|2,0,0]=4 1099 B11R1.1 CCCNc1ccc(cc1)Cl 34a_100000210052_100000210303 [1,1,0,0,0,0|2,0,0]=4 1100 B11R1.1 CCCNc1ccc(cc1)F 34a_100000185862_100000210303 [1,1,0,0,0,0|2,0,0]=4 1101 B11R1.1 CCCNc1ccc(cc1)I 34a_100000185761_100000210303 [1,1,0,0,0,0|2,0,0]=4 1102 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [1,1,0,0,0,0|1,0,0]=3 1103 B11R1.1 CCCOc1ccc(cc1)Br 34a_100000185759_100000210303 [1,1,0,0,0,0|2,0,0]=4 1104 B11R1.1 CCCOc1ccc(cc1)Br 7a_100000185759_100000210303 [1,1,0,0,0,0|2,0,0]=4 1105 B11R1.1 CCCOc1ccc(cc1)C 34a_100000210336_100000210303 [1,1,0,0,0,0|2,0,0]=4 1106 B11R1.1 CCCOc1ccc(cc1)C 7a_100000210336_100000210303 [1,1,0,0,0,0|2,0,0]=4 1107 B11R1.1 CCCOc1ccc(cc1)Cl 34a_100000210216_100000210303 [1,1,0,0,0,0|2,0,0]=4 1108 B11R1.1 CCCOc1ccc(cc1)Cl 7a_100000210216_100000210303 [1,1,0,0,0,0|2,0,0]=4 1109 B11R1.1 CCCOc1ccc(cc1)F 34a_100000210339_100000210303 [1,1,0,0,0,0|2,0,0]=4 1110 B11R1.1 CCCOc1ccc(cc1)I 34a_100000212066_100000210303 [1,1,0,0,0,0|2,0,0]=4 1111 B11R1.1 CCCOc1ccc(cc1)I 7a_100000212066_100000210303 [1,1,0,0,0,0|2,0,0]=4 1112 B11R1.1 CCCOc1ccc(cc1)N 34a_100000185829_100000210303 [1,1,0,0,0,0|2,0,0]=4 1113 B11R1.1 CCCOc1ccc(cc1)O 271570a_203496583355_100000169948 [1,1,0,0,0,0|1,0,0]=3 1114 B11R1.1 CCCOc1ccc(cn1)O 271570a_203496583355_100011465619 [1,1,0,0,0,0|2,0,0]=4 1115 B11R1.1 CCCOc1ccc(nc1)O 271570a_203496583355_100000719977 [1,1,0,0,0,0|2,0,0]=4 1116 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000210303_100000752885 [1,1,0,0,0,0|2,0,0]=4 1117 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000752885_100000210303 [1,1,0,0,0,0|2,0,0]=4 1118 B11R1.1 CCCSc1ccc(cc1)C 62a_100000186775_100000210303 [1,1,0,0,0,0|2,0,0]=4 1119 B11R1.1 CCCSc1ccc(cc1)C 62a_100000210303_100000186775 [1,1,0,0,0,0|2,0,0]=4 1120 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000210303_100000755918 [1,1,0,0,0,0|2,0,0]=4 1121 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000755918_100000210303 [1,1,0,0,0,0|2,0,0]=4 1122 B11R1.1 CCCSc1ccc(cc1)F 62a_100000210303_100000211213 [1,1,0,0,0,0|2,0,0]=4 1123 B11R1.1 CCCSc1ccc(cc1)F 62a_100000211213_100000210303 [1,1,0,0,0,0|2,0,0]=4 1124 B11R1.1 CCCSc1ccc(cc1)N 62a_100000185761_100000210303 [1,1,0,0,0,0|2,0,0]=4 1125 B11R1.1 CCCSc1ccc(cc1)N 62a_100000210303_100000185761 [1,1,0,0,0,0|2,0,0]=4 1126 B11R1.1 CCCSc1ccc(cc1)O 271570a_203496583355_200009811899 [1,1,0,0,0,0|1,0,0]=3 1127 B11R1.1 CCCSc1ccc(cc1)O 62a_100000210303_100000185759 [1,1,0,0,0,0|1,0,0]=3 1128 B11R1.1 CCCSc1ccc(cn1)O 62a_100000210303_100000744096 [1,1,0,0,0,0|2,0,0]=4 1129 B11R1.1 CCCSc1ccc(cn1)O 62a_100000685995_100000210303 [1,1,0,0,0,0|2,0,0]=4 1130 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [1,1,0,0,0,0|2,0,0]=4 1131 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [1,1,0,0,0,0|2,0,0]=4 1132 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [1,1,0,0,0,0|2,0,0]=4 1133 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [1,1,0,0,0,0|2,0,0]=4 1134 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [1,1,0,0,0,0|2,0,0]=4 1135 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [1,1,0,0,0,0|2,0,0]=4 1136 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [1,1,0,0,0,0|2,0,0]=4 1137 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [1,1,0,0,0,0|2,0,0]=4 1138 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [1,1,0,0,0,0|2,0,0]=4 1139 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [1,1,0,0,0,0|2,0,0]=4 1140 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [1,1,0,0,0,0|2,0,0]=4 1141 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [1,1,0,0,0,0|2,0,0]=4 1142 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [1,1,0,0,0,0|2,0,0]=4 1143 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [1,1,0,0,0,0|2,0,0]=4 1144 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [1,1,0,0,0,0|2,0,0]=4 1145 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [1,1,0,0,0,0|2,0,0]=4 1146 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [1,1,0,0,0,0|2,0,0]=4 1147 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [1,1,0,0,0,0|2,0,0]=4 1148 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [1,1,0,0,0,0|2,0,0]=4 1149 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [1,1,0,0,0,0|2,0,0]=4 1150 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [1,1,0,0,0,0|2,0,0]=4 1151 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [1,1,0,0,0,0|2,0,0]=4 1152 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [1,1,0,0,0,0|2,0,0]=4 1153 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [1,1,0,0,0,0|2,0,0]=4 1154 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [1,1,0,0,0,0|1,0,0]=3 1155 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [1,1,0,0,0,0|1,0,0]=3 1156 B11R1.1 CCNCc1ccc(nc1)O 207a_100015525214_100011361521 [1,1,0,0,0,0|2,0,0]=4 1157 B11R1.1 CCNCc1ccc(nc1)O 2230a_100000757128_100000210202 [1,1,0,0,0,0|2,0,0]=4 1158 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [1,1,0,0,0,0|2,0,0]=4 1159 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [1,1,0,0,0,0|2,0,0]=4 1160 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [1,1,0,0,0,0|2,0,0]=4 1161 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [1,1,0,0,0,0|2,0,0]=4 1162 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [1,1,0,0,0,0|2,0,0]=4 1163 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [1,1,0,0,0,0|2,0,0]=4 1164 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [1,1,0,0,0,0|2,0,0]=4 1165 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [1,1,0,0,0,0|2,0,0]=4 1166 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [1,1,0,0,0,0|2,0,0]=4 1167 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [1,1,0,0,0,0|2,0,0]=4 1168 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [1,1,0,0,0,0|2,0,0]=4 1169 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [1,1,0,0,0,0|2,0,0]=4 1170 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [1,1,0,0,0,0|2,0,0]=4 1171 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [1,1,0,0,0,0|2,0,0]=4 1172 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [1,1,0,0,0,0|2,0,0]=4 1173 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [1,1,0,0,0,0|1,0,0]=3 1174 B11R1.1 CCOCc1ccc(nc1)O 271570a_203496583355_100011206209 [1,1,0,0,0,0|2,0,0]=4 1175 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000189115_100000210202 [1,1,0,0,0,0|2,0,0]=4 1176 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000210202_100000189115 [1,1,0,0,0,0|2,0,0]=4 1177 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210202_100000210814 [1,1,0,0,0,0|2,0,0]=4 1178 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210814_100000210202 [1,1,0,0,0,0|2,0,0]=4 1179 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000187161_100000210202 [1,1,0,0,0,0|2,0,0]=4 1180 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000210202_100000187161 [1,1,0,0,0,0|2,0,0]=4 1181 B11R1.1 CCSCc1ccc(cc1)F 62a_100000198546_100000210202 [1,1,0,0,0,0|2,0,0]=4 1182 B11R1.1 CCSCc1ccc(cc1)F 62a_100000210202_100000187164 [1,1,0,0,0,0|2,0,0]=4 1183 B11R1.1 CCSCc1ccc(cc1)I 62a_100000189116_100000210202 [1,1,0,0,0,0|2,0,0]=4 1184 B11R1.1 CCSCc1ccc(cc1)I 62a_100000210202_100000189116 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.1 CNCCc1ccc(cc1)Br 2230a_100000755846_200000210301 [1,1,0,0,0,0|1,0,0]=3 1186 B11R1.1 CNCCc1ccc(cc1)Br 2230a_106832991635_100011740612 [1,1,0,0,0,0|1,0,0]=3 1187 B11R1.1 CNCCc1ccc(cc1)Br 34a_100000755846_200000210301 [1,1,0,0,0,0|1,0,0]=3 1188 B11R1.1 CNCCc1ccc(cc1)Br 34a_100102657272_100011740612 [1,1,0,0,0,0|1,0,0]=3 1189 B11R1.1 CNCCc1ccc(cc1)Br 7a_106832991635_100011740612 [1,1,0,0,0,0|1,0,0]=3 1190 B11R1.1 CNCCc1ccc(cc1)C 2230a_100000705350_200000210301 [1,1,0,0,0,0|1,0,0]=3 1191 B11R1.1 CNCCc1ccc(cc1)C 2230a_106832991635_100011713686 [1,1,0,0,0,0|1,0,0]=3 1192 B11R1.1 CNCCc1ccc(cc1)C 34a_100000705350_200000210301 [1,1,0,0,0,0|1,0,0]=3 1193 B11R1.1 CNCCc1ccc(cc1)C 34a_100102657272_100011713686 [1,1,0,0,0,0|1,0,0]=3 1194 B11R1.1 CNCCc1ccc(cc1)C 7a_106832991635_100011713686 [1,1,0,0,0,0|1,0,0]=3 1195 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_100000185265_200000210301 [1,1,0,0,0,0|1,0,0]=3 1196 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_106832991635_100011713675 [1,1,0,0,0,0|1,0,0]=3 1197 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100000185265_200000210301 [1,1,0,0,0,0|1,0,0]=3 1198 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100102657272_100011713675 [1,1,0,0,0,0|1,0,0]=3 1199 B11R1.1 CNCCc1ccc(cc1)Cl 7a_106832991635_100011713675 [1,1,0,0,0,0|1,0,0]=3 1200 B11R1.1 CNCCc1ccc(cc1)F 2230a_100000199005_200000210301 [1,1,0,0,0,0|1,0,0]=3 1201 B11R1.1 CNCCc1ccc(cc1)F 2230a_106832991635_100011217392 [1,1,0,0,0,0|1,0,0]=3 1202 B11R1.1 CNCCc1ccc(cc1)F 34a_100000199005_200000210301 [1,1,0,0,0,0|1,0,0]=3 1203 B11R1.1 CNCCc1ccc(cc1)F 34a_100102657272_100011217392 [1,1,0,0,0,0|1,0,0]=3 1204 B11R1.1 CNCCc1ccc(cc1)F 7a_106832991635_100011217392 [1,1,0,0,0,0|1,0,0]=3 1205 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [1,1,0,0,0,0|0,0,0]=2 1206 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [1,1,0,0,0,0|0,0,0]=2 1207 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [1,1,0,0,0,0|0,0,0]=2 1208 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [1,1,0,0,0,0|0,0,0]=2 1209 B11R1.1 COCCc1ccc(cc1)Br 34a_100000766406_200000210301 [1,1,0,0,0,0|2,0,0]=4 1210 B11R1.1 COCCc1ccc(cc1)Br 34a_100138415774_100011740612 [1,1,0,0,0,0|2,0,0]=4 1211 B11R1.1 COCCc1ccc(cc1)Br 7a_100000766406_200000210301 [1,1,0,0,0,0|2,0,0]=4 1212 B11R1.1 COCCc1ccc(cc1)C 34a_100000756670_200000210301 [1,1,0,0,0,0|2,0,0]=4 1213 B11R1.1 COCCc1ccc(cc1)C 34a_100138415774_100011713686 [1,1,0,0,0,0|2,0,0]=4 1214 B11R1.1 COCCc1ccc(cc1)C 7a_100000756670_200000210301 [1,1,0,0,0,0|2,0,0]=4 1215 B11R1.1 COCCc1ccc(cc1)Cl 34a_100011219627_200000210301 [1,1,0,0,0,0|2,0,0]=4 1216 B11R1.1 COCCc1ccc(cc1)Cl 34a_100138415774_100011713675 [1,1,0,0,0,0|2,0,0]=4 1217 B11R1.1 COCCc1ccc(cc1)Cl 7a_100011219627_200000210301 [1,1,0,0,0,0|2,0,0]=4 1218 B11R1.1 COCCc1ccc(cc1)F 34a_100000754732_200000210301 [1,1,0,0,0,0|2,0,0]=4 1219 B11R1.1 COCCc1ccc(cc1)F 34a_100138415774_100011217392 [1,1,0,0,0,0|2,0,0]=4 1220 B11R1.1 COCCc1ccc(cc1)F 7a_100000754732_200000210301 [1,1,0,0,0,0|2,0,0]=4 1221 B11R1.1 COCCc1ccc(cc1)I 34a_100012291149_200000210301 [1,1,0,0,0,0|2,0,0]=4 1222 B11R1.1 COCCc1ccc(cc1)I 7a_100012291149_200000210301 [1,1,0,0,0,0|2,0,0]=4 1223 B11R1.1 COCCc1ccc(cc1)N 34a_100011204434_200000210301 [1,1,0,0,0,0|2,0,0]=4 1224 B11R1.1 COCCc1ccc(cc1)O 271570a_203496583355_100000739703 [1,1,0,0,0,0|1,0,0]=3 1225 B11R1.1 COCOc1ccc(cc1)O 271570a_203496583355_100012265687 [1,1,0,0,0,0|2,0,0]=4 1226 B11R1.1 COCSc1ccc(cc1)O 62a_100000766300_100000185759 [1,1,0,0,0,0|2,0,0]=4 1227 B11R1.1 CSCCc1ccc(cc1)Br 62a_100011740612_200000210301 [1,1,0,0,0,0|2,0,0]=4 1228 B11R1.1 CSCCc1ccc(cc1)Br 62a_200000210301_100011740612 [1,1,0,0,0,0|2,0,0]=4 1229 B11R1.1 CSCCc1ccc(cc1)C 62a_100011713686_200000210301 [1,1,0,0,0,0|2,0,0]=4 1230 B11R1.1 CSCCc1ccc(cc1)C 62a_200000210301_100011713686 [1,1,0,0,0,0|2,0,0]=4 1231 B11R1.1 CSCCc1ccc(cc1)Cl 62a_100011713675_200000210301 [1,1,0,0,0,0|2,0,0]=4 1232 B11R1.1 CSCCc1ccc(cc1)Cl 62a_200000210301_100011713675 [1,1,0,0,0,0|2,0,0]=4 1233 B11R1.1 CSCCc1ccc(cc1)F 62a_100011217392_200000210301 [1,1,0,0,0,0|2,0,0]=4 1234 B11R1.1 CSCCc1ccc(cc1)F 62a_200000210301_100011217392 [1,1,0,0,0,0|2,0,0]=4 1235 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [1,1,0,0,0,0|1,0,0]=3 1236 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [1,1,0,0,0,0|1,0,0]=3 1237 B11R1.1 CSCNc1ccc(cc1)O 34a_100000185829_100011218213 [1,1,0,0,0,0|2,0,0]=4 1238 B11R1.1 CSCSc1ccc(cc1)O 62a_100011218213_100000185759 [1,1,0,0,0,0|2,0,0]=4 1239 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 2230a_100000705350_200025704644 [1,1,0,0,0,0|1,0,0]=3 1240 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 34a_100000705350_200025704644 [1,1,0,0,0,0|1,0,0]=3 1241 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 34a_100000756670_200025704644 [1,1,0,0,0,0|2,0,0]=4 1242 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 7a_100000756670_200025704644 [1,1,0,0,0,0|2,0,0]=4 1243 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_100011713686_200025704644 [1,1,0,0,0,0|2,0,0]=4 1244 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713686 [1,1,0,0,0,0|2,0,0]=4 1245 B11R1.1 Cc1ccc(cc1)CNCF 34a_100000174908_100015361967 [1,1,0,0,0,0|2,0,0]=4 1246 B11R1.1 Cc1ccc(cc1)COCF 34a_100011215236_100015361967 [1,1,0,0,0,0|2,0,0]=4 1247 B11R1.1 Cc1ccc(cc1)COCF 7a_100011215236_100015361967 [1,1,0,0,0,0|2,0,0]=4 1248 B11R1.1 Cc1ccc(cc1)CSCF 62a_100000210814_100015361967 [1,1,0,0,0,0|2,0,0]=4 1249 B11R1.1 Cc1ccc(cc1)CSCF 62a_100015361967_100000210814 [1,1,0,0,0,0|2,0,0]=4 1250 B11R1.1 Cc1ccc(cc1)NCCF 34a_100000124888_100011217306 [1,1,0,0,0,0|2,0,0]=4 1251 B11R1.1 Cc1ccc(cc1)NCCO 34a_100000124888_100000211926 [1,1,0,0,0,0|2,0,0]=4 1252 B11R1.1 Cc1ccc(cc1)OCCF 34a_100000210336_100011217306 [1,1,0,0,0,0|2,0,0]=4 1253 B11R1.1 Cc1ccc(cc1)OCCF 7a_100000210336_100011217306 [1,1,0,0,0,0|2,0,0]=4 1254 B11R1.1 Cc1ccc(cc1)OCCO 34a_100000210336_100000211926 [1,1,0,0,0,0|2,0,0]=4 1255 B11R1.1 Cc1ccc(cc1)OCCO 7a_100000210336_100000211926 [1,1,0,0,0,0|2,0,0]=4 1256 B11R1.1 Cc1ccc(cc1)SCCF 62a_100000186775_100011217306 [1,1,0,0,0,0|2,0,0]=4 1257 B11R1.1 Cc1ccc(cc1)SCCF 62a_100011217306_100000186775 [1,1,0,0,0,0|2,0,0]=4 1258 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000186775_100000211926 [1,1,0,0,0,0|2,0,0]=4 1259 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000211926_100000186775 [1,1,0,0,0,0|2,0,0]=4 1260 B11R1.1 FCCNc1ccc(cc1)Br 2230a_100000210018_100011217306 [1,1,0,0,0,0|2,0,0]=4 1261 B11R1.1 FCCNc1ccc(cc1)Br 34a_100000210018_100011217306 [1,1,0,0,0,0|2,0,0]=4 1262 B11R1.1 FCCNc1ccc(cc1)Cl 2230a_100000210052_100011217306 [1,1,0,0,0,0|2,0,0]=4 1263 B11R1.1 FCCNc1ccc(cc1)Cl 34a_100000210052_100011217306 [1,1,0,0,0,0|2,0,0]=4 1264 B11R1.1 FCCNc1ccc(cc1)F 34a_100000185862_100011217306 [1,1,0,0,0,0|2,0,0]=4 1265 B11R1.1 FCCNc1ccc(cc1)I 34a_100000185761_100011217306 [1,1,0,0,0,0|2,0,0]=4 1266 B11R1.1 FCCOc1ccc(cc1)Br 34a_100000185759_100011217306 [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.1 FCCOc1ccc(cc1)Br 7a_100000185759_100011217306 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.1 FCCOc1ccc(cc1)Cl 34a_100000210216_100011217306 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.1 FCCOc1ccc(cc1)Cl 7a_100000210216_100011217306 [1,1,0,0,0,0|2,0,0]=4 1270 B11R1.1 FCCOc1ccc(cc1)F 34a_100000210339_100011217306 [1,1,0,0,0,0|2,0,0]=4 1271 B11R1.1 FCCOc1ccc(cc1)I 34a_100000212066_100011217306 [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.1 FCCOc1ccc(cc1)I 7a_100000212066_100011217306 [1,1,0,0,0,0|2,0,0]=4 1273 B11R1.1 FCCSc1ccc(cc1)Br 62a_100000752885_100011217306 [1,1,0,0,0,0|2,0,0]=4 1274 B11R1.1 FCCSc1ccc(cc1)Br 62a_100011217306_100000752885 [1,1,0,0,0,0|2,0,0]=4 1275 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100000755918_100011217306 [1,1,0,0,0,0|2,0,0]=4 1276 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100011217306_100000755918 [1,1,0,0,0,0|2,0,0]=4 1277 B11R1.1 FCCSc1ccc(cc1)F 62a_100000211213_100011217306 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.1 FCCSc1ccc(cc1)F 62a_100011217306_100000211213 [1,1,0,0,0,0|2,0,0]=4 1279 B11R1.1 FCNCc1ccc(cc1)Br 34a_100000174875_100015361967 [1,1,0,0,0,0|2,0,0]=4 1280 B11R1.1 FCNCc1ccc(cc1)Cl 34a_100000174871_100015361967 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.1 FCNCc1ccc(cc1)F 34a_100000174882_100015361967 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.1 FCNCc1ccc(cc1)I 34a_100016989417_100015361967 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.1 FCOCc1ccc(cc1)Br 34a_100000695286_100015361967 [1,1,0,0,0,0|2,0,0]=4 1284 B11R1.1 FCOCc1ccc(cc1)Cl 34a_100000211118_100015361967 [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.1 FCOCc1ccc(cc1)Cl 7a_100000211118_100015361967 [1,1,0,0,0,0|2,0,0]=4 1286 B11R1.1 FCOCc1ccc(cc1)F 34a_100000210977_100015361967 [1,1,0,0,0,0|2,0,0]=4 1287 B11R1.1 FCOCc1ccc(cc1)F 7a_100000210977_100015361967 [1,1,0,0,0,0|2,0,0]=4 1288 B11R1.1 FCOCc1ccc(cc1)I 34a_100000690907_100015361967 [1,1,0,0,0,0|2,0,0]=4 1289 B11R1.1 FCOCc1ccc(cc1)I 7a_100000690907_100015361967 [1,1,0,0,0,0|2,0,0]=4 1290 B11R1.1 FCSCc1ccc(cc1)Br 62a_100000189115_100015361967 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.1 FCSCc1ccc(cc1)Br 62a_100015361967_100000189115 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100000187161_100015361967 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100015361967_100000187161 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.1 FCSCc1ccc(cc1)F 62a_100000198546_100015361967 [1,1,0,0,0,0|2,0,0]=4 1295 B11R1.1 FCSCc1ccc(cc1)F 62a_100015361967_100000187164 [1,1,0,0,0,0|2,0,0]=4 1296 B11R1.1 FCSCc1ccc(cc1)I 62a_100000189116_100015361967 [1,1,0,0,0,0|2,0,0]=4 1297 B11R1.1 FCSCc1ccc(cc1)I 62a_100015361967_100000189116 [1,1,0,0,0,0|2,0,0]=4 1298 B11R1.1 N#CCCc1ccc(cc1)O 271570a_203496583355_100011216407 [1,1,0,0,0,0|0,0,1]=3 1299 B11R1.1 N#CCOc1ccc(cc1)O 271570a_203496583355_200000169425 [1,1,0,0,0,0|0,0,2]=4 1300 B11R1.1 N#CCSc1ccc(cc1)O 62a_100011215382_100000185759 [1,1,0,0,0,0|0,0,2]=4 1301 B11R1.1 N#CSCc1ccc(cc1)O 271570a_203496583355_200010141448 [1,1,0,0,0,0|0,0,2]=4 1302 B11R1.1 NCCCc1ccc(cc1)O 271570a_203496583355_100011297623 [1,1,0,0,0,0|0,0,0]=2 1303 B11R1.1 NCCNc1ccc(cn1)O 271570a_203496583355_200011214600 [1,1,0,0,0,0|1,0,0]=3 1304 B11R1.1 NCCOc1ccc(cc1)O 271570a_203496583355_100000746992 [1,1,0,0,0,0|0,0,0]=2 1305 B11R1.1 NCCSc1ccc(cc1)O 271570a_203496583355_100000184645 [1,1,0,0,0,0|0,0,0]=2 1306 B11R1.1 Nc1ccc(cc1)COCF 34a_100011215238_100015361967 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.1 Nc1ccc(cc1)OCCF 34a_100000185829_100011217306 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.1 Nc1ccc(cc1)OCCO 34a_100000185829_100000211926 [1,1,0,0,0,0|2,0,0]=4 1309 B11R1.1 Nc1ccc(cc1)SCCF 62a_100000185761_100011217306 [1,1,0,0,0,0|2,0,0]=4 1310 B11R1.1 Nc1ccc(cc1)SCCF 62a_100011217306_100000185761 [1,1,0,0,0,0|2,0,0]=4 1311 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000185761_100000211926 [1,1,0,0,0,0|2,0,0]=4 1312 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000211926_100000185761 [1,1,0,0,0,0|2,0,0]=4 1313 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [1,1,0,0,0,0|1,0,0]=3 1314 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [1,1,0,0,0,0|1,0,1]=4 1315 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [1,1,0,0,0,0|1,0,1]=4 1316 B11R1.1 OCC#Cc1ccc(cc1)O 271570a_203496583355_100009814260 [1,1,0,0,0,0|1,0,1]=4 1317 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [1,1,0,0,0,0|1,0,0]=3 1318 B11R1.1 OCCNc1ccc(cc1)Br 2230a_100000210018_100000211926 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.1 OCCNc1ccc(cc1)Br 34a_100000210018_100000211926 [1,1,0,0,0,0|2,0,0]=4 1320 B11R1.1 OCCNc1ccc(cc1)Cl 2230a_100000210052_100000211926 [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.1 OCCNc1ccc(cc1)Cl 34a_100000210052_100000211926 [1,1,0,0,0,0|2,0,0]=4 1322 B11R1.1 OCCNc1ccc(cc1)F 34a_100000185862_100000211926 [1,1,0,0,0,0|2,0,0]=4 1323 B11R1.1 OCCNc1ccc(cc1)I 34a_100000185761_100000211926 [1,1,0,0,0,0|2,0,0]=4 1324 B11R1.1 OCCNc1ccc(cc1)O 34a_100000185829_100000211926 [1,1,0,0,0,0|1,0,0]=3 1325 B11R1.1 OCCOc1ccc(cc1)Br 34a_100000185759_100000211926 [1,1,0,0,0,0|2,0,0]=4 1326 B11R1.1 OCCOc1ccc(cc1)Br 7a_100000185759_100000211926 [1,1,0,0,0,0|2,0,0]=4 1327 B11R1.1 OCCOc1ccc(cc1)Cl 34a_100000210216_100000211926 [1,1,0,0,0,0|2,0,0]=4 1328 B11R1.1 OCCOc1ccc(cc1)Cl 7a_100000210216_100000211926 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.1 OCCOc1ccc(cc1)F 34a_100000210339_100000211926 [1,1,0,0,0,0|2,0,0]=4 1330 B11R1.1 OCCOc1ccc(cc1)I 34a_100000212066_100000211926 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.1 OCCOc1ccc(cc1)I 7a_100000212066_100000211926 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [1,1,0,0,0,0|1,0,0]=3 1333 B11R1.1 OCCOc1ccc(nc1)O 271570a_203496583355_200013150534 [1,1,0,0,0,0|2,0,0]=4 1334 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000211926_100000752885 [1,1,0,0,0,0|2,0,0]=4 1335 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000752885_100000211926 [1,1,0,0,0,0|2,0,0]=4 1336 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000211926_100000755918 [1,1,0,0,0,0|2,0,0]=4 1337 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000755918_100000211926 [1,1,0,0,0,0|2,0,0]=4 1338 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211213_100000211926 [1,1,0,0,0,0|2,0,0]=4 1339 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211926_100000211213 [1,1,0,0,0,0|2,0,0]=4 1340 B11R1.1 OCCSc1ccc(cc1)O 62a_100000211926_100000185759 [1,1,0,0,0,0|1,0,0]=3 1341 B11R1.1 OCCSc1ccc(cn1)O 62a_100000211926_100000744096 [1,1,0,0,0,0|2,0,0]=4 1342 B11R1.1 OCCSc1ccc(cn1)O 62a_100000685995_100000211926 [1,1,0,0,0,0|2,0,0]=4 1343 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [1,1,0,0,0,0|1,0,0]=3 1344 B11R1.1 Oc1ccc(cc1)NCCF 34a_100000185829_100011217306 [1,1,0,0,0,0|1,0,0]=3 1345 B11R1.1 Oc1ccc(cc1)OCCF 271570a_203496583355_100012347556 [1,1,0,0,0,0|1,0,0]=3 1346 B11R1.1 Oc1ccc(cc1)SCCF 62a_100011217306_100000185759 [1,1,0,0,0,0|1,0,0]=3 1347 B11R1.1 Oc1ccc(nc1)SCCF 62a_100000685995_100011217306 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.1 Oc1ccc(nc1)SCCF 62a_100011217306_100000744096 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 2230a_100000755846_200025704644 [1,1,0,0,0,0|1,0,0]=3 1350 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 34a_100000755846_200025704644 [1,1,0,0,0,0|1,0,0]=3 1351 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 2230a_100000185265_200025704644 [1,1,0,0,0,0|1,0,0]=3 1352 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 34a_100000185265_200025704644 [1,1,0,0,0,0|1,0,0]=3 1353 B11R1.1 [13CH3]NCCc1ccc(cc1)F 2230a_100000199005_200025704644 [1,1,0,0,0,0|1,0,0]=3 1354 B11R1.1 [13CH3]NCCc1ccc(cc1)F 34a_100000199005_200025704644 [1,1,0,0,0,0|1,0,0]=3 1355 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [1,1,0,0,0,0|0,0,0]=2 1356 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 34a_100000766406_200025704644 [1,1,0,0,0,0|2,0,0]=4 1357 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 7a_100000766406_200025704644 [1,1,0,0,0,0|2,0,0]=4 1358 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 34a_100011219627_200025704644 [1,1,0,0,0,0|2,0,0]=4 1359 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 7a_100011219627_200025704644 [1,1,0,0,0,0|2,0,0]=4 1360 B11R1.1 [13CH3]OCCc1ccc(cc1)F 34a_100000754732_200025704644 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.1 [13CH3]OCCc1ccc(cc1)F 7a_100000754732_200025704644 [1,1,0,0,0,0|2,0,0]=4 1362 B11R1.1 [13CH3]OCCc1ccc(cc1)I 34a_100012291149_200025704644 [1,1,0,0,0,0|2,0,0]=4 1363 B11R1.1 [13CH3]OCCc1ccc(cc1)I 7a_100012291149_200025704644 [1,1,0,0,0,0|2,0,0]=4 1364 B11R1.1 [13CH3]OCCc1ccc(cc1)N 34a_100011204434_200025704644 [1,1,0,0,0,0|2,0,0]=4 1365 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_100011740612_200025704644 [1,1,0,0,0,0|2,0,0]=4 1366 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_200025704644_100011740612 [1,1,0,0,0,0|2,0,0]=4 1367 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_100011713675_200025704644 [1,1,0,0,0,0|2,0,0]=4 1368 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_200025704644_100011713675 [1,1,0,0,0,0|2,0,0]=4 1369 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_100011217392_200025704644 [1,1,0,0,0,0|2,0,0]=4 1370 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_200025704644_100011217392 [1,1,0,0,0,0|2,0,0]=4 1371 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [1,1,0,0,0,0|1,0,0]=3 1372 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [1,1,0,0,0,0|1,0,0]=3 1373 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,1,0,0,0,0|1,0,1]=4 1374 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,1,0,0,0,0|1,0,1]=4 1375 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [1,1,0,0,0,0|1,0,0]=3 1376 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [1,1,0,0,0,0|2,0,0]=4 1377 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [1,1,0,0,0,0|2,0,0]=4 1378 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,1,0,0,0,0|2,0,0]=4 1379 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [1,1,0,0,0,0|2,0,0]=4 1380 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [1,1,0,0,0,0|2,0,0]=4 1381 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,1,0,0,0,0|2,0,0]=4 1382 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,1,0,0,0,0|2,0,0]=4 1383 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,1,0,0,0,0|2,0,0]=4 1384 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,1,0,0,0,0|2,0,0]=4 1385 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,1,0,0,0,0|2,0,0]=4 1386 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [1,1,0,0,0,0|0,0,1]=3 1387 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [1,1,0,0,0,0|1,0,1]=4 1388 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [1,1,0,0,0,0|1,0,1]=4 1389 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [1,1,0,0,0,0|1,0,1]=4 1390 B11R1.20 Oc1ccc(cc1)OC(F)F 271570a_203496583355_100000179047 [1,1,0,0,0,0|2,0,0]=4 1391 B11R1.20 Oc1ccc(cc1)SC(F)F 271570a_203496583355_100000178776 [1,1,0,0,0,0|2,0,0]=4 1392 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,1,0,0,0,0|1,0,1]=4 1393 B11R1.81 CCNc1ccc(cc1Br)O 34a_100012001276_100000210202 [1,1,0,0,0,0|2,0,0]=4 1394 B11R1.81 CCNc1ccc(cc1C)O 34a_100000756630_100000210202 [1,1,0,0,0,0|2,0,0]=4 1395 B11R1.81 CCNc1ccc(cc1Cl)O 34a_100011215599_100000210202 [1,1,0,0,0,0|2,0,0]=4 1396 B11R1.81 CCNc1ccc(cc1F)O 34a_100000759473_100000210202 [1,1,0,0,0,0|2,0,0]=4 1397 B11R1.81 CCNc1ccc(cc1I)O 34a_100010084370_100000210202 [1,1,0,0,0,0|2,0,0]=4 1398 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [1,1,0,0,0,0|2,0,0]=4 1399 B11R1.81 CCOc1ccc(cc1C)O 271570a_203496583355_100011308936 [1,1,0,0,0,0|2,0,0]=4 1400 B11R1.81 CCOc1ccc(cc1F)O 271570a_203496583355_200000171753 [1,1,0,0,0,0|2,0,0]=4 1401 B11R1.81 CCOc1ccc(cc1N)O 271570a_203496583355_100000751366 [1,1,0,0,0,0|2,0,0]=4 1402 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000210202_100000701344 [1,1,0,0,0,0|2,0,0]=4 1403 B11R1.81 CCSc1ccc(cc1Br)O 62a_100000701344_100000210202 [1,1,0,0,0,0|2,0,0]=4 1404 B11R1.81 CCSc1ccc(cc1C)O 62a_100000210202_100000690111 [1,1,0,0,0,0|2,0,0]=4 1405 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000047559_100000210202 [1,1,0,0,0,0|2,0,0]=4 1406 B11R1.81 CCSc1ccc(cc1Cl)O 62a_100000210202_100000047559 [1,1,0,0,0,0|2,0,0]=4 1407 B11R1.81 CCSc1ccc(cc1F)O 62a_100000210202_100000755031 [1,1,0,0,0,0|2,0,0]=4 1408 B11R1.81 CCSc1ccc(cc1F)O 62a_100000755031_100000210202 [1,1,0,0,0,0|2,0,0]=4 1409 B11R1.81 CCSc1ccc(cc1N)O 62a_100000210202_100011999798 [1,1,0,0,0,0|2,0,0]=4 1410 B11R1.81 CCSc1ccc(cc1N)O 62a_100011999798_100000210202 [1,1,0,0,0,0|2,0,0]=4 1411 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [1,1,0,0,0,0|2,0,0]=4 1412 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [1,1,0,0,0,0|2,0,0]=4 1413 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [1,1,0,0,0,0|2,0,0]=4 1414 B11R1.81 Cc1cc(ccc1CC#N)O 271570a_203496583355_100000697864 [1,1,0,0,0,0|0,0,2]=4 1415 B11R1.81 Cc1cc(ccc1NCF)O 34a_100000756630_100015361967 [1,1,0,0,0,0|2,0,0]=4 1416 B11R1.81 Cc1cc(ccc1SCF)O 62a_100015361967_100000690111 [1,1,0,0,0,0|2,0,0]=4 1417 B11R1.81 N#CCc1ccc(cc1F)O 271570a_203496583355_100011295474 [1,1,0,0,0,0|0,0,2]=4 1418 B11R1.81 Nc1cc(ccc1SCF)O 62a_100011999798_100015361967 [1,1,0,0,0,0|2,0,0]=4 1419 B11R1.81 Nc1cc(ccc1SCF)O 62a_100015361967_100011999798 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.81 OCCc1ccc(cc1F)O 271570a_203496583355_100011962869 [1,1,0,0,0,0|1,0,0]=3 1421 B11R1.81 Oc1ccc(c(c1)Br)NCF 34a_100012001276_100015361967 [1,1,0,0,0,0|2,0,0]=4 1422 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100000701344_100015361967 [1,1,0,0,0,0|2,0,0]=4 1423 B11R1.81 Oc1ccc(c(c1)Br)SCF 62a_100015361967_100000701344 [1,1,0,0,0,0|2,0,0]=4 1424 B11R1.81 Oc1ccc(c(c1)Cl)NCF 34a_100011215599_100015361967 [1,1,0,0,0,0|2,0,0]=4 1425 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100000047559_100015361967 [1,1,0,0,0,0|2,0,0]=4 1426 B11R1.81 Oc1ccc(c(c1)Cl)SCF 62a_100015361967_100000047559 [1,1,0,0,0,0|2,0,0]=4 1427 B11R1.81 Oc1ccc(c(c1)F)NCF 34a_100000759473_100015361967 [1,1,0,0,0,0|2,0,0]=4 1428 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100000755031_100015361967 [1,1,0,0,0,0|2,0,0]=4 1429 B11R1.81 Oc1ccc(c(c1)F)SCF 62a_100015361967_100000755031 [1,1,0,0,0,0|2,0,0]=4 1430 B11R1.81 Oc1ccc(c(c1)I)NCF 34a_100010084370_100015361967 [1,1,0,0,0,0|2,0,0]=4 1431 B11R1.81 Oc1ccc(c(c1)O)NCF 34a_100000106777_100015361967 [1,1,0,0,0,0|2,0,0]=4 1432 B11R1.81 Oc1ccc(c(c1)O)SCF 62a_100015361967_100009813921 [1,1,0,0,0,0|2,0,0]=4 1433 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [1,1,0,0,0,0|2,0,0]=4 1434 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [1,1,0,0,0,0|1,0,1]=4 1435 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [1,1,0,0,0,0|1,0,1]=4 1436 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [1,1,0,0,0,0|1,0,1]=4 1437 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [1,1,0,0,0,0|1,0,1]=4 1438 B11R1.83 C=Cc1ccc(cc1)CCC 271570a_100011290941_100000750032 [1,1,0,0,0,0|2,0,0]=4 1439 B11R1.83 C=Cc1ccc(cc1)CCN 271570a_100011290941_100000755846 [1,1,0,0,0,0|1,0,0]=3 1440 B11R1.83 C=Cc1ccc(cc1)CCO 271570a_100011290941_100000766406 [1,1,0,0,0,0|2,0,0]=4 1441 B11R1.83 C=Cc1ccc(cc1)CNN 271570a_100011290941_100016993955 [1,1,0,0,0,0|2,0,0]=4 1442 B11R1.83 CCCc1ccc(cc1)NC 2230a_100000211780_200000210301 [1,1,0,0,0,0|2,0,0]=4 1443 B11R1.83 CCCc1ccc(cc1)NC 34a_100000211780_200000210301 [1,1,0,0,0,0|2,0,0]=4 1444 B11R1.83 CCCc1ccc(cc1)N[13CH3] 2230a_100000211780_200025704644 [1,1,0,0,0,0|2,0,0]=4 1445 B11R1.83 CCCc1ccc(cc1)N[13CH3] 34a_100000211780_200025704644 [1,1,0,0,0,0|2,0,0]=4 1446 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [1,1,0,0,0,0|1,0,0]=3 1447 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [1,1,0,0,0,0|1,0,0]=3 1448 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [1,1,0,0,0,0|1,0,0]=3 1449 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [1,1,0,0,0,0|1,0,0]=3 1450 B11R1.83 CCCc1ccc(cc1)SC 62a_100000750032_200000210301 [1,1,0,0,0,0|1,1,0]=4 1451 B11R1.83 CCCc1ccc(cc1)SC 62a_200000210301_100000750032 [1,1,0,0,0,0|1,1,0]=4 1452 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_100000750032_200025704644 [1,1,0,0,0,0|1,1,0]=4 1453 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000750032 [1,1,0,0,0,0|1,1,0]=4 1454 B11R1.83 CCNc1ccc(cc1)CO 2230a_100011215238_100000210202 [1,1,0,0,0,0|2,0,0]=4 1455 B11R1.83 CCNc1ccc(cc1)CO 34a_100011215238_100000210202 [1,1,0,0,0,0|2,0,0]=4 1456 B11R1.83 CCNc1ccc(cc1)OC 34a_100000184247_100000210202 [1,1,0,0,0,0|2,0,0]=4 1457 B11R1.83 CCNc1ccc(cc1)OC 34a_100011337800_200000210301 [1,1,0,0,0,0|2,0,0]=4 1458 B11R1.83 CCNc1ccc(cc1)OC 7a_100011337800_200000210301 [1,1,0,0,0,0|2,0,0]=4 1459 B11R1.83 CCNc1ccc(cc1)O[13CH3] 34a_100011337800_200025704644 [1,1,0,0,0,0|2,0,0]=4 1460 B11R1.83 CCNc1ccc(cc1)O[13CH3] 7a_100011337800_200025704644 [1,1,0,0,0,0|2,0,0]=4 1461 B11R1.83 CCOc1ccc(cc1)CO 34a_100000211755_100000210202 [1,1,0,0,0,0|2,0,0]=4 1462 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [1,1,0,0,0,0|2,0,0]=4 1463 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [1,1,0,0,0,0|2,0,0]=4 1464 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [1,1,0,0,0,0|2,0,0]=4 1465 B11R1.83 CCSc1ccc(cc1)CO 62a_100000210202_100000690907 [1,1,0,0,0,0|2,0,0]=4 1466 B11R1.83 CCSc1ccc(cc1)CO 62a_100000690907_100000210202 [1,1,0,0,0,0|2,0,0]=4 1467 B11R1.83 CCSc1ccc(cc1)OC 62a_100000210202_100000171711 [1,1,0,0,0,0|2,0,0]=4 1468 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [1,1,0,0,0,0|2,0,0]=4 1469 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [1,1,0,0,0,0|2,0,0]=4 1470 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [1,1,0,0,0,0|2,0,0]=4 1471 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [1,1,0,0,0,0|2,0,0]=4 1472 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [1,1,0,0,0,0|2,0,0]=4 1473 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [1,1,0,0,0,0|2,0,0]=4 1474 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [1,1,0,0,0,0|2,0,0]=4 1475 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [1,1,0,0,0,0|2,0,0]=4 1476 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [1,1,0,0,0,0|2,0,0]=4 1477 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [1,1,0,0,0,0|2,0,0]=4 1478 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [1,1,0,0,0,0|2,0,0]=4 1479 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [1,1,0,0,0,0|2,0,0]=4 1480 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [1,1,0,0,0,0|2,0,0]=4 1481 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [1,1,0,0,0,0|2,0,0]=4 1482 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [1,1,0,0,0,0|2,0,0]=4 1483 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [1,1,0,0,0,0|2,0,0]=4 1484 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [1,1,0,0,0,0|2,0,0]=4 1485 B11R1.83 CNc1ccc(cc1)CCO 2230a_100011204434_200000210301 [1,1,0,0,0,0|2,0,0]=4 1486 B11R1.83 CNc1ccc(cc1)CCO 34a_100011204434_200000210301 [1,1,0,0,0,0|2,0,0]=4 1487 B11R1.83 COCc1ccc(cc1)CO 34a_100138415774_100000067286 [1,1,0,0,0,0|2,0,0]=4 1488 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [1,1,0,0,0,0|2,0,0]=4 1489 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [1,1,0,0,0,0|2,0,0]=4 1490 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [1,1,0,0,0,0|2,0,0]=4 1491 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [1,1,0,0,0,0|2,0,0]=4 1492 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [1,1,0,0,0,0|2,0,0]=4 1493 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [1,1,0,0,0,0|2,0,0]=4 1494 B11R1.83 COc1ccc(cc1)CC#N 34a_100000198970_200000210301 [1,1,0,0,0,0|0,0,2]=4 1495 B11R1.83 COc1ccc(cc1)CC#N 7a_100000198970_200000210301 [1,1,0,0,0,0|0,0,2]=4 1496 B11R1.83 COc1ccc(cc1)CCBr 34a_100009816426_200000210301 [1,1,0,0,0,0|1,0,0]=3 1497 B11R1.83 COc1ccc(cc1)CCBr 7a_100009816426_200000210301 [1,1,0,0,0,0|1,0,0]=3 1498 B11R1.83 COc1ccc(cc1)CCN 34a_100000743037_200000210301 [1,1,0,0,0,0|0,0,0]=2 1499 B11R1.83 COc1ccc(cc1)CCO 34a_100011215338_200000210301 [1,1,0,0,0,0|1,0,0]=3 1500 B11R1.83 COc1ccc(cc1)CCO 7a_100011215338_200000210301 [1,1,0,0,0,0|1,0,0]=3 1501 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [1,1,0,0,0,0|2,0,0]=4 1502 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [1,1,0,0,0,0|2,0,0]=4 1503 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [1,1,0,0,0,0|2,0,0]=4 1504 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [1,1,0,0,0,0|2,0,0]=4 1505 B11R1.83 COc1ccc(cc1)NCF 34a_100000184247_100015361967 [1,1,0,0,0,0|2,0,0]=4 1506 B11R1.83 COc1ccc(cc1)OCF 34a_100000210503_100015361967 [1,1,0,0,0,0|2,0,0]=4 1507 B11R1.83 COc1ccc(cc1)SCF 62a_100015361967_100000171711 [1,1,0,0,0,0|2,0,0]=4 1508 B11R1.83 CSCc1ccc(cc1)CO 62a_100000067286_200000210301 [1,1,0,0,0,0|2,0,0]=4 1509 B11R1.83 CSCc1ccc(cc1)CO 62a_200000210301_100000067286 [1,1,0,0,0,0|2,0,0]=4 1510 B11R1.83 CSc1ccc(cc1)CCN 62a_100000755846_200000210301 [1,1,0,0,0,0|0,1,0]=3 1511 B11R1.83 CSc1ccc(cc1)CCN 62a_200000210301_100000755846 [1,1,0,0,0,0|0,1,0]=3 1512 B11R1.83 CSc1ccc(cc1)CCO 62a_100000766406_200000210301 [1,1,0,0,0,0|1,1,0]=4 1513 B11R1.83 CSc1ccc(cc1)CCO 62a_200000210301_100000766406 [1,1,0,0,0,0|1,1,0]=4 1514 B11R1.83 CSc1ccc(cc1)CNN 62a_100016993955_200000210301 [1,1,0,0,0,0|1,1,0]=4 1515 B11R1.83 CSc1ccc(cc1)CNN 62a_200000210301_100016993955 [1,1,0,0,0,0|1,1,0]=4 1516 B11R1.83 OCc1ccc(cc1)NCF 34a_100011215238_100015361967 [1,1,0,0,0,0|2,0,0]=4 1517 B11R1.83 OCc1ccc(cc1)OCF 34a_100000211755_100015361967 [1,1,0,0,0,0|2,0,0]=4 1518 B11R1.83 OCc1ccc(cc1)SCF 62a_100000690907_100015361967 [1,1,0,0,0,0|2,0,0]=4 1519 B11R1.83 OCc1ccc(cc1)SCF 62a_100015361967_100000690907 [1,1,0,0,0,0|2,0,0]=4 1520 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [1,1,0,0,0,0|2,0,0]=4 1521 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [1,1,0,0,0,0|2,0,0]=4 1522 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 2230a_100011204434_200025704644 [1,1,0,0,0,0|2,0,0]=4 1523 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 34a_100011204434_200025704644 [1,1,0,0,0,0|2,0,0]=4 1524 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 34a_100000198970_200025704644 [1,1,0,0,0,0|0,0,2]=4 1525 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 7a_100000198970_200025704644 [1,1,0,0,0,0|0,0,2]=4 1526 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 34a_100009816426_200025704644 [1,1,0,0,0,0|1,0,0]=3 1527 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 7a_100009816426_200025704644 [1,1,0,0,0,0|1,0,0]=3 1528 B11R1.83 [13CH3]Oc1ccc(cc1)CCN 34a_100000743037_200025704644 [1,1,0,0,0,0|0,0,0]=2 1529 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 34a_100011215338_200025704644 [1,1,0,0,0,0|1,0,0]=3 1530 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 7a_100011215338_200025704644 [1,1,0,0,0,0|1,0,0]=3 1531 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_100000067286_200025704644 [1,1,0,0,0,0|2,0,0]=4 1532 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_200025704644_100000067286 [1,1,0,0,0,0|2,0,0]=4 1533 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_100000755846_200025704644 [1,1,0,0,0,0|0,1,0]=3 1534 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_200025704644_100000755846 [1,1,0,0,0,0|0,1,0]=3 1535 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_100000766406_200025704644 [1,1,0,0,0,0|1,1,0]=4 1536 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_200025704644_100000766406 [1,1,0,0,0,0|1,1,0]=4 1537 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_100016993955_200025704644 [1,1,0,0,0,0|1,1,0]=4 1538 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_200025704644_100016993955 [1,1,0,0,0,0|1,1,0]=4 1539 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,1,0,0,0,0|1,0,0]=3 1540 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [1,1,0,0,0,0|2,0,0]=4 1541 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [1,1,0,0,0,0|2,0,0]=4 1542 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [1,1,0,0,0,0|2,0,0]=4 1543 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [1,1,0,0,0,0|2,0,0]=4 1544 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [1,1,0,0,0,0|2,0,0]=4 1545 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [1,1,0,0,0,0|2,0,0]=4 1546 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [1,1,0,0,0,0|2,0,0]=4 1547 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,1,0,0,0,0|2,0,0]=4 1548 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [1,1,0,0,0,0|2,0,0]=4 1549 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [1,1,0,0,0,0|2,0,0]=4 1550 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [1,1,0,0,0,0|2,0,0]=4 1551 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [1,1,0,0,0,0|2,0,0]=4 1552 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [1,1,0,0,0,0|2,0,0]=4 1553 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [1,1,0,0,0,0|2,0,0]=4 1554 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [1,1,0,0,0,0|2,0,0]=4 1555 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [1,1,0,0,0,0|2,0,0]=4 1556 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [1,1,0,0,0,0|2,0,0]=4 1557 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [1,1,0,0,0,0|2,0,0]=4 1558 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [1,1,0,0,0,0|2,0,0]=4 1559 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,1,0,0,0,0|2,0,0]=4 1560 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,1,0,0,0,0|2,0,0]=4 1561 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,1,0,0,0,0|2,0,0]=4 1562 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [1,1,0,0,0,0|2,0,0]=4 1563 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [1,1,0,0,0,0|2,0,0]=4 1564 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [1,1,0,0,0,0|0,0,2]=4 1565 B11R1.192 Cc1cc(ccc1O)NCF 34a_100011218179_100015361967 [1,1,0,0,0,0|2,0,0]=4 1566 B11R1.192 Cc1cc(ccc1O)NCF 7a_100011218179_100015361967 [1,1,0,0,0,0|2,0,0]=4 1567 B11R1.192 Cc1cc(ccc1O)SCF 62a_100015361967_100000186361 [1,1,0,0,0,0|2,0,0]=4 1568 B11R1.192 N#CCc1ccc(c(c1)F)O 271570a_203496583355_100000691973 [1,1,0,0,0,0|0,0,2]=4 1569 B11R1.192 Nc1cc(ccc1O)SCF 62a_100000752626_100015361967 [1,1,0,0,0,0|2,0,0]=4 1570 B11R1.192 Nc1cc(ccc1O)SCF 62a_100015361967_100000752626 [1,1,0,0,0,0|2,0,0]=4 1571 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [1,1,0,0,0,0|1,0,0]=3 1572 B11R1.192 Oc1ccc(cc1Br)NCF 34a_100011534360_100015361967 [1,1,0,0,0,0|2,0,0]=4 1573 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100012361655_100015361967 [1,1,0,0,0,0|2,0,0]=4 1574 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100015361967_100012361655 [1,1,0,0,0,0|2,0,0]=4 1575 B11R1.192 Oc1ccc(cc1Cl)NCF 34a_100000744943_100015361967 [1,1,0,0,0,0|2,0,0]=4 1576 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100012360047_100015361967 [1,1,0,0,0,0|2,0,0]=4 1577 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100015361967_100012360047 [1,1,0,0,0,0|2,0,0]=4 1578 B11R1.192 Oc1ccc(cc1F)NCF 34a_100011220035_100015361967 [1,1,0,0,0,0|2,0,0]=4 1579 B11R1.192 Oc1ccc(cc1F)NCF 7a_100011220035_100015361967 [1,1,0,0,0,0|2,0,0]=4 1580 B11R1.192 Oc1ccc(cc1F)SCF 62a_100000185481_100015361967 [1,1,0,0,0,0|2,0,0]=4 1581 B11R1.192 Oc1ccc(cc1F)SCF 62a_100015361967_100000185481 [1,1,0,0,0,0|2,0,0]=4 1582 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [1,1,0,0,0,0|2,0,0]=4 1583 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [1,1,0,0,0,0|2,0,0]=4 1584 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,1,0,0,0,0|2,0,0]=4 1585 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,1,0,0,0,0|2,0,0]=4 1586 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [1,1,0,0,0,0|1,0,1]=4 1587 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [1,1,0,0,0,0|1,0,1]=4 1588 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [1,1,0,0,0,0|1,0,1]=4 1589 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [1,1,0,0,0,0|1,0,1]=4 1590 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [1,1,0,0,0,0|1,0,1]=4 1591 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [1,1,0,0,0,0|1,0,1]=4 1592 B11R1.3 C=Cc1ccc(cc1)C(C)C 271570a_100011290941_100000750031 [1,1,0,0,0,0|2,0,0]=4 1593 B11R1.3 C=Cc1ccc(cc1)C(C)O 271570a_100011290941_100000745893 [1,1,0,0,0,0|1,0,0]=3 1594 B11R1.3 C=Cc1ccc(cc1)[C@@H](C)N 271570a_100011290941_100000720352 [1,1,0,0,0,0|2,0,0]=4 1595 B11R1.3 C=Cc1ccc(cc1)[C@H](C)N 271570a_100011290941_100000753911 [1,1,0,0,0,0|2,0,0]=4 1596 B11R1.3 C=Cc1ccc(cn1)C(C)O 271570a_100011290941_200010274204 [1,1,0,0,0,0|2,0,0]=4 1597 B11R1.3 C=Cc1ccc(nc1)C(C)O 271570a_100011290941_100012353650 [1,1,0,0,0,0|2,0,0]=4 1598 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [1,1,0,0,0,0|0,0,2]=4 1599 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [1,1,0,0,0,0|0,0,2]=4 1600 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [1,1,0,0,0,0|0,0,2]=4 1601 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 2230a_100000210773_200025704644 [1,1,0,0,0,0|2,0,0]=4 1602 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 34a_100000210773_200025704644 [1,1,0,0,0,0|2,0,0]=4 1603 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 7a_100000210773_200025704644 [1,1,0,0,0,0|2,0,0]=4 1604 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [1,1,0,0,0,0|1,0,0]=3 1605 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [1,1,0,0,0,0|1,0,0]=3 1606 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_100000750031_200025704644 [1,1,0,0,0,0|1,1,0]=4 1607 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000750031 [1,1,0,0,0,0|1,1,0]=4 1608 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 2230a_100011216399_200025704644 [1,1,0,0,0,0|1,0,0]=3 1609 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 34a_100011216399_200025704644 [1,1,0,0,0,0|1,0,0]=3 1610 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [1,1,0,0,0,0|0,0,0]=2 1611 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [1,1,0,0,0,0|0,0,0]=2 1612 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_100000745893_200025704644 [1,1,0,0,0,0|0,1,0]=3 1613 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000745893 [1,1,0,0,0,0|0,1,0]=3 1614 B11R1.3 CC(O)c1ccc(cn1)S[13CH3] 62a_100012353650_200025704644 [1,1,0,0,0,0|1,1,0]=4 1615 B11R1.3 CC(O)c1ccc(cn1)S[13CH3] 62a_200025704644_100012353650 [1,1,0,0,0,0|1,1,0]=4 1616 B11R1.3 CC(O)c1ccc(nc1)S[13CH3] 62a_200010274204_200025704644 [1,1,0,0,0,0|1,1,0]=4 1617 B11R1.3 CC(O)c1ccc(nc1)S[13CH3] 62a_200025704644_200010274204 [1,1,0,0,0,0|1,1,0]=4 1618 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [1,1,0,0,0,0|2,0,0]=4 1619 B11R1.3 CNc1ccc(cc1)C(C)C 2230a_100000210773_200000210301 [1,1,0,0,0,0|2,0,0]=4 1620 B11R1.3 CNc1ccc(cc1)C(C)C 34a_100000210773_200000210301 [1,1,0,0,0,0|2,0,0]=4 1621 B11R1.3 CNc1ccc(cc1)C(C)C 7a_100000210773_200000210301 [1,1,0,0,0,0|2,0,0]=4 1622 B11R1.3 CNc1ccc(cc1)C(C)O 2230a_100011216399_200000210301 [1,1,0,0,0,0|1,0,0]=3 1623 B11R1.3 CNc1ccc(cc1)C(C)O 34a_100011216399_200000210301 [1,1,0,0,0,0|1,0,0]=3 1624 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [1,1,0,0,0,0|0,0,2]=4 1625 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [1,1,0,0,0,0|0,0,2]=4 1626 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [1,1,0,0,0,0|0,0,2]=4 1627 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [1,1,0,0,0,0|0,0,2]=4 1628 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [1,1,0,0,0,0|0,0,2]=4 1629 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [1,1,0,0,0,0|0,0,2]=4 1630 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [1,1,0,0,0,0|1,0,0]=3 1631 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [1,1,0,0,0,0|1,0,0]=3 1632 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [1,1,0,0,0,0|0,0,0]=2 1633 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [1,1,0,0,0,0|0,0,0]=2 1634 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 1635 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 1636 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [1,1,0,0,0,0|2,0,0]=4 1637 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [1,1,0,0,0,0|2,0,0]=4 1638 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 1639 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 1640 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [1,1,0,0,0,0|2,0,0]=4 1641 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [1,1,0,0,0,0|1,0,1]=4 1642 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [1,1,0,0,0,0|1,0,1]=4 1643 B11R1.3 COc1ccc(cc1)[C@H](C)N 34a_100161106496_200000210301 [1,1,0,0,0,0|1,0,0]=3 1644 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [1,1,0,0,0,0|2,0,0]=4 1645 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [1,1,0,0,0,0|2,0,0]=4 1646 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [1,1,0,0,0,0|1,0,1]=4 1647 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [1,1,0,0,0,0|1,0,1]=4 1648 B11R1.3 CSc1ccc(cc1)C(C)C 62a_100000750031_200000210301 [1,1,0,0,0,0|1,1,0]=4 1649 B11R1.3 CSc1ccc(cc1)C(C)C 62a_200000210301_100000750031 [1,1,0,0,0,0|1,1,0]=4 1650 B11R1.3 CSc1ccc(cc1)C(C)O 62a_100000745893_200000210301 [1,1,0,0,0,0|0,1,0]=3 1651 B11R1.3 CSc1ccc(cc1)C(C)O 62a_200000210301_100000745893 [1,1,0,0,0,0|0,1,0]=3 1652 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_100000720352_200000210301 [1,1,0,0,0,0|1,1,0]=4 1653 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_200000210301_100000720352 [1,1,0,0,0,0|1,1,0]=4 1654 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_100000753911_200000210301 [1,1,0,0,0,0|1,1,0]=4 1655 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_200000210301_100000753911 [1,1,0,0,0,0|1,1,0]=4 1656 B11R1.3 CSc1ccc(cn1)C(C)O 62a_200000210301_200010274204 [1,1,0,0,0,0|1,1,0]=4 1657 B11R1.3 CSc1ccc(cn1)C(C)O 62a_200010274204_200000210301 [1,1,0,0,0,0|1,1,0]=4 1658 B11R1.3 CSc1ccc(nc1)C(C)O 62a_100012353650_200000210301 [1,1,0,0,0,0|1,1,0]=4 1659 B11R1.3 CSc1ccc(nc1)C(C)O 62a_200000210301_100012353650 [1,1,0,0,0,0|1,1,0]=4 1660 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_100000720352_200025704644 [1,1,0,0,0,0|1,1,0]=4 1661 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000720352 [1,1,0,0,0,0|1,1,0]=4 1662 B11R1.3 C[C@H](N)c1ccc(cc1)O[13CH3] 34a_100161106496_200025704644 [1,1,0,0,0,0|1,0,0]=3 1663 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_100000753911_200025704644 [1,1,0,0,0,0|1,1,0]=4 1664 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753911 [1,1,0,0,0,0|1,1,0]=4 1665 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [1,1,0,0,0,0|2,0,0]=4 1666 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [1,1,0,0,0,0|2,0,0]=4 1667 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [1,1,0,0,0,0|0,0,2]=4 1668 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [1,1,0,0,0,0|0,0,2]=4 1669 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [1,1,0,0,0,0|0,0,2]=4 1670 B11R1.19 CC(C)(C)c1ccc(cc1)O 271570a_203496583355_100011215385 [1,1,0,0,0,0|1,0,0]=3 1671 B11R1.19 CC(C)(C)c1ccc(cn1)O 271570a_203496583355_100010245212 [1,1,0,0,0,0|2,0,0]=4 1672 B11R1.19 CC(C)(C)c1ccc(nc1)O 271570a_203496583355_100000686854 [1,1,0,0,0,0|2,0,0]=4 1673 B11R1.19 CC(C)(N)c1ccc(cc1)O 271570a_203496583355_100000739617 [1,1,0,0,0,0|1,0,0]=3 1674 B11R1.19 CC(C)(O)c1ccc(cc1)O 271570a_203496583355_100000753367 [1,1,0,0,0,0|0,0,0]=2 1675 B11R1.19 CC(C)(O)c1ccc(cn1)O 271570a_203496583355_100010246419 [1,1,0,0,0,0|1,0,0]=3 1676 B11R1.19 CC(C)(O)c1ccc(nc1)O 271570a_203496583355_100010080785 [1,1,0,0,0,0|1,0,0]=3 1677 B11R1.19 CC(C)(O)c1ncc(cn1)O 271570a_203496583355_100010115376 [1,1,0,0,0,0|2,0,0]=4 1678 B11R1.19 CC(F)(F)c1ccc(cc1)O 271570a_203496583355_100009817129 [1,1,0,0,0,0|1,0,0]=3 1679 B11R1.19 CC(F)(F)c1ccc(nc1)O 271570a_203496583355_100010208559 [1,1,0,0,0,0|2,0,0]=4 1680 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [1,1,0,0,0,0|1,0,1]=4 1681 B11R1.19 C[Si](C)(C)c1ccc(cc1)O 271570a_203496583355_100009813420 [1,1,0,0,0,0|1,1,0]=4 1682 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [1,1,0,0,0,0|1,0,1]=4 1683 B11R1.19 Oc1ccc(cc1)C(F)(F)F 271570a_203496583355_100000727837 [1,1,0,0,0,0|2,0,0]=4 1684 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [1,1,0,0,0,0|1,0,1]=4 1685 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [1,1,0,0,0,0|1,0,1]=4 1686 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [1,1,0,0,0,0|1,0,1]=4 1687 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [1,1,0,0,0,0|1,0,1]=4 1688 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [1,1,0,0,0,0|1,0,1]=4 1689 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,1,0,0,0,0|1,0,1]=4 1690 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,1,0,0,0,0|0,0,2]=4 1691 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,1,0,0,0,0|0,0,2]=4 1692 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,1,0,0,0,0|0,0,2]=4 1693 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,1,0,0,0,0|0,0,2]=4 1694 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,1,0,0,0,0|0,0,2]=4 1695 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,1,0,0,0,0|0,0,2]=4 1696 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,1,0,0,0,0|0,0,2]=4 1697 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,1,0,0,0,0|0,0,2]=4 1698 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,1,0,0,0,0|0,0,2]=4 1699 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,1,0,0,0,0|0,0,2]=4 1700 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,1,0,0,0,0|0,0,2]=4 1701 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [1,1,0,0,0,0|1,0,0]=3 1702 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [1,1,0,0,0,0|2,0,0]=4 1703 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [1,1,0,0,0,0|1,0,0]=3 1704 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [1,1,0,0,0,0|1,0,0]=3 1705 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [1,1,0,0,0,0|2,0,0]=4 1706 B11R1.21 Cc1cc(ccc1O)B(O)O 271570a_203496583355_100010089846 [1,1,0,0,0,0|2,0,0]=4 1707 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,1,0,0,0,0|0,0,2]=4 1708 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,1,0,0,0,0|0,0,2]=4 1709 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [1,1,0,0,0,0|2,0,0]=4 1710 B11R1.21 Cc1cc(ncc1O)C(C)C 271570a_203496583355_100021475462 [1,1,0,0,0,0|2,0,0]=4 1711 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,1,0,0,0,0|0,0,2]=4 1712 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,1,0,0,0,0|0,0,2]=4 1713 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,1,0,0,0,0|0,0,2]=4 1714 B11R1.21 OB(O)c1ccc(c(c1)F)O 271570a_203496583355_100009813512 [1,1,0,0,0,0|2,0,0]=4 1715 B11R1.21 Oc1ccc(cc1F)C(F)F 271570a_203496583355_100010189893 [1,1,0,0,0,0|2,0,0]=4 1716 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,1,0,0,0,0|0,0,2]=4 1717 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,1,0,0,0,0|0,0,2]=4 1718 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,1,0,0,0,0|0,0,2]=4 1719 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,1,0,0,0,0|0,0,2]=4 1720 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,1,0,0,0,0|0,0,2]=4 1721 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [1,1,0,0,0,0|1,0,1]=4 1722 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [1,1,0,0,0,0|1,0,1]=4 1723 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [1,1,0,0,0,0|1,0,1]=4 1724 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [1,1,0,0,0,0|1,0,1]=4 1725 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,1,0,0,0,0|1,0,1]=4 1726 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [1,1,0,0,0,0|1,0,1]=4 1727 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,1,0,0,0,0|0,0,2]=4 1728 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,1,0,0,0,0|0,0,2]=4 1729 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,1,0,0,0,0|0,0,2]=4 1730 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,1,0,0,0,0|0,0,2]=4 1731 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,1,0,0,0,0|0,0,2]=4 1732 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,1,0,0,0,0|0,0,2]=4 1733 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,1,0,0,0,0|0,0,2]=4 1734 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,1,0,0,0,0|0,0,2]=4 1735 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,1,0,0,0,0|0,0,2]=4 1736 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,1,0,0,0,0|0,0,2]=4 1737 B11R1.166 CC(N)c1ccc(cc1F)O 271570a_203496583355_100000730447 [1,1,0,0,0,0|1,0,0]=3 1738 B11R1.166 CN(C)c1ccc(cc1N)O 271570a_203496583355_100000737018 [1,1,0,0,0,0|2,0,0]=4 1739 B11R1.166 C[C@@H](N)c1ccc(cc1O)F 271570a_203496583355_100025704064 [1,1,0,0,0,0|2,0,0]=4 1740 B11R1.166 Cc1cc(ccc1B(O)O)O 271570a_203496583355_100010074995 [1,1,0,0,0,0|2,0,0]=4 1741 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,1,0,0,0,0|0,0,2]=4 1742 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,1,0,0,0,0|0,0,2]=4 1743 B11R1.166 Cc1cc(ccc1N(C)C)O 269982a_100161107805_200000210301 [1,1,0,0,0,0|2,0,0]=4 1744 B11R1.166 Cc1cc(ccc1N(C)C)O 34a_100161107805_200000210301 [1,1,0,0,0,0|2,0,0]=4 1745 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 269982a_100161107805_200025704644 [1,1,0,0,0,0|2,0,0]=4 1746 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 34a_100161107805_200025704644 [1,1,0,0,0,0|2,0,0]=4 1747 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,1,0,0,0,0|0,0,2]=4 1748 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,1,0,0,0,0|0,0,2]=4 1749 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,1,0,0,0,0|0,0,2]=4 1750 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,1,0,0,0,0|0,0,2]=4 1751 B11R1.166 OB(O)c1ccc(cc1F)O 271570a_203496583355_100009813958 [1,1,0,0,0,0|2,0,0]=4 1752 B11R1.166 OB(O)c1ccc(cc1O)O 271570a_203496583355_100010158982 [1,1,0,0,0,0|2,0,0]=4 1753 B11R1.166 Oc1ccc(c(c1)F)C(F)F 271570a_203496583355_100010169825 [1,1,0,0,0,0|2,0,0]=4 1754 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,1,0,0,0,0|0,0,2]=4 1755 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,1,0,0,0,0|0,0,2]=4 1756 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,1,0,0,0,0|0,0,2]=4 1757 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,1,0,0,0,0|0,0,2]=4 1758 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 1759 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 1760 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 1761 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 1762 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 1763 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 1764 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 1765 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 1766 B11R1.12 CCC(NC)c1ccccc1 2230a_100000737752_200000210301 [1,1,0,0,0,0|2,0,0]=4 1767 B11R1.12 CCC(NC)c1ccccc1 269862a_106832991636_100000210124 [1,1,0,0,0,0|2,0,0]=4 1768 B11R1.12 CCC(N[13CH3])c1ccccc1 2230a_100000737752_200025704644 [1,1,0,0,0,0|2,0,0]=4 1769 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [1,1,0,0,0,0|1,0,0]=3 1770 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [1,1,0,0,0,0|1,0,0]=3 1771 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [1,1,0,0,0,0|1,0,0]=3 1772 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [1,1,0,0,0,0|1,0,0]=3 1773 B11R1.12 CN[C@H](CO)c1ccccc1 2230a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1774 B11R1.12 CN[C@H](CO)c1ccccc1 34a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1775 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [1,1,0,0,0,0|0,0,2]=4 1776 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [1,1,0,0,0,0|1,0,0]=3 1777 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [1,1,0,0,0,0|0,0,0]=2 1778 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1779 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1780 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 2230a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1781 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 34a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1782 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [1,1,0,0,0,0|0,0,2]=4 1783 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [1,1,0,0,0,0|1,0,0]=3 1784 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [1,1,0,0,0,0|0,0,0]=2 1785 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1786 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1787 B11R1.16 CC(CN[13CH3])c1ccccc1 2230a_100000701038_200025704644 [1,1,0,0,0,0|1,0,0]=3 1788 B11R1.16 CC(CN[13CH3])c1ccccc1 34a_100000701038_200025704644 [1,1,0,0,0,0|1,0,0]=3 1789 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [1,1,0,0,0,0|2,0,0]=4 1790 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [1,1,0,0,0,0|2,0,0]=4 1791 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [1,1,0,0,0,0|2,0,0]=4 1792 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [1,1,0,0,0,0|2,0,0]=4 1793 B11R1.16 CC(SCF)c1ccccc1 62a_100000230085_100015361967 [1,1,0,0,0,0|2,0,0]=4 1794 B11R1.16 CC(SCF)c1ccccc1 62a_100015361967_100000230085 [1,1,0,0,0,0|2,0,0]=4 1795 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [1,1,0,0,0,0|2,0,0]=4 1796 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [1,1,0,0,0,0|2,0,0]=4 1797 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [1,1,0,0,0,0|2,0,0]=4 1798 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [1,1,0,0,0,0|2,0,0]=4 1799 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [1,1,0,0,0,0|2,0,0]=4 1800 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [1,1,0,0,0,0|2,0,0]=4 1801 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [1,1,0,0,0,0|2,0,0]=4 1802 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [1,1,0,0,0,0|2,0,0]=4 1803 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [1,1,0,0,0,0|0,0,2]=4 1804 B11R1.16 CNCC(C)c1ccccc1 2230a_100000701038_200000210301 [1,1,0,0,0,0|1,0,0]=3 1805 B11R1.16 CNCC(C)c1ccccc1 2230a_106832991635_100000756946 [1,1,0,0,0,0|1,0,0]=3 1806 B11R1.16 CNCC(C)c1ccccc1 270004a_106832991635_100000212034 [1,1,0,0,0,0|1,0,0]=3 1807 B11R1.16 CNCC(C)c1ccccc1 34a_100000701038_200000210301 [1,1,0,0,0,0|1,0,0]=3 1808 B11R1.16 CNCC(C)c1ccccc1 34a_100102657272_100000756946 [1,1,0,0,0,0|1,0,0]=3 1809 B11R1.16 CNCC(C)c1ccccc1 7a_106832991635_100000756946 [1,1,0,0,0,0|1,0,0]=3 1810 B11R1.16 CNCC(O)c1ccccc1 2230a_100000210709_200000210301 [1,1,0,0,0,0|0,0,0]=2 1811 B11R1.16 CNCC(O)c1ccccc1 2230a_106832991635_100000185958 [1,1,0,0,0,0|0,0,0]=2 1812 B11R1.16 CNCC(O)c1ccccc1 34a_100102657272_100000185958 [1,1,0,0,0,0|0,0,0]=2 1813 B11R1.16 CNCC(O)c1ccccc1 7a_106832991635_100000185958 [1,1,0,0,0,0|0,0,0]=2 1814 B11R1.16 CNCC(O)c1ccccn1 2230a_100000691469_200000210301 [1,1,0,0,0,0|1,0,0]=3 1815 B11R1.16 CNCC(O)c1cccnc1 2230a_100020605170_200000210301 [1,1,0,0,0,0|1,0,0]=3 1816 B11R1.16 CNC[C@@H](O)c1ccccc1 2230a_106832991635_100011933945 [1,1,0,0,0,0|0,0,0]=2 1817 B11R1.16 CNC[C@@H](O)c1ccccc1 34a_100102657272_100011933945 [1,1,0,0,0,0|0,0,0]=2 1818 B11R1.16 CNC[C@@H](O)c1ccccc1 7a_106832991635_100011933945 [1,1,0,0,0,0|0,0,0]=2 1819 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [1,1,0,0,0,0|2,0,0]=4 1820 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [1,1,0,0,0,0|2,0,0]=4 1821 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [1,1,0,0,0,0|2,0,0]=4 1822 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [1,1,0,0,0,0|1,0,0]=3 1823 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1824 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [1,1,0,0,0,0|1,0,0]=3 1825 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [1,1,0,0,0,0|2,0,0]=4 1826 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [1,1,0,0,0,0|2,0,0]=4 1827 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [1,1,0,0,0,0|1,0,0]=3 1828 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [1,1,0,0,0,0|1,0,0]=3 1829 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1830 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [1,1,0,0,0,0|1,0,0]=3 1831 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [1,1,0,0,0,0|2,0,0]=4 1832 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [1,1,0,0,0,0|2,0,0]=4 1833 B11R1.16 [13CH3]NCC(O)c1ccccc1 2230a_100000210709_200025704644 [1,1,0,0,0,0|0,0,0]=2 1834 B11R1.16 [13CH3]NCC(O)c1ccccn1 2230a_100000691469_200025704644 [1,1,0,0,0,0|1,0,0]=3 1835 B11R1.16 [13CH3]NCC(O)c1cccnc1 2230a_100020605170_200025704644 [1,1,0,0,0,0|1,0,0]=3 1836 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1837 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [1,1,0,0,0,0|1,0,0]=3 1838 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [1,1,0,0,0,0|1,0,0]=3 1839 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1840 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [1,1,0,0,0,0|1,0,0]=3 1841 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [1,1,0,0,0,0|1,0,0]=3 1842 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [1,1,0,0,0,0|2,0,0]=4 1843 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [1,1,0,0,0,0|2,0,0]=4 1844 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [1,1,0,0,0,0|0,0,2]=4 1845 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,1,0,0,0,0|1,0,1]=4 1846 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,1,0,0,0,0|1,0,1]=4 1847 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [1,1,0,0,0,0|0,0,0]=2 1848 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [1,1,0,0,0,0|2,0,0]=4 1849 B13R1.5 CC(CO)Nc1ccc(cc1)CO 2230a_100011215238_100012180447 [0,1,0,0,0,1|2,0,0]=4 1850 B13R1.5 CC(CO)Nc1ccc(cc1)CO 34a_100011215238_100012180447 [0,1,0,0,0,1|2,0,0]=4 1851 B13R1.5 CC(CO)Oc1ccc(cc1)CO 34a_100000211755_100012180447 [0,1,0,0,0,1|2,0,0]=4 1852 B13R1.5 CC(CO)Sc1ccc(cc1)CO 62a_100012180447_100000690907 [0,1,0,0,0,1|2,0,0]=4 1853 B13R1.5 CCC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000758301 [0,1,0,0,0,1|2,0,0]=4 1854 B13R1.5 CCC(C)Nc1ccc(cc1)CO 34a_100011215238_100011215416 [0,1,0,0,0,1|2,0,0]=4 1855 B13R1.5 CCC(C)Nc1ccc(cc1)OC 34a_100000184247_100011215416 [0,1,0,0,0,1|2,0,0]=4 1856 B13R1.5 CCC(C)Oc1ccc(cc1)CO 34a_100000211755_100011215416 [0,1,0,0,0,1|2,0,0]=4 1857 B13R1.5 CCC(C)Oc1ccc(cc1)OC 34a_100000210503_100011215416 [0,1,0,0,0,1|2,0,0]=4 1858 B13R1.5 CCC(C)Sc1ccc(cc1)CO 62a_100000690907_100000758301 [0,1,0,0,0,1|2,0,0]=4 1859 B13R1.5 CCC(C)Sc1ccc(cc1)CO 62a_100000758301_100000690907 [0,1,0,0,0,1|2,0,0]=4 1860 B13R1.5 CCC(C)Sc1ccc(cc1)OC 62a_100000758301_100000171711 [0,1,0,0,0,1|2,0,0]=4 1861 B13R1.5 COc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_200000210301 [0,1,0,0,0,1|2,0,0]=4 1862 B13R1.5 COc1ccc(cc1)NC(C)CO 34a_100000184247_100012180447 [0,1,0,0,0,1|2,0,0]=4 1863 B13R1.5 COc1ccc(cc1)OC(C)CO 34a_100000210503_100012180447 [0,1,0,0,0,1|2,0,0]=4 1864 B13R1.5 COc1ccc(cc1)SC(C)CO 62a_100012180447_100000171711 [0,1,0,0,0,1|2,0,0]=4 1865 B13R1.5 COc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000171711 [0,1,0,0,0,1|2,0,0]=4 1866 B13R1.5 C[C@H](CO)Sc1ccc(cc1)CO 62a_100000690907_100016084084 [0,1,0,0,0,1|2,0,0]=4 1867 B13R1.5 C[C@H](CO)Sc1ccc(cc1)CO 62a_100016084084_100000690907 [0,1,0,0,0,1|2,0,0]=4 1868 B13R1.5 [13CH3]Oc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_200025704644 [0,1,0,0,0,1|2,0,0]=4 1869 B13R1.19 CC(CC#N)Sc1ccc(cc1)O 62a_100009813641_100000185759 [0,1,0,0,0,1|1,0,1]=4 1870 B13R1.19 CC(CCO)Nc1ccc(cc1)O 34a_100000185829_100009893172 [0,1,0,0,0,1|2,0,0]=4 1871 B13R1.19 CC(CCO)Sc1ccc(cc1)O 62a_100009893172_100000185759 [0,1,0,0,0,1|2,0,0]=4 1872 B13R1.19 CC(CN[13CH3])Oc1ccc(cc1)F 2230a_200020586543_200025704644 [0,1,0,0,0,1|2,0,0]=4 1873 B13R1.19 CC(CN[13CH3])Oc1ccc(cc1)F 34a_200020586543_200025704644 [0,1,0,0,0,1|2,0,0]=4 1874 B13R1.19 CC(Cc1ccc(cc1)O)NCF 34a_100102634573_100015361967 [0,1,0,0,0,1|2,0,0]=4 1875 B13R1.19 CCCC(C)Nc1ccc(cc1)O 34a_100000185829_100000766640 [0,1,0,0,0,1|2,0,0]=4 1876 B13R1.19 CCCC(C)Sc1ccc(cc1)O 62a_100000766640_100000185759 [0,1,0,0,0,1|2,0,0]=4 1877 B13R1.19 CCNC(C)Cc1ccc(cc1)O 2230a_100102634573_100000210202 [0,1,0,0,0,1|2,0,0]=4 1878 B13R1.19 CCNC(C)Cc1ccc(cc1)O 270004a_100015525214_100011218180 [0,1,0,0,0,1|2,0,0]=4 1879 B13R1.19 CCNC(C)Cc1ccc(cc1)O 34a_100102634573_100000210202 [0,1,0,0,0,1|2,0,0]=4 1880 B13R1.19 CCOC(C)Oc1ccc(cc1)O 271570a_203496583355_100009812852 [0,1,0,0,0,1|2,0,0]=4 1881 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 2230a_106832991635_100000233757 [0,1,0,0,0,1|0,0,2]=4 1882 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 34a_100102657272_100000233757 [0,1,0,0,0,1|0,0,2]=4 1883 B13R1.19 CNCC(=O)Nc1ccc(cc1)O 7a_106832991635_100000233757 [0,1,0,0,0,1|0,0,2]=4 1884 B13R1.19 CNCC(C)Oc1ccc(cc1)C 2230a_100000763606_200000210301 [0,1,0,0,0,1|2,0,0]=4 1885 B13R1.19 CNCC(C)Oc1ccc(cc1)C 34a_100000763606_200000210301 [0,1,0,0,0,1|2,0,0]=4 1886 B13R1.19 CNCC(C)Oc1ccc(cc1)F 2230a_106832991635_100010228477 [0,1,0,0,0,1|2,0,0]=4 1887 B13R1.19 CNCC(C)Oc1ccc(cc1)F 2230a_200020586543_200000210301 [0,1,0,0,0,1|2,0,0]=4 1888 B13R1.19 CNCC(C)Oc1ccc(cc1)F 34a_100102657272_100010228477 [0,1,0,0,0,1|2,0,0]=4 1889 B13R1.19 CNCC(C)Oc1ccc(cc1)F 34a_200020586543_200000210301 [0,1,0,0,0,1|2,0,0]=4 1890 B13R1.19 CNCC(C)Oc1ccc(cc1)F 7a_106832991635_100010228477 [0,1,0,0,0,1|2,0,0]=4 1891 B13R1.19 COCC(C)Nc1ccc(cc1)O 34a_100000185829_100000765312 [0,1,0,0,0,1|2,0,0]=4 1892 B13R1.19 COCC(C)Sc1ccc(cc1)O 62a_100000765312_100000185759 [0,1,0,0,0,1|2,0,0]=4 1893 B13R1.19 Cc1ccc(cc1)OC(C)CN[13CH3] 2230a_100000763606_200025704644 [0,1,0,0,0,1|2,0,0]=4 1894 B13R1.19 Cc1ccc(cc1)OC(C)CN[13CH3] 34a_100000763606_200025704644 [0,1,0,0,0,1|2,0,0]=4 1895 B13R1.19 NCCC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000743120 [0,1,0,0,0,1|0,0,2]=4 1896 B13R1.21 CC(CO)N(C)c1ccc(cc1)O 34a_100000182112_100012180447 [0,1,0,0,0,1|2,0,0]=4 1897 B13R1.21 CCC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000758301 [0,1,0,0,0,1|2,0,0]=4 1898 B13R1.21 CCC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000758301 [0,1,0,0,0,1|2,0,0]=4 1899 B13R1.21 CCC(C)N(C)c1ccc(cc1)O 34a_100000182112_100011215416 [0,1,0,0,0,1|2,0,0]=4 1900 B13R1.21 C[C@H](CO)N(C)c1ccc(cc1)O 269982a_100000182112_100016084084 [0,1,0,0,0,1|2,0,0]=4 1901 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [0,1,0,0,0,1|1,0,1]=4 1902 B13R1.133 CC(Nc1ccc(cc1)O)C(=O)N 34a_100000185829_100000702099 [0,1,0,0,0,1|1,0,1]=4 1903 B13R1.133 CC(Oc1ccc(cc1)O)C(=O)N 271570a_203496583355_100000150412 [0,1,0,0,0,1|1,0,1]=4 1904 B13R1.133 CC(Sc1ccc(cc1)O)C(=O)N 62a_100000702099_100000185759 [0,1,0,0,0,1|1,0,1]=4 1905 B13R1.133 NC(=O)C(F)Nc1ccc(cc1)O 34a_100000185829_100009813875 [0,1,0,0,0,1|1,0,1]=4 1906 B13R1.133 NC(=O)C(F)Sc1ccc(cc1)O 62a_100009813875_100000185759 [0,1,0,0,0,1|1,0,1]=4 1907 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [0,1,0,0,0,1|1,0,1]=4 1908 B13R1.145 CCC(CC)Sc1ccc(cc1)O 62a_100000210505_100000185759 [0,1,0,0,0,1|2,0,0]=4 1909 B13R1.145 CN[C@@H](CO)Cc1ccc(cc1)O 2230a_100020629837_200000210301 [0,1,0,0,0,1|2,0,0]=4 1910 B13R1.145 CN[C@@H](CO)Cc1ccc(cc1)O 34a_100020629837_200000210301 [0,1,0,0,0,1|2,0,0]=4 1911 B13R1.145 [13CH3]N[C@@H](CO)Cc1ccc(cc1)O 2230a_100020629837_200025704644 [0,1,0,0,0,1|2,0,0]=4 1912 B13R1.145 [13CH3]N[C@@H](CO)Cc1ccc(cc1)O 34a_100020629837_200025704644 [0,1,0,0,0,1|2,0,0]=4 1913 B13R1.249 CCC(C)(C)Sc1ccc(cc1)O 62a_100000032637_100000185759 [0,1,0,0,0,1|2,0,0]=4 1914 B13R1.249 OCC(F)(F)Sc1ccc(cc1)O 62a_100011217949_100000185759 [0,1,0,0,0,1|2,0,0]=4 1915 B13R1.2679 CC(CO)Nc1ccc(cc1Br)O 34a_100012001276_100012180447 [0,1,0,0,0,1|2,0,0]=4 1916 B13R1.2679 CC(CO)Nc1ccc(cc1Cl)O 34a_100011215599_100012180447 [0,1,0,0,0,1|2,0,0]=4 1917 B13R1.2679 CC(CO)Nc1ccc(cc1F)O 34a_100000759473_100012180447 [0,1,0,0,0,1|2,0,0]=4 1918 B13R1.2679 CC(CO)Nc1ccc(cc1I)O 34a_100010084370_100012180447 [0,1,0,0,0,1|2,0,0]=4 1919 B13R1.2679 CC(CO)Nc1ccc(cc1O)O 34a_100000106777_100012180447 [0,1,0,0,0,1|2,0,0]=4 1920 B13R1.2679 CC(CO)Sc1ccc(cc1Br)O 62a_100012180447_100000701344 [0,1,0,0,0,1|2,0,0]=4 1921 B13R1.2679 CC(CO)Sc1ccc(cc1Cl)O 62a_100012180447_100000047559 [0,1,0,0,0,1|2,0,0]=4 1922 B13R1.2679 CC(CO)Sc1ccc(cc1F)O 62a_100012180447_100000755031 [0,1,0,0,0,1|2,0,0]=4 1923 B13R1.2679 CC(CO)Sc1ccc(cc1N)O 62a_100012180447_100011999798 [0,1,0,0,0,1|2,0,0]=4 1924 B13R1.2679 CC(CO)Sc1ccc(cc1O)O 62a_100012180447_100009813921 [0,1,0,0,0,1|2,0,0]=4 1925 B13R1.2679 CCC(C)Nc1ccc(cc1Br)O 34a_100012001276_100011215416 [0,1,0,0,0,1|2,0,0]=4 1926 B13R1.2679 CCC(C)Nc1ccc(cc1C)O 34a_100000756630_100011215416 [0,1,0,0,0,1|2,0,0]=4 1927 B13R1.2679 CCC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100011215416 [0,1,0,0,0,1|2,0,0]=4 1928 B13R1.2679 CCC(C)Nc1ccc(cc1F)O 34a_100000759473_100011215416 [0,1,0,0,0,1|2,0,0]=4 1929 B13R1.2679 CCC(C)Nc1ccc(cc1I)O 34a_100010084370_100011215416 [0,1,0,0,0,1|2,0,0]=4 1930 B13R1.2679 CCC(C)Nc1ccc(cc1O)O 34a_100000106777_100011215416 [0,1,0,0,0,1|2,0,0]=4 1931 B13R1.2679 CCC(C)Sc1ccc(cc1Br)O 62a_100000701344_100000758301 [0,1,0,0,0,1|2,0,0]=4 1932 B13R1.2679 CCC(C)Sc1ccc(cc1Br)O 62a_100000758301_100000701344 [0,1,0,0,0,1|2,0,0]=4 1933 B13R1.2679 CCC(C)Sc1ccc(cc1C)O 62a_100000758301_100000690111 [0,1,0,0,0,1|2,0,0]=4 1934 B13R1.2679 CCC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000758301 [0,1,0,0,0,1|2,0,0]=4 1935 B13R1.2679 CCC(C)Sc1ccc(cc1Cl)O 62a_100000758301_100000047559 [0,1,0,0,0,1|2,0,0]=4 1936 B13R1.2679 CCC(C)Sc1ccc(cc1F)O 62a_100000755031_100000758301 [0,1,0,0,0,1|2,0,0]=4 1937 B13R1.2679 CCC(C)Sc1ccc(cc1F)O 62a_100000758301_100000755031 [0,1,0,0,0,1|2,0,0]=4 1938 B13R1.2679 CCC(C)Sc1ccc(cc1N)O 62a_100000758301_100011999798 [0,1,0,0,0,1|2,0,0]=4 1939 B13R1.2679 CCC(C)Sc1ccc(cc1N)O 62a_100011999798_100000758301 [0,1,0,0,0,1|2,0,0]=4 1940 B13R1.2679 CCC(C)Sc1ccc(cc1O)O 62a_100000758301_100009813921 [0,1,0,0,0,1|2,0,0]=4 1941 B13R1.2679 C[C@H](CO)Sc1ccc(cc1Br)O 62a_100000701344_100016084084 [0,1,0,0,0,1|2,0,0]=4 1942 B13R1.2679 C[C@H](CO)Sc1ccc(cc1Br)O 62a_100016084084_100000701344 [0,1,0,0,0,1|2,0,0]=4 1943 B13R1.2679 C[C@H](CO)Sc1ccc(cc1Cl)O 62a_100000047559_100016084084 [0,1,0,0,0,1|2,0,0]=4 1944 B13R1.2679 C[C@H](CO)Sc1ccc(cc1Cl)O 62a_100016084084_100000047559 [0,1,0,0,0,1|2,0,0]=4 1945 B13R1.2679 C[C@H](CO)Sc1ccc(cc1F)O 62a_100000755031_100016084084 [0,1,0,0,0,1|2,0,0]=4 1946 B13R1.2679 C[C@H](CO)Sc1ccc(cc1F)O 62a_100016084084_100000755031 [0,1,0,0,0,1|2,0,0]=4 1947 B13R1.2679 C[C@H](CO)Sc1ccc(cc1N)O 62a_100011999798_100016084084 [0,1,0,0,0,1|2,0,0]=4 1948 B13R1.2679 C[C@H](CO)Sc1ccc(cc1N)O 62a_100016084084_100011999798 [0,1,0,0,0,1|2,0,0]=4 1949 B13R1.2679 C[C@H](CO)Sc1ccc(cc1O)O 62a_100016084084_100009813921 [0,1,0,0,0,1|2,0,0]=4 1950 B13R1.2679 Cc1cc(ccc1NC(C)CO)O 34a_100000756630_100012180447 [0,1,0,0,0,1|2,0,0]=4 1951 B13R1.2679 Cc1cc(ccc1SC(C)CO)O 62a_100012180447_100000690111 [0,1,0,0,0,1|2,0,0]=4 1952 B13R1.2679 Cc1cc(ccc1S[C@H](C)CO)O 62a_100016084084_100000690111 [0,1,0,0,0,1|2,0,0]=4 1953 B13R1.2879 CC(CO)Nc1ccc(c(c1)Br)O 34a_100011534360_100012180447 [0,1,0,0,0,1|2,0,0]=4 1954 B13R1.2879 CC(CO)Nc1ccc(c(c1)Cl)O 34a_100000744943_100012180447 [0,1,0,0,0,1|2,0,0]=4 1955 B13R1.2879 CC(CO)Nc1ccc(c(c1)F)O 34a_100011220035_100012180447 [0,1,0,0,0,1|2,0,0]=4 1956 B13R1.2879 CC(CO)Nc1ccc(c(c1)F)O 7a_100011220035_100012180447 [0,1,0,0,0,1|2,0,0]=4 1957 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [0,1,0,0,0,1|2,0,0]=4 1958 B13R1.2879 CC(CO)Sc1ccc(c(c1)Br)O 62a_100012180447_100012361655 [0,1,0,0,0,1|2,0,0]=4 1959 B13R1.2879 CC(CO)Sc1ccc(c(c1)Cl)O 62a_100012180447_100012360047 [0,1,0,0,0,1|2,0,0]=4 1960 B13R1.2879 CC(CO)Sc1ccc(c(c1)F)O 62a_100012180447_100000185481 [0,1,0,0,0,1|2,0,0]=4 1961 B13R1.2879 CC(CO)Sc1ccc(c(c1)N)O 62a_100012180447_100000752626 [0,1,0,0,0,1|2,0,0]=4 1962 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [0,1,0,0,0,1|2,0,0]=4 1963 B13R1.2879 CCC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100011215416 [0,1,0,0,0,1|2,0,0]=4 1964 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100011215416 [0,1,0,0,0,1|2,0,0]=4 1965 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000758301 [0,1,0,0,0,1|2,0,0]=4 1966 B13R1.2879 CCC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100011215416 [0,1,0,0,0,1|2,0,0]=4 1967 B13R1.2879 CCC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100011215416 [0,1,0,0,0,1|2,0,0]=4 1968 B13R1.2879 CCC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000758301 [0,1,0,0,0,1|2,0,0]=4 1969 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011215416 [0,1,0,0,0,1|2,0,0]=4 1970 B13R1.2879 CCC(C)Sc1ccc(c(c1)Br)O 62a_100000758301_100012361655 [0,1,0,0,0,1|2,0,0]=4 1971 B13R1.2879 CCC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000758301 [0,1,0,0,0,1|2,0,0]=4 1972 B13R1.2879 CCC(C)Sc1ccc(c(c1)C)O 62a_100000758301_100000186361 [0,1,0,0,0,1|2,0,0]=4 1973 B13R1.2879 CCC(C)Sc1ccc(c(c1)Cl)O 62a_100000758301_100012360047 [0,1,0,0,0,1|2,0,0]=4 1974 B13R1.2879 CCC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000758301 [0,1,0,0,0,1|2,0,0]=4 1975 B13R1.2879 CCC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000758301 [0,1,0,0,0,1|2,0,0]=4 1976 B13R1.2879 CCC(C)Sc1ccc(c(c1)F)O 62a_100000758301_100000185481 [0,1,0,0,0,1|2,0,0]=4 1977 B13R1.2879 CCC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000758301 [0,1,0,0,0,1|2,0,0]=4 1978 B13R1.2879 CCC(C)Sc1ccc(c(c1)N)O 62a_100000758301_100000752626 [0,1,0,0,0,1|2,0,0]=4 1979 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)O 62a_100000758301_100009813601 [0,1,0,0,0,1|2,0,0]=4 1980 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)Br)O 62a_100012361655_100016084084 [0,1,0,0,0,1|2,0,0]=4 1981 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)Br)O 62a_100016084084_100012361655 [0,1,0,0,0,1|2,0,0]=4 1982 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)Cl)O 62a_100012360047_100016084084 [0,1,0,0,0,1|2,0,0]=4 1983 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)Cl)O 62a_100016084084_100012360047 [0,1,0,0,0,1|2,0,0]=4 1984 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)F)O 62a_100000185481_100016084084 [0,1,0,0,0,1|2,0,0]=4 1985 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)F)O 62a_100016084084_100000185481 [0,1,0,0,0,1|2,0,0]=4 1986 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)N)O 62a_100000752626_100016084084 [0,1,0,0,0,1|2,0,0]=4 1987 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)N)O 62a_100016084084_100000752626 [0,1,0,0,0,1|2,0,0]=4 1988 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [0,1,0,0,0,1|2,0,0]=4 1989 B13R1.2879 Cc1cc(ccc1O)NC(C)CO 34a_100011218179_100012180447 [0,1,0,0,0,1|2,0,0]=4 1990 B13R1.2879 Cc1cc(ccc1O)NC(C)CO 7a_100011218179_100012180447 [0,1,0,0,0,1|2,0,0]=4 1991 B13R1.2879 Cc1cc(ccc1O)SC(C)CO 62a_100012180447_100000186361 [0,1,0,0,0,1|2,0,0]=4 1992 B13R1.2879 Cc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000186361 [0,1,0,0,0,1|2,0,0]=4 1993 B13R1.36 COc1ccc(cc1)C(O)C(=O)C 1458a_100011218652_200000210301 [0,2,0,0,0,0|1,0,1]=4 1994 B13R1.36 COc1ccc(cc1)C(O)C(=O)[13CH3] 1458a_100011218652_200025704644 [0,2,0,0,0,0|1,0,1]=4 1995 B13R1.39 CCC(=NO)c1ccc(cc1)OC 34a_100000740173_200000210301 [0,2,0,0,0,0|1,0,1]=4 1996 B13R1.39 CCC(=NO)c1ccc(cc1)O[13CH3] 34a_100000740173_200025704644 [0,2,0,0,0,0|1,0,1]=4 1997 B13R1.39 CCC(NC)c1ccc(cc1)OC 2230a_100000195527_200000210301 [0,2,0,0,0,0|2,0,0]=4 1998 B13R1.39 CCC(NC)c1ccc(cc1)OC 269862a_106832991636_100000170455 [0,2,0,0,0,0|2,0,0]=4 1999 B13R1.39 CCC(NC)c1ccc(cc1)OC 34a_100000195527_200000210301 [0,2,0,0,0,0|2,0,0]=4 2000 B13R1.39 CCC(N[13CH3])c1ccc(cc1)OC 2230a_100000195527_200025704644 [0,2,0,0,0,0|2,0,0]=4 2001 B13R1.39 CCC(N[13CH3])c1ccc(cc1)OC 34a_100000195527_200025704644 [0,2,0,0,0,0|2,0,0]=4 2002 B13R1.39 CCC(OC)c1ccc(cc1)OC 34a_100000246523_200000210301 [0,2,0,0,0,0|1,0,0]=3 2003 B13R1.39 CCC(OC)c1ccc(cc1)OC 7a_100000246523_200000210301 [0,2,0,0,0,0|1,0,0]=3 2004 B13R1.39 CCC(O[13CH3])c1ccc(cc1)OC 34a_100000246523_200025704644 [0,2,0,0,0,0|1,0,0]=3 2005 B13R1.39 CCC(O[13CH3])c1ccc(cc1)OC 7a_100000246523_200025704644 [0,2,0,0,0,0|1,0,0]=3 2006 B13R1.39 CNC(CO)c1ccc(cc1)OC 2230a_100000751956_200000210301 [0,2,0,0,0,0|2,0,0]=4 2007 B13R1.39 CNC(CO)c1ccc(cc1)OC 34a_100000751956_200000210301 [0,2,0,0,0,0|2,0,0]=4 2008 B13R1.39 COc1ccc(cc1)C(C#N)OC 34a_100011218237_200000210301 [0,2,0,0,0,0|0,0,2]=4 2009 B13R1.39 COc1ccc(cc1)C(C#N)OC 7a_100011218237_200000210301 [0,2,0,0,0,0|0,0,2]=4 2010 B13R1.39 COc1ccc(cc1)C(C#N)O[13CH3] 34a_100011218237_200025704644 [0,2,0,0,0,0|0,0,2]=4 2011 B13R1.39 COc1ccc(cc1)C(C#N)O[13CH3] 7a_100011218237_200025704644 [0,2,0,0,0,0|0,0,2]=4 2012 B13R1.39 COc1ccc(cc1)C(CN)OC 34a_100000738651_200000210301 [0,2,0,0,0,0|0,0,0]=2 2013 B13R1.39 COc1ccc(cc1)C(CN)O[13CH3] 34a_100000738651_200025704644 [0,2,0,0,0,0|0,0,0]=2 2014 B13R1.39 COc1ccc(cc1)C(CO)N[13CH3] 2230a_100000751956_200025704644 [0,2,0,0,0,0|2,0,0]=4 2015 B13R1.39 COc1ccc(cc1)C(CO)N[13CH3] 34a_100000751956_200025704644 [0,2,0,0,0,0|2,0,0]=4 2016 B13R1.139 C=C=Cc1ccc(cc1)C(O)CC 271570a_100015277604_100000246506 [0,2,0,0,0,0|2,0,0]=4 2017 B13R1.139 C=C=Cc1ccc(cc1)C(O)CN 271570a_100015277604_100020626992 [0,2,0,0,0,0|1,0,0]=3 2018 B13R1.139 C=C=Cc1ccc(cc1)C(O)CO 271570a_100015277604_200012355997 [0,2,0,0,0,0|2,0,0]=4 2019 B13R1.139 CC(CN)c1ccc(cc1)OCF 34a_200015188644_100015361967 [0,2,0,0,0,0|1,0,0]=3 2020 B13R1.139 CC=Cc1ccc(cc1)C(O)CC 271570a_100016259895_100000246506 [0,2,0,0,0,0|2,0,0]=4 2021 B13R1.139 CC=Cc1ccc(cc1)C(O)CN 271570a_100016259895_100020626992 [0,2,0,0,0,0|1,0,0]=3 2022 B13R1.139 CC=Cc1ccc(cc1)C(O)CO 271570a_100016259895_200012355997 [0,2,0,0,0,0|2,0,0]=4 2023 B13R1.139 CCC(C)c1ccc(cc1)OCF 34a_100000211540_100015361967 [0,2,0,0,0,0|2,0,0]=4 2024 B13R1.139 CCC(C)c1ccc(cc1)OCF 7a_100000211540_100015361967 [0,2,0,0,0,0|2,0,0]=4 2025 B13R1.139 CCC(N)c1ccc(cc1)OCF 34a_100015187210_100015361967 [0,2,0,0,0,0|2,0,0]=4 2026 B13R1.139 CCC(O)c1ccc(cc1)SCF 62a_100000246506_100015361967 [0,2,0,0,0,0|1,1,0]=4 2027 B13R1.139 CCC(O)c1ccc(cc1)SCF 62a_100015361967_100000246506 [0,2,0,0,0,0|1,1,0]=4 2028 B13R1.139 CCOc1ccc(cc1)C(C)CC 34a_100000211540_100000210202 [0,2,0,0,0,0|2,0,0]=4 2029 B13R1.139 CCOc1ccc(cc1)C(C)CC 7a_100000211540_100000210202 [0,2,0,0,0,0|2,0,0]=4 2030 B13R1.139 CCOc1ccc(cc1)C(C)CN 34a_200015188644_100000210202 [0,2,0,0,0,0|1,0,0]=3 2031 B13R1.139 CCOc1ccc(cc1)C(N)CC 34a_100015187210_100000210202 [0,2,0,0,0,0|2,0,0]=4 2032 B13R1.139 CCOc1ccc(cc1)C(O)CN 34a_100000067596_100000210202 [0,2,0,0,0,0|0,0,0]=2 2033 B13R1.139 CCSc1ccc(cc1)C(O)CC 62a_100000210202_100000246506 [0,2,0,0,0,0|1,1,0]=4 2034 B13R1.139 CCSc1ccc(cc1)C(O)CC 62a_100000246506_100000210202 [0,2,0,0,0,0|1,1,0]=4 2035 B13R1.139 CCSc1ccc(cc1)C(O)CN 62a_100000210202_100020626992 [0,2,0,0,0,0|0,1,0]=3 2036 B13R1.139 CCSc1ccc(cc1)C(O)CN 62a_100020626992_100000210202 [0,2,0,0,0,0|0,1,0]=3 2037 B13R1.139 CCSc1ccc(cc1)C(O)CO 62a_100000210202_200012355997 [0,2,0,0,0,0|1,1,0]=4 2038 B13R1.139 CCSc1ccc(cc1)C(O)CO 62a_200012355997_100000210202 [0,2,0,0,0,0|1,1,0]=4 2039 B13R1.139 CNCc1ccc(cc1)C(C)CN 26a_100102657272_200015188644 [0,2,0,0,0,0|2,0,0]=4 2040 B13R1.139 CNCc1ccc(cc1)C(O)CN 26a_100102657272_100000067596 [0,2,0,0,0,0|1,0,0]=3 2041 B13R1.139 NCC(O)c1ccc(cc1)OCF 34a_100000067596_100015361967 [0,2,0,0,0,0|0,0,0]=2 2042 B13R1.139 NCC(O)c1ccc(cc1)SCF 62a_100015361967_100020626992 [0,2,0,0,0,0|0,1,0]=3 2043 B13R1.139 NCC(O)c1ccc(cc1)SCF 62a_100020626992_100015361967 [0,2,0,0,0,0|0,1,0]=3 2044 B13R1.139 OCC(O)c1ccc(cc1)SCF 62a_100015361967_200012355997 [0,2,0,0,0,0|1,1,0]=4 2045 B13R1.139 OCC(O)c1ccc(cc1)SCF 62a_200012355997_100015361967 [0,2,0,0,0,0|1,1,0]=4 2046 B13R1.187 CCC(C)(C)c1ccc(cc1)OC 7a_100000211029_200000210301 [0,2,0,0,0,0|2,0,0]=4 2047 B13R1.187 CCC(C)(C)c1ccc(cc1)O[13CH3] 7a_100000211029_200025704644 [0,2,0,0,0,0|2,0,0]=4 2048 B13R1.452 C=CCC(O)c1ccc(cc1)C=C 271570a_100011290941_100011466436 [0,2,0,0,0,0|2,0,0]=4 2049 B13R1.452 C=CCC(O)c1ccc(cc1)SC 62a_100011466436_200000210301 [0,2,0,0,0,0|1,1,0]=4 2050 B13R1.452 C=CCC(O)c1ccc(cc1)SC 62a_200000210301_100011466436 [0,2,0,0,0,0|1,1,0]=4 2051 B13R1.452 C=CCC(O)c1ccc(cc1)S[13CH3] 62a_100011466436_200025704644 [0,2,0,0,0,0|1,1,0]=4 2052 B13R1.452 C=CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011466436 [0,2,0,0,0,0|1,1,0]=4 2053 B13R1.452 C=Cc1ccc(cc1)C(O)CCC 271570a_100011290941_100011350873 [0,2,0,0,0,0|2,0,0]=4 2054 B13R1.452 CCCC(O)c1ccc(cc1)SC 62a_100011350873_200000210301 [0,2,0,0,0,0|1,1,0]=4 2055 B13R1.452 CCCC(O)c1ccc(cc1)SC 62a_200000210301_100011350873 [0,2,0,0,0,0|1,1,0]=4 2056 B13R1.452 CCCC(O)c1ccc(cc1)S[13CH3] 62a_100011350873_200025704644 [0,2,0,0,0,0|1,1,0]=4 2057 B13R1.452 CCCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011350873 [0,2,0,0,0,0|1,1,0]=4 2058 B13R1.452 CCNC(C)c1ccc(cc1)CO 269862a_100015525214_100000082505 [0,2,0,0,0,0|2,0,0]=4 2059 B13R1.452 CCNC(C)c1ccc(cc1)OC 269862a_100015525214_100000169859 [0,2,0,0,0,0|2,0,0]=4 2060 B13R1.452 CCN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_100000210202 [0,2,0,0,0,0|2,0,0]=4 2061 B13R1.452 CCOC(C)c1ccc(cc1)OC 34a_100000742907_100000210202 [0,2,0,0,0,0|2,0,0]=4 2062 B13R1.452 CCOC(C)c1ccc(cc1)OC 7a_100000742907_100000210202 [0,2,0,0,0,0|2,0,0]=4 2063 B13R1.452 CNCC(=O)c1ccc(cc1)OC 2230a_106832991635_100000212054 [0,2,0,0,0,0|0,0,2]=4 2064 B13R1.452 CNCC(=O)c1ccc(cc1)OC 7a_106832991635_100000212054 [0,2,0,0,0,0|0,0,2]=4 2065 B13R1.452 CNCC(O)c1ccc(cc1)OC 2230a_100000738651_200000210301 [0,2,0,0,0,0|0,0,0]=2 2066 B13R1.452 CNCC(O)c1ccc(cc1)OC 34a_100000738651_200000210301 [0,2,0,0,0,0|0,0,0]=2 2067 B13R1.452 CNCC(O)c1ccc(cc1)OC 34a_100016988945_200000210301 [0,2,0,0,0,0|0,0,0]=2 2068 B13R1.452 CNCC(O)c1ccc(cc1)O[13CH3] 34a_100016988945_200025704644 [0,2,0,0,0,0|0,0,0]=2 2069 B13R1.452 COCC(N)c1ccc(cc1)OC 34a_100000751956_200000210301 [0,2,0,0,0,0|2,0,0]=4 2070 B13R1.452 COc1ccc(cc1)C(C)OCF 34a_100000742907_100015361967 [0,2,0,0,0,0|2,0,0]=4 2071 B13R1.452 COc1ccc(cc1)C(C)OCF 7a_100000742907_100015361967 [0,2,0,0,0,0|2,0,0]=4 2072 B13R1.452 COc1ccc(cc1)C(N)CO[13CH3] 34a_100000751956_200025704644 [0,2,0,0,0,0|2,0,0]=4 2073 B13R1.452 COc1ccc(cc1)C(O)CN[13CH3] 2230a_100000738651_200025704644 [0,2,0,0,0,0|0,0,0]=2 2074 B13R1.452 COc1ccc(cc1)C(O)CN[13CH3] 34a_100000738651_200025704644 [0,2,0,0,0,0|0,0,0]=2 2075 B13R1.537 C=C(C)c1ccc(cc1)C(O)CC 271570a_100000694244_100000246506 [0,2,0,0,0,0|2,0,0]=4 2076 B13R1.537 C=C(C)c1ccc(cc1)C(O)CN 271570a_100000694244_100020626992 [0,2,0,0,0,0|1,0,0]=3 2077 B13R1.537 C=C(C)c1ccc(cc1)C(O)CO 271570a_100000694244_200012355997 [0,2,0,0,0,0|2,0,0]=4 2078 B13R1.29 CC(C)(CN[13CH3])c1ccc(cc1)Cl 2230a_100000742012_200025704644 [0,2,0,0,0,0|2,0,0]=4 2079 B13R1.29 CNCC(C)(C)c1ccc(cc1)Br 270004a_106832991635_100010228009 [0,2,0,0,0,0|2,0,0]=4 2080 B13R1.29 CNCC(C)(C)c1ccc(cc1)Cl 2230a_100000742012_200000210301 [0,2,0,0,0,0|2,0,0]=4 2081 B13R1.29 CNCC(F)(F)c1ccc(cc1)Br 34a_100102657272_100010185546 [0,2,0,0,0,0|2,0,0]=4 2082 B13R1.29 NCCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000744336 [0,2,0,0,0,0|1,0,1]=4 2083 B13R1.1 C=CCC(OC)c1ccc(cc1)Br 34a_100011466436_200000210301 [0,2,0,0,0,0|2,0,0]=4 2084 B13R1.1 C=CCC(OC)c1ccc(cc1)Br 7a_100011466436_200000210301 [0,2,0,0,0,0|2,0,0]=4 2085 B13R1.1 C=CCC(OC)c1ccc(cc1)Cl 34a_200011466439_200000210301 [0,2,0,0,0,0|2,0,0]=4 2086 B13R1.1 C=CCC(OC)c1ccc(cc1)Cl 7a_200011466439_200000210301 [0,2,0,0,0,0|2,0,0]=4 2087 B13R1.1 C=CCC(O[13CH3])c1ccc(cc1)Br 34a_100011466436_200025704644 [0,2,0,0,0,0|2,0,0]=4 2088 B13R1.1 C=CCC(O[13CH3])c1ccc(cc1)Br 7a_100011466436_200025704644 [0,2,0,0,0,0|2,0,0]=4 2089 B13R1.1 C=CCC(O[13CH3])c1ccc(cc1)Cl 34a_200011466439_200025704644 [0,2,0,0,0,0|2,0,0]=4 2090 B13R1.1 C=CCC(O[13CH3])c1ccc(cc1)Cl 7a_200011466439_200025704644 [0,2,0,0,0,0|2,0,0]=4 2091 B13R1.1 CCC(NCF)c1ccc(cc1)O 34a_100015187210_100015361967 [0,2,0,0,0,0|2,0,0]=4 2092 B13R1.1 CCC(OCF)c1ccc(cc1)Br 34a_100000246506_100015361967 [0,2,0,0,0,0|2,0,0]=4 2093 B13R1.1 CCC(OCF)c1ccc(cc1)Br 7a_100000246506_100015361967 [0,2,0,0,0,0|2,0,0]=4 2094 B13R1.1 CCC(OCF)c1ccc(cc1)C 34a_100000246521_100015361967 [0,2,0,0,0,0|2,0,0]=4 2095 B13R1.1 CCC(OCF)c1ccc(cc1)C 7a_100000246521_100015361967 [0,2,0,0,0,0|2,0,0]=4 2096 B13R1.1 CCC(OCF)c1ccc(cc1)Cl 34a_100000246471_100015361967 [0,2,0,0,0,0|2,0,0]=4 2097 B13R1.1 CCC(OCF)c1ccc(cc1)Cl 7a_100000246471_100015361967 [0,2,0,0,0,0|2,0,0]=4 2098 B13R1.1 CCC(OCF)c1ccc(cc1)F 34a_100000246474_100015361967 [0,2,0,0,0,0|2,0,0]=4 2099 B13R1.1 CCC(OCF)c1ccc(cc1)F 7a_100000246474_100015361967 [0,2,0,0,0,0|2,0,0]=4 2100 B13R1.1 CCCC(OC)c1ccc(cc1)Br 34a_100011350873_200000210301 [0,2,0,0,0,0|2,0,0]=4 2101 B13R1.1 CCCC(OC)c1ccc(cc1)Br 7a_100011350873_200000210301 [0,2,0,0,0,0|2,0,0]=4 2102 B13R1.1 CCCC(O[13CH3])c1ccc(cc1)Br 34a_100011350873_200025704644 [0,2,0,0,0,0|2,0,0]=4 2103 B13R1.1 CCCC(O[13CH3])c1ccc(cc1)Br 7a_100011350873_200025704644 [0,2,0,0,0,0|2,0,0]=4 2104 B13R1.1 CCN(CCO)c1ccc(cc1)O 2230a_100011337800_100000211926 [0,2,0,0,0,0|2,0,0]=4 2105 B13R1.1 CCN(CCO)c1ccc(cc1)O 269982a_100011337800_100000211926 [0,2,0,0,0,0|2,0,0]=4 2106 B13R1.1 CCN(CCO)c1ccc(cc1)O 34a_100011337800_100000211926 [0,2,0,0,0,0|2,0,0]=4 2107 B13R1.1 CCN(COC)c1ccc(cc1)O 2230a_100011337800_100000766300 [0,2,0,0,0,0|2,0,0]=4 2108 B13R1.1 CCN(COC)c1ccc(cc1)O 269982a_100011337800_100000766300 [0,2,0,0,0,0|2,0,0]=4 2109 B13R1.1 CCNC(CC)c1ccc(cc1)O 34a_100015187210_100000210202 [0,2,0,0,0,0|2,0,0]=4 2110 B13R1.1 CCNC(CO)c1ccc(cc1)Br 2230a_100000734186_100000210202 [0,2,0,0,0,0|2,0,0]=4 2111 B13R1.1 CCNC(CO)c1ccc(cc1)Br 34a_100000734186_100000210202 [0,2,0,0,0,0|2,0,0]=4 2112 B13R1.1 CCNC(CO)c1ccc(cc1)F 2230a_100000705410_100000210202 [0,2,0,0,0,0|2,0,0]=4 2113 B13R1.1 CCNC(CO)c1ccc(cc1)F 34a_100000705410_100000210202 [0,2,0,0,0,0|2,0,0]=4 2114 B13R1.1 CCN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_100000210202 [0,2,0,0,0,0|2,0,0]=4 2115 B13R1.1 CCN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_100000210202 [0,2,0,0,0,0|2,0,0]=4 2116 B13R1.1 CCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000210202 [0,2,0,0,0,0|2,0,0]=4 2117 B13R1.1 CCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000210202 [0,2,0,0,0,0|2,0,0]=4 2118 B13R1.1 CCOC(CC)c1ccc(cc1)Br 34a_100000246506_100000210202 [0,2,0,0,0,0|2,0,0]=4 2119 B13R1.1 CCOC(CC)c1ccc(cc1)Br 7a_100000246506_100000210202 [0,2,0,0,0,0|2,0,0]=4 2120 B13R1.1 CCOC(CC)c1ccc(cc1)C 34a_100000246521_100000210202 [0,2,0,0,0,0|2,0,0]=4 2121 B13R1.1 CCOC(CC)c1ccc(cc1)C 7a_100000246521_100000210202 [0,2,0,0,0,0|2,0,0]=4 2122 B13R1.1 CCOC(CC)c1ccc(cc1)Cl 34a_100000246471_100000210202 [0,2,0,0,0,0|2,0,0]=4 2123 B13R1.1 CCOC(CC)c1ccc(cc1)Cl 7a_100000246471_100000210202 [0,2,0,0,0,0|2,0,0]=4 2124 B13R1.1 CCOC(CC)c1ccc(cc1)F 34a_100000246474_100000210202 [0,2,0,0,0,0|2,0,0]=4 2125 B13R1.1 CCOC(CC)c1ccc(cc1)F 7a_100000246474_100000210202 [0,2,0,0,0,0|2,0,0]=4 2126 B13R1.1 CCOC(CCl)c1ccc(cc1)Cl 34a_200011996143_100000210202 [0,2,0,0,0,0|2,0,0]=4 2127 B13R1.1 CCOC(CCl)c1ccc(cc1)Cl 7a_200011996143_100000210202 [0,2,0,0,0,0|2,0,0]=4 2128 B13R1.1 CCOC(CN)c1ccc(cc1)Br 34a_100020626992_100000210202 [0,2,0,0,0,0|1,0,0]=3 2129 B13R1.1 CCOC(CN)c1ccc(cc1)Cl 34a_100000736658_100000210202 [0,2,0,0,0,0|1,0,0]=3 2130 B13R1.1 CCO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_100000210202 [0,2,0,0,0,0|2,0,0]=4 2131 B13R1.1 CCO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_100000210202 [0,2,0,0,0,0|2,0,0]=4 2132 B13R1.1 Cc1ccc(cc1)[C@H](CO)NCF 34a_100009818840_100015361967 [0,2,0,0,0,0|2,0,0]=4 2133 B13R1.1 FCOC(CCl)c1ccc(cc1)Cl 34a_200011996143_100015361967 [0,2,0,0,0,0|2,0,0]=4 2134 B13R1.1 FCOC(CCl)c1ccc(cc1)Cl 7a_200011996143_100015361967 [0,2,0,0,0,0|2,0,0]=4 2135 B13R1.1 FCO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_100015361967 [0,2,0,0,0,0|2,0,0]=4 2136 B13R1.1 FCO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_100015361967 [0,2,0,0,0,0|2,0,0]=4 2137 B13R1.1 NCC(OCF)c1ccc(cc1)Br 34a_100020626992_100015361967 [0,2,0,0,0,0|1,0,0]=3 2138 B13R1.1 NCC(OCF)c1ccc(cc1)Cl 34a_100000736658_100015361967 [0,2,0,0,0,0|1,0,0]=3 2139 B13R1.1 OCC(NCF)c1ccc(cc1)Br 34a_100000734186_100015361967 [0,2,0,0,0,0|2,0,0]=4 2140 B13R1.1 OCC(NCF)c1ccc(cc1)F 34a_100000705410_100015361967 [0,2,0,0,0,0|2,0,0]=4 2141 B13R1.1 OC[C@@H](NCF)c1ccc(cc1)Cl 34a_100009818818_100015361967 [0,2,0,0,0,0|2,0,0]=4 2142 B13R1.331 CCC(NC)c1ccc(c(c1)Cl)O 269862a_106832991636_100011218862 [0,2,0,0,0,0|2,0,0]=4 2143 B13R1.331 CO[C@H](CCl)c1ccc(c(c1)F)F 34a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2144 B13R1.331 CO[C@H](CCl)c1ccc(c(c1)F)F 7a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2145 B13R1.331 [13CH3]O[C@H](CCl)c1ccc(c(c1)F)F 34a_100000761251_200025704644 [0,2,0,0,0,0|2,0,0]=4 2146 B13R1.331 [13CH3]O[C@H](CCl)c1ccc(c(c1)F)F 7a_100000761251_200025704644 [0,2,0,0,0,0|2,0,0]=4 2147 B13R1.706 CC(C)C(C#N)c1ccc(cc1)O 271570a_203496583355_100000698803 [0,2,0,0,0,0|2,0,0]=4 2148 B13R1.706 CO[C@@H](c1ccc(cc1)Cl)[C@@H](C)N 34a_200009830414_200000210301 [0,2,0,0,0,0|1,0,0]=3 2149 B13R1.706 C[C@@H](N)[C@@H](O[13CH3])c1ccc(cc1)Cl 34a_200009830414_200025704644 [0,2,0,0,0,0|1,0,0]=3 2150 B13R1.961 COC(OC)c1ccc(cc1F)O 271570a_203496583355_100010185892 [0,2,0,0,0,0|2,0,0]=4 2151 B13R1.961 CO[C@@H](CCl)c1ccc(cc1Cl)Cl 34a_100000761231_200000210301 [0,2,0,0,0,0|2,0,0]=4 2152 B13R1.961 CO[C@@H](CCl)c1ccc(cc1Cl)Cl 7a_100000761231_200000210301 [0,2,0,0,0,0|2,0,0]=4 2153 B13R1.961 CO[C@H](CCl)c1ccc(cc1F)F 34a_100000761269_200000210301 [0,2,0,0,0,0|2,0,0]=4 2154 B13R1.961 CO[C@H](CCl)c1ccc(cc1F)F 7a_100000761269_200000210301 [0,2,0,0,0,0|2,0,0]=4 2155 B13R1.961 [13CH3]O[C@@H](CCl)c1ccc(cc1Cl)Cl 34a_100000761231_200025704644 [0,2,0,0,0,0|2,0,0]=4 2156 B13R1.961 [13CH3]O[C@@H](CCl)c1ccc(cc1Cl)Cl 7a_100000761231_200025704644 [0,2,0,0,0,0|2,0,0]=4 2157 B13R1.961 [13CH3]O[C@H](CCl)c1ccc(cc1F)F 34a_100000761269_200025704644 [0,2,0,0,0,0|2,0,0]=4 2158 B13R1.961 [13CH3]O[C@H](CCl)c1ccc(cc1F)F 7a_100000761269_200025704644 [0,2,0,0,0,0|2,0,0]=4 2159 B13R1.17 C#CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000038162 [0,2,0,0,0,0|2,0,0]=4 2160 B13R1.17 C=CCCC(O)c1ccc(cc1)O 271570a_203496583355_200012050447 [0,2,0,0,0,0|1,0,0]=3 2161 B13R1.17 C=CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210623 [0,2,0,0,0,0|2,0,0]=4 2162 B13R1.17 CC(CNCF)c1ccc(cc1)O 34a_200015188644_100015361967 [0,2,0,0,0,0|1,0,0]=3 2163 B13R1.17 CC(OCCN)c1ccc(cc1)Br 34a_100000210304_100000755118 [0,2,0,0,0,0|2,0,0]=4 2164 B13R1.17 CC(OCCN)c1ccc(cc1)F 34a_100000210304_100000743420 [0,2,0,0,0,0|2,0,0]=4 2165 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210303 [0,2,0,0,0,0|2,0,0]=4 2166 B13R1.17 CCNCC(C)c1ccc(cc1)O 34a_200015188644_100000210202 [0,2,0,0,0,0|1,0,0]=3 2167 B13R1.17 CCNCC(O)c1ccc(cc1)Br 2230a_100020626992_100000210202 [0,2,0,0,0,0|1,0,0]=3 2168 B13R1.17 CCNCC(O)c1ccc(cc1)Br 34a_100020626992_100000210202 [0,2,0,0,0,0|1,0,0]=3 2169 B13R1.17 CCNCC(O)c1ccc(cc1)C 2230a_200020610344_100000210202 [0,2,0,0,0,0|1,0,0]=3 2170 B13R1.17 CCNCC(O)c1ccc(cc1)C 34a_200020610344_100000210202 [0,2,0,0,0,0|1,0,0]=3 2171 B13R1.17 CCNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000210202 [0,2,0,0,0,0|1,0,0]=3 2172 B13R1.17 CCNCC(O)c1ccc(cc1)Cl 2230a_100015525214_200011996143 [0,2,0,0,0,0|1,0,0]=3 2173 B13R1.17 CCNCC(O)c1ccc(cc1)Cl 34a_100000736658_100000210202 [0,2,0,0,0,0|1,0,0]=3 2174 B13R1.17 CCNCC(O)c1ccc(cc1)O 34a_100000067596_100000210202 [0,2,0,0,0,0|0,0,0]=2 2175 B13R1.17 CCNC[C@H](O)c1ccc(cc1)F 2230a_100015525214_100000720402 [0,2,0,0,0,0|1,0,0]=3 2176 B13R1.17 CCOCC(O)c1ccc(cc1)Cl 34a_100121572206_200011996143 [0,2,0,0,0,0|2,0,0]=4 2177 B13R1.17 CCOC[C@H](O)c1ccc(cc1)F 34a_100121572206_100000720402 [0,2,0,0,0,0|2,0,0]=4 2178 B13R1.17 CCSCC(O)c1ccc(cc1)Cl 62a_100000210202_200011996143 [0,2,0,0,0,0|2,0,0]=4 2179 B13R1.17 CCSCC(O)c1ccc(cc1)Cl 62a_200011996143_100000210202 [0,2,0,0,0,0|2,0,0]=4 2180 B13R1.17 CCSC[C@H](O)c1ccc(cc1)F 62a_100000210202_100000720402 [0,2,0,0,0,0|2,0,0]=4 2181 B13R1.17 CCSC[C@H](O)c1ccc(cc1)F 62a_100000720402_100000210202 [0,2,0,0,0,0|2,0,0]=4 2182 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [0,2,0,0,0,0|0,0,2]=4 2183 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [0,2,0,0,0,0|0,0,2]=4 2184 B13R1.17 COCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000766300 [0,2,0,0,0,0|2,0,0]=4 2185 B13R1.17 CSCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100011218213 [0,2,0,0,0,0|2,0,0]=4 2186 B13R1.17 C[C@H](NCC#N)c1ccc(cc1)O 2230a_100161106496_100011215382 [0,2,0,0,0,0|1,0,1]=4 2187 B13R1.17 C[C@H](NCC=O)c1ccc(cc1)O 2230a_100161106496_200015260668 [0,2,0,0,0,0|2,0,0]=4 2188 B13R1.17 C[C@H](NCCF)c1ccc(cc1)O 2230a_100161106496_100011217306 [0,2,0,0,0,0|2,0,0]=4 2189 B13R1.17 C[C@H](NCCO)c1ccc(cc1)O 2230a_100161106496_100000211926 [0,2,0,0,0,0|2,0,0]=4 2190 B13R1.17 Cc1ccc(cc1)C(C)OCCN 34a_100000210304_100011261388 [0,2,0,0,0,0|2,0,0]=4 2191 B13R1.17 Cc1ccc(cc1)C(O)CNCF 34a_200020610344_100015361967 [0,2,0,0,0,0|1,0,0]=3 2192 B13R1.17 OC(CNCF)c1ccc(cc1)Br 34a_100020626992_100015361967 [0,2,0,0,0,0|1,0,0]=3 2193 B13R1.17 OC(CNCF)c1ccc(cc1)Cl 34a_100000736658_100015361967 [0,2,0,0,0,0|1,0,0]=3 2194 B13R1.17 OC(CSCF)c1ccc(cc1)Cl 62a_100015361967_200011996143 [0,2,0,0,0,0|2,0,0]=4 2195 B13R1.17 OC(CSCF)c1ccc(cc1)Cl 62a_200011996143_100015361967 [0,2,0,0,0,0|2,0,0]=4 2196 B13R1.17 O[C@@H](CSCF)c1ccc(cc1)F 62a_100000720402_100015361967 [0,2,0,0,0,0|2,0,0]=4 2197 B13R1.17 O[C@@H](CSCF)c1ccc(cc1)F 62a_100015361967_100000720402 [0,2,0,0,0,0|2,0,0]=4 2198 B13R1.17 Oc1ccc(cc1)C(O)CNCF 34a_100000067596_100015361967 [0,2,0,0,0,0|0,0,0]=2 2199 B13R1.132 CC(=O)CC(O)c1ccc(cc1)Cl 1458a_100000070787_200011996143 [0,2,0,0,0,0|2,0,0]=4 2200 B13R1.132 CC(=O)C[C@H](O)c1ccc(cc1)F 1458a_100000070787_100000720402 [0,2,0,0,0,0|2,0,0]=4 2201 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)O 271570a_100015190218_100000185759 [0,2,0,0,0,0|2,0,0]=4 2202 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210206 [0,2,0,0,0,0|2,0,0]=4 2203 B13R1.132 CN(C)CC(=O)c1ccc(cc1)O 269982a_100102631434_100009814261 [0,2,0,0,0,0|0,0,2]=4 2204 B13R1.132 CN(C)CC(O)c1ccc(cc1)Cl 2230a_100102631434_200011996143 [0,2,0,0,0,0|1,0,0]=3 2205 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 2230a_100016988945_200000210301 [0,2,0,0,0,0|0,0,0]=2 2206 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 269982a_100016988945_200000210301 [0,2,0,0,0,0|0,0,0]=2 2207 B13R1.132 CN(C)C[C@H](O)c1ccc(cc1)F 2230a_100102631434_100000720402 [0,2,0,0,0,0|1,0,0]=3 2208 B13R1.132 CN(CC(=O)N)c1ccc(cc1)O 269982a_100000182112_100000187820 [0,2,0,0,0,0|2,0,0]=4 2209 B13R1.132 CN(CC(=O)N)c1ccc(cc1)O 34a_100000182112_100000187820 [0,2,0,0,0,0|2,0,0]=4 2210 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 2230a_100016988945_200025704644 [0,2,0,0,0,0|0,0,0]=2 2211 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 269982a_100016988945_200025704644 [0,2,0,0,0,0|0,0,0]=2 2212 B13R1.132 NC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000187820 [0,2,0,0,0,0|0,0,2]=4 2213 B13R1.466 CCNC(C)c1ccc(c(c1)Br)O 269862a_100015525214_100011772453 [0,2,0,0,0,0|2,0,0]=4 2214 B13R1.466 CCNC(C)c1ccc(c(c1)C)O 269862a_100015525214_100000188726 [0,2,0,0,0,0|2,0,0]=4 2215 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)O 269862a_100015525214_100000188625 [0,2,0,0,0,0|2,0,0]=4 2216 B13R1.466 CCNC(C)c1ccc(c(c1)F)O 269862a_100015525214_100000751691 [0,2,0,0,0,0|2,0,0]=4 2217 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)O 7a_106832991635_200010170092 [0,2,0,0,0,0|0,0,2]=4 2218 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [0,2,0,0,0,0|0,0,2]=4 2219 B13R1.466 CNCC(O)c1ccc(c(c1)O)O 34a_100000106456_200000210301 [0,2,0,0,0,0|0,0,0]=2 2220 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 2230a_106832991635_100000761251 [0,2,0,0,0,0|1,0,0]=3 2221 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 34a_100102657272_100000761251 [0,2,0,0,0,0|1,0,0]=3 2222 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 7a_106832991635_100000761251 [0,2,0,0,0,0|1,0,0]=3 2223 B13R1.466 COC[C@@H](O)c1ccc(c(c1)F)F 34a_100138415774_100000761251 [0,2,0,0,0,0|2,0,0]=4 2224 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2225 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_200000210301_100000761251 [0,2,0,0,0,0|2,0,0]=4 2226 B13R1.466 [13CH3]NCC(O)c1ccc(c(c1)O)O 34a_100000106456_200025704644 [0,2,0,0,0,0|0,0,0]=2 2227 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200025704644 [0,2,0,0,0,0|2,0,0]=4 2228 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_200025704644_100000761251 [0,2,0,0,0,0|2,0,0]=4 2229 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 34a_100102657272_100009814262 [0,2,0,0,0,0|0,0,2]=4 2230 B13R1.1511 CNCC(=O)c1ccc(cc1O)O 7a_106832991635_100009814262 [0,2,0,0,0,0|0,0,2]=4 2231 B13R1.1511 CNC[C@@H](O)c1ccc(cc1F)F 2230a_106832991635_100000761269 [0,2,0,0,0,0|1,0,0]=3 2232 B13R1.1511 CNC[C@@H](O)c1ccc(cc1F)F 34a_100102657272_100000761269 [0,2,0,0,0,0|1,0,0]=3 2233 B13R1.1511 CNC[C@@H](O)c1ccc(cc1F)F 7a_106832991635_100000761269 [0,2,0,0,0,0|1,0,0]=3 2234 B13R1.1511 CNC[C@H](O)c1ccc(cc1Cl)Cl 2230a_106832991635_100000761231 [0,2,0,0,0,0|1,0,0]=3 2235 B13R1.1511 CNC[C@H](O)c1ccc(cc1Cl)Cl 34a_100102657272_100000761231 [0,2,0,0,0,0|1,0,0]=3 2236 B13R1.1511 CNC[C@H](O)c1ccc(cc1Cl)Cl 7a_106832991635_100000761231 [0,2,0,0,0,0|1,0,0]=3 2237 B13R1.1511 COC[C@@H](O)c1ccc(cc1F)F 34a_100138415774_100000761269 [0,2,0,0,0,0|2,0,0]=4 2238 B13R1.1511 COC[C@H](O)c1ccc(cc1Cl)Cl 34a_100138415774_100000761231 [0,2,0,0,0,0|2,0,0]=4 2239 B13R1.1511 CSC[C@@H](O)c1ccc(cc1F)F 62a_100000761269_200000210301 [0,2,0,0,0,0|2,0,0]=4 2240 B13R1.1511 CSC[C@@H](O)c1ccc(cc1F)F 62a_200000210301_100000761269 [0,2,0,0,0,0|2,0,0]=4 2241 B13R1.1511 CSC[C@H](O)c1ccc(cc1Cl)Cl 62a_100000761231_200000210301 [0,2,0,0,0,0|2,0,0]=4 2242 B13R1.1511 CSC[C@H](O)c1ccc(cc1Cl)Cl 62a_200000210301_100000761231 [0,2,0,0,0,0|2,0,0]=4 2243 B13R1.1511 [13CH3]SC[C@@H](O)c1ccc(cc1F)F 62a_100000761269_200025704644 [0,2,0,0,0,0|2,0,0]=4 2244 B13R1.1511 [13CH3]SC[C@@H](O)c1ccc(cc1F)F 62a_200025704644_100000761269 [0,2,0,0,0,0|2,0,0]=4 2245 B13R1.1511 [13CH3]SC[C@H](O)c1ccc(cc1Cl)Cl 62a_100000761231_200025704644 [0,2,0,0,0,0|2,0,0]=4 2246 B13R1.1511 [13CH3]SC[C@H](O)c1ccc(cc1Cl)Cl 62a_200025704644_100000761231 [0,2,0,0,0,0|2,0,0]=4 2247 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,2,0,0,0,0|1,0,1]=4 2248 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,2,0,0,0,0|1,0,1]=4 2249 B13R1.525 N[C@@H](c1ccc(cc1)O)C(F)(F)F 271570a_203496583355_100016988356 [0,2,0,0,0,0|2,0,0]=4 2250 B13R1.525 Oc1ccc(cc1)[C@H](O)C(F)(F)F 271570a_203496583355_100010192173 [0,2,0,0,0,0|1,0,0]=3 2251 B11R2.34 Brc1ccc(cc1)C2CC2 271570a_100011220607_100000752885 [1,0,0,1,0,0|2,0,0]=4 2252 B11R2.34 Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186775 [1,0,0,1,0,0|2,0,0]=4 2253 B11R2.34 Clc1ccc(cc1)C2CC2 271570a_100011220607_100000755918 [1,0,0,1,0,0|2,0,0]=4 2254 B11R2.34 Fc1ccc(cc1)C2CC2 271570a_100011220607_100000211213 [1,0,0,1,0,0|2,0,0]=4 2255 B11R2.34 Nc1ccc(cc1)C2CC2 271570a_100011220607_100000185761 [1,0,0,1,0,0|2,0,0]=4 2256 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [1,0,0,1,0,0|1,0,0]=3 2257 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [1,0,0,1,0,0|1,0,0]=3 2258 B11R2.34 Oc1ccc(cn1)C2CC2 271570a_203496583355_200000118129 [1,0,0,1,0,0|2,0,0]=4 2259 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_100011220607_100000685995 [1,0,0,1,0,0|2,0,0]=4 2260 B11R2.34 Oc1ccc(nc1)C2CC2 271570a_203496583355_100009850895 [1,0,0,1,0,0|2,0,0]=4 2261 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [1,0,0,1,0,0|1,0,0]=3 2262 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,0,0,1,0,0|1,0,1]=4 2263 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,0,0,1,0,0|1,0,0]=3 2264 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,0,0,1,0,0|2,0,0]=4 2265 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,0,0,1,0,0|2,0,0]=4 2266 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,0,0,1,0,0|2,0,0]=4 2267 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,0,0,1,0,0|2,0,0]=4 2268 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,0,0,1,0,0|0,0,0]=2 2269 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,0,0,1,0,0|1,0,0]=3 2270 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,0,0,1,0,0|2,0,0]=4 2271 B11R2.36 Oc1ccc2c(n1)CCC2 271570a_203496583355_100000046531 [1,0,0,1,0,0|2,0,0]=4 2272 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,1,0,0|0,0,2]=4 2273 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,0,0,1,0,0|1,0,1]=4 2274 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [1,0,0,1,0,0|2,0,0]=4 2275 B11R2.36 Oc1cnc2c(c1)CCC2 271570a_203496583355_100000693888 [1,0,0,1,0,0|2,0,0]=4 2276 B11R2.36 Oc1cnc2c(c1)NCC2 271570a_203496583355_100000698607 [1,0,0,1,0,0|1,0,0]=3 2277 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,0,0,1,0,0|1,0,1]=4 2278 B13R2.1069 Oc1ccc(cc1)NC2CCC2 34a_100000185829_100000749161 [0,0,0,1,0,1|2,0,0]=4 2279 B13R2.1069 Oc1ccc(cc1)NC2COC2 34a_100000185829_100009818527 [0,0,0,1,0,1|2,0,0]=4 2280 B13R2.1069 Oc1ccc(cn1)OC2CNC2 271570a_203496583355_102515421147 [0,0,0,1,0,1|2,0,0]=4 2281 B13R2.3683 CC1CCc2cc(ccc2N1)O 271570a_203496583355_100010333662 [0,0,0,1,0,1|2,0,0]=4 2282 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,0,0,1,0,1|0,0,2]=4 2283 B13R2.16 C=Cc1ccc(cc1)C2CC2N 271570a_100011290941_100000755575 [0,1,0,1,0,0|2,0,0]=4 2284 B13R2.16 CSc1ccc(cc1)C2CC2N 62a_100000755575_200000210301 [0,1,0,1,0,0|1,1,0]=4 2285 B13R2.16 CSc1ccc(cc1)C2CC2N 62a_200000210301_100000755575 [0,1,0,1,0,0|1,1,0]=4 2286 B13R2.16 [13CH3]Sc1ccc(cc1)C2CC2N 62a_100000755575_200025704644 [0,1,0,1,0,0|1,1,0]=4 2287 B13R2.16 [13CH3]Sc1ccc(cc1)C2CC2N 62a_200025704644_100000755575 [0,1,0,1,0,0|1,1,0]=4 2288 B13R2.2130 C=Cc1ccc2c(c1)CCC2O 271570a_100011290941_100000747877 [0,1,0,1,0,0|2,0,0]=4 2289 B13R2.2130 COc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049672 [0,1,0,1,0,0|1,0,1]=4 2290 B13R2.2130 CSc1ccc2c(c1)CCC2O 62a_100000747877_200000210301 [0,1,0,1,0,0|1,1,0]=4 2291 B13R2.2130 CSc1ccc2c(c1)CCC2O 62a_200000210301_100000747877 [0,1,0,1,0,0|1,1,0]=4 2292 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2O 62a_100000747877_200025704644 [0,1,0,1,0,0|1,1,0]=4 2293 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2O 62a_200025704644_100000747877 [0,1,0,1,0,0|1,1,0]=4 2294 B13R2.102 N#CC1(CC1)c2ccc(cc2)O 271570a_203496583355_100011246087 [0,1,0,1,0,0|2,0,0]=4 2295 B13R2.102 NCC1(CC1)c2ccc(cc2)O 271570a_203496583355_100020622185 [0,1,0,1,0,0|1,0,0]=3 2296 B13R2.102 OCC1(CC1)c2ccc(cc2)O 271570a_203496583355_100010178529 [0,1,0,1,0,0|1,0,0]=3 2297 B13R2.2986 NC1(CCC1)c2ccc(cc2)O 271570a_203496583355_100000746438 [0,1,0,1,0,0|2,0,0]=4 2298 B13R2.2986 Oc1ccc(cc1)C2(CCC2)O 271570a_203496583355_100010132843 [0,1,0,1,0,0|1,0,0]=3 2299 B13R2.2986 Oc1ccc(cc1)C2(COC2)O 271570a_203496583355_100010074357 [0,1,0,1,0,0|1,0,0]=3 2300 B13R2.2986 Oc1ccc(nc1)C2(COC2)O 271570a_203496583355_200010113846 [0,1,0,1,0,0|2,0,0]=4 2301 B13R2.3108 CC1(CNc2c1ncc(c2)O)C 271570a_203496583355_100010744808 [0,1,0,1,0,0|2,0,0]=4 2302 B13R2.12 Oc1ccc(cc1)C2=COCC2 271570a_100000118173_100000185759 [0,1,0,1,0,0|1,0,1]=4 2303 B13R2.12 Oc1ccc(cc1)C2=NCCO2 271570a_203496583355_100009812740 [0,1,0,1,0,0|1,0,1]=4 2304 B13R2.12 Oc1ccc(cc1)C2=NOCC2 271570a_203496583355_100010889492 [0,1,0,1,0,0|1,0,1]=4 2305 B13R2.12 Oc1ccc(cc1)C2CCCN2 271570a_203496583355_100000766735 [0,1,0,1,0,0|2,0,0]=4 2306 B13R2.12 Oc1ccc(cc1)C2OCCO2 271570a_203496583355_100009813560 [0,1,0,1,0,0|1,0,0]=3 2307 B13R2.12 Oc1ccc(nc1)C2OCCO2 271570a_203496583355_100010170810 [0,1,0,1,0,0|2,0,0]=4 2308 B13R2.662 COC1CCc2c1ccc(c2)Br 34a_100000747877_200000210301 [0,1,0,1,0,0|2,0,0]=4 2309 B13R2.662 COC1CCc2c1ccc(c2)Br 7a_100000747877_200000210301 [0,1,0,1,0,0|2,0,0]=4 2310 B13R2.662 COC1CCc2c1ccc(c2)C 34a_100000103036_200000210301 [0,1,0,1,0,0|2,0,0]=4 2311 B13R2.662 COC1CCc2c1ccc(c2)C 7a_100000103036_200000210301 [0,1,0,1,0,0|2,0,0]=4 2312 B13R2.662 COC1CCc2c1ccc(c2)Cl 34a_100012002497_200000210301 [0,1,0,1,0,0|2,0,0]=4 2313 B13R2.662 COC1CCc2c1ccc(c2)Cl 7a_100012002497_200000210301 [0,1,0,1,0,0|2,0,0]=4 2314 B13R2.662 COC1CCc2c1ccc(c2)F 34a_100012002498_200000210301 [0,1,0,1,0,0|2,0,0]=4 2315 B13R2.662 COC1CCc2c1ccc(c2)F 7a_100012002498_200000210301 [0,1,0,1,0,0|2,0,0]=4 2316 B13R2.662 COc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010742842 [0,1,0,1,0,0|1,0,1]=4 2317 B13R2.662 Cc1ccc2c(c1)CCC2O[13CH3] 34a_100000103036_200025704644 [0,1,0,1,0,0|2,0,0]=4 2318 B13R2.662 Cc1ccc2c(c1)CCC2O[13CH3] 7a_100000103036_200025704644 [0,1,0,1,0,0|2,0,0]=4 2319 B13R2.662 N#CC1CCc2c1ccc(c2)O 271570a_203496583355_200012360267 [0,1,0,1,0,0|2,0,0]=4 2320 B13R2.662 OCc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010177469 [0,1,0,1,0,0|1,0,1]=4 2321 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)Br 34a_100000747877_200025704644 [0,1,0,1,0,0|2,0,0]=4 2322 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)Br 7a_100000747877_200025704644 [0,1,0,1,0,0|2,0,0]=4 2323 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)Cl 34a_100012002497_200025704644 [0,1,0,1,0,0|2,0,0]=4 2324 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)Cl 7a_100012002497_200025704644 [0,1,0,1,0,0|2,0,0]=4 2325 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)F 34a_100012002498_200025704644 [0,1,0,1,0,0|2,0,0]=4 2326 B13R2.662 [13CH3]OC1CCc2c1ccc(c2)F 7a_100012002498_200025704644 [0,1,0,1,0,0|2,0,0]=4 2327 B13R2.147 O=C1CC(C1)c2ccc(cc2)O 271570a_203496583355_100000741321 [0,1,0,1,0,0|2,0,0]=4 2328 B13R2.147 Oc1ccc(cc1)C2CC(C2)O 271570a_203496583355_200000751978 [0,1,0,1,0,0|2,0,0]=4 2329 B13R2.520 Oc1ccc(cc1)C(O)C2CC2 271570a_203496583355_100000756592 [0,1,0,1,0,0|1,0,0]=3 2330 B13R2.5179 CN1CCNc2c1ccc(c2)O 271570a_203496583355_100011551014 [0,1,0,1,0,0|2,0,0]=4 2331 B13R2.5179 N[C@@H]1CCOc2c1ccc(c2)O 271570a_203496583355_100020639266 [0,1,0,1,0,0|2,0,0]=4 2332 B13R2.5179 N[C@H]1CCCc2c1ccc(c2)O 271570a_203496583355_100160469487 [0,1,0,1,0,0|2,0,0]=4 2333 B13R2.5179 O=C1CCNc2c1ccc(c2)O 271570a_203496583355_100010157303 [0,1,0,1,0,0|0,0,2]=4 2334 B13R2.5179 Oc1ccc2c(c1)OCCC2O 271570a_203496583355_100012676011 [0,1,0,1,0,0|1,0,0]=3 2335 B13R2.2988 Oc1ccc(cc1)C2CC2(F)F 271570a_203496583355_100010729999 [0,1,0,1,0,0|2,0,0]=4 2336 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,1,0,1,0,0|1,0,1]=4 2337 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [1,0,0,0,1,0|2,0,0]=4 2338 B9R1.7 NCCn1cc(cn1)O 271570a_203496583355_100000730845 [1,0,0,0,1,0|2,0,0]=4 2339 B9R1.35 CC(N)c1cc(cs1)O 271570a_203496583355_100159270200 [1,0,0,0,1,0|2,0,0]=4 2340 B9R1.35 CC(N)c1ccc(s1)O 271570a_203496583355_100102723530 [1,0,0,0,1,0|2,0,0]=4 2341 B11R1.40 CC(CO)Nc1ccccc1 34a_100000106764_100012180447 [1,0,0,0,0,1|2,0,0]=4 2342 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [1,0,0,0,0,1|2,0,0]=4 2343 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [1,0,0,0,0,1|2,0,0]=4 2344 B11R1.40 CC(CO)Sc1ccccc1 62a_100012180447_100000041952 [1,0,0,0,0,1|2,0,0]=4 2345 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [1,0,0,0,0,1|2,0,0]=4 2346 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [1,0,0,0,0,1|2,0,0]=4 2347 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [1,0,0,0,0,1|2,0,0]=4 2348 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [1,0,0,0,0,1|2,0,0]=4 2349 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [1,0,0,0,0,1|2,0,0]=4 2350 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100000719477_100016084084 [1,0,0,0,0,1|2,0,0]=4 2351 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100016084084_100000041952 [1,0,0,0,0,1|2,0,0]=4 2352 B13R1.14 C=CC(O)CNc1ccc(cc1)O 34a_100000185829_100000730141 [0,0,0,0,0,2|1,0,1]=4 2353 B13R1.14 C=CC(O)CSc1ccc(cc1)O 62a_100000730141_100000185759 [0,0,0,0,0,2|1,0,1]=4 2354 B13R1.14 CC(CN)OCc1ccc(cc1)Br 34a_100000210904_100000189115 [0,0,0,0,0,2|2,0,0]=4 2355 B13R1.14 CC(CN)OCc1ccc(cc1)Cl 34a_100000210904_100000694040 [0,0,0,0,0,2|2,0,0]=4 2356 B13R1.14 CC(CN)OCc1ccc(cc1)F 34a_100000210904_100000198546 [0,0,0,0,0,2|2,0,0]=4 2357 B13R1.14 CC(CN)OCc1ccc(cc1)I 34a_100000210904_100000189116 [0,0,0,0,0,2|2,0,0]=4 2358 B13R1.14 CC(CO)NCc1ccc(cc1)O 34a_100000185549_100012180447 [0,0,0,0,0,2|2,0,0]=4 2359 B13R1.14 CCC(C)CNc1ccc(cc1)O 34a_100000185829_100000748023 [0,0,0,0,0,2|2,0,0]=4 2360 B13R1.14 CCC(C)CSc1ccc(cc1)O 62a_100000748023_100000185759 [0,0,0,0,0,2|2,0,0]=4 2361 B13R1.14 CCC(C)NCc1ccc(cc1)O 271570a_203496583355_100015186513 [0,0,0,0,0,2|2,0,0]=4 2362 B13R1.14 CCC(C)NCc1ccc(cc1)O 34a_100000185549_100011215416 [0,0,0,0,0,2|2,0,0]=4 2363 B13R1.14 CCC(O)CNc1ccc(cc1)Br 2230a_100000210018_100011218378 [0,0,0,0,0,2|2,0,0]=4 2364 B13R1.14 CCC(O)CNc1ccc(cc1)Br 34a_100000210018_100011218378 [0,0,0,0,0,2|2,0,0]=4 2365 B13R1.14 CCC(O)CNc1ccc(cc1)C 34a_100000124888_100011218378 [0,0,0,0,0,2|2,0,0]=4 2366 B13R1.14 CCC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011218378 [0,0,0,0,0,2|2,0,0]=4 2367 B13R1.14 CCC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011218378 [0,0,0,0,0,2|2,0,0]=4 2368 B13R1.14 CCC(O)CNc1ccc(cc1)F 34a_100000185862_100011218378 [0,0,0,0,0,2|2,0,0]=4 2369 B13R1.14 CCC(O)CNc1ccc(cc1)I 34a_100000185761_100011218378 [0,0,0,0,0,2|2,0,0]=4 2370 B13R1.14 CCC(O)CNc1ccc(cc1)O 34a_100000185829_100011218378 [0,0,0,0,0,2|1,0,0]=3 2371 B13R1.14 CCC(O)COc1ccc(cc1)Br 34a_100000185759_100011218378 [0,0,0,0,0,2|2,0,0]=4 2372 B13R1.14 CCC(O)COc1ccc(cc1)Br 7a_100000185759_100011218378 [0,0,0,0,0,2|2,0,0]=4 2373 B13R1.14 CCC(O)COc1ccc(cc1)C 34a_100000210336_100011218378 [0,0,0,0,0,2|2,0,0]=4 2374 B13R1.14 CCC(O)COc1ccc(cc1)C 7a_100000210336_100011218378 [0,0,0,0,0,2|2,0,0]=4 2375 B13R1.14 CCC(O)COc1ccc(cc1)Cl 34a_100000210216_100011218378 [0,0,0,0,0,2|2,0,0]=4 2376 B13R1.14 CCC(O)COc1ccc(cc1)Cl 7a_100000210216_100011218378 [0,0,0,0,0,2|2,0,0]=4 2377 B13R1.14 CCC(O)COc1ccc(cc1)F 34a_100000210339_100011218378 [0,0,0,0,0,2|2,0,0]=4 2378 B13R1.14 CCC(O)COc1ccc(cc1)I 34a_100000212066_100011218378 [0,0,0,0,0,2|2,0,0]=4 2379 B13R1.14 CCC(O)COc1ccc(cc1)I 7a_100000212066_100011218378 [0,0,0,0,0,2|2,0,0]=4 2380 B13R1.14 CCC(O)COc1ccc(cc1)N 34a_100000185829_100011218378 [0,0,0,0,0,2|2,0,0]=4 2381 B13R1.14 CCC(O)CSc1ccc(cc1)Br 62a_100000752885_100011218378 [0,0,0,0,0,2|2,0,0]=4 2382 B13R1.14 CCC(O)CSc1ccc(cc1)Br 62a_100011218378_100000752885 [0,0,0,0,0,2|2,0,0]=4 2383 B13R1.14 CCC(O)CSc1ccc(cc1)C 62a_100000186775_100011218378 [0,0,0,0,0,2|2,0,0]=4 2384 B13R1.14 CCC(O)CSc1ccc(cc1)C 62a_100011218378_100000186775 [0,0,0,0,0,2|2,0,0]=4 2385 B13R1.14 CCC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011218378 [0,0,0,0,0,2|2,0,0]=4 2386 B13R1.14 CCC(O)CSc1ccc(cc1)Cl 62a_100011218378_100000755918 [0,0,0,0,0,2|2,0,0]=4 2387 B13R1.14 CCC(O)CSc1ccc(cc1)F 62a_100000211213_100011218378 [0,0,0,0,0,2|2,0,0]=4 2388 B13R1.14 CCC(O)CSc1ccc(cc1)F 62a_100011218378_100000211213 [0,0,0,0,0,2|2,0,0]=4 2389 B13R1.14 CCC(O)CSc1ccc(cc1)N 62a_100000185761_100011218378 [0,0,0,0,0,2|2,0,0]=4 2390 B13R1.14 CCC(O)CSc1ccc(cc1)N 62a_100011218378_100000185761 [0,0,0,0,0,2|2,0,0]=4 2391 B13R1.14 CCC(O)CSc1ccc(cc1)O 62a_100011218378_100000185759 [0,0,0,0,0,2|1,0,0]=3 2392 B13R1.14 CCC(O)CSc1ccc(cn1)O 62a_100000685995_100011218378 [0,0,0,0,0,2|2,0,0]=4 2393 B13R1.14 CCC(O)CSc1ccc(cn1)O 62a_100011218378_100000744096 [0,0,0,0,0,2|2,0,0]=4 2394 B13R1.14 CC[C@H](C)CNc1ccc(cc1)O 34a_100000185829_100009816398 [0,0,0,0,0,2|2,0,0]=4 2395 B13R1.14 CC[C@H](C)CSc1ccc(cc1)O 62a_100009816398_100000185759 [0,0,0,0,0,2|2,0,0]=4 2396 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)O 34a_100000185829_100000059175 [0,0,0,0,0,2|2,0,0]=4 2397 B13R1.14 C[C@@H](CO)CSc1ccc(cc1)O 62a_100000059175_100000185759 [0,0,0,0,0,2|2,0,0]=4 2398 B13R1.14 Cc1ccc(cc1)COC(C)CN 34a_100000210904_100000210814 [0,0,0,0,0,2|2,0,0]=4 2399 B13R1.14 Cc1ccc(cc1)NCC(O)CO 34a_100000124888_100011219619 [0,0,0,0,0,2|2,0,0]=4 2400 B13R1.14 Cc1ccc(cc1)NC[C@@H](O)CF 34a_100000124888_100015614560 [0,0,0,0,0,2|2,0,0]=4 2401 B13R1.14 Cc1ccc(cc1)NC[C@@H](O)CO 34a_100000124888_100009815848 [0,0,0,0,0,2|2,0,0]=4 2402 B13R1.14 Cc1ccc(cc1)OCC(O)CO 34a_100000210336_100011219619 [0,0,0,0,0,2|2,0,0]=4 2403 B13R1.14 Cc1ccc(cc1)OCC(O)CO 7a_100000210336_100011219619 [0,0,0,0,0,2|2,0,0]=4 2404 B13R1.14 Cc1ccc(cc1)OC[C@@H](O)CF 34a_100000210336_100015614560 [0,0,0,0,0,2|2,0,0]=4 2405 B13R1.14 Cc1ccc(cc1)OC[C@@H](O)CF 7a_100000210336_100015614560 [0,0,0,0,0,2|2,0,0]=4 2406 B13R1.14 Cc1ccc(cc1)OC[C@@H](O)CO 34a_100000210336_100009815848 [0,0,0,0,0,2|2,0,0]=4 2407 B13R1.14 Cc1ccc(cc1)OC[C@@H](O)CO 7a_100000210336_100009815848 [0,0,0,0,0,2|2,0,0]=4 2408 B13R1.14 Cc1ccc(cc1)SCC(O)CO 62a_100000186775_100011219619 [0,0,0,0,0,2|2,0,0]=4 2409 B13R1.14 Cc1ccc(cc1)SCC(O)CO 62a_100011219619_100000186775 [0,0,0,0,0,2|2,0,0]=4 2410 B13R1.14 Cc1ccc(cc1)SC[C@@H](O)CF 62a_100000186775_100015614560 [0,0,0,0,0,2|2,0,0]=4 2411 B13R1.14 Cc1ccc(cc1)SC[C@@H](O)CF 62a_100015614560_100000186775 [0,0,0,0,0,2|2,0,0]=4 2412 B13R1.14 Cc1ccc(cc1)SC[C@@H](O)CO 62a_100000186775_100009815848 [0,0,0,0,0,2|2,0,0]=4 2413 B13R1.14 Cc1ccc(cc1)SC[C@@H](O)CO 62a_100009815848_100000186775 [0,0,0,0,0,2|2,0,0]=4 2414 B13R1.14 Nc1ccc(cc1)OCC(O)CO 34a_100000185829_100011219619 [0,0,0,0,0,2|2,0,0]=4 2415 B13R1.14 Nc1ccc(cc1)OC[C@@H](O)CF 34a_100000185829_100015614560 [0,0,0,0,0,2|2,0,0]=4 2416 B13R1.14 Nc1ccc(cc1)OC[C@@H](O)CO 34a_100000185829_100009815848 [0,0,0,0,0,2|2,0,0]=4 2417 B13R1.14 Nc1ccc(cc1)SCC(O)CO 62a_100000185761_100011219619 [0,0,0,0,0,2|2,0,0]=4 2418 B13R1.14 Nc1ccc(cc1)SCC(O)CO 62a_100011219619_100000185761 [0,0,0,0,0,2|2,0,0]=4 2419 B13R1.14 Nc1ccc(cc1)SC[C@@H](O)CF 62a_100000185761_100015614560 [0,0,0,0,0,2|2,0,0]=4 2420 B13R1.14 Nc1ccc(cc1)SC[C@@H](O)CF 62a_100015614560_100000185761 [0,0,0,0,0,2|2,0,0]=4 2421 B13R1.14 Nc1ccc(cc1)SC[C@@H](O)CO 62a_100000185761_100009815848 [0,0,0,0,0,2|2,0,0]=4 2422 B13R1.14 Nc1ccc(cc1)SC[C@@H](O)CO 62a_100009815848_100000185761 [0,0,0,0,0,2|2,0,0]=4 2423 B13R1.14 OCC(O)CNc1ccc(cc1)Br 2230a_100000210018_100011219619 [0,0,0,0,0,2|2,0,0]=4 2424 B13R1.14 OCC(O)CNc1ccc(cc1)Br 34a_100000210018_100011219619 [0,0,0,0,0,2|2,0,0]=4 2425 B13R1.14 OCC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011219619 [0,0,0,0,0,2|2,0,0]=4 2426 B13R1.14 OCC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011219619 [0,0,0,0,0,2|2,0,0]=4 2427 B13R1.14 OCC(O)CNc1ccc(cc1)F 34a_100000185862_100011219619 [0,0,0,0,0,2|2,0,0]=4 2428 B13R1.14 OCC(O)CNc1ccc(cc1)I 34a_100000185761_100011219619 [0,0,0,0,0,2|2,0,0]=4 2429 B13R1.14 OCC(O)CNc1ccc(cc1)O 34a_100000185829_100011219619 [0,0,0,0,0,2|1,0,0]=3 2430 B13R1.14 OCC(O)COc1ccc(cc1)Br 34a_100000185759_100011219619 [0,0,0,0,0,2|2,0,0]=4 2431 B13R1.14 OCC(O)COc1ccc(cc1)Br 7a_100000185759_100011219619 [0,0,0,0,0,2|2,0,0]=4 2432 B13R1.14 OCC(O)COc1ccc(cc1)Cl 34a_100000210216_100011219619 [0,0,0,0,0,2|2,0,0]=4 2433 B13R1.14 OCC(O)COc1ccc(cc1)Cl 7a_100000210216_100011219619 [0,0,0,0,0,2|2,0,0]=4 2434 B13R1.14 OCC(O)COc1ccc(cc1)F 34a_100000210339_100011219619 [0,0,0,0,0,2|2,0,0]=4 2435 B13R1.14 OCC(O)COc1ccc(cc1)I 34a_100000212066_100011219619 [0,0,0,0,0,2|2,0,0]=4 2436 B13R1.14 OCC(O)COc1ccc(cc1)I 7a_100000212066_100011219619 [0,0,0,0,0,2|2,0,0]=4 2437 B13R1.14 OCC(O)CSc1ccc(cc1)Br 62a_100000752885_100011219619 [0,0,0,0,0,2|2,0,0]=4 2438 B13R1.14 OCC(O)CSc1ccc(cc1)Br 62a_100011219619_100000752885 [0,0,0,0,0,2|2,0,0]=4 2439 B13R1.14 OCC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011219619 [0,0,0,0,0,2|2,0,0]=4 2440 B13R1.14 OCC(O)CSc1ccc(cc1)Cl 62a_100011219619_100000755918 [0,0,0,0,0,2|2,0,0]=4 2441 B13R1.14 OCC(O)CSc1ccc(cc1)F 62a_100000211213_100011219619 [0,0,0,0,0,2|2,0,0]=4 2442 B13R1.14 OCC(O)CSc1ccc(cc1)F 62a_100011219619_100000211213 [0,0,0,0,0,2|2,0,0]=4 2443 B13R1.14 OCC(O)CSc1ccc(cc1)O 62a_100011219619_100000185759 [0,0,0,0,0,2|1,0,0]=3 2444 B13R1.14 OCC(O)CSc1ccc(cn1)O 62a_100000685995_100011219619 [0,0,0,0,0,2|2,0,0]=4 2445 B13R1.14 OCC(O)CSc1ccc(cn1)O 62a_100011219619_100000744096 [0,0,0,0,0,2|2,0,0]=4 2446 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Br 2230a_100000210018_100009815848 [0,0,0,0,0,2|2,0,0]=4 2447 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Br 34a_100000210018_100009815848 [0,0,0,0,0,2|2,0,0]=4 2448 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Cl 2230a_100000210052_100009815848 [0,0,0,0,0,2|2,0,0]=4 2449 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Cl 34a_100000210052_100009815848 [0,0,0,0,0,2|2,0,0]=4 2450 B13R1.14 OC[C@H](O)CNc1ccc(cc1)F 34a_100000185862_100009815848 [0,0,0,0,0,2|2,0,0]=4 2451 B13R1.14 OC[C@H](O)CNc1ccc(cc1)I 34a_100000185761_100009815848 [0,0,0,0,0,2|2,0,0]=4 2452 B13R1.14 OC[C@H](O)CNc1ccc(cc1)O 34a_100000185829_100009815848 [0,0,0,0,0,2|1,0,0]=3 2453 B13R1.14 OC[C@H](O)COc1ccc(cc1)Br 34a_100000185759_100009815848 [0,0,0,0,0,2|2,0,0]=4 2454 B13R1.14 OC[C@H](O)COc1ccc(cc1)Br 7a_100000185759_100009815848 [0,0,0,0,0,2|2,0,0]=4 2455 B13R1.14 OC[C@H](O)COc1ccc(cc1)Cl 34a_100000210216_100009815848 [0,0,0,0,0,2|2,0,0]=4 2456 B13R1.14 OC[C@H](O)COc1ccc(cc1)Cl 7a_100000210216_100009815848 [0,0,0,0,0,2|2,0,0]=4 2457 B13R1.14 OC[C@H](O)COc1ccc(cc1)F 34a_100000210339_100009815848 [0,0,0,0,0,2|2,0,0]=4 2458 B13R1.14 OC[C@H](O)COc1ccc(cc1)I 34a_100000212066_100009815848 [0,0,0,0,0,2|2,0,0]=4 2459 B13R1.14 OC[C@H](O)COc1ccc(cc1)I 7a_100000212066_100009815848 [0,0,0,0,0,2|2,0,0]=4 2460 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Br 62a_100000752885_100009815848 [0,0,0,0,0,2|2,0,0]=4 2461 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Br 62a_100009815848_100000752885 [0,0,0,0,0,2|2,0,0]=4 2462 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Cl 62a_100000755918_100009815848 [0,0,0,0,0,2|2,0,0]=4 2463 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Cl 62a_100009815848_100000755918 [0,0,0,0,0,2|2,0,0]=4 2464 B13R1.14 OC[C@H](O)CSc1ccc(cc1)F 62a_100000211213_100009815848 [0,0,0,0,0,2|2,0,0]=4 2465 B13R1.14 OC[C@H](O)CSc1ccc(cc1)F 62a_100009815848_100000211213 [0,0,0,0,0,2|2,0,0]=4 2466 B13R1.14 OC[C@H](O)CSc1ccc(cc1)O 62a_100009815848_100000185759 [0,0,0,0,0,2|1,0,0]=3 2467 B13R1.14 OC[C@H](O)CSc1ccc(cn1)O 62a_100000685995_100009815848 [0,0,0,0,0,2|2,0,0]=4 2468 B13R1.14 OC[C@H](O)CSc1ccc(cn1)O 62a_100009815848_100000744096 [0,0,0,0,0,2|2,0,0]=4 2469 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)Br 2230a_100000210018_100015614560 [0,0,0,0,0,2|2,0,0]=4 2470 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)Br 34a_100000210018_100015614560 [0,0,0,0,0,2|2,0,0]=4 2471 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)Cl 2230a_100000210052_100015614560 [0,0,0,0,0,2|2,0,0]=4 2472 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)Cl 34a_100000210052_100015614560 [0,0,0,0,0,2|2,0,0]=4 2473 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)F 34a_100000185862_100015614560 [0,0,0,0,0,2|2,0,0]=4 2474 B13R1.14 O[C@@H](CF)CNc1ccc(cc1)I 34a_100000185761_100015614560 [0,0,0,0,0,2|2,0,0]=4 2475 B13R1.14 O[C@@H](CF)COc1ccc(cc1)Br 34a_100000185759_100015614560 [0,0,0,0,0,2|2,0,0]=4 2476 B13R1.14 O[C@@H](CF)COc1ccc(cc1)Br 7a_100000185759_100015614560 [0,0,0,0,0,2|2,0,0]=4 2477 B13R1.14 O[C@@H](CF)COc1ccc(cc1)Cl 34a_100000210216_100015614560 [0,0,0,0,0,2|2,0,0]=4 2478 B13R1.14 O[C@@H](CF)COc1ccc(cc1)Cl 7a_100000210216_100015614560 [0,0,0,0,0,2|2,0,0]=4 2479 B13R1.14 O[C@@H](CF)COc1ccc(cc1)F 34a_100000210339_100015614560 [0,0,0,0,0,2|2,0,0]=4 2480 B13R1.14 O[C@@H](CF)COc1ccc(cc1)I 34a_100000212066_100015614560 [0,0,0,0,0,2|2,0,0]=4 2481 B13R1.14 O[C@@H](CF)COc1ccc(cc1)I 7a_100000212066_100015614560 [0,0,0,0,0,2|2,0,0]=4 2482 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)Br 62a_100000752885_100015614560 [0,0,0,0,0,2|2,0,0]=4 2483 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)Br 62a_100015614560_100000752885 [0,0,0,0,0,2|2,0,0]=4 2484 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)Cl 62a_100000755918_100015614560 [0,0,0,0,0,2|2,0,0]=4 2485 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)Cl 62a_100015614560_100000755918 [0,0,0,0,0,2|2,0,0]=4 2486 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)F 62a_100000211213_100015614560 [0,0,0,0,0,2|2,0,0]=4 2487 B13R1.14 O[C@@H](CF)CSc1ccc(cc1)F 62a_100015614560_100000211213 [0,0,0,0,0,2|2,0,0]=4 2488 B13R1.14 Oc1ccc(cc1)NC[C@@H](O)CF 34a_100000185829_100015614560 [0,0,0,0,0,2|1,0,0]=3 2489 B13R1.14 Oc1ccc(cc1)SC[C@@H](O)CF 62a_100015614560_100000185759 [0,0,0,0,0,2|1,0,0]=3 2490 B13R1.14 Oc1ccc(nc1)SC[C@@H](O)CF 62a_100000685995_100015614560 [0,0,0,0,0,2|2,0,0]=4 2491 B13R1.14 Oc1ccc(nc1)SC[C@@H](O)CF 62a_100015614560_100000744096 [0,0,0,0,0,2|2,0,0]=4