0 B11R1.23 CC(N[13CH3])c1cccc(c1)Br 2230a_100020642005_200025704644 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 2230a_100102723534_200025704644 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 34a_100102723534_200025704644 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [0,0,0,0,0,0|1,0,2]=3 19 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [0,0,0,0,0,0|1,0,2]=3 20 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000219648_100000210202 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000738899_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000219648_100000204670 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000738899_200000210301 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000219648_100000210202 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000738899_200000210301 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.23 CCN(C)c1cccc(c1)Cl 2230a_100000220044_100000210202 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.23 CCN(C)c1cccc(c1)Cl 269982a_100000220044_100000204670 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.23 CCN(C)c1cccc(c1)Cl 34a_100000220044_100000210202 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.23 CCN(C)c1cccc(c1)F 2230a_100020633736_100000210202 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.23 CCN(C)c1cccc(c1)F 269982a_100020633736_100000204670 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.23 CCN(C)c1cccc(c1)F 34a_100020633736_100000210202 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.23 CCN(C)c1cccc(c1)I 2230a_100000221217_100000210202 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.23 CCN(C)c1cccc(c1)I 269982a_100000221217_100000204670 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.23 CCN(C)c1cccc(c1)I 34a_100000221217_100000210202 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [0,0,0,0,0,0|3,0,0]=3 49 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.23 CCN([13CH3])c1cccc(c1)Br 2230a_100000738899_200025704644 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.23 CCN([13CH3])c1cccc(c1)Br 269982a_100000738899_200025704644 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.23 CCN([13CH3])c1cccc(c1)Br 34a_100000738899_200025704644 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [0,0,0,0,0,0|2,0,0]=2 61 B11R1.23 CN(CF)c1cccc(c1)Br 269982a_100000219648_100015361967 [0,0,0,0,0,0|4,0,0]=4 62 B11R1.23 CN(CF)c1cccc(c1)Br 34a_100000219648_100015361967 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.23 CN(CF)c1cccc(c1)Cl 269982a_100000220044_100015361967 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.23 CN(CF)c1cccc(c1)Cl 34a_100000220044_100015361967 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.23 CN(CF)c1cccc(c1)F 269982a_100020633736_100015361967 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.23 CN(CF)c1cccc(c1)F 34a_100020633736_100015361967 [0,0,0,0,0,0|4,0,0]=4 67 B11R1.23 CN(CF)c1cccc(c1)I 269982a_100000221217_100015361967 [0,0,0,0,0,0|4,0,0]=4 68 B11R1.23 CN(CF)c1cccc(c1)I 34a_100000221217_100015361967 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.23 CN(CF)c1cccc(c1)O 269982a_100000756613_100015361967 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.23 CN(CF)c1cccc(c1)O 34a_100000756613_100015361967 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [0,0,0,0,0,0|2,0,2]=4 72 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [0,0,0,0,0,0|2,0,2]=4 73 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [0,0,0,0,0,0|2,0,2]=4 74 B11R1.23 CNC(C)c1cccc(c1)Br 2230a_100020642005_200000210301 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.23 CNC(C)c1cccc(c1)Br 269862a_106832991636_100000210093 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.23 CNC(C)c1cccc(c1)Cl 2230a_100102723534_200000210301 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.23 CNC(C)c1cccc(c1)Cl 269862a_106832991636_200000210964 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.23 CNC(C)c1cccc(c1)Cl 34a_100102723534_200000210301 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.23 CNC(C)c1cccc(c1)F 269862a_106832991636_100000187083 [0,0,0,0,0,0|4,0,0]=4 81 B11R1.23 CNC(C)c1cccc(c1)I 269862a_106832991636_100011356966 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [0,0,0,0,0,0|3,0,0]=3 84 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [0,0,0,0,0,0|3,0,0]=3 85 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [0,0,0,0,0,0|4,0,0]=4 86 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.23 CN[C@H](C)c1cccc(c1)F 2230a_100015193778_200000210301 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.23 CN[C@H](C)c1cccc(c1)F 34a_100015193778_200000210301 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [0,0,0,0,0,0|2,0,2]=4 90 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [0,0,0,0,0,0|4,0,0]=4 91 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [0,0,0,0,0,0|4,0,0]=4 92 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [0,0,0,0,0,0|4,0,0]=4 93 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [0,0,0,0,0,0|4,0,0]=4 94 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [0,0,0,0,0,0|4,0,0]=4 95 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [0,0,0,0,0,0|4,0,0]=4 97 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [0,0,0,0,0,0|4,0,0]=4 98 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [0,0,0,0,0,0|4,0,0]=4 99 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [0,0,0,0,0,0|4,0,0]=4 100 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [0,0,0,0,0,0|4,0,0]=4 102 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 2230a_100015193778_200025704644 [0,0,0,0,0,0|4,0,0]=4 103 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 34a_100015193778_200025704644 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [0,0,0,0,0,0|4,0,0]=4 105 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [0,0,0,0,0,0|2,0,2]=4 107 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [0,0,0,0,0,0|4,0,0]=4 108 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [0,0,0,0,0,0|4,0,0]=4 109 B11R1.23 Cc1cccc(c1)N(C)CF 269982a_100000219674_100015361967 [0,0,0,0,0,0|4,0,0]=4 110 B11R1.23 Cc1cccc(c1)N(C)CF 34a_100000219674_100015361967 [0,0,0,0,0,0|4,0,0]=4 111 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [0,0,0,0,0,0|4,0,0]=4 112 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [0,0,0,0,0,0|0,0,4]=4 114 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [0,0,0,0,0,0|2,0,0]=2 115 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [0,0,0,0,0,0|0,0,2]=2 116 B11R1.23 NNC(=O)c1cc(ccn1)O 271570a_203496583355_100000017052 [0,0,0,0,0,0|2,0,2]=4 117 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [0,0,0,0,0,0|1,0,2]=3 118 B11R1.23 NNC(=O)c1cccc(n1)O 271570a_203496583355_100011631096 [0,0,0,0,0,0|2,0,2]=4 119 B11R1.23 NNC(=O)c1ccnc(c1)O 271570a_203496583355_100000021280 [0,0,0,0,0,0|2,0,2]=4 120 B11R1.23 NNC(=O)c1cncc(c1)O 271570a_203496583355_100000189809 [0,0,0,0,0,0|2,0,2]=4 121 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [0,0,0,0,0,0|2,0,2]=4 122 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [0,0,0,0,0,0|2,0,2]=4 123 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [0,0,0,0,0,0|2,0,2]=4 124 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [0,0,0,0,0,0|2,0,2]=4 125 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [0,0,0,0,0,0|1,0,2]=3 126 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [0,0,0,0,0,0|1,0,3]=4 127 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,0,0,0,0,0|1,0,2]=4 128 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,0,0,0,0|1,0,1]=3 129 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,0,0,0,0,0|1,0,2]=4 130 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,0,0,0,0|1,0,2]=4 131 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,0,0,0,0,0|1,0,0]=2 132 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,0,0,0,0,0|2,0,0]=3 139 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,0,0,0,0,0|2,0,0]=3 140 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [1,0,0,0,0,0|3,0,0]=4 141 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,0,0,0,0,0|2,0,0]=3 154 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,0,0,0,0,0|2,0,0]=3 169 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,0,0,0,0,0|2,0,0]=3 170 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,0,0,0,0,0|2,1,0]=4 171 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,0,0,0,0,0|2,1,0]=4 172 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,0,0,0,0,0|3,0,0]=4 194 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,0,0,0,0,0|3,0,0]=4 196 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,0,0,0,0,0|3,0,0]=4 210 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,0,0,0,0,0|2,0,0]=3 212 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,0,0,0,0,0|2,0,0]=3 213 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,0,0,0,0,0|2,0,0]=3 214 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,0,0,0,0,0|2,0,0]=3 215 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,0,0,0,0,0|2,0,0]=3 216 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,0,0,0,0,0|2,0,0]=3 217 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,0,0,0,0,0|2,0,0]=3 218 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,0,0,0,0,0|2,0,0]=3 219 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [1,0,0,0,0,0|3,0,0]=4 220 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,0,0,0,0,0|3,0,0]=4 232 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,0,0,0,0,0|3,0,0]=4 234 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,0,0,0,0,0|3,0,0]=4 235 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,0,0,0,0,0|3,0,0]=4 238 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,0,0,0,0,0|3,0,0]=4 239 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,0,0,0,0,0|2,0,0]=3 241 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,0,0,0,0,0|3,0,0]=4 244 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,0,0,0,0,0|3,0,0]=4 246 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,0,0,0,0,0|3,0,0]=4 248 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,0,0,0,0,0|2,0,0]=3 253 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,0,0,0,0,0|2,0,0]=3 254 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,0,0,0,0,0|3,0,0]=4 256 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,0,0,0,0,0|3,0,0]=4 258 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.10 FCNc1cccc(c1)Br 34a_100000210019_100015361967 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.10 FCNc1cccc(c1)Cl 34a_100000185859_100015361967 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.10 FCNc1cccc(c1)F 34a_100000210047_100015361967 [1,0,0,0,0,0|3,0,0]=4 268 B10R1.10 FCNc1cccc(c1)I 34a_100000211102_100015361967 [1,0,0,0,0,0|3,0,0]=4 269 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [1,0,0,0,0,0|3,0,0]=4 270 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [1,0,0,0,0,0|3,0,0]=4 271 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [1,0,0,0,0,0|3,0,0]=4 272 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [1,0,0,0,0,0|3,0,0]=4 273 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [1,0,0,0,0,0|3,0,0]=4 274 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [1,0,0,0,0,0|3,0,0]=4 275 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [1,0,0,0,0,0|3,0,0]=4 276 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [1,0,0,0,0,0|3,0,0]=4 277 B10R1.10 FCSc1cccc(c1)Br 62a_100000691529_100015361967 [1,0,0,0,0,0|3,0,0]=4 278 B10R1.10 FCSc1cccc(c1)Br 62a_100015361967_100000691529 [1,0,0,0,0,0|3,0,0]=4 279 B10R1.10 FCSc1cccc(c1)Cl 62a_100000699651_100015361967 [1,0,0,0,0,0|3,0,0]=4 280 B10R1.10 FCSc1cccc(c1)Cl 62a_100015361967_100000699651 [1,0,0,0,0,0|3,0,0]=4 281 B10R1.10 FCSc1cccc(c1)F 62a_100000685547_100015361967 [1,0,0,0,0,0|3,0,0]=4 282 B10R1.10 FCSc1cccc(c1)F 62a_100015361967_100000685547 [1,0,0,0,0,0|3,0,0]=4 283 B10R1.10 FCSc1cccc(c1)[S] 62a_100015361967_114929384022 [1,0,0,0,0,0|2,1,0]=4 284 B10R1.10 FCSc1cccc(c1)[S] 62a_114929384022_100015361967 [1,0,0,0,0,0|2,1,0]=4 285 B10R1.10 N#CCc1cc(ccn1)O 271570a_203496583355_100009875060 [1,0,0,0,0,0|1,0,2]=4 286 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,0,0,0,0,0|0,0,2]=3 287 B10R1.10 N#CCc1cccc(n1)O 271570a_203496583355_100000727631 [1,0,0,0,0,0|1,0,2]=4 288 B10R1.10 N#CCc1ccnc(c1)O 271570a_203496583355_100009819943 [1,0,0,0,0,0|1,0,2]=4 289 B10R1.10 N#CCc1cncc(c1)O 271570a_203496583355_100015508350 [1,0,0,0,0,0|1,0,2]=4 290 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,0,0,0,0,0|0,0,0]=1 291 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,0,0,0,0,0|1,0,0]=2 292 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [1,0,0,0,0,0|3,0,0]=4 293 B10R1.10 Nc1cccc(c1)SCF 62a_100000210019_100015361967 [1,0,0,0,0,0|3,0,0]=4 294 B10R1.10 Nc1cccc(c1)SCF 62a_100015361967_100000210019 [1,0,0,0,0,0|3,0,0]=4 295 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,0,0,0,0,0|1,0,1]=3 296 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,0,0,0,0,0|1,0,0]=2 297 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [1,0,0,0,0,0|2,0,0]=3 298 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,0,0,0,0,0|2,0,0]=3 299 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [1,0,0,0,0,0|2,0,0]=3 300 B10R1.10 Oc1ccnc(c1)SCF 62a_100015361967_100000762945 [1,0,0,0,0,0|3,0,0]=4 301 B10R1.10 Oc1cncc(c1)SCF 62a_100000754920_100015361967 [1,0,0,0,0,0|3,0,0]=4 302 B10R1.10 Oc1cncc(c1)SCF 62a_100015361967_100000754920 [1,0,0,0,0,0|3,0,0]=4 303 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,0,0,0,0,0|3,0,0]=4 304 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,0,0,0,0,0|3,0,0]=4 305 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,0,0,0,0,0|3,0,0]=4 306 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,0,0,0,0,0|3,0,0]=4 307 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,0,0,0,0,0|3,0,0]=4 308 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,0,0,0,0,0|3,0,0]=4 309 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,0,0,0,0,0|3,0,0]=4 310 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,0,0,0,0,0|3,0,0]=4 311 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,0,0,0,0,0|2,0,0]=3 312 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,0,0,0,0,0|2,0,0]=3 313 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,0,0,0,0,0|3,0,0]=4 314 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,0,0,0,0,0|3,0,0]=4 315 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,0,0,0,0,0|3,0,0]=4 316 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,0,0,0,0,0|3,0,0]=4 317 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,0,0,0,0,0|3,0,0]=4 318 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,0,0,0,0,0|3,0,0]=4 319 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,0,0,0,0,0|3,0,0]=4 320 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,0,0,0,0,0|3,0,0]=4 321 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,0,0,0,0,0|3,0,0]=4 322 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,0,0,0,0,0|3,0,0]=4 323 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,0,0,0,0,0|3,0,0]=4 324 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,0,0,0,0,0|3,0,0]=4 325 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,0,0,0,0,0|3,0,0]=4 326 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,0,0,0,0,0|3,0,0]=4 329 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,0,0,0,0,0|3,0,0]=4 330 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,0,0,0,0,0|2,0,0]=3 331 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,0,0,0,0,0|2,0,0]=3 332 B10R1.10 [N-]=[N+]=Nc1cccc(c1)O 271570a_203496583355_100000735707 [1,0,0,0,0,0|2,0,1]=4 333 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,0,0,0,0,0|3,0,0]=4 335 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,0,0,0,0,0|1,0,2]=4 336 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 337 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 338 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 340 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,0,0,0,0,0|3,0,0]=4 352 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,0,0,0,0,0|3,0,0]=4 353 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,0,0,0,0,0|3,0,0]=4 354 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,0,0,0,0,0|3,0,0]=4 355 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,0,0,0,0,0|3,0,0]=4 356 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,0,0,0,0,0|3,0,0]=4 357 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,0,0,0,0,0|3,0,0]=4 358 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,0,0,0,0,0|3,0,0]=4 359 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,0,0,0,0,0|3,0,0]=4 360 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,0,0,0,0,0|1,0,2]=4 361 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [1,0,0,0,0,0|2,0,1]=4 362 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,0,0,0,0,0|2,0,1]=4 363 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,0,0,0,0,0|2,0,1]=4 364 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,0,0,0,0,0|2,0,1]=4 365 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,0,0,0,0,0|2,0,1]=4 366 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,0,0,0,0,0|2,0,1]=4 367 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,0,0,0,0,0|1,0,1]=3 368 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,0,0,0,0,0|1,0,1]=3 369 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,0,0,0,0,0|1,1,1]=4 370 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [1,0,0,0,0,0|2,0,1]=4 371 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [1,0,0,0,0,0|2,0,1]=4 372 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [1,0,0,0,0,0|1,0,2]=4 373 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,0,0,0,0,0|1,0,2]=4 374 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,0,0,0,0,0|1,0,2]=4 375 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,0,0,0,0,0|1,0,2]=4 376 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,0,0,0,0,0|1,0,2]=4 377 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,0,0,0,0,0|1,0,2]=4 378 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,0,0,0,0,0|0,0,2]=3 379 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,0,0,0,0,0|0,0,2]=3 380 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [1,0,0,0,0,0|1,0,2]=4 381 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,0,0,0,0,0|1,0,2]=4 382 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [1,0,0,0,0,0|1,0,2]=4 383 B10R1.113 CC(C)c1cc(ccn1)O 271570a_203496583355_100010237922 [1,0,0,0,0,0|2,0,0]=3 384 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,0,0,0,0,0|1,0,0]=2 385 B10R1.113 CC(C)c1cccc(n1)O 271570a_203496583355_100012318657 [1,0,0,0,0,0|2,0,0]=3 386 B10R1.113 CC(C)c1ccnc(c1)O 271570a_203496583355_100010237925 [1,0,0,0,0,0|2,0,0]=3 387 B10R1.113 CC(C)c1ccnc(n1)O 271570a_203496583355_100011935126 [1,0,0,0,0,0|3,0,0]=4 388 B10R1.113 CC(C)c1cncc(c1)O 271570a_203496583355_200010191214 [1,0,0,0,0,0|2,0,0]=3 389 B10R1.113 CC(C)c1cncc(n1)O 271570a_203496583355_100012056704 [1,0,0,0,0,0|3,0,0]=4 390 B10R1.113 CC(C)c1nccc(n1)O 271570a_203496583355_100000752938 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,0,0,0,0,0|1,0,0]=2 392 B10R1.113 CC(N)c1cccc(n1)O 271570a_203496583355_200010173468 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.113 CC(O)c1cc(ccn1)O 271570a_203496583355_100000144657 [1,0,0,0,0,0|1,0,0]=2 394 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,0,0,0,0,0|0,0,0]=1 395 B10R1.113 CC(O)c1cccc(n1)O 271570a_203496583355_100009820884 [1,0,0,0,0,0|1,0,0]=2 396 B10R1.113 CC(O)c1cncc(c1)O 271570a_203496583355_100012351597 [1,0,0,0,0,0|1,0,0]=2 397 B10R1.113 CN(C)c1cc(ccn1)O 271570a_203496583355_100012361627 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 402 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 405 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 406 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 407 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 409 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 410 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,0,0,0,0,0|2,0,0]=3 411 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,0,0,0,0,0|2,0,0]=3 412 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,0,0,0,0,0|2,0,0]=3 413 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.113 CN(C)c1cccc(n1)O 271570a_203496583355_100011960435 [1,0,0,0,0,0|3,0,0]=4 415 B10R1.113 CN(C)c1ccnc(c1)O 271570a_203496583355_100000766659 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.113 CN(C)c1cncc(c1)O 271570a_203496583355_100012350714 [1,0,0,0,0,0|3,0,0]=4 417 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 418 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 421 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 422 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 423 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 424 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,0,0,0,0,0|2,0,0]=3 430 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,0,0,0,0,0|2,0,0]=3 432 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,0,0,0,0,0|1,0,1]=3 433 B10R1.113 C[C@@H](N)c1cncc(c1)O 271570a_203496583355_100012350620 [1,0,0,0,0,0|2,0,0]=3 434 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,0,0,0,0,0|1,0,2]=4 435 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [1,0,0,0,0,0|3,0,0]=4 436 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [1,0,0,0,0,0|3,0,0]=4 437 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [1,0,0,0,0,0|3,0,0]=4 438 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [1,0,0,0,0,0|1,0,2]=4 442 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,0,0,0,0,0|0,0,2]=3 443 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [1,0,0,0,0,0|1,0,2]=4 444 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,0,0,0,0,0|1,0,2]=4 445 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [1,0,0,0,0,0|1,0,2]=4 446 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.113 OB(O)c1cccc(n1)O 271570a_203496583355_100000117343 [1,0,0,0,0,0|3,0,0]=4 448 B10R1.113 OB(O)c1ccnc(c1)O 271570a_203496583355_100000049459 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.113 OB(O)c1cncc(c1)O 271570a_203496583355_200009814628 [1,0,0,0,0,0|3,0,0]=4 450 B10R1.113 Oc1cc(ccn1)C(F)F 271570a_203496583355_100010180920 [1,0,0,0,0,0|3,0,0]=4 451 B10R1.113 Oc1cccc(c1)C(F)F 271570a_203496583355_100009892619 [1,0,0,0,0,0|2,0,0]=3 452 B10R1.113 Oc1cccc(n1)C(F)F 271570a_203496583355_100010208565 [1,0,0,0,0,0|3,0,0]=4 453 B10R1.113 Oc1ccnc(c1)C(F)F 271570a_203496583355_100010136062 [1,0,0,0,0,0|3,0,0]=4 454 B10R1.113 Oc1cncc(c1)C(F)F 271570a_203496583355_100000694488 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,0,0,0,0,0|1,0,2]=4 456 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,0,0,0,0,0|1,0,2]=4 457 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,0,0,0,0,0|1,0,2]=4 458 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,0,0,0,0,0|1,0,2]=4 459 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,0,0,0,0,0|0,0,2]=3 460 B12R1.10 CC(C)(C#N)c1cccc(c1)O 271570a_203496583355_100011389682 [0,1,0,0,0,0|1,0,2]=4 461 B12R1.10 CC(C)(CN)c1cccc(c1)O 271570a_203496583355_100000749542 [0,1,0,0,0,0|1,0,0]=2 462 B12R1.10 CC(C)(CO)c1cccc(c1)O 271570a_203496583355_200010233077 [0,1,0,0,0,0|2,0,0]=3 463 B12R1.10 CCS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815775 [0,1,0,0,0,0|2,0,1]=4 464 B12R1.13 CCC(NC)c1cccc(c1)Br 269862a_106832991636_100000211677 [0,1,0,0,0,0|3,0,0]=4 465 B12R1.13 CCC(NC)c1cccc(c1)C 269862a_106832991636_100000730664 [0,1,0,0,0,0|3,0,0]=4 466 B12R1.13 CCC(NC)c1cccc(c1)Cl 2230a_100000737531_200000210301 [0,1,0,0,0,0|3,0,0]=4 467 B12R1.13 CCC(NC)c1cccc(c1)Cl 269862a_106832991636_100000211052 [0,1,0,0,0,0|3,0,0]=4 468 B12R1.13 CCC(NC)c1cccc(c1)Cl 34a_100000737531_200000210301 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.13 CCC(NC)c1cccc(c1)F 2230a_100159265421_200000210301 [0,1,0,0,0,0|3,0,0]=4 470 B12R1.13 CCC(NC)c1cccc(c1)F 269862a_106832991636_100000687998 [0,1,0,0,0,0|3,0,0]=4 471 B12R1.13 CCC(NC)c1cccc(c1)F 34a_100159265421_200000210301 [0,1,0,0,0,0|3,0,0]=4 472 B12R1.13 CCC(NC)c1cccc(c1)O 2230a_100159312145_200000210301 [0,1,0,0,0,0|2,0,0]=3 473 B12R1.13 CCC(NC)c1cccc(c1)O 269862a_106832991636_100011996911 [0,1,0,0,0,0|2,0,0]=3 474 B12R1.13 CCC(NC)c1cccc(c1)O 34a_100159312145_200000210301 [0,1,0,0,0,0|2,0,0]=3 475 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 2230a_100000737531_200025704644 [0,1,0,0,0,0|3,0,0]=4 476 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 34a_100000737531_200025704644 [0,1,0,0,0,0|3,0,0]=4 477 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 2230a_100159265421_200025704644 [0,1,0,0,0,0|3,0,0]=4 478 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 34a_100159265421_200025704644 [0,1,0,0,0,0|3,0,0]=4 479 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 2230a_100159312145_200025704644 [0,1,0,0,0,0|2,0,0]=3 480 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 34a_100159312145_200025704644 [0,1,0,0,0,0|2,0,0]=3 481 B12R1.13 CCC(OC)c1cccc(c1)Cl 34a_100000766619_200000210301 [0,1,0,0,0,0|2,0,0]=3 482 B12R1.13 CCC(OC)c1cccc(c1)Cl 7a_100000766619_200000210301 [0,1,0,0,0,0|2,0,0]=3 483 B12R1.13 CCC(OC)c1cccc(c1)F 34a_100011350881_200000210301 [0,1,0,0,0,0|2,0,0]=3 484 B12R1.13 CCC(OC)c1cccc(c1)F 7a_100011350881_200000210301 [0,1,0,0,0,0|2,0,0]=3 485 B12R1.13 CCC(OC)c1cccc(c1)I 34a_200013212081_200000210301 [0,1,0,0,0,0|2,0,0]=3 486 B12R1.13 CCC(OC)c1cccc(c1)I 7a_200013212081_200000210301 [0,1,0,0,0,0|2,0,0]=3 487 B12R1.13 CCC(O[13CH3])c1cccc(c1)Cl 34a_100000766619_200025704644 [0,1,0,0,0,0|2,0,0]=3 488 B12R1.13 CCC(O[13CH3])c1cccc(c1)Cl 7a_100000766619_200025704644 [0,1,0,0,0,0|2,0,0]=3 489 B12R1.13 CCC(O[13CH3])c1cccc(c1)F 34a_100011350881_200025704644 [0,1,0,0,0,0|2,0,0]=3 490 B12R1.13 CCC(O[13CH3])c1cccc(c1)F 7a_100011350881_200025704644 [0,1,0,0,0,0|2,0,0]=3 491 B12R1.13 CCC(O[13CH3])c1cccc(c1)I 34a_200013212081_200025704644 [0,1,0,0,0,0|2,0,0]=3 492 B12R1.13 CCC(O[13CH3])c1cccc(c1)I 7a_200013212081_200025704644 [0,1,0,0,0,0|2,0,0]=3 493 B12R1.13 CCN(CC)c1cccc(c1)O 2230a_100000717746_100000210202 [0,1,0,0,0,0|3,0,0]=4 494 B12R1.13 CCN(CC)c1cccc(c1)O 269982a_100000717746_100000204670 [0,1,0,0,0,0|3,0,0]=4 495 B12R1.13 CCN(CC)c1cccc(c1)O 34a_100000717746_100000210202 [0,1,0,0,0,0|3,0,0]=4 496 B12R1.13 CCN(CF)c1cccc(c1)O 269982a_100000717746_100015361967 [0,1,0,0,0,0|3,0,0]=4 497 B12R1.13 CCN(CF)c1cccc(c1)O 34a_100000717746_100015361967 [0,1,0,0,0,0|3,0,0]=4 498 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 2230a_200016991486_200000210301 [0,1,0,0,0,0|3,0,0]=4 499 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 34a_200016991486_200000210301 [0,1,0,0,0,0|3,0,0]=4 500 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 2230a_200016991486_200025704644 [0,1,0,0,0,0|3,0,0]=4 501 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 34a_200016991486_200025704644 [0,1,0,0,0,0|3,0,0]=4 502 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 2230a_100102422761_200000210301 [0,1,0,0,0,0|3,0,0]=4 503 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 34a_100102422761_200000210301 [0,1,0,0,0,0|3,0,0]=4 504 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 2230a_100102422761_200025704644 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 34a_100102422761_200025704644 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.13 CNC(CO)c1cccc(c1)Br 2230a_100000690078_200000210301 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.13 CNC(CO)c1cccc(c1)Br 34a_100000690078_200000210301 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.13 CNC(CO)c1cccc(c1)O 2230a_100025717460_200000210301 [0,1,0,0,0,0|2,0,0]=3 509 B12R1.13 CNC(CO)c1cccc(c1)O 34a_100025717460_200000210301 [0,1,0,0,0,0|2,0,0]=3 510 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200000210301 [0,1,0,0,0,0|3,0,0]=4 511 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200000210301 [0,1,0,0,0,0|3,0,0]=4 512 B12R1.13 CN[C@H](CO)c1cccc(c1)C 2230a_100009818812_200000210301 [0,1,0,0,0,0|3,0,0]=4 513 B12R1.13 CN[C@H](CO)c1cccc(c1)C 34a_100009818812_200000210301 [0,1,0,0,0,0|3,0,0]=4 514 B12R1.13 CN[C@H](CO)c1cccc(c1)F 2230a_100020641251_200000210301 [0,1,0,0,0,0|3,0,0]=4 515 B12R1.13 CN[C@H](CO)c1cccc(c1)F 34a_100020641251_200000210301 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.13 COC(OC)c1cccc(c1)O 271570a_203496583355_100009816312 [0,1,0,0,0,0|2,0,0]=3 517 B12R1.13 COC(OC)c1cncc(c1)O 271570a_203496583355_100010232022 [0,1,0,0,0,0|3,0,0]=4 518 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 2230a_100009818812_200025704644 [0,1,0,0,0,0|3,0,0]=4 519 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 34a_100009818812_200025704644 [0,1,0,0,0,0|3,0,0]=4 520 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 2230a_100000690078_200025704644 [0,1,0,0,0,0|3,0,0]=4 521 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 34a_100000690078_200025704644 [0,1,0,0,0,0|3,0,0]=4 522 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 2230a_100025717460_200025704644 [0,1,0,0,0,0|2,0,0]=3 523 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 34a_100025717460_200025704644 [0,1,0,0,0,0|2,0,0]=3 524 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200025704644 [0,1,0,0,0,0|3,0,0]=4 525 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200025704644 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 2230a_100020641251_200025704644 [0,1,0,0,0,0|3,0,0]=4 527 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 34a_100020641251_200025704644 [0,1,0,0,0,0|3,0,0]=4 528 B12R1.17 C#CCC(=O)c1cccc(c1)O 1458a_100000183914_100000184674 [0,1,0,0,0,0|1,0,2]=4 529 B12R1.17 C#CCN(C)c1cccc(c1)O 2230a_100000756613_100000038162 [0,1,0,0,0,0|3,0,0]=4 530 B12R1.17 C#CCN(C)c1cccc(c1)O 34a_100000756613_100000184674 [0,1,0,0,0,0|3,0,0]=4 531 B12R1.17 C=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210623 [0,1,0,0,0,0|1,0,2]=4 532 B12R1.17 C=CCN(C)c1cccc(c1)O 2230a_100000756613_100000210623 [0,1,0,0,0,0|3,0,0]=4 533 B12R1.17 C=CCN(C)c1cccc(c1)O 269982a_100000756613_100000210623 [0,1,0,0,0,0|3,0,0]=4 534 B12R1.17 C=CCN(C)c1cccc(c1)O 34a_100000756613_100015514636 [0,1,0,0,0,0|3,0,0]=4 535 B12R1.17 CC(NCF)c1cccc(c1)Cl 34a_100102723534_100015361967 [0,1,0,0,0,0|3,0,0]=4 536 B12R1.17 CC(OCF)c1cccc(c1)Br 34a_100000246457_100015361967 [0,1,0,0,0,0|3,0,0]=4 537 B12R1.17 CC(OCF)c1cccc(c1)Br 7a_100000246457_100015361967 [0,1,0,0,0,0|3,0,0]=4 538 B12R1.17 CC(OCF)c1cccc(c1)F 34a_100000744526_100015361967 [0,1,0,0,0,0|3,0,0]=4 539 B12R1.17 CC(OCF)c1cccc(c1)F 7a_100000744526_100015361967 [0,1,0,0,0,0|3,0,0]=4 540 B12R1.17 CC(OCF)c1cccc(c1)I 34a_100013085317_100015361967 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.17 CC(OCF)c1cccc(c1)I 7a_100013085317_100015361967 [0,1,0,0,0,0|3,0,0]=4 542 B12R1.17 CC(OCF)c1cccc(c1)N 34a_100011217120_100015361967 [0,1,0,0,0,0|3,0,0]=4 543 B12R1.17 CC(OCF)c1cccc(c1)N 7a_100011217120_100015361967 [0,1,0,0,0,0|3,0,0]=4 544 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [0,1,0,0,0,0|1,0,2]=4 545 B12R1.17 CCCN(C)c1cccc(c1)O 2230a_100000756613_100000210303 [0,1,0,0,0,0|3,0,0]=4 546 B12R1.17 CCCN(C)c1cccc(c1)O 269982a_100000756613_100000210303 [0,1,0,0,0,0|3,0,0]=4 547 B12R1.17 CCCN(C)c1cccc(c1)O 34a_100000756613_100000210303 [0,1,0,0,0,0|3,0,0]=4 548 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [0,1,0,0,0,0|1,0,2]=4 549 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [0,1,0,0,0,0|1,0,2]=4 550 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [0,1,0,0,0,0|1,0,2]=4 551 B12R1.17 CCNC(C)c1cccc(c1)Br 2230a_100020642005_100000210202 [0,1,0,0,0,0|3,0,0]=4 552 B12R1.17 CCNC(C)c1cccc(c1)Br 269862a_100015525214_100000210093 [0,1,0,0,0,0|3,0,0]=4 553 B12R1.17 CCNC(C)c1cccc(c1)C 269862a_100015525214_100000211476 [0,1,0,0,0,0|3,0,0]=4 554 B12R1.17 CCNC(C)c1cccc(c1)Cl 2230a_100102723534_100000210202 [0,1,0,0,0,0|3,0,0]=4 555 B12R1.17 CCNC(C)c1cccc(c1)Cl 269862a_100015525214_200000210964 [0,1,0,0,0,0|3,0,0]=4 556 B12R1.17 CCNC(C)c1cccc(c1)Cl 34a_100102723534_100000210202 [0,1,0,0,0,0|3,0,0]=4 557 B12R1.17 CCNC(C)c1cccc(c1)F 269862a_100015525214_100000187083 [0,1,0,0,0,0|3,0,0]=4 558 B12R1.17 CCNC(C)c1cccc(c1)I 269862a_100015525214_100011356966 [0,1,0,0,0,0|3,0,0]=4 559 B12R1.17 CCNC(C)c1cccc(c1)O 2230a_100000740644_100000210202 [0,1,0,0,0,0|2,0,0]=3 560 B12R1.17 CCNC(C)c1cccc(c1)O 269862a_100015525214_100000211620 [0,1,0,0,0,0|2,0,0]=3 561 B12R1.17 CCN[C@H](C)c1cccc(c1)C 2230a_100000698126_100000210202 [0,1,0,0,0,0|3,0,0]=4 562 B12R1.17 CCN[C@H](C)c1cccc(c1)C 34a_100000698126_100000210202 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.17 CCN[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210202 [0,1,0,0,0,0|3,0,0]=4 564 B12R1.17 CCN[C@H](C)c1cccc(c1)F 34a_100015193778_100000210202 [0,1,0,0,0,0|3,0,0]=4 565 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [0,1,0,0,0,0|1,0,2]=4 566 B12R1.17 CCOC(C)c1cccc(c1)Br 34a_100000246457_100000210202 [0,1,0,0,0,0|3,0,0]=4 567 B12R1.17 CCOC(C)c1cccc(c1)Br 7a_100000246457_100000210202 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.17 CCOC(C)c1cccc(c1)C 34a_100000757818_100000210202 [0,1,0,0,0,0|3,0,0]=4 569 B12R1.17 CCOC(C)c1cccc(c1)C 7a_100000757818_100000210202 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.17 CCOC(C)c1cccc(c1)F 34a_100000744526_100000210202 [0,1,0,0,0,0|3,0,0]=4 571 B12R1.17 CCOC(C)c1cccc(c1)F 7a_100000744526_100000210202 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.17 CCOC(C)c1cccc(c1)I 34a_100013085317_100000210202 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.17 CCOC(C)c1cccc(c1)I 7a_100013085317_100000210202 [0,1,0,0,0,0|3,0,0]=4 574 B12R1.17 CCOC(C)c1cccc(c1)N 34a_100011217120_100000210202 [0,1,0,0,0,0|3,0,0]=4 575 B12R1.17 CCOC(C)c1cccc(c1)N 7a_100011217120_100000210202 [0,1,0,0,0,0|3,0,0]=4 576 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210202 [0,1,0,0,0,0|3,0,0]=4 577 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210202 [0,1,0,0,0,0|3,0,0]=4 578 B12R1.17 CN(CC#N)c1cccc(c1)O 2230a_100000756613_100011215382 [0,1,0,0,0,0|2,0,1]=4 579 B12R1.17 CN(CC#N)c1cccc(c1)O 269982a_100000756613_100011214920 [0,1,0,0,0,0|2,0,1]=4 580 B12R1.17 CN(CC=O)c1cccc(c1)O 2230a_100000756613_200015260668 [0,1,0,0,0,0|3,0,0]=4 581 B12R1.17 CN(CC=O)c1cccc(c1)O 269982a_100000756613_200015260668 [0,1,0,0,0,0|3,0,0]=4 582 B12R1.17 CN(CC=O)c1cccc(c1)O 34a_100000756613_200009817547 [0,1,0,0,0,0|3,0,0]=4 583 B12R1.17 CN(CCF)c1cccc(c1)O 2230a_100000756613_100011217306 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.17 CN(CCF)c1cccc(c1)O 269982a_100000756613_100011217306 [0,1,0,0,0,0|3,0,0]=4 585 B12R1.17 CN(CCF)c1cccc(c1)O 34a_100000756613_100011217306 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.17 CN(CCO)c1cccc(c1)O 2230a_100000756613_100000211926 [0,1,0,0,0,0|3,0,0]=4 587 B12R1.17 CN(CCO)c1cccc(c1)O 269982a_100000756613_100000211926 [0,1,0,0,0,0|3,0,0]=4 588 B12R1.17 CN(CCO)c1cccc(c1)O 34a_100000756613_100000211926 [0,1,0,0,0,0|3,0,0]=4 589 B12R1.17 CNCC(=O)c1cccc(c1)Br 2230a_106832991635_100000212080 [0,1,0,0,0,0|1,0,2]=4 590 B12R1.17 CNCC(=O)c1cccc(c1)Br 34a_100102657272_100000212080 [0,1,0,0,0,0|1,0,2]=4 591 B12R1.17 CNCC(=O)c1cccc(c1)Br 7a_106832991635_100000212080 [0,1,0,0,0,0|1,0,2]=4 592 B12R1.17 CNCC(=O)c1cccc(c1)C 2230a_106832991635_100000739480 [0,1,0,0,0,0|1,0,2]=4 593 B12R1.17 CNCC(=O)c1cccc(c1)C 34a_100102657272_100000739480 [0,1,0,0,0,0|1,0,2]=4 594 B12R1.17 CNCC(=O)c1cccc(c1)C 7a_106832991635_100000739480 [0,1,0,0,0,0|1,0,2]=4 595 B12R1.17 CNCC(=O)c1cccc(c1)Cl 2230a_106832991635_100000211444 [0,1,0,0,0,0|1,0,2]=4 596 B12R1.17 CNCC(=O)c1cccc(c1)Cl 34a_100102657272_100000211444 [0,1,0,0,0,0|1,0,2]=4 597 B12R1.17 CNCC(=O)c1cccc(c1)Cl 7a_106832991635_100000211444 [0,1,0,0,0,0|1,0,2]=4 598 B12R1.17 CNCC(=O)c1cccc(c1)F 2230a_106832991635_100000215616 [0,1,0,0,0,0|1,0,2]=4 599 B12R1.17 CNCC(=O)c1cccc(c1)F 34a_100102657272_100000215616 [0,1,0,0,0,0|1,0,2]=4 600 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [0,1,0,0,0,0|0,0,2]=3 601 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [0,1,0,0,0,0|0,0,2]=3 602 B12R1.17 CNCC(O)c1cccc(c1)O 2230a_100020657549_200000210301 [0,1,0,0,0,0|0,0,0]=1 603 B12R1.17 CNCC(O)c1cccc(c1)O 271570a_203496583355_200000733937 [0,1,0,0,0,0|0,0,0]=1 604 B12R1.17 CNCC(O)c1cccc(c1)O 34a_100020657549_200000210301 [0,1,0,0,0,0|0,0,0]=1 605 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [0,1,0,0,0,0|1,0,2]=4 606 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [0,1,0,0,0,0|1,0,2]=4 607 B12R1.17 COCC(N)c1cccc(c1)Br 34a_100000690078_200000210301 [0,1,0,0,0,0|3,0,0]=4 608 B12R1.17 COCN(C)c1cccc(c1)O 2230a_100000756613_100000766300 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.17 COCN(C)c1cccc(c1)O 269982a_100000756613_100000766300 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.17 COC[C@@H](N)c1cccc(c1)C 34a_100009818812_200000210301 [0,1,0,0,0,0|3,0,0]=4 611 B12R1.17 COC[C@@H](N)c1cccc(c1)F 34a_100020641251_200000210301 [0,1,0,0,0,0|3,0,0]=4 612 B12R1.17 COC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [0,1,0,0,0,0|1,0,2]=4 614 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [0,1,0,0,0,0|1,0,2]=4 615 B12R1.17 CSCN(C)c1cccc(c1)O 2230a_100000756613_100011218213 [0,1,0,0,0,0|3,0,0]=4 616 B12R1.17 CSCN(C)c1cccc(c1)O 269982a_100000756613_100011218213 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.17 CSCN(C)c1cccc(c1)O 34a_100000756613_100011218213 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.17 C[C@@H](NCF)c1cccc(c1)F 34a_100015193778_100015361967 [0,1,0,0,0,0|3,0,0]=4 619 B12R1.17 C[C@@H](OCF)c1cccc(c1)Cl 34a_100000747380_100015361967 [0,1,0,0,0,0|3,0,0]=4 620 B12R1.17 C[C@@H](OCF)c1cccc(c1)Cl 7a_100000747380_100015361967 [0,1,0,0,0,0|3,0,0]=4 621 B12R1.17 Cc1cccc(c1)C(C)OCF 34a_100000757818_100015361967 [0,1,0,0,0,0|3,0,0]=4 622 B12R1.17 Cc1cccc(c1)C(C)OCF 7a_100000757818_100015361967 [0,1,0,0,0,0|3,0,0]=4 623 B12R1.17 Cc1cccc(c1)[C@@H](C)NCF 34a_100000698126_100015361967 [0,1,0,0,0,0|3,0,0]=4 624 B12R1.17 Cc1cccc(c1)[C@H](N)CO[13CH3] 34a_100009818812_200025704644 [0,1,0,0,0,0|3,0,0]=4 625 B12R1.17 N#CCC(=O)c1cccc(c1)O 1458a_100000183914_100011214920 [0,1,0,0,0,0|0,0,3]=4 626 B12R1.17 N#CCC(=O)c1cccc(c1)O 271570a_203496583355_100000740218 [0,1,0,0,0,0|0,0,3]=4 627 B12R1.17 NC(CCO)c1cccc(c1)O 271570a_203496583355_200011661555 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.17 O=C(CCF)c1cccc(c1)O 1458a_100000183914_100011217306 [0,1,0,0,0,0|1,0,2]=4 629 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [0,1,0,0,0,0|1,0,2]=4 630 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 2230a_100020657549_200025704644 [0,1,0,0,0,0|0,0,0]=1 631 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 34a_100020657549_200025704644 [0,1,0,0,0,0|0,0,0]=1 632 B12R1.17 [13CH3]OCC(N)c1cccc(c1)Br 34a_100000690078_200025704644 [0,1,0,0,0,0|3,0,0]=4 633 B12R1.17 [13CH3]OC[C@@H](N)c1cccc(c1)F 34a_100020641251_200025704644 [0,1,0,0,0,0|3,0,0]=4 634 B12R1.17 [13CH3]OC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200025704644 [0,1,0,0,0,0|3,0,0]=4 635 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [0,1,0,0,0,0|1,0,2]=4 636 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [0,1,0,0,0,0|1,0,2]=4 637 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [0,1,0,0,0,0|1,0,2]=4 638 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [0,1,0,0,0,0|1,0,2]=4 639 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [0,1,0,0,0,0|1,0,2]=4 640 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [0,1,0,0,0,0|1,0,2]=4 641 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [0,1,0,0,0,0|1,0,2]=4 642 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [0,1,0,0,0,0|1,0,2]=4 643 B12R1.24 COC(C)c1cccc(c1F)O 271570a_203496583355_200010365929 [0,1,0,0,0,0|3,0,0]=4 644 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [0,1,0,0,0,0|1,0,2]=4 645 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [0,1,0,0,0,0|1,0,2]=4 646 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [0,1,0,0,0,0|1,0,2]=4 647 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [0,1,0,0,0,0|1,0,2]=4 648 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [0,1,0,0,0,0|1,0,2]=4 649 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [0,1,0,0,0,0|1,0,2]=4 650 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [0,1,0,0,0,0|1,0,2]=4 651 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,1,0,0,0,0|2,0,1]=4 652 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,1,0,0,0,0|2,0,1]=4 653 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,1,0,0,0,0|2,0,1]=4 654 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [0,1,0,0,0,0|1,0,2]=4 655 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [0,1,0,0,0,0|1,0,2]=4 656 B12R1.225 CC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000210206 [0,1,0,0,0,0|3,0,0]=4 657 B12R1.225 CC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000210206 [0,1,0,0,0,0|3,0,0]=4 658 B12R1.225 CC(C)N(C)c1cccc(c1)O 34a_100000756613_100000210206 [0,1,0,0,0,0|3,0,0]=4 659 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,1,0,0,0,0|2,0,1]=4 660 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,1,0,0,0,0|2,0,1]=4 661 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,1,0,0,0,0|2,0,1]=4 662 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [0,1,0,0,0,0|1,0,2]=4 663 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [0,1,0,0,0,0|1,0,2]=4 664 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [0,1,0,0,0,0|1,0,2]=4 665 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [0,1,0,0,0,0|1,0,2]=4 666 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [0,1,0,0,0,0|1,0,2]=4 667 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [0,1,0,0,0,0|1,0,2]=4 668 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [0,1,0,0,0,0|1,0,2]=4 669 B12R1.354 CCN(C)c1cc(ccc1C)O 269982a_100000211784_200000210301 [0,1,0,0,0,0|3,0,0]=4 670 B12R1.354 CCN(C)c1cc(ccc1C)O 34a_100000211784_200000210301 [0,1,0,0,0,0|3,0,0]=4 671 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 269982a_100000211784_200025704644 [0,1,0,0,0,0|3,0,0]=4 672 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 34a_100000211784_200025704644 [0,1,0,0,0,0|3,0,0]=4 673 B12R1.354 Cc1ccc(cc1C(=O)CF)O 1458a_100000687834_100015361967 [0,1,0,0,0,0|1,0,2]=4 674 B12R1.354 NNC(=O)c1cc(ccc1Br)O 271570a_203496583355_200011356971 [0,1,0,0,0,0|1,0,2]=4 675 B12R1.354 NNC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200000049959 [0,1,0,0,0,0|1,0,2]=4 676 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [0,1,0,0,0,0|1,0,2]=4 677 B12R1.354 N[C@H](CO)c1cc(ccc1F)O 271570a_203496583355_100010142275 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.354 O=C(CF)c1cc(ccc1Br)O 1458a_100012352043_100015361967 [0,1,0,0,0,0|1,0,2]=4 679 B12R1.354 O=C(CF)c1cc(ccc1Cl)O 1458a_100000719527_100015361967 [0,1,0,0,0,0|1,0,2]=4 680 B12R1.354 O=C(CF)c1cc(ccc1F)O 1458a_100000037260_100015361967 [0,1,0,0,0,0|1,0,2]=4 681 B12R1.354 O=C(CF)c1cc(ccc1I)O 1458a_200009995701_100015361967 [0,1,0,0,0,0|1,0,2]=4 682 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [0,1,0,0,0,0|1,0,2]=4 683 B12R1.358 CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210202 [0,1,0,0,0,0|1,0,2]=4 684 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210202 [0,1,0,0,0,0|1,0,2]=4 685 B12R1.358 CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210202 [0,1,0,0,0,0|1,0,2]=4 686 B12R1.358 CCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210202 [0,1,0,0,0,0|1,0,2]=4 687 B12R1.358 CNC(C)c1cc(cc(c1)O)C 269862a_106832991636_100009855872 [0,1,0,0,0,0|3,0,0]=4 688 B12R1.358 Cc1cc(cc(c1)C(=O)CF)O 1458a_100000094094_100015361967 [0,1,0,0,0,0|1,0,2]=4 689 B12R1.358 NNC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100011279999 [0,1,0,0,0,0|1,0,2]=4 690 B12R1.358 N[C@H](CO)c1cc(cc(c1)F)O 271570a_203496583355_100138412358 [0,1,0,0,0,0|2,0,0]=3 691 B12R1.358 O=C(CF)c1cc(cc(c1)Br)O 1458a_100011934545_100015361967 [0,1,0,0,0,0|1,0,2]=4 692 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)O 1458a_100011997059_100015361967 [0,1,0,0,0,0|1,0,2]=4 693 B12R1.358 O=C(CF)c1cc(cc(c1)F)O 1458a_100012017291_100015361967 [0,1,0,0,0,0|1,0,2]=4 694 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,1,0,0,0,0|1,0,2]=4 695 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,1,0,0,0,0|1,0,2]=4 696 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,1,0,0,0,0|1,0,2]=4 697 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,1,0,0,0,0|1,0,2]=4 698 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,1,0,0,0,0|1,0,2]=4 699 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,1,0,0,0,0|1,0,2]=4 700 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,1,0,0,0,0|1,0,2]=4 701 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [0,1,0,0,0,0|3,0,0]=4 702 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [0,1,0,0,0,0|3,0,0]=4 703 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [0,1,0,0,0,0|1,0,2]=4 704 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [0,1,0,0,0,0|1,0,2]=4 705 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,1,0,0,0,0|1,0,2]=4 706 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [0,1,0,0,0,0|1,0,2]=4 707 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [0,1,0,0,0,0|1,0,2]=4 708 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [0,1,0,0,0,0|1,0,2]=4 709 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [0,1,0,0,0,0|1,0,2]=4 710 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [0,1,0,0,0,0|1,0,2]=4 711 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,1,0,0,0,0|1,0,2]=4 712 B12R1.435 C=Cc1cccc(c1)C(=O)CN 271570a_100011290941_100020587001 [0,1,0,0,0,0|1,0,2]=4 713 B12R1.435 C=Cc1cccc(c1)C(N)CO 271570a_100011290941_100000690078 [0,1,0,0,0,0|3,0,0]=4 714 B12R1.435 C=Cc1cccc(c1)C(O)CC 271570a_100011290941_200013212081 [0,1,0,0,0,0|2,0,0]=3 715 B12R1.435 C=Cc1cccc(c1)[C@@H](N)CC 271570a_100011290941_100102422761 [0,1,0,0,0,0|3,0,0]=4 716 B12R1.435 CC(=NN)c1cccc(c1)O[13CH3] 34a_100000689795_200025704644 [0,1,0,0,0,0|2,0,1]=4 717 B12R1.435 CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210202 [0,1,0,0,0,0|1,0,2]=4 718 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [0,1,0,0,0,0|1,0,2]=4 719 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [0,1,0,0,0,0|1,0,2]=4 720 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [0,1,0,0,0,0|1,0,2]=4 721 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [0,1,0,0,0,0|1,0,2]=4 722 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [0,1,0,0,0,0|1,0,2]=4 723 B12R1.435 CCC(N)c1cccc(c1)OC 34a_100159312145_200000210301 [0,1,0,0,0,0|2,0,0]=3 724 B12R1.435 CCC(N)c1cccc(c1)O[13CH3] 34a_100159312145_200025704644 [0,1,0,0,0,0|2,0,0]=3 725 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200000210301_200013212081 [0,1,0,0,0,0|1,1,0]=3 726 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200013212081_200000210301 [0,1,0,0,0,0|1,1,0]=3 727 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200013212081_200025704644 [0,1,0,0,0,0|1,1,0]=3 728 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200025704644_200013212081 [0,1,0,0,0,0|1,1,0]=3 729 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219725_100000210202 [0,1,0,0,0,0|3,0,0]=4 730 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219733_200000210301 [0,1,0,0,0,0|3,0,0]=4 731 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219725_100000204670 [0,1,0,0,0,0|3,0,0]=4 732 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219733_200000210301 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219725_100000210202 [0,1,0,0,0,0|3,0,0]=4 734 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219733_200000210301 [0,1,0,0,0,0|3,0,0]=4 735 B12R1.435 CCN([13CH3])c1cccc(c1)OC 2230a_100000219733_200025704644 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.435 CCN([13CH3])c1cccc(c1)OC 269982a_100000219733_200025704644 [0,1,0,0,0,0|3,0,0]=4 737 B12R1.435 CCN([13CH3])c1cccc(c1)OC 34a_100000219733_200025704644 [0,1,0,0,0,0|3,0,0]=4 738 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_100102422761_200000210301 [0,1,0,0,0,0|2,1,0]=4 739 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_200000210301_100102422761 [0,1,0,0,0,0|2,1,0]=4 740 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_100102422761_200025704644 [0,1,0,0,0,0|2,1,0]=4 741 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_200025704644_100102422761 [0,1,0,0,0,0|2,1,0]=4 742 B12R1.435 CNC(C)c1cccc(c1)OC 2230a_100000737859_200000210301 [0,1,0,0,0,0|3,0,0]=4 743 B12R1.435 CNC(C)c1cccc(c1)OC 269862a_106832991636_100000171656 [0,1,0,0,0,0|3,0,0]=4 744 B12R1.435 COc1cccc(c1)C(=NN)C 34a_100000689795_200000210301 [0,1,0,0,0,0|2,0,1]=4 745 B12R1.435 COc1cccc(c1)C(=O)CBr 7a_100009813753_200000210301 [0,1,0,0,0,0|1,0,2]=4 746 B12R1.435 COc1cccc(c1)C(=O)CF 1458a_100000188888_100015361967 [0,1,0,0,0,0|1,0,2]=4 747 B12R1.435 COc1cccc(c1)C(=O)NN 34a_100000184184_200000210301 [0,1,0,0,0,0|1,0,2]=4 748 B12R1.435 COc1cccc(c1)C(C)N[13CH3] 2230a_100000737859_200025704644 [0,1,0,0,0,0|3,0,0]=4 749 B12R1.435 COc1cccc(c1)C(C)OC 34a_100000246466_200000210301 [0,1,0,0,0,0|3,0,0]=4 750 B12R1.435 COc1cccc(c1)C(C)OC 7a_100000246466_200000210301 [0,1,0,0,0,0|3,0,0]=4 751 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 34a_100000246466_200025704644 [0,1,0,0,0,0|3,0,0]=4 752 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 7a_100000246466_200025704644 [0,1,0,0,0,0|3,0,0]=4 753 B12R1.435 COc1cccc(c1)C(N)CO 34a_100025717460_200000210301 [0,1,0,0,0,0|2,0,0]=3 754 B12R1.435 COc1cccc(c1)C(O)CN 34a_100020657549_200000210301 [0,1,0,0,0,0|0,0,0]=1 755 B12R1.435 COc1cccc(c1)N(C)CF 269982a_100000219725_100015361967 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.435 COc1cccc(c1)N(C)CF 34a_100000219725_100015361967 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_100020587001_200000210301 [0,1,0,0,0,0|0,1,2]=4 758 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_200000210301_100020587001 [0,1,0,0,0,0|0,1,2]=4 759 B12R1.435 CSc1cccc(c1)C(N)CO 62a_100000690078_200000210301 [0,1,0,0,0,0|2,1,0]=4 760 B12R1.435 CSc1cccc(c1)C(N)CO 62a_200000210301_100000690078 [0,1,0,0,0,0|2,1,0]=4 761 B12R1.435 O=C(CF)c1cccc(c1)CO 1458a_100000746274_100015361967 [0,1,0,0,0,0|1,0,2]=4 762 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)CBr 7a_100009813753_200025704644 [0,1,0,0,0,0|1,0,2]=4 763 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)NN 34a_100000184184_200025704644 [0,1,0,0,0,0|1,0,2]=4 764 B12R1.435 [13CH3]Oc1cccc(c1)C(N)CO 34a_100025717460_200025704644 [0,1,0,0,0,0|2,0,0]=3 765 B12R1.435 [13CH3]Oc1cccc(c1)C(O)CN 34a_100020657549_200025704644 [0,1,0,0,0,0|0,0,0]=1 766 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_100020587001_200025704644 [0,1,0,0,0,0|0,1,2]=4 767 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_200025704644_100020587001 [0,1,0,0,0,0|0,1,2]=4 768 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_100000690078_200025704644 [0,1,0,0,0,0|2,1,0]=4 769 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_200025704644_100000690078 [0,1,0,0,0,0|2,1,0]=4 770 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,0,0,1,0,0|1,0,2]=4 771 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,0,0,1,0,0|2,0,1]=4 772 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,0,0,1,0,0|2,0,1]=4 773 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [0,0,0,1,0,0|2,0,0]=3 774 B12R2.132 Nc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353729 [0,0,0,1,0,0|2,0,1]=4 775 B12R2.132 Nc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100011934329 [0,0,0,1,0,0|2,0,1]=4 776 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,0,0,1,0,0|1,0,2]=4 777 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,0,0,1,0,0|1,0,2]=4 778 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,0,0,1,0,0|1,0,2]=4 779 B12R2.132 Oc1ccc2[nH]nc(c2c1)Br 271570a_203496583355_200012353728 [0,0,0,1,0,0|2,0,1]=4 780 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [0,0,0,1,0,0|1,0,0]=2 781 B12R2.132 Oc1n[nH]c2c1cc(cc2)Br 271570a_203496583355_100010186058 [0,0,0,1,0,0|2,0,1]=4 782 B12R2.132 Oc1n[nH]c2c1cc(cc2)Cl 271570a_203496583355_100010174404 [0,0,0,1,0,0|2,0,1]=4 783 B12R2.132 Oc1n[nH]c2c1cc(cc2)F 271570a_203496583355_100011934747 [0,0,0,1,0,0|2,0,1]=4 784 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,0,0,1,0,0|1,0,2]=4 785 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [0,0,0,1,0,0|2,0,1]=4 786 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,0,0,1,0,0|2,0,1]=4 787 B12R2.196 NC1CCc2c1cccc2O 271570a_203496583355_100000751068 [0,0,0,1,0,0|2,0,0]=3 788 B12R2.196 NC1COc2c1cccc2O 271570a_203496583355_100025715106 [0,0,0,1,0,0|2,0,0]=3 789 B12R2.196 Nc1cccc2c1[nH]nc2O 271570a_203496583355_100009888981 [0,0,0,1,0,0|2,0,1]=4 790 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [0,0,0,1,0,0|2,0,1]=4 791 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,0,0,1,0,0|1,0,2]=4 792 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,0,0,1,0,0|1,0,2]=4 793 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,0,0,1,0,0|1,0,2]=4 794 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,0,0,1,0,0|1,0,0]=2 795 B12R2.196 Oc1ccnc2c1CCC2O 271570a_203496583355_100009868430 [0,0,0,1,0,0|2,0,0]=3 796 B12R2.196 Oc1n[nH]c2c1cccc2Br 271570a_203496583355_100010197283 [0,0,0,1,0,0|2,0,1]=4 797 B12R2.196 Oc1n[nH]c2c1cccc2Cl 271570a_203496583355_100000050086 [0,0,0,1,0,0|2,0,1]=4 798 B12R2.196 Oc1n[nH]c2c1cccc2F 271570a_203496583355_100010231504 [0,0,0,1,0,0|2,0,1]=4 799 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [0,0,0,1,0,0|1,0,1]=3 800 B12R2.1282 NC1(CC1)c2cccc(c2)O 271570a_203496583355_100000759329 [0,0,0,1,0,0|2,0,0]=3 801 B12R2.1282 NC1(CC1)c2cncc(c2)O 271570a_203496583355_200025708055 [0,0,0,1,0,0|3,0,0]=4 802 B12R1.50 C#CC(C)Nc1cccc(c1)O 34a_100000210217_200000035995 [0,0,0,0,0,1|2,0,1]=4 803 B12R1.50 C#CC(C)Sc1cccc(c1)O 62a_200000035995_100000211634 [0,0,0,0,0,1|2,0,1]=4 804 B12R1.50 C=CC(C)Sc1cccc(c1)O 62a_100011215867_100000211634 [0,0,0,0,0,1|2,0,1]=4 805 B12R1.50 CC(C#N)Sc1cccc(c1)O 62a_100000703298_100000211634 [0,0,0,0,0,1|1,0,2]=4 806 B12R1.50 CC(CO)Nc1cccc(c1)Br 34a_100000210019_100012180447 [0,0,0,0,0,1|3,0,0]=4 807 B12R1.50 CC(CO)Nc1cccc(c1)Cl 34a_100000185859_100012180447 [0,0,0,0,0,1|3,0,0]=4 808 B12R1.50 CC(CO)Nc1cccc(c1)F 34a_100000210047_100012180447 [0,0,0,0,0,1|3,0,0]=4 809 B12R1.50 CC(CO)Nc1cccc(c1)I 34a_100000211102_100012180447 [0,0,0,0,0,1|3,0,0]=4 810 B12R1.50 CC(CO)Nc1cccc(c1)O 34a_100000210217_100012180447 [0,0,0,0,0,1|2,0,0]=3 811 B12R1.50 CC(CO)Oc1cccc(c1)Br 34a_100000210342_100012180447 [0,0,0,0,0,1|3,0,0]=4 812 B12R1.50 CC(CO)Oc1cccc(c1)Br 7a_100000210342_100012180447 [0,0,0,0,0,1|3,0,0]=4 813 B12R1.50 CC(CO)Oc1cccc(c1)Cl 34a_100000210295_100012180447 [0,0,0,0,0,1|3,0,0]=4 814 B12R1.50 CC(CO)Oc1cccc(c1)Cl 7a_100000210295_100012180447 [0,0,0,0,0,1|3,0,0]=4 815 B12R1.50 CC(CO)Oc1cccc(c1)F 34a_100000210426_100012180447 [0,0,0,0,0,1|3,0,0]=4 816 B12R1.50 CC(CO)Oc1cccc(c1)F 7a_100000210426_100012180447 [0,0,0,0,0,1|3,0,0]=4 817 B12R1.50 CC(CO)Oc1cccc(c1)I 34a_100000211634_100012180447 [0,0,0,0,0,1|3,0,0]=4 818 B12R1.50 CC(CO)Oc1cccc(c1)I 7a_100000211634_100012180447 [0,0,0,0,0,1|3,0,0]=4 819 B12R1.50 CC(CO)Oc1cccc(c1)N 34a_100000210217_100012180447 [0,0,0,0,0,1|3,0,0]=4 820 B12R1.50 CC(CO)Sc1cc(ccn1)O 62a_100012180447_100000762945 [0,0,0,0,0,1|3,0,0]=4 821 B12R1.50 CC(CO)Sc1cccc(c1)Br 62a_100012180447_100000691529 [0,0,0,0,0,1|3,0,0]=4 822 B12R1.50 CC(CO)Sc1cccc(c1)Cl 62a_100012180447_100000699651 [0,0,0,0,0,1|3,0,0]=4 823 B12R1.50 CC(CO)Sc1cccc(c1)F 62a_100012180447_100000685547 [0,0,0,0,0,1|3,0,0]=4 824 B12R1.50 CC(CO)Sc1cccc(c1)N 62a_100012180447_100000210019 [0,0,0,0,0,1|3,0,0]=4 825 B12R1.50 CC(CO)Sc1cccc(c1)O 62a_100012180447_100000211634 [0,0,0,0,0,1|2,0,0]=3 826 B12R1.50 CC(CO)Sc1cccc(c1)[S] 62a_100012180447_114929384022 [0,0,0,0,0,1|2,1,0]=4 827 B12R1.50 CC(CO)Sc1cncc(c1)O 62a_100012180447_100000754920 [0,0,0,0,0,1|3,0,0]=4 828 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [0,0,0,0,0,1|1,0,2]=4 829 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [0,0,0,0,0,1|1,0,2]=4 830 B12R1.50 CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210414 [0,0,0,0,0,1|1,0,2]=4 831 B12R1.50 CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210414 [0,0,0,0,0,1|1,0,2]=4 832 B12R1.50 CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210414 [0,0,0,0,0,1|1,0,2]=4 833 B12R1.50 CCC(C)Nc1cccc(c1)Br 34a_100000210019_100011215416 [0,0,0,0,0,1|3,0,0]=4 834 B12R1.50 CCC(C)Nc1cccc(c1)C 2230a_100000188690_100000758301 [0,0,0,0,0,1|3,0,0]=4 835 B12R1.50 CCC(C)Nc1cccc(c1)C 34a_100000188690_100011215416 [0,0,0,0,0,1|3,0,0]=4 836 B12R1.50 CCC(C)Nc1cccc(c1)Cl 34a_100000185859_100011215416 [0,0,0,0,0,1|3,0,0]=4 837 B12R1.50 CCC(C)Nc1cccc(c1)F 34a_100000210047_100011215416 [0,0,0,0,0,1|3,0,0]=4 838 B12R1.50 CCC(C)Nc1cccc(c1)I 34a_100000211102_100011215416 [0,0,0,0,0,1|3,0,0]=4 839 B12R1.50 CCC(C)Nc1cccc(c1)O 34a_100000210217_100011215416 [0,0,0,0,0,1|2,0,0]=3 840 B12R1.50 CCC(C)Oc1cccc(c1)Br 34a_100000210342_100011215416 [0,0,0,0,0,1|3,0,0]=4 841 B12R1.50 CCC(C)Oc1cccc(c1)Br 7a_100000210342_100000758301 [0,0,0,0,0,1|3,0,0]=4 842 B12R1.50 CCC(C)Oc1cccc(c1)C 34a_100000210337_100011215416 [0,0,0,0,0,1|3,0,0]=4 843 B12R1.50 CCC(C)Oc1cccc(c1)C 7a_100000210337_100000758301 [0,0,0,0,0,1|3,0,0]=4 844 B12R1.50 CCC(C)Oc1cccc(c1)Cl 34a_100000210295_100011215416 [0,0,0,0,0,1|3,0,0]=4 845 B12R1.50 CCC(C)Oc1cccc(c1)Cl 7a_100000210295_100000758301 [0,0,0,0,0,1|3,0,0]=4 846 B12R1.50 CCC(C)Oc1cccc(c1)F 34a_100000210426_100011215416 [0,0,0,0,0,1|3,0,0]=4 847 B12R1.50 CCC(C)Oc1cccc(c1)F 7a_100000210426_100000758301 [0,0,0,0,0,1|3,0,0]=4 848 B12R1.50 CCC(C)Oc1cccc(c1)I 34a_100000211634_100011215416 [0,0,0,0,0,1|3,0,0]=4 849 B12R1.50 CCC(C)Oc1cccc(c1)I 7a_100000211634_100000758301 [0,0,0,0,0,1|3,0,0]=4 850 B12R1.50 CCC(C)Oc1cccc(c1)N 34a_100000210217_100011215416 [0,0,0,0,0,1|3,0,0]=4 851 B12R1.50 CCC(C)Oc1cccc(c1)O 271570a_203496583355_200011236628 [0,0,0,0,0,1|2,0,0]=3 852 B12R1.50 CCC(C)Sc1cc(ccn1)O 62a_100000758301_100000762945 [0,0,0,0,0,1|3,0,0]=4 853 B12R1.50 CCC(C)Sc1cccc(c1)Br 62a_100000691529_100000758301 [0,0,0,0,0,1|3,0,0]=4 854 B12R1.50 CCC(C)Sc1cccc(c1)Br 62a_100000758301_100000691529 [0,0,0,0,0,1|3,0,0]=4 855 B12R1.50 CCC(C)Sc1cccc(c1)C 62a_100000758301_100011215228 [0,0,0,0,0,1|3,0,0]=4 856 B12R1.50 CCC(C)Sc1cccc(c1)C 62a_100011215228_100000758301 [0,0,0,0,0,1|3,0,0]=4 857 B12R1.50 CCC(C)Sc1cccc(c1)Cl 62a_100000699651_100000758301 [0,0,0,0,0,1|3,0,0]=4 858 B12R1.50 CCC(C)Sc1cccc(c1)Cl 62a_100000758301_100000699651 [0,0,0,0,0,1|3,0,0]=4 859 B12R1.50 CCC(C)Sc1cccc(c1)F 62a_100000685547_100000758301 [0,0,0,0,0,1|3,0,0]=4 860 B12R1.50 CCC(C)Sc1cccc(c1)F 62a_100000758301_100000685547 [0,0,0,0,0,1|3,0,0]=4 861 B12R1.50 CCC(C)Sc1cccc(c1)N 62a_100000210019_100000758301 [0,0,0,0,0,1|3,0,0]=4 862 B12R1.50 CCC(C)Sc1cccc(c1)N 62a_100000758301_100000210019 [0,0,0,0,0,1|3,0,0]=4 863 B12R1.50 CCC(C)Sc1cccc(c1)O 62a_100000758301_100000211634 [0,0,0,0,0,1|2,0,0]=3 864 B12R1.50 CCC(C)Sc1cccc(c1)[S] 62a_100000758301_114929384022 [0,0,0,0,0,1|2,1,0]=4 865 B12R1.50 CCC(C)Sc1cccc(c1)[S] 62a_114929384022_100000758301 [0,0,0,0,0,1|2,1,0]=4 866 B12R1.50 CCC(C)Sc1cncc(c1)O 62a_100000754920_100000758301 [0,0,0,0,0,1|3,0,0]=4 867 B12R1.50 CCC(C)Sc1cncc(c1)O 62a_100000758301_100000754920 [0,0,0,0,0,1|3,0,0]=4 868 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000201218_200000210301 [0,0,0,0,0,1|3,0,0]=4 869 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210202 [0,0,0,0,0,1|3,0,0]=4 870 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000225621_100011660834 [0,0,0,0,0,1|3,0,0]=4 871 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000201218_200000210301 [0,0,0,0,0,1|3,0,0]=4 872 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000204670 [0,0,0,0,0,1|3,0,0]=4 873 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000225621_100000084143 [0,0,0,0,0,1|3,0,0]=4 874 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 2230a_100000201218_200025704644 [0,0,0,0,0,1|3,0,0]=4 875 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 269982a_100000201218_200025704644 [0,0,0,0,0,1|3,0,0]=4 876 B12R1.50 CN(CF)Cc1cccc(c1)O 269982a_100000207540_100015361967 [0,0,0,0,0,1|3,0,0]=4 877 B12R1.50 COC(C)Sc1cccc(c1)O 62a_100009879195_100000211634 [0,0,0,0,0,1|3,0,0]=4 878 B12R1.50 C[C@H](CO)Sc1cc(ccn1)O 62a_100016084084_100000762945 [0,0,0,0,0,1|3,0,0]=4 879 B12R1.50 C[C@H](CO)Sc1cccc(c1)Br 62a_100000691529_100016084084 [0,0,0,0,0,1|3,0,0]=4 880 B12R1.50 C[C@H](CO)Sc1cccc(c1)Br 62a_100016084084_100000691529 [0,0,0,0,0,1|3,0,0]=4 881 B12R1.50 C[C@H](CO)Sc1cccc(c1)Cl 62a_100000699651_100016084084 [0,0,0,0,0,1|3,0,0]=4 882 B12R1.50 C[C@H](CO)Sc1cccc(c1)Cl 62a_100016084084_100000699651 [0,0,0,0,0,1|3,0,0]=4 883 B12R1.50 C[C@H](CO)Sc1cccc(c1)F 62a_100000685547_100016084084 [0,0,0,0,0,1|3,0,0]=4 884 B12R1.50 C[C@H](CO)Sc1cccc(c1)F 62a_100016084084_100000685547 [0,0,0,0,0,1|3,0,0]=4 885 B12R1.50 C[C@H](CO)Sc1cccc(c1)N 62a_100000210019_100016084084 [0,0,0,0,0,1|3,0,0]=4 886 B12R1.50 C[C@H](CO)Sc1cccc(c1)N 62a_100016084084_100000210019 [0,0,0,0,0,1|3,0,0]=4 887 B12R1.50 C[C@H](CO)Sc1cccc(c1)O 62a_100016084084_100000211634 [0,0,0,0,0,1|2,0,0]=3 888 B12R1.50 C[C@H](CO)Sc1cccc(c1)[S] 62a_100016084084_114929384022 [0,0,0,0,0,1|2,1,0]=4 889 B12R1.50 C[C@H](CO)Sc1cccc(c1)[S] 62a_114929384022_100016084084 [0,0,0,0,0,1|2,1,0]=4 890 B12R1.50 C[C@H](CO)Sc1cncc(c1)O 62a_100000754920_100016084084 [0,0,0,0,0,1|3,0,0]=4 891 B12R1.50 C[C@H](CO)Sc1cncc(c1)O 62a_100016084084_100000754920 [0,0,0,0,0,1|3,0,0]=4 892 B12R1.50 Cc1cccc(c1)NC(C)CO 2230a_100000188690_100012180447 [0,0,0,0,0,1|3,0,0]=4 893 B12R1.50 Cc1cccc(c1)NC(C)CO 34a_100000188690_100012180447 [0,0,0,0,0,1|3,0,0]=4 894 B12R1.50 Cc1cccc(c1)OC(C)CO 34a_100000210337_100012180447 [0,0,0,0,0,1|3,0,0]=4 895 B12R1.50 Cc1cccc(c1)OC(C)CO 7a_100000210337_100012180447 [0,0,0,0,0,1|3,0,0]=4 896 B12R1.50 Cc1cccc(c1)SC(C)CO 62a_100012180447_100011215228 [0,0,0,0,0,1|3,0,0]=4 897 B12R1.50 Cc1cccc(c1)S[C@H](C)CO 62a_100011215228_100016084084 [0,0,0,0,0,1|3,0,0]=4 898 B12R1.50 Cc1cccc(c1)S[C@H](C)CO 62a_100016084084_100011215228 [0,0,0,0,0,1|3,0,0]=4 899 B12R1.50 N#CC(F)Sc1cccc(c1)O 62a_200000117898_100000211634 [0,0,0,0,0,1|1,0,2]=4 900 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [0,0,0,0,0,1|2,0,0]=3 901 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [0,0,0,0,0,1|1,0,2]=4 902 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [0,0,0,0,0,1|1,0,2]=4 903 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [0,0,0,0,0,1|1,0,2]=4 904 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [0,0,0,0,0,1|1,0,2]=4 905 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|0,0,2]=4 906 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [2,0,0,0,0,0|1,0,0]=3 907 B9R1.2 CCc1cc(ncn1)O 271570a_203496583355_100000744278 [2,0,0,0,0,0|2,0,0]=4 908 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|0,0,0]=2 909 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [2,0,0,0,0,0|1,0,0]=3 910 B9R1.2 CCc1ccnc(c1)O 271570a_203496583355_100009817561 [2,0,0,0,0,0|1,0,0]=3 911 B9R1.2 CCc1ccnc(n1)O 271570a_203496583355_100000100215 [2,0,0,0,0,0|2,0,0]=4 912 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [2,0,0,0,0,0|1,0,0]=3 913 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [2,0,0,0,0,0|2,0,0]=4 914 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 915 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,0,0,0,0,0|2,0,0]=4 916 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,0,0,0,0,0|2,0,0]=4 917 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,0,0,0,0,0|2,0,0]=4 918 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,0,0,0,0,0|2,0,0]=4 919 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,0,0,0,0,0|2,0,0]=4 920 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,0,0,0,0,0|1,0,0]=3 921 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,0,0,0,0,0|1,0,0]=3 922 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [2,0,0,0,0,0|2,0,0]=4 923 B9R1.2 CNc1ccnc(c1)O 271570a_203496583355_100009869472 [2,0,0,0,0,0|2,0,0]=4 924 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [2,0,0,0,0,0|2,0,0]=4 925 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [2,0,0,0,0,0|2,0,0]=4 926 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,0,0,0,0,0|2,0,0]=4 927 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,0,0,0,0,0|2,0,0]=4 928 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,0,0,0,0,0|2,0,0]=4 929 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,0,0,0,0,0|2,0,0]=4 930 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,0,0,0,0,0|2,0,0]=4 931 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,0,0,0,0,0|2,0,0]=4 932 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,0,0,0,0,0|2,0,0]=4 933 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,0,0,0,0,0|2,0,0]=4 934 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,0,0,0,0,0|2,0,0]=4 935 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,0,0,0,0,0|2,0,0]=4 936 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,0,0,0,0,0|2,0,0]=4 937 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,0,0,0,0,0|1,0,0]=3 938 B9R1.2 COc1cccc(n1)O 271570a_203496583355_100000760917 [2,0,0,0,0,0|2,0,0]=4 939 B9R1.2 COc1ccnc(c1)O 271570a_203496583355_100011216251 [2,0,0,0,0,0|2,0,0]=4 940 B9R1.2 COc1cncc(c1)O 271570a_203496583355_100000684773 [2,0,0,0,0,0|2,0,0]=4 941 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [2,0,0,0,0,0|2,0,0]=4 942 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,0,0,0,0,0|2,0,0]=4 943 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,0,0,0,0,0|2,0,0]=4 944 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,0,0,0,0,0|2,0,0]=4 945 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,0,0,0,0,0|2,0,0]=4 946 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,0,0,0,0,0|2,0,0]=4 947 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,0,0,0,0,0|2,0,0]=4 948 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,0,0,0,0,0|2,0,0]=4 949 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,0,0,0,0,0|2,0,0]=4 950 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 951 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,0,0,0,0,0|2,0,0]=4 952 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,0,0,0,0,0|1,0,0]=3 953 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,0,0,0,0,0|1,0,0]=3 954 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,0,0,0,0,0|1,1,0]=4 955 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,0,0,0,0,0|1,1,0]=4 956 B9R1.2 CSc1cccc(n1)O 271570a_203496583355_100011960944 [2,0,0,0,0,0|2,0,0]=4 957 B9R1.2 CSc1ccnc(c1)O 271570a_203496583355_100010883326 [2,0,0,0,0,0|2,0,0]=4 958 B9R1.2 CSc1cncc(c1)O 271570a_203496583355_100009816972 [2,0,0,0,0,0|2,0,0]=4 959 B9R1.2 CSc1cncc(c1)O 62a_100000754920_200000210301 [2,0,0,0,0,0|2,0,0]=4 960 B9R1.2 CSc1cncc(c1)O 62a_200000210301_100000754920 [2,0,0,0,0,0|2,0,0]=4 961 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,0,0,0,0,0|2,0,0]=4 962 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,0,0,0,0,0|2,0,0]=4 963 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,0,0,0,0,0|2,0,0]=4 964 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,0,0,0,0,0|2,0,0]=4 965 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,0,0,0,0,0|2,0,0]=4 966 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,0,0,0,0,0|2,0,0]=4 967 B9R1.2 N#Cc1cccc(c1)O 271570a_203496583355_100000189340 [2,0,0,0,0,0|0,0,2]=4 968 B9R1.2 NCc1cc(ccn1)O 271570a_203496583355_100000085674 [2,0,0,0,0,0|1,0,0]=3 969 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,0,0,0,0,0|0,0,0]=2 970 B9R1.2 NCc1cccc(n1)O 271570a_203496583355_100016990191 [2,0,0,0,0,0|1,0,0]=3 971 B9R1.2 NCc1cncc(c1)O 271570a_203496583355_100011249555 [2,0,0,0,0,0|1,0,0]=3 972 B9R1.2 NNc1cc(ccn1)O 271570a_203496583355_100000764631 [2,0,0,0,0,0|2,0,0]=4 973 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [2,0,0,0,0,0|1,0,0]=3 974 B9R1.2 NNc1cccc(n1)O 271570a_203496583355_100009817029 [2,0,0,0,0,0|2,0,0]=4 975 B9R1.2 NNc1cncc(c1)O 271570a_203496583355_100000727789 [2,0,0,0,0,0|2,0,0]=4 976 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|0,0,2]=4 977 B9R1.2 OCc1cc(ccn1)O 271570a_203496583355_100009819072 [2,0,0,0,0,0|1,0,0]=3 978 B9R1.2 OCc1cc(ncn1)O 271570a_203496583355_100000731546 [2,0,0,0,0,0|2,0,0]=4 979 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,0,0,0,0,0|0,0,0]=2 980 B9R1.2 OCc1cccc(n1)O 271570a_203496583355_100000694195 [2,0,0,0,0,0|1,0,0]=3 981 B9R1.2 OCc1ccnc(c1)O 271570a_203496583355_100009814636 [2,0,0,0,0,0|1,0,0]=3 982 B9R1.2 OCc1cncc(c1)O 271570a_203496583355_100011259137 [2,0,0,0,0,0|1,0,0]=3 983 B9R1.2 OCc1cncc(n1)O 271570a_203496583355_100009853123 [2,0,0,0,0,0|2,0,0]=4 984 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,0,0,0,0,0|1,0,0]=3 985 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 986 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,0,0,0,0,0|2,0,0]=4 987 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,0,0,0,0,0|2,0,0]=4 988 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,0,0,0,0,0|2,0,0]=4 989 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,0,0,0,0,0|1,0,0]=3 990 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,0,0,0,0,0|2,0,0]=4 991 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,0,0,0,0,0|2,0,0]=4 992 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,0,0,0,0,0|2,0,0]=4 993 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,0,0,0,0,0|2,0,0]=4 994 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,0,0,0,0,0|2,0,0]=4 995 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,0,0,0,0,0|2,0,0]=4 996 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,0,0,0,0,0|2,0,0]=4 997 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,0,0,0,0,0|2,0,0]=4 998 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,0,0,0,0,0|2,0,0]=4 999 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [2,0,0,0,0,0|2,0,0]=4 1000 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,0,0,0,0,0|2,0,0]=4 1001 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,0,0,0,0,0|2,0,0]=4 1002 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,0,0,0,0,0|2,0,0]=4 1003 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,0,0,0,0,0|2,0,0]=4 1004 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,0,0,0,0,0|2,0,0]=4 1005 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,0,0,0,0,0|2,0,0]=4 1006 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 1007 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,0,0,0,0,0|2,0,0]=4 1008 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,0,0,0,0,0|1,0,0]=3 1009 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,0,0,0,0,0|1,1,0]=4 1010 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,0,0,0,0,0|1,1,0]=4 1011 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_100000754920_200025704644 [2,0,0,0,0,0|2,0,0]=4 1012 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_200025704644_100000754920 [2,0,0,0,0,0|2,0,0]=4 1013 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [2,0,0,0,0,0|2,0,0]=4 1014 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1015 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|2,0,0]=4 1016 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [2,0,0,0,0,0|2,0,0]=4 1017 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [2,0,0,0,0,0|2,0,0]=4 1018 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|2,0,0]=4 1019 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 1020 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|2,0,0]=4 1021 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|2,0,0]=4 1022 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 1023 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|2,0,0]=4 1024 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|2,0,0]=4 1025 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 1026 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|2,0,0]=4 1027 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 1028 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|2,0,0]=4 1029 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|2,0,0]=4 1030 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [2,0,0,0,0,0|2,0,0]=4 1031 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 1032 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 1033 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [2,0,0,0,0,0|2,0,0]=4 1034 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [2,0,0,0,0,0|2,0,0]=4 1035 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 1036 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 1037 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 1038 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 1039 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|2,0,0]=4 1040 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|2,0,0]=4 1041 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [2,0,0,0,0,0|1,0,1]=4 1042 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [2,0,0,0,0,0|0,0,2]=4 1043 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1044 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1045 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 1046 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1047 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1048 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 1049 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [2,0,0,0,0,0|0,0,2]=4 1050 B11R1.13 CCNc1cccc(c1Br)O 34a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 1051 B11R1.13 CCNc1cccc(c1Br)O 7a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 1052 B11R1.13 CCNc1cccc(c1C)O 34a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 1053 B11R1.13 CCNc1cccc(c1C)O 7a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 1054 B11R1.13 CCNc1cccc(c1Cl)O 34a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 1055 B11R1.13 CCNc1cccc(c1Cl)O 7a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 1056 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [1,1,0,0,0,0|2,0,0]=4 1057 B11R1.13 CCSc1cccc(c1Br)O 62a_100000210202_100010187914 [1,1,0,0,0,0|2,0,0]=4 1058 B11R1.13 CCSc1cccc(c1Br)O 62a_100010187914_100000210202 [1,1,0,0,0,0|2,0,0]=4 1059 B11R1.13 CCSc1cccc(c1C)O 62a_100000210202_100012002258 [1,1,0,0,0,0|2,0,0]=4 1060 B11R1.13 CCSc1cccc(c1C)O 62a_100012002258_100000210202 [1,1,0,0,0,0|2,0,0]=4 1061 B11R1.13 CCSc1cccc(c1Cl)O 62a_100000210202_100000049636 [1,1,0,0,0,0|2,0,0]=4 1062 B11R1.13 CCSc1cccc(c1F)O 62a_100000210202_100009817021 [1,1,0,0,0,0|2,0,0]=4 1063 B11R1.13 CCSc1cccc(c1F)O 62a_100009817021_100000210202 [1,1,0,0,0,0|2,0,0]=4 1064 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [1,1,0,0,0,0|2,0,0]=4 1065 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [1,1,0,0,0,0|2,0,0]=4 1066 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [1,1,0,0,0,0|2,0,0]=4 1067 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [1,1,0,0,0,0|2,0,0]=4 1068 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [1,1,0,0,0,0|2,0,0]=4 1069 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [1,1,0,0,0,0|2,0,0]=4 1070 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [1,1,0,0,0,0|2,0,0]=4 1071 B11R1.13 Cc1c(cccc1CC#N)O 271570a_203496583355_100010147028 [1,1,0,0,0,0|0,0,2]=4 1072 B11R1.13 Cc1c(cccc1CCN)O 271570a_203496583355_100161000114 [1,1,0,0,0,0|0,0,0]=2 1073 B11R1.13 Cc1c(cccc1NCF)O 34a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 1074 B11R1.13 Cc1c(cccc1NCF)O 7a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 1075 B11R1.13 Cc1c(cccc1SCF)O 62a_100012002258_100015361967 [1,1,0,0,0,0|2,0,0]=4 1076 B11R1.13 Cc1c(cccc1SCF)O 62a_100015361967_100012002258 [1,1,0,0,0,0|2,0,0]=4 1077 B11R1.13 N#CCc1cccc(c1F)O 271570a_203496583355_100009817020 [1,1,0,0,0,0|0,0,2]=4 1078 B11R1.13 Nc1c(cccc1SCF)O 62a_100015361967_100011934926 [1,1,0,0,0,0|2,0,0]=4 1079 B11R1.13 Oc1cccc(c1Br)NCF 34a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 1080 B11R1.13 Oc1cccc(c1Br)NCF 7a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 1081 B11R1.13 Oc1cccc(c1Br)SCF 62a_100010187914_100015361967 [1,1,0,0,0,0|2,0,0]=4 1082 B11R1.13 Oc1cccc(c1Br)SCF 62a_100015361967_100010187914 [1,1,0,0,0,0|2,0,0]=4 1083 B11R1.13 Oc1cccc(c1Cl)NCF 34a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 1084 B11R1.13 Oc1cccc(c1Cl)NCF 7a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 1085 B11R1.13 Oc1cccc(c1Cl)SCF 62a_100015361967_100000049636 [1,1,0,0,0,0|2,0,0]=4 1086 B11R1.13 Oc1cccc(c1F)SCF 62a_100009817021_100015361967 [1,1,0,0,0,0|2,0,0]=4 1087 B11R1.13 Oc1cccc(c1F)SCF 62a_100015361967_100009817021 [1,1,0,0,0,0|2,0,0]=4 1088 B11R1.13 Oc1cccc(c1O)SCF 62a_100015361967_100009815950 [1,1,0,0,0,0|2,0,0]=4 1089 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [1,1,0,0,0,0|2,0,0]=4 1090 B11R1.24 C#CCNc1cccc(c1)O 34a_100000210217_100000184674 [1,1,0,0,0,0|1,0,1]=4 1091 B11R1.24 C#CCSc1cccc(c1)O 62a_100000038162_100000211634 [1,1,0,0,0,0|1,0,1]=4 1092 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,1,0,0,0,0|1,0,1]=4 1093 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,1,0,0,0,0|1,0,1]=4 1094 B11R1.24 CCCCc1cc(ccn1)O 271570a_100020621405_100000762945 [1,1,0,0,0,0|2,0,0]=4 1095 B11R1.24 CCCCc1cccc(c1)Br 271570a_100020621405_100000691529 [1,1,0,0,0,0|2,0,0]=4 1096 B11R1.24 CCCCc1cccc(c1)C 271570a_100020621405_100011215228 [1,1,0,0,0,0|2,0,0]=4 1097 B11R1.24 CCCCc1cccc(c1)Cl 271570a_100020621405_100000699651 [1,1,0,0,0,0|2,0,0]=4 1098 B11R1.24 CCCCc1cccc(c1)F 271570a_100020621405_100000685547 [1,1,0,0,0,0|2,0,0]=4 1099 B11R1.24 CCCCc1cccc(c1)N 271570a_100020621405_100000210019 [1,1,0,0,0,0|2,0,0]=4 1100 B11R1.24 CCCCc1cccc(c1)O 271570a_100020621405_100000211634 [1,1,0,0,0,0|1,0,0]=3 1101 B11R1.24 CCCCc1cccc(c1)O 271570a_203496583355_200010244551 [1,1,0,0,0,0|1,0,0]=3 1102 B11R1.24 CCCCc1cccc(c1)[S] 271570a_100020621405_114929384022 [1,1,0,0,0,0|1,1,0]=4 1103 B11R1.24 CCCCc1cncc(c1)O 271570a_100020621405_100000754920 [1,1,0,0,0,0|2,0,0]=4 1104 B11R1.24 CCCNc1cccc(c1)Br 34a_100000210019_100000210303 [1,1,0,0,0,0|2,0,0]=4 1105 B11R1.24 CCCNc1cccc(c1)C 2230a_100000188690_100000210303 [1,1,0,0,0,0|2,0,0]=4 1106 B11R1.24 CCCNc1cccc(c1)C 34a_100000188690_100000210303 [1,1,0,0,0,0|2,0,0]=4 1107 B11R1.24 CCCNc1cccc(c1)Cl 34a_100000185859_100000210303 [1,1,0,0,0,0|2,0,0]=4 1108 B11R1.24 CCCNc1cccc(c1)F 34a_100000210047_100000210303 [1,1,0,0,0,0|2,0,0]=4 1109 B11R1.24 CCCNc1cccc(c1)I 34a_100000211102_100000210303 [1,1,0,0,0,0|2,0,0]=4 1110 B11R1.24 CCCNc1cccc(c1)O 34a_100000210217_100000210303 [1,1,0,0,0,0|1,0,0]=3 1111 B11R1.24 CCCNc1cccc(n1)O 271570a_203496583355_200025756634 [1,1,0,0,0,0|2,0,0]=4 1112 B11R1.24 CCCOc1cccc(c1)Br 34a_100000210342_100000210303 [1,1,0,0,0,0|2,0,0]=4 1113 B11R1.24 CCCOc1cccc(c1)Br 7a_100000210342_100000210303 [1,1,0,0,0,0|2,0,0]=4 1114 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [1,1,0,0,0,0|2,0,0]=4 1115 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [1,1,0,0,0,0|2,0,0]=4 1116 B11R1.24 CCCOc1cccc(c1)Cl 34a_100000210295_100000210303 [1,1,0,0,0,0|2,0,0]=4 1117 B11R1.24 CCCOc1cccc(c1)Cl 7a_100000210295_100000210303 [1,1,0,0,0,0|2,0,0]=4 1118 B11R1.24 CCCOc1cccc(c1)F 34a_100000210426_100000210303 [1,1,0,0,0,0|2,0,0]=4 1119 B11R1.24 CCCOc1cccc(c1)F 7a_100000210426_100000210303 [1,1,0,0,0,0|2,0,0]=4 1120 B11R1.24 CCCOc1cccc(c1)I 34a_100000211634_100000210303 [1,1,0,0,0,0|2,0,0]=4 1121 B11R1.24 CCCOc1cccc(c1)I 7a_100000211634_100000210303 [1,1,0,0,0,0|2,0,0]=4 1122 B11R1.24 CCCOc1cccc(c1)N 34a_100000210217_100000210303 [1,1,0,0,0,0|2,0,0]=4 1123 B11R1.24 CCCOc1cccc(c1)O 271570a_203496583355_100000170004 [1,1,0,0,0,0|1,0,0]=3 1124 B11R1.24 CCCOc1cccc(n1)O 271570a_203496583355_200011960250 [1,1,0,0,0,0|2,0,0]=4 1125 B11R1.24 CCCOc1cncc(c1)O 271570a_203496583355_200012029621 [1,1,0,0,0,0|2,0,0]=4 1126 B11R1.24 CCCSc1cc(ccn1)O 62a_100000210303_100000762945 [1,1,0,0,0,0|2,0,0]=4 1127 B11R1.24 CCCSc1cccc(c1)Br 62a_100000210303_100000691529 [1,1,0,0,0,0|2,0,0]=4 1128 B11R1.24 CCCSc1cccc(c1)Br 62a_100000691529_100000210303 [1,1,0,0,0,0|2,0,0]=4 1129 B11R1.24 CCCSc1cccc(c1)C 62a_100000210303_100011215228 [1,1,0,0,0,0|2,0,0]=4 1130 B11R1.24 CCCSc1cccc(c1)C 62a_100011215228_100000210303 [1,1,0,0,0,0|2,0,0]=4 1131 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000210303_100000699651 [1,1,0,0,0,0|2,0,0]=4 1132 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000699651_100000210303 [1,1,0,0,0,0|2,0,0]=4 1133 B11R1.24 CCCSc1cccc(c1)F 62a_100000210303_100000685547 [1,1,0,0,0,0|2,0,0]=4 1134 B11R1.24 CCCSc1cccc(c1)F 62a_100000685547_100000210303 [1,1,0,0,0,0|2,0,0]=4 1135 B11R1.24 CCCSc1cccc(c1)N 62a_100000210019_100000210303 [1,1,0,0,0,0|2,0,0]=4 1136 B11R1.24 CCCSc1cccc(c1)N 62a_100000210303_100000210019 [1,1,0,0,0,0|2,0,0]=4 1137 B11R1.24 CCCSc1cccc(c1)O 271570a_203496583355_200009815762 [1,1,0,0,0,0|1,0,0]=3 1138 B11R1.24 CCCSc1cccc(c1)O 62a_100000210303_100000211634 [1,1,0,0,0,0|1,0,0]=3 1139 B11R1.24 CCCSc1cccc(c1)[S] 62a_100000210303_114929384022 [1,1,0,0,0,0|1,1,0]=4 1140 B11R1.24 CCCSc1cccc(c1)[S] 62a_114929384022_100000210303 [1,1,0,0,0,0|1,1,0]=4 1141 B11R1.24 CCCSc1cncc(c1)O 62a_100000210303_100000754920 [1,1,0,0,0,0|2,0,0]=4 1142 B11R1.24 CCCSc1cncc(c1)O 62a_100000754920_100000210303 [1,1,0,0,0,0|2,0,0]=4 1143 B11R1.24 CCNCc1cccc(c1)Br 207a_100015525214_100000210085 [1,1,0,0,0,0|2,0,0]=4 1144 B11R1.24 CCNCc1cccc(c1)Br 2230a_100000174977_100000210202 [1,1,0,0,0,0|2,0,0]=4 1145 B11R1.24 CCNCc1cccc(c1)Br 2230a_100015525214_100000698116 [1,1,0,0,0,0|2,0,0]=4 1146 B11R1.24 CCNCc1cccc(c1)Br 270004a_100015525214_100000210085 [1,1,0,0,0,0|2,0,0]=4 1147 B11R1.24 CCNCc1cccc(c1)Br 34a_100000174977_100000210202 [1,1,0,0,0,0|2,0,0]=4 1148 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [1,1,0,0,0,0|2,0,0]=4 1149 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [1,1,0,0,0,0|2,0,0]=4 1150 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [1,1,0,0,0,0|2,0,0]=4 1151 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [1,1,0,0,0,0|2,0,0]=4 1152 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [1,1,0,0,0,0|2,0,0]=4 1153 B11R1.24 CCNCc1cccc(c1)Cl 207a_100015525214_100000210801 [1,1,0,0,0,0|2,0,0]=4 1154 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100000174878_100000210202 [1,1,0,0,0,0|2,0,0]=4 1155 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100015525214_100000181238 [1,1,0,0,0,0|2,0,0]=4 1156 B11R1.24 CCNCc1cccc(c1)Cl 270004a_100015525214_100000210801 [1,1,0,0,0,0|2,0,0]=4 1157 B11R1.24 CCNCc1cccc(c1)Cl 34a_100000174878_100000210202 [1,1,0,0,0,0|2,0,0]=4 1158 B11R1.24 CCNCc1cccc(c1)F 207a_100015525214_100000210812 [1,1,0,0,0,0|2,0,0]=4 1159 B11R1.24 CCNCc1cccc(c1)F 2230a_100000174948_100000210202 [1,1,0,0,0,0|2,0,0]=4 1160 B11R1.24 CCNCc1cccc(c1)F 2230a_100015525214_100000230114 [1,1,0,0,0,0|2,0,0]=4 1161 B11R1.24 CCNCc1cccc(c1)F 270004a_100015525214_100000210812 [1,1,0,0,0,0|2,0,0]=4 1162 B11R1.24 CCNCc1cccc(c1)F 34a_100000174948_100000210202 [1,1,0,0,0,0|2,0,0]=4 1163 B11R1.24 CCNCc1cccc(c1)I 207a_100015525214_100000014684 [1,1,0,0,0,0|2,0,0]=4 1164 B11R1.24 CCNCc1cccc(c1)I 2230a_100000106179_100000210202 [1,1,0,0,0,0|2,0,0]=4 1165 B11R1.24 CCNCc1cccc(c1)I 2230a_100015525214_100011218688 [1,1,0,0,0,0|2,0,0]=4 1166 B11R1.24 CCNCc1cccc(c1)I 270004a_100015525214_100000014684 [1,1,0,0,0,0|2,0,0]=4 1167 B11R1.24 CCNCc1cccc(c1)I 34a_100000106179_100000210202 [1,1,0,0,0,0|2,0,0]=4 1168 B11R1.24 CCNCc1cccc(c1)O 207a_100015525214_100000188321 [1,1,0,0,0,0|1,0,0]=3 1169 B11R1.24 CCNCc1cccc(c1)O 2230a_100000743036_100000210202 [1,1,0,0,0,0|1,0,0]=3 1170 B11R1.24 CCNCc1cccc(c1)O 2230a_100015525214_100011660834 [1,1,0,0,0,0|1,0,0]=3 1171 B11R1.24 CCNCc1cccc(c1)O 270004a_100015525214_100000188321 [1,1,0,0,0,0|1,0,0]=3 1172 B11R1.24 CCNCc1cccc(c1)O 271570a_203496583355_100000187426 [1,1,0,0,0,0|1,0,0]=3 1173 B11R1.24 CCNCc1cccc(c1)O 34a_100000743036_100000210202 [1,1,0,0,0,0|1,0,0]=3 1174 B11R1.24 CCNCc1ccnc(c1)O 207a_100015525214_100000688113 [1,1,0,0,0,0|2,0,0]=4 1175 B11R1.24 CCNCc1cncc(c1)O 207a_100015525214_100012187055 [1,1,0,0,0,0|2,0,0]=4 1176 B11R1.24 CCNCc1cncc(c1)O 270004a_100015525214_100012187055 [1,1,0,0,0,0|2,0,0]=4 1177 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [1,1,0,0,0,0|2,0,0]=4 1178 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [1,1,0,0,0,0|2,0,0]=4 1179 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [1,1,0,0,0,0|2,0,0]=4 1180 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [1,1,0,0,0,0|2,0,0]=4 1181 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [1,1,0,0,0,0|2,0,0]=4 1182 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [1,1,0,0,0,0|2,0,0]=4 1183 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [1,1,0,0,0,0|2,0,0]=4 1184 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [1,1,0,0,0,0|2,0,0]=4 1186 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [1,1,0,0,0,0|2,0,0]=4 1187 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [1,1,0,0,0,0|2,0,0]=4 1188 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [1,1,0,0,0,0|2,0,0]=4 1189 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1190 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [1,1,0,0,0,0|2,0,0]=4 1191 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [1,1,0,0,0,0|2,0,0]=4 1192 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [1,1,0,0,0,0|2,0,0]=4 1193 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [1,1,0,0,0,0|1,0,0]=3 1194 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [1,1,0,0,0,0|1,0,0]=3 1195 B11R1.24 CCSCc1cccc(c1)Br 62a_100000210202_100000211773 [1,1,0,0,0,0|2,0,0]=4 1196 B11R1.24 CCSCc1cccc(c1)Br 62a_100000211773_100000210202 [1,1,0,0,0,0|2,0,0]=4 1197 B11R1.24 CCSCc1cccc(c1)C 62a_100000210202_100000211840 [1,1,0,0,0,0|2,0,0]=4 1198 B11R1.24 CCSCc1cccc(c1)C 62a_100000211840_100000210202 [1,1,0,0,0,0|2,0,0]=4 1199 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000187163_100000210202 [1,1,0,0,0,0|2,0,0]=4 1200 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000210202_100000187163 [1,1,0,0,0,0|2,0,0]=4 1201 B11R1.24 CCSCc1cccc(c1)F 62a_100000210202_100000230114 [1,1,0,0,0,0|2,0,0]=4 1202 B11R1.24 CCSCc1cccc(c1)F 62a_100000230114_100000210202 [1,1,0,0,0,0|2,0,0]=4 1203 B11R1.24 CCSCc1cccc(c1)I 62a_100000210202_100011218688 [1,1,0,0,0,0|2,0,0]=4 1204 B11R1.24 CCSCc1cccc(c1)I 62a_100011218688_100000210202 [1,1,0,0,0,0|2,0,0]=4 1205 B11R1.24 CCSCc1cccc(c1)O 62a_100000210202_100011660834 [1,1,0,0,0,0|1,0,0]=3 1206 B11R1.24 CCSCc1cccc(c1)O 62a_100011660834_100000210202 [1,1,0,0,0,0|1,0,0]=3 1207 B11R1.24 CNCCc1cccc(c1)Br 2230a_100011207229_200000210301 [1,1,0,0,0,0|1,0,0]=3 1208 B11R1.24 CNCCc1cccc(c1)Br 2230a_106832991635_100011740638 [1,1,0,0,0,0|1,0,0]=3 1209 B11R1.24 CNCCc1cccc(c1)Br 34a_100011207229_200000210301 [1,1,0,0,0,0|1,0,0]=3 1210 B11R1.24 CNCCc1cccc(c1)Br 34a_100102657272_100011740638 [1,1,0,0,0,0|1,0,0]=3 1211 B11R1.24 CNCCc1cccc(c1)Br 7a_106832991635_100011740638 [1,1,0,0,0,0|1,0,0]=3 1212 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [1,1,0,0,0,0|1,0,0]=3 1213 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [1,1,0,0,0,0|1,0,0]=3 1214 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [1,1,0,0,0,0|1,0,0]=3 1215 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [1,1,0,0,0,0|1,0,0]=3 1216 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [1,1,0,0,0,0|1,0,0]=3 1217 B11R1.24 CNCCc1cccc(c1)Cl 2230a_100000185263_200000210301 [1,1,0,0,0,0|1,0,0]=3 1218 B11R1.24 CNCCc1cccc(c1)Cl 2230a_106832991635_100011713710 [1,1,0,0,0,0|1,0,0]=3 1219 B11R1.24 CNCCc1cccc(c1)Cl 34a_100000185263_200000210301 [1,1,0,0,0,0|1,0,0]=3 1220 B11R1.24 CNCCc1cccc(c1)Cl 34a_100102657272_100011713710 [1,1,0,0,0,0|1,0,0]=3 1221 B11R1.24 CNCCc1cccc(c1)Cl 7a_106832991635_100011713710 [1,1,0,0,0,0|1,0,0]=3 1222 B11R1.24 CNCCc1cccc(c1)F 2230a_100000205154_200000210301 [1,1,0,0,0,0|1,0,0]=3 1223 B11R1.24 CNCCc1cccc(c1)F 2230a_106832991635_100011217235 [1,1,0,0,0,0|1,0,0]=3 1224 B11R1.24 CNCCc1cccc(c1)F 34a_100000205154_200000210301 [1,1,0,0,0,0|1,0,0]=3 1225 B11R1.24 CNCCc1cccc(c1)F 34a_100102657272_100011217235 [1,1,0,0,0,0|1,0,0]=3 1226 B11R1.24 CNCCc1cccc(c1)F 7a_106832991635_100011217235 [1,1,0,0,0,0|1,0,0]=3 1227 B11R1.24 CNCCc1cccc(c1)O 2230a_100000747277_200000210301 [1,1,0,0,0,0|0,0,0]=2 1228 B11R1.24 CNCCc1cccc(c1)O 34a_100000747277_200000210301 [1,1,0,0,0,0|0,0,0]=2 1229 B11R1.24 CNCCc1cccc(n1)C 2230a_100011824523_200000210301 [1,1,0,0,0,0|2,0,0]=4 1230 B11R1.24 CNCCc1cccc(n1)C 34a_100011824523_200000210301 [1,1,0,0,0,0|2,0,0]=4 1231 B11R1.24 COCCc1cccc(c1)Br 34a_100011217444_200000210301 [1,1,0,0,0,0|2,0,0]=4 1232 B11R1.24 COCCc1cccc(c1)Br 34a_100138415774_100011740638 [1,1,0,0,0,0|2,0,0]=4 1233 B11R1.24 COCCc1cccc(c1)Br 7a_100011217444_200000210301 [1,1,0,0,0,0|2,0,0]=4 1234 B11R1.24 COCCc1cccc(c1)C 34a_100011217157_200000210301 [1,1,0,0,0,0|2,0,0]=4 1235 B11R1.24 COCCc1cccc(c1)C 34a_100138415774_100011713685 [1,1,0,0,0,0|2,0,0]=4 1236 B11R1.24 COCCc1cccc(c1)C 7a_100011217157_200000210301 [1,1,0,0,0,0|2,0,0]=4 1237 B11R1.24 COCCc1cccc(c1)Cl 34a_100000754733_200000210301 [1,1,0,0,0,0|2,0,0]=4 1238 B11R1.24 COCCc1cccc(c1)Cl 34a_100138415774_100011713710 [1,1,0,0,0,0|2,0,0]=4 1239 B11R1.24 COCCc1cccc(c1)Cl 7a_100000754733_200000210301 [1,1,0,0,0,0|2,0,0]=4 1240 B11R1.24 COCCc1cccc(c1)F 34a_100000763591_200000210301 [1,1,0,0,0,0|2,0,0]=4 1241 B11R1.24 COCCc1cccc(c1)F 34a_100138415774_100011217235 [1,1,0,0,0,0|2,0,0]=4 1242 B11R1.24 COCCc1cccc(c1)F 7a_100000763591_200000210301 [1,1,0,0,0,0|2,0,0]=4 1243 B11R1.24 COCCc1cccc(c1)N 34a_100011996697_200000210301 [1,1,0,0,0,0|2,0,0]=4 1244 B11R1.24 COCOc1cccc(c1)O 271570a_203496583355_100012265688 [1,1,0,0,0,0|2,0,0]=4 1245 B11R1.24 COCSc1cccc(c1)O 62a_100000766300_100000211634 [1,1,0,0,0,0|2,0,0]=4 1246 B11R1.24 CSCCc1cccc(c1)Br 62a_100011740638_200000210301 [1,1,0,0,0,0|2,0,0]=4 1247 B11R1.24 CSCCc1cccc(c1)Br 62a_200000210301_100011740638 [1,1,0,0,0,0|2,0,0]=4 1248 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [1,1,0,0,0,0|2,0,0]=4 1249 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [1,1,0,0,0,0|2,0,0]=4 1250 B11R1.24 CSCCc1cccc(c1)Cl 62a_100011713710_200000210301 [1,1,0,0,0,0|2,0,0]=4 1251 B11R1.24 CSCCc1cccc(c1)Cl 62a_200000210301_100011713710 [1,1,0,0,0,0|2,0,0]=4 1252 B11R1.24 CSCCc1cccc(c1)F 62a_100011217235_200000210301 [1,1,0,0,0,0|2,0,0]=4 1253 B11R1.24 CSCCc1cccc(c1)F 62a_200000210301_100011217235 [1,1,0,0,0,0|2,0,0]=4 1254 B11R1.24 CSCNc1cccc(c1)O 34a_100000210217_100011218213 [1,1,0,0,0,0|2,0,0]=4 1255 B11R1.24 CSCSc1cccc(c1)O 62a_100011218213_100000211634 [1,1,0,0,0,0|2,0,0]=4 1256 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [1,1,0,0,0,0|1,0,0]=3 1257 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [1,1,0,0,0,0|1,0,0]=3 1258 B11R1.24 Cc1cccc(c1)CCO[13CH3] 34a_100011217157_200025704644 [1,1,0,0,0,0|2,0,0]=4 1259 B11R1.24 Cc1cccc(c1)CCO[13CH3] 7a_100011217157_200025704644 [1,1,0,0,0,0|2,0,0]=4 1260 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [1,1,0,0,0,0|2,0,0]=4 1261 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [1,1,0,0,0,0|2,0,0]=4 1262 B11R1.24 Cc1cccc(c1)CNCF 34a_100000185548_100015361967 [1,1,0,0,0,0|2,0,0]=4 1263 B11R1.24 Cc1cccc(c1)COCF 34a_100011217746_100015361967 [1,1,0,0,0,0|2,0,0]=4 1264 B11R1.24 Cc1cccc(c1)COCF 7a_100011217746_100015361967 [1,1,0,0,0,0|2,0,0]=4 1265 B11R1.24 Cc1cccc(c1)CSCF 62a_100000211840_100015361967 [1,1,0,0,0,0|2,0,0]=4 1266 B11R1.24 Cc1cccc(c1)CSCF 62a_100015361967_100000211840 [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.24 Cc1cccc(c1)NCCF 2230a_100000188690_100011217306 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.24 Cc1cccc(c1)NCCF 34a_100000188690_100011217306 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.24 Cc1cccc(c1)NCCO 2230a_100000188690_100000211926 [1,1,0,0,0,0|2,0,0]=4 1270 B11R1.24 Cc1cccc(c1)NCCO 34a_100000188690_100000211926 [1,1,0,0,0,0|2,0,0]=4 1271 B11R1.24 Cc1cccc(c1)OCCF 34a_100000210337_100011217306 [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.24 Cc1cccc(c1)OCCF 7a_100000210337_100011217306 [1,1,0,0,0,0|2,0,0]=4 1273 B11R1.24 Cc1cccc(c1)OCCO 34a_100000210337_100000211926 [1,1,0,0,0,0|2,0,0]=4 1274 B11R1.24 Cc1cccc(c1)OCCO 7a_100000210337_100000211926 [1,1,0,0,0,0|2,0,0]=4 1275 B11R1.24 Cc1cccc(c1)SCCF 62a_100011215228_100011217306 [1,1,0,0,0,0|2,0,0]=4 1276 B11R1.24 Cc1cccc(c1)SCCF 62a_100011217306_100011215228 [1,1,0,0,0,0|2,0,0]=4 1277 B11R1.24 Cc1cccc(c1)SCCO 62a_100000211926_100011215228 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.24 Cc1cccc(c1)SCCO 62a_100011215228_100000211926 [1,1,0,0,0,0|2,0,0]=4 1279 B11R1.24 Cc1cccc(n1)CCN[13CH3] 2230a_100011824523_200025704644 [1,1,0,0,0,0|2,0,0]=4 1280 B11R1.24 Cc1cccc(n1)CCN[13CH3] 34a_100011824523_200025704644 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.24 FCCNc1cccc(c1)Br 34a_100000210019_100011217306 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.24 FCCNc1cccc(c1)Cl 34a_100000185859_100011217306 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.24 FCCNc1cccc(c1)F 34a_100000210047_100011217306 [1,1,0,0,0,0|2,0,0]=4 1284 B11R1.24 FCCNc1cccc(c1)I 34a_100000211102_100011217306 [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.24 FCCOc1cccc(c1)Br 34a_100000210342_100011217306 [1,1,0,0,0,0|2,0,0]=4 1286 B11R1.24 FCCOc1cccc(c1)Br 7a_100000210342_100011217306 [1,1,0,0,0,0|2,0,0]=4 1287 B11R1.24 FCCOc1cccc(c1)Cl 34a_100000210295_100011217306 [1,1,0,0,0,0|2,0,0]=4 1288 B11R1.24 FCCOc1cccc(c1)Cl 7a_100000210295_100011217306 [1,1,0,0,0,0|2,0,0]=4 1289 B11R1.24 FCCOc1cccc(c1)F 34a_100000210426_100011217306 [1,1,0,0,0,0|2,0,0]=4 1290 B11R1.24 FCCOc1cccc(c1)F 7a_100000210426_100011217306 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.24 FCCOc1cccc(c1)I 34a_100000211634_100011217306 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.24 FCCOc1cccc(c1)I 7a_100000211634_100011217306 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.24 FCCSc1cccc(c1)Br 62a_100000691529_100011217306 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.24 FCCSc1cccc(c1)Br 62a_100011217306_100000691529 [1,1,0,0,0,0|2,0,0]=4 1295 B11R1.24 FCCSc1cccc(c1)Cl 62a_100000699651_100011217306 [1,1,0,0,0,0|2,0,0]=4 1296 B11R1.24 FCCSc1cccc(c1)Cl 62a_100011217306_100000699651 [1,1,0,0,0,0|2,0,0]=4 1297 B11R1.24 FCCSc1cccc(c1)F 62a_100000685547_100011217306 [1,1,0,0,0,0|2,0,0]=4 1298 B11R1.24 FCCSc1cccc(c1)F 62a_100011217306_100000685547 [1,1,0,0,0,0|2,0,0]=4 1299 B11R1.24 FCCSc1cccc(c1)[S] 62a_100011217306_114929384022 [1,1,0,0,0,0|1,1,0]=4 1300 B11R1.24 FCCSc1cccc(c1)[S] 62a_114929384022_100011217306 [1,1,0,0,0,0|1,1,0]=4 1301 B11R1.24 FCNCc1cccc(c1)Br 34a_100000174977_100015361967 [1,1,0,0,0,0|2,0,0]=4 1302 B11R1.24 FCNCc1cccc(c1)Cl 34a_100000174878_100015361967 [1,1,0,0,0,0|2,0,0]=4 1303 B11R1.24 FCNCc1cccc(c1)F 34a_100000174948_100015361967 [1,1,0,0,0,0|2,0,0]=4 1304 B11R1.24 FCNCc1cccc(c1)I 34a_100000106179_100015361967 [1,1,0,0,0,0|2,0,0]=4 1305 B11R1.24 FCOCc1cccc(c1)Br 34a_100000687537_100015361967 [1,1,0,0,0,0|2,0,0]=4 1306 B11R1.24 FCOCc1cccc(c1)Br 7a_100000687537_100015361967 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.24 FCOCc1cccc(c1)Cl 34a_100000241301_100015361967 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.24 FCOCc1cccc(c1)Cl 7a_100000241301_100015361967 [1,1,0,0,0,0|2,0,0]=4 1309 B11R1.24 FCOCc1cccc(c1)F 34a_100000210976_100015361967 [1,1,0,0,0,0|2,0,0]=4 1310 B11R1.24 FCOCc1cccc(c1)F 7a_100000210976_100015361967 [1,1,0,0,0,0|2,0,0]=4 1311 B11R1.24 FCOCc1cccc(c1)I 34a_100011215336_100015361967 [1,1,0,0,0,0|2,0,0]=4 1312 B11R1.24 FCOCc1cccc(c1)I 7a_100011215336_100015361967 [1,1,0,0,0,0|2,0,0]=4 1313 B11R1.24 FCSCc1cccc(c1)Br 62a_100000211773_100015361967 [1,1,0,0,0,0|2,0,0]=4 1314 B11R1.24 FCSCc1cccc(c1)Br 62a_100015361967_100000211773 [1,1,0,0,0,0|2,0,0]=4 1315 B11R1.24 FCSCc1cccc(c1)Cl 62a_100000187163_100015361967 [1,1,0,0,0,0|2,0,0]=4 1316 B11R1.24 FCSCc1cccc(c1)Cl 62a_100015361967_100000187163 [1,1,0,0,0,0|2,0,0]=4 1317 B11R1.24 FCSCc1cccc(c1)F 62a_100000230114_100015361967 [1,1,0,0,0,0|2,0,0]=4 1318 B11R1.24 FCSCc1cccc(c1)F 62a_100015361967_100000230114 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.24 FCSCc1cccc(c1)I 62a_100011218688_100015361967 [1,1,0,0,0,0|2,0,0]=4 1320 B11R1.24 FCSCc1cccc(c1)I 62a_100015361967_100011218688 [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.24 N#CCCc1cccc(c1)O 271570a_203496583355_100011219771 [1,1,0,0,0,0|0,0,1]=3 1322 B11R1.24 N#CCOc1cccc(c1)O 271570a_203496583355_200000169433 [1,1,0,0,0,0|0,0,2]=4 1323 B11R1.24 N#CCSc1cccc(c1)O 271570a_203496583355_200011756096 [1,1,0,0,0,0|0,0,2]=4 1324 B11R1.24 N#CCSc1cccc(c1)O 62a_100011215382_100000211634 [1,1,0,0,0,0|0,0,2]=4 1325 B11R1.24 N#CSCc1cccc(c1)O 271570a_203496583355_200010199461 [1,1,0,0,0,0|0,0,2]=4 1326 B11R1.24 NCCCc1cccc(c1)O 271570a_203496583355_100000753791 [1,1,0,0,0,0|0,0,0]=2 1327 B11R1.24 NCCOc1cccc(c1)O 271570a_203496583355_100000743521 [1,1,0,0,0,0|0,0,0]=2 1328 B11R1.24 Nc1cccc(c1)COCF 34a_100000211919_100015361967 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.24 Nc1cccc(c1)OCCF 34a_100000210217_100011217306 [1,1,0,0,0,0|2,0,0]=4 1330 B11R1.24 Nc1cccc(c1)OCCO 34a_100000210217_100000211926 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.24 Nc1cccc(c1)SCCF 62a_100000210019_100011217306 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.24 Nc1cccc(c1)SCCF 62a_100011217306_100000210019 [1,1,0,0,0,0|2,0,0]=4 1333 B11R1.24 Nc1cccc(c1)SCCO 62a_100000210019_100000211926 [1,1,0,0,0,0|2,0,0]=4 1334 B11R1.24 Nc1cccc(c1)SCCO 62a_100000211926_100000210019 [1,1,0,0,0,0|2,0,0]=4 1335 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [1,1,0,0,0,0|1,0,1]=4 1336 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [1,1,0,0,0,0|1,0,1]=4 1337 B11R1.24 OCC#Cc1cccc(c1)O 271570a_203496583355_100009814051 [1,1,0,0,0,0|1,0,1]=4 1338 B11R1.24 OCCCc1cccc(c1)O 271570a_203496583355_100011709248 [1,1,0,0,0,0|1,0,0]=3 1339 B11R1.24 OCCNc1cccc(c1)Br 34a_100000210019_100000211926 [1,1,0,0,0,0|2,0,0]=4 1340 B11R1.24 OCCNc1cccc(c1)Cl 34a_100000185859_100000211926 [1,1,0,0,0,0|2,0,0]=4 1341 B11R1.24 OCCNc1cccc(c1)F 34a_100000210047_100000211926 [1,1,0,0,0,0|2,0,0]=4 1342 B11R1.24 OCCNc1cccc(c1)I 34a_100000211102_100000211926 [1,1,0,0,0,0|2,0,0]=4 1343 B11R1.24 OCCNc1cccc(c1)O 34a_100000210217_100000211926 [1,1,0,0,0,0|1,0,0]=3 1344 B11R1.24 OCCNc1cccc(n1)O 271570a_203496583355_200011880208 [1,1,0,0,0,0|2,0,0]=4 1345 B11R1.24 OCCOc1cccc(c1)Br 34a_100000210342_100000211926 [1,1,0,0,0,0|2,0,0]=4 1346 B11R1.24 OCCOc1cccc(c1)Br 7a_100000210342_100000211926 [1,1,0,0,0,0|2,0,0]=4 1347 B11R1.24 OCCOc1cccc(c1)Cl 34a_100000210295_100000211926 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.24 OCCOc1cccc(c1)Cl 7a_100000210295_100000211926 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.24 OCCOc1cccc(c1)F 34a_100000210426_100000211926 [1,1,0,0,0,0|2,0,0]=4 1350 B11R1.24 OCCOc1cccc(c1)F 7a_100000210426_100000211926 [1,1,0,0,0,0|2,0,0]=4 1351 B11R1.24 OCCOc1cccc(c1)I 34a_100000211634_100000211926 [1,1,0,0,0,0|2,0,0]=4 1352 B11R1.24 OCCOc1cccc(c1)I 7a_100000211634_100000211926 [1,1,0,0,0,0|2,0,0]=4 1353 B11R1.24 OCCOc1cccc(c1)O 271570a_203496583355_100000757546 [1,1,0,0,0,0|1,0,0]=3 1354 B11R1.24 OCCSc1cc(ccn1)O 62a_100000211926_100000762945 [1,1,0,0,0,0|2,0,0]=4 1355 B11R1.24 OCCSc1cccc(c1)Br 62a_100000211926_100000691529 [1,1,0,0,0,0|2,0,0]=4 1356 B11R1.24 OCCSc1cccc(c1)Br 62a_100000691529_100000211926 [1,1,0,0,0,0|2,0,0]=4 1357 B11R1.24 OCCSc1cccc(c1)Cl 62a_100000211926_100000699651 [1,1,0,0,0,0|2,0,0]=4 1358 B11R1.24 OCCSc1cccc(c1)Cl 62a_100000699651_100000211926 [1,1,0,0,0,0|2,0,0]=4 1359 B11R1.24 OCCSc1cccc(c1)F 62a_100000211926_100000685547 [1,1,0,0,0,0|2,0,0]=4 1360 B11R1.24 OCCSc1cccc(c1)F 62a_100000685547_100000211926 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.24 OCCSc1cccc(c1)O 271570a_203496583355_200011756134 [1,1,0,0,0,0|1,0,0]=3 1362 B11R1.24 OCCSc1cccc(c1)O 62a_100000211926_100000211634 [1,1,0,0,0,0|1,0,0]=3 1363 B11R1.24 OCCSc1cccc(c1)[S] 62a_100000211926_114929384022 [1,1,0,0,0,0|1,1,0]=4 1364 B11R1.24 OCCSc1cccc(c1)[S] 62a_114929384022_100000211926 [1,1,0,0,0,0|1,1,0]=4 1365 B11R1.24 OCCSc1cncc(c1)O 62a_100000211926_100000754920 [1,1,0,0,0,0|2,0,0]=4 1366 B11R1.24 OCCSc1cncc(c1)O 62a_100000754920_100000211926 [1,1,0,0,0,0|2,0,0]=4 1367 B11R1.24 Oc1cccc(c1)CNCF 34a_100000743036_100015361967 [1,1,0,0,0,0|1,0,0]=3 1368 B11R1.24 Oc1cccc(c1)CSCF 62a_100011660834_100015361967 [1,1,0,0,0,0|1,0,0]=3 1369 B11R1.24 Oc1cccc(c1)CSCF 62a_100015361967_100011660834 [1,1,0,0,0,0|1,0,0]=3 1370 B11R1.24 Oc1cccc(c1)NCCF 34a_100000210217_100011217306 [1,1,0,0,0,0|1,0,0]=3 1371 B11R1.24 Oc1cccc(c1)SCCF 62a_100011217306_100000211634 [1,1,0,0,0,0|1,0,0]=3 1372 B11R1.24 Oc1ccnc(c1)SCCF 62a_100011217306_100000762945 [1,1,0,0,0,0|2,0,0]=4 1373 B11R1.24 Oc1cncc(c1)SCCF 62a_100000754920_100011217306 [1,1,0,0,0,0|2,0,0]=4 1374 B11R1.24 Oc1cncc(c1)SCCF 62a_100011217306_100000754920 [1,1,0,0,0,0|2,0,0]=4 1375 B11R1.24 [13CH3]NCCc1cccc(c1)Br 2230a_100011207229_200025704644 [1,1,0,0,0,0|1,0,0]=3 1376 B11R1.24 [13CH3]NCCc1cccc(c1)Br 34a_100011207229_200025704644 [1,1,0,0,0,0|1,0,0]=3 1377 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 2230a_100000185263_200025704644 [1,1,0,0,0,0|1,0,0]=3 1378 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 34a_100000185263_200025704644 [1,1,0,0,0,0|1,0,0]=3 1379 B11R1.24 [13CH3]NCCc1cccc(c1)F 2230a_100000205154_200025704644 [1,1,0,0,0,0|1,0,0]=3 1380 B11R1.24 [13CH3]NCCc1cccc(c1)F 34a_100000205154_200025704644 [1,1,0,0,0,0|1,0,0]=3 1381 B11R1.24 [13CH3]NCCc1cccc(c1)O 2230a_100000747277_200025704644 [1,1,0,0,0,0|0,0,0]=2 1382 B11R1.24 [13CH3]NCCc1cccc(c1)O 34a_100000747277_200025704644 [1,1,0,0,0,0|0,0,0]=2 1383 B11R1.24 [13CH3]OCCc1cccc(c1)Br 34a_100011217444_200025704644 [1,1,0,0,0,0|2,0,0]=4 1384 B11R1.24 [13CH3]OCCc1cccc(c1)Br 7a_100011217444_200025704644 [1,1,0,0,0,0|2,0,0]=4 1385 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 34a_100000754733_200025704644 [1,1,0,0,0,0|2,0,0]=4 1386 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 7a_100000754733_200025704644 [1,1,0,0,0,0|2,0,0]=4 1387 B11R1.24 [13CH3]OCCc1cccc(c1)F 34a_100000763591_200025704644 [1,1,0,0,0,0|2,0,0]=4 1388 B11R1.24 [13CH3]OCCc1cccc(c1)F 7a_100000763591_200025704644 [1,1,0,0,0,0|2,0,0]=4 1389 B11R1.24 [13CH3]OCCc1cccc(c1)N 34a_100011996697_200025704644 [1,1,0,0,0,0|2,0,0]=4 1390 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_100011740638_200025704644 [1,1,0,0,0,0|2,0,0]=4 1391 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_200025704644_100011740638 [1,1,0,0,0,0|2,0,0]=4 1392 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_100011713710_200025704644 [1,1,0,0,0,0|2,0,0]=4 1393 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_200025704644_100011713710 [1,1,0,0,0,0|2,0,0]=4 1394 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_100011217235_200025704644 [1,1,0,0,0,0|2,0,0]=4 1395 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_200025704644_100011217235 [1,1,0,0,0,0|2,0,0]=4 1396 B11R1.34 CCNc1cc(cc(c1)Cl)O 34a_100000123917_100000210202 [1,1,0,0,0,0|2,0,0]=4 1397 B11R1.34 CCNc1cc(cc(c1)Cl)O 7a_100000123917_100000210202 [1,1,0,0,0,0|2,0,0]=4 1398 B11R1.34 CCNc1cc(cc(c1)O)C 34a_100011995906_100000210202 [1,1,0,0,0,0|2,0,0]=4 1399 B11R1.34 CCNc1cc(cc(c1)O)C 7a_100011995906_100000210202 [1,1,0,0,0,0|2,0,0]=4 1400 B11R1.34 CCNc1cc(cc(c1)O)O 34a_100000043371_100000210202 [1,1,0,0,0,0|2,0,0]=4 1401 B11R1.34 CCOc1cc(cc(c1)F)O 271570a_203496583355_100012343907 [1,1,0,0,0,0|2,0,0]=4 1402 B11R1.34 CCSc1cc(cc(c1)Br)O 62a_100000210202_100010068917 [1,1,0,0,0,0|2,0,0]=4 1403 B11R1.34 CCSc1cc(cc(c1)Br)O 62a_100010068917_100000210202 [1,1,0,0,0,0|2,0,0]=4 1404 B11R1.34 CCSc1cc(cc(c1)Cl)O 62a_100000210202_100010068924 [1,1,0,0,0,0|2,0,0]=4 1405 B11R1.34 CCSc1cc(cc(c1)Cl)O 62a_100010068924_100000210202 [1,1,0,0,0,0|2,0,0]=4 1406 B11R1.34 CCSc1cc(cc(c1)F)O 62a_100000210202_100000688818 [1,1,0,0,0,0|2,0,0]=4 1407 B11R1.34 CCSc1cc(cc(c1)F)O 62a_100000688818_100000210202 [1,1,0,0,0,0|2,0,0]=4 1408 B11R1.34 CCSc1cc(cc(c1)O)C 62a_100000210202_100011999630 [1,1,0,0,0,0|2,0,0]=4 1409 B11R1.34 CCSc1cc(cc(c1)O)O 62a_100000210202_100009868816 [1,1,0,0,0,0|2,0,0]=4 1410 B11R1.34 CNCc1cc(cc(c1)Br)O 207a_100102657272_100010176088 [1,1,0,0,0,0|2,0,0]=4 1411 B11R1.34 CNCc1cc(cc(c1)Br)O 270004a_106832991635_100010176088 [1,1,0,0,0,0|2,0,0]=4 1412 B11R1.34 CNCc1cc(cc(c1)Cl)O 207a_100102657272_100000050827 [1,1,0,0,0,0|2,0,0]=4 1413 B11R1.34 CNCc1cc(cc(c1)Cl)O 2230a_107254831445_200000210301 [1,1,0,0,0,0|2,0,0]=4 1414 B11R1.34 CNCc1cc(cc(c1)Cl)O 270004a_106832991635_100000050827 [1,1,0,0,0,0|2,0,0]=4 1415 B11R1.34 CNCc1cc(cc(c1)Cl)O 34a_107254831445_200000210301 [1,1,0,0,0,0|2,0,0]=4 1416 B11R1.34 CNCc1cc(cc(c1)F)O 207a_100102657272_100000703664 [1,1,0,0,0,0|2,0,0]=4 1417 B11R1.34 CNCc1cc(cc(c1)F)O 2230a_100160469513_200000210301 [1,1,0,0,0,0|2,0,0]=4 1418 B11R1.34 CNCc1cc(cc(c1)F)O 270004a_106832991635_100000703664 [1,1,0,0,0,0|2,0,0]=4 1419 B11R1.34 CNCc1cc(cc(c1)F)O 34a_100160469513_200000210301 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.34 CNCc1cc(cc(c1)O)C 207a_100102657272_100009853434 [1,1,0,0,0,0|2,0,0]=4 1421 B11R1.34 CNCc1cc(cc(c1)O)C 270004a_106832991635_100009853434 [1,1,0,0,0,0|2,0,0]=4 1422 B11R1.34 CNCc1cc(cc(c1)O)O 207a_100102657272_100000043415 [1,1,0,0,0,0|2,0,0]=4 1423 B11R1.34 CNCc1cc(cc(c1)O)O 2230a_100159270720_200000210301 [1,1,0,0,0,0|2,0,0]=4 1424 B11R1.34 CNCc1cc(cc(c1)O)O 34a_100159270720_200000210301 [1,1,0,0,0,0|2,0,0]=4 1425 B11R1.34 COCc1cc(cc(c1)F)O 271570a_203496583355_100012630430 [1,1,0,0,0,0|2,0,0]=4 1426 B11R1.34 Cc1cc(cc(c1)NCF)O 34a_100011995906_100015361967 [1,1,0,0,0,0|2,0,0]=4 1427 B11R1.34 Cc1cc(cc(c1)NCF)O 7a_100011995906_100015361967 [1,1,0,0,0,0|2,0,0]=4 1428 B11R1.34 Cc1cc(cc(c1)SCF)O 62a_100015361967_100011999630 [1,1,0,0,0,0|2,0,0]=4 1429 B11R1.34 N#CCc1cc(cc(c1)F)O 271570a_203496583355_100000729538 [1,1,0,0,0,0|0,0,2]=4 1430 B11R1.34 OCCc1cc(cc(c1)F)O 271570a_203496583355_100012630564 [1,1,0,0,0,0|1,0,0]=3 1431 B11R1.34 Oc1cc(cc(c1)NCF)Cl 34a_100000123917_100015361967 [1,1,0,0,0,0|2,0,0]=4 1432 B11R1.34 Oc1cc(cc(c1)NCF)Cl 7a_100000123917_100015361967 [1,1,0,0,0,0|2,0,0]=4 1433 B11R1.34 Oc1cc(cc(c1)NCF)O 34a_100000043371_100015361967 [1,1,0,0,0,0|2,0,0]=4 1434 B11R1.34 Oc1cc(cc(c1)SCF)Br 62a_100010068917_100015361967 [1,1,0,0,0,0|2,0,0]=4 1435 B11R1.34 Oc1cc(cc(c1)SCF)Br 62a_100015361967_100010068917 [1,1,0,0,0,0|2,0,0]=4 1436 B11R1.34 Oc1cc(cc(c1)SCF)Cl 62a_100010068924_100015361967 [1,1,0,0,0,0|2,0,0]=4 1437 B11R1.34 Oc1cc(cc(c1)SCF)Cl 62a_100015361967_100010068924 [1,1,0,0,0,0|2,0,0]=4 1438 B11R1.34 Oc1cc(cc(c1)SCF)F 62a_100000688818_100015361967 [1,1,0,0,0,0|2,0,0]=4 1439 B11R1.34 Oc1cc(cc(c1)SCF)F 62a_100015361967_100000688818 [1,1,0,0,0,0|2,0,0]=4 1440 B11R1.34 Oc1cc(cc(c1)SCF)O 62a_100015361967_100009868816 [1,1,0,0,0,0|2,0,0]=4 1441 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 2230a_107254831445_200025704644 [1,1,0,0,0,0|2,0,0]=4 1442 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 34a_107254831445_200025704644 [1,1,0,0,0,0|2,0,0]=4 1443 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 2230a_100160469513_200025704644 [1,1,0,0,0,0|2,0,0]=4 1444 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 34a_100160469513_200025704644 [1,1,0,0,0,0|2,0,0]=4 1445 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 2230a_100159270720_200025704644 [1,1,0,0,0,0|2,0,0]=4 1446 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 34a_100159270720_200025704644 [1,1,0,0,0,0|2,0,0]=4 1447 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,1,0,0,0,0|1,0,1]=4 1448 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,1,0,0,0,0|1,0,1]=4 1449 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,1,0,0,0,0|1,0,1]=4 1450 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [1,1,0,0,0,0|1,0,0]=3 1451 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [1,1,0,0,0,0|2,0,0]=4 1452 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [1,1,0,0,0,0|2,0,0]=4 1453 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [1,1,0,0,0,0|2,0,0]=4 1454 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [1,1,0,0,0,0|2,0,0]=4 1455 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [1,1,0,0,0,0|2,0,0]=4 1456 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [1,1,0,0,0,0|2,0,0]=4 1457 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [1,1,0,0,0,0|2,0,0]=4 1458 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [1,1,0,0,0,0|2,0,0]=4 1459 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [1,1,0,0,0,0|2,0,0]=4 1460 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [1,1,0,0,0,0|2,0,0]=4 1461 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [1,1,0,0,0,0|2,0,0]=4 1462 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [1,1,0,0,0,0|2,0,0]=4 1463 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [1,1,0,0,0,0|2,0,0]=4 1464 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [1,1,0,0,0,0|0,0,1]=3 1465 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [1,1,0,0,0,0|1,0,1]=4 1466 B11R1.157 Oc1cccc(c1)OC(F)F 271570a_203496583355_100000179092 [1,1,0,0,0,0|2,0,0]=4 1467 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,1,0,0,0,0|1,0,1]=4 1468 B11R1.182 CCNc1cc(ccc1Br)O 34a_100011999798_100000210202 [1,1,0,0,0,0|2,0,0]=4 1469 B11R1.182 CCNc1cc(ccc1C)O 34a_100011216113_100000210202 [1,1,0,0,0,0|2,0,0]=4 1470 B11R1.182 CCNc1cc(ccc1Cl)O 34a_100011934297_100000210202 [1,1,0,0,0,0|2,0,0]=4 1471 B11R1.182 CCNc1cc(ccc1F)O 34a_100012017239_100000210202 [1,1,0,0,0,0|2,0,0]=4 1472 B11R1.182 CCNc1cc(ccc1N)O 271570a_203496583355_100000696630 [1,1,0,0,0,0|2,0,0]=4 1473 B11R1.182 CCOc1cc(ccc1C)O 271570a_203496583355_100012361169 [1,1,0,0,0,0|2,0,0]=4 1474 B11R1.182 CCOc1cc(ccc1F)O 271570a_203496583355_200012344967 [1,1,0,0,0,0|2,0,0]=4 1475 B11R1.182 CCOc1cc(ccc1N)O 271570a_203496583355_100000688918 [1,1,0,0,0,0|2,0,0]=4 1476 B11R1.182 CCSc1cc(ccc1Br)O 62a_100000210202_100012339312 [1,1,0,0,0,0|2,0,0]=4 1477 B11R1.182 CCSc1cc(ccc1Br)O 62a_100012339312_100000210202 [1,1,0,0,0,0|2,0,0]=4 1478 B11R1.182 CCSc1cc(ccc1C)O 62a_100000210202_100011380479 [1,1,0,0,0,0|2,0,0]=4 1479 B11R1.182 CCSc1cc(ccc1C)O 62a_100011380479_100000210202 [1,1,0,0,0,0|2,0,0]=4 1480 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000049588_100000210202 [1,1,0,0,0,0|2,0,0]=4 1481 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000210202_100000049588 [1,1,0,0,0,0|2,0,0]=4 1482 B11R1.182 CCSc1cc(ccc1F)O 62a_100000210202_100000693481 [1,1,0,0,0,0|2,0,0]=4 1483 B11R1.182 CCSc1cc(ccc1F)O 62a_100000693481_100000210202 [1,1,0,0,0,0|2,0,0]=4 1484 B11R1.182 CCSc1cc(ccc1N)O 62a_100000210202_100012001276 [1,1,0,0,0,0|2,0,0]=4 1485 B11R1.182 CCSc1cc(ccc1N)O 62a_100012001276_100000210202 [1,1,0,0,0,0|2,0,0]=4 1486 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [1,1,0,0,0,0|2,0,0]=4 1487 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [1,1,0,0,0,0|2,0,0]=4 1488 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [1,1,0,0,0,0|2,0,0]=4 1489 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [1,1,0,0,0,0|2,0,0]=4 1490 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,1,0,0,0,0|2,0,0]=4 1491 B11R1.182 COCc1cc(ccc1Br)O 271570a_203496583355_202125822959 [1,1,0,0,0,0|2,0,0]=4 1492 B11R1.182 COCc1cc(ccc1F)O 271570a_203496583355_100010140362 [1,1,0,0,0,0|2,0,0]=4 1493 B11R1.182 Cc1ccc(cc1CC#N)O 271570a_203496583355_100010147029 [1,1,0,0,0,0|0,0,2]=4 1494 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [1,1,0,0,0,0|2,0,0]=4 1495 B11R1.182 Cc1ccc(cc1NCF)O 34a_100011216113_100015361967 [1,1,0,0,0,0|2,0,0]=4 1496 B11R1.182 Cc1ccc(cc1SCF)O 62a_100011380479_100015361967 [1,1,0,0,0,0|2,0,0]=4 1497 B11R1.182 Cc1ccc(cc1SCF)O 62a_100015361967_100011380479 [1,1,0,0,0,0|2,0,0]=4 1498 B11R1.182 N#CCc1cc(ccc1Br)O 271570a_203496583355_100010146707 [1,1,0,0,0,0|0,0,2]=4 1499 B11R1.182 N#CCc1cc(ccc1F)O 271570a_203496583355_100000739769 [1,1,0,0,0,0|0,0,2]=4 1500 B11R1.182 N#CCc1cc(ccc1N)O 271570a_203496583355_100010188562 [1,1,0,0,0,0|0,0,2]=4 1501 B11R1.182 Nc1ccc(cc1SCF)O 62a_100012001276_100015361967 [1,1,0,0,0,0|2,0,0]=4 1502 B11R1.182 Nc1ccc(cc1SCF)O 62a_100015361967_100012001276 [1,1,0,0,0,0|2,0,0]=4 1503 B11R1.182 Oc1ccc(c(c1)NCF)Br 34a_100011999798_100015361967 [1,1,0,0,0,0|2,0,0]=4 1504 B11R1.182 Oc1ccc(c(c1)NCF)Cl 34a_100011934297_100015361967 [1,1,0,0,0,0|2,0,0]=4 1505 B11R1.182 Oc1ccc(c(c1)NCF)F 34a_100012017239_100015361967 [1,1,0,0,0,0|2,0,0]=4 1506 B11R1.182 Oc1ccc(c(c1)SCF)Br 62a_100012339312_100015361967 [1,1,0,0,0,0|2,0,0]=4 1507 B11R1.182 Oc1ccc(c(c1)SCF)Br 62a_100015361967_100012339312 [1,1,0,0,0,0|2,0,0]=4 1508 B11R1.182 Oc1ccc(c(c1)SCF)Cl 62a_100000049588_100015361967 [1,1,0,0,0,0|2,0,0]=4 1509 B11R1.182 Oc1ccc(c(c1)SCF)Cl 62a_100015361967_100000049588 [1,1,0,0,0,0|2,0,0]=4 1510 B11R1.182 Oc1ccc(c(c1)SCF)F 62a_100000693481_100015361967 [1,1,0,0,0,0|2,0,0]=4 1511 B11R1.182 Oc1ccc(c(c1)SCF)F 62a_100015361967_100000693481 [1,1,0,0,0,0|2,0,0]=4 1512 B11R1.182 Oc1ccc(c(c1)SCF)O 62a_100015361967_100009813629 [1,1,0,0,0,0|2,0,0]=4 1513 B11R1.189 C=Cc1cccc(c1)CCC 271570a_100011290941_100000694964 [1,1,0,0,0,0|2,0,0]=4 1514 B11R1.189 C=Cc1cccc(c1)CCN 271570a_100011290941_100011207229 [1,1,0,0,0,0|1,0,0]=3 1515 B11R1.189 C=Cc1cccc(c1)CCO 271570a_100011290941_100011217444 [1,1,0,0,0,0|2,0,0]=4 1516 B11R1.189 C=Cc1cccc(c1)CNN 271570a_100011290941_100000686200 [1,1,0,0,0,0|2,0,0]=4 1517 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,1,0,0,0,0|1,0,0]=3 1518 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,1,0,0,0,0|1,0,0]=3 1519 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,1,0,0,0,0|1,0,0]=3 1520 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,1,0,0,0,0|1,0,0]=3 1521 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [1,1,0,0,0,0|1,1,0]=4 1522 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [1,1,0,0,0,0|1,1,0]=4 1523 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [1,1,0,0,0,0|1,1,0]=4 1524 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [1,1,0,0,0,0|1,1,0]=4 1525 B11R1.189 CCNc1cccc(c1)CO 2230a_100000211919_100000210202 [1,1,0,0,0,0|2,0,0]=4 1526 B11R1.189 CCNc1cccc(c1)CO 34a_100000211919_100000210202 [1,1,0,0,0,0|2,0,0]=4 1527 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [1,1,0,0,0,0|2,0,0]=4 1528 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [1,1,0,0,0,0|2,0,0]=4 1529 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [1,1,0,0,0,0|2,0,0]=4 1530 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [1,1,0,0,0,0|2,0,0]=4 1531 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [1,1,0,0,0,0|2,0,0]=4 1532 B11R1.189 CCOc1cccc(c1)CO 34a_100011214949_100000210202 [1,1,0,0,0,0|2,0,0]=4 1533 B11R1.189 CCOc1cccc(c1)CO 7a_100011214949_100000210202 [1,1,0,0,0,0|2,0,0]=4 1534 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [1,1,0,0,0,0|2,0,0]=4 1535 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [1,1,0,0,0,0|2,0,0]=4 1536 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [1,1,0,0,0,0|2,0,0]=4 1537 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [1,1,0,0,0,0|2,0,0]=4 1538 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [1,1,0,0,0,0|2,0,0]=4 1539 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [1,1,0,0,0,0|2,0,0]=4 1540 B11R1.189 CCSc1cccc(c1)CO 62a_100000210202_100000687537 [1,1,0,0,0,0|2,0,0]=4 1541 B11R1.189 CCSc1cccc(c1)CO 62a_100000687537_100000210202 [1,1,0,0,0,0|2,0,0]=4 1542 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [1,1,0,0,0,0|2,0,0]=4 1543 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,1,0,0,0,0|2,0,0]=4 1544 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,1,0,0,0,0|2,0,0]=4 1545 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,1,0,0,0,0|2,0,0]=4 1546 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,1,0,0,0,0|2,0,0]=4 1547 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,1,0,0,0,0|2,0,0]=4 1548 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,1,0,0,0,0|2,0,0]=4 1549 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,1,0,0,0,0|2,0,0]=4 1550 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,1,0,0,0,0|2,0,0]=4 1551 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,1,0,0,0,0|2,0,0]=4 1552 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,1,0,0,0,0|2,0,0]=4 1553 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,1,0,0,0,0|2,0,0]=4 1554 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,1,0,0,0,0|2,0,0]=4 1555 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,1,0,0,0,0|2,0,0]=4 1556 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,1,0,0,0,0|2,0,0]=4 1557 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,1,0,0,0,0|2,0,0]=4 1558 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,1,0,0,0,0|2,0,0]=4 1559 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,1,0,0,0,0|2,0,0]=4 1560 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,1,0,0,0,0|2,0,0]=4 1561 B11R1.189 CNc1cccc(c1)CCO 2230a_100011996697_200000210301 [1,1,0,0,0,0|2,0,0]=4 1562 B11R1.189 CNc1cccc(c1)CCO 34a_100011996697_200000210301 [1,1,0,0,0,0|2,0,0]=4 1563 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,1,0,0,0,0|2,0,0]=4 1564 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,1,0,0,0,0|2,0,0]=4 1565 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,1,0,0,0,0|2,0,0]=4 1566 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [1,1,0,0,0,0|0,0,2]=4 1567 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [1,1,0,0,0,0|0,0,0]=2 1568 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [1,1,0,0,0,0|1,0,0]=3 1569 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [1,1,0,0,0,0|1,0,0]=3 1570 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [1,1,0,0,0,0|1,0,0]=3 1571 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,1,0,0,0,0|2,0,0]=4 1572 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,1,0,0,0,0|2,0,0]=4 1573 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,1,0,0,0,0|2,0,0]=4 1574 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,1,0,0,0,0|2,0,0]=4 1575 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,1,0,0,0,0|2,0,0]=4 1576 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,1,0,0,0,0|2,0,0]=4 1577 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,1,0,0,0,0|2,0,0]=4 1578 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [1,1,0,0,0,0|2,0,0]=4 1579 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [1,1,0,0,0,0|2,0,0]=4 1580 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [1,1,0,0,0,0|2,0,0]=4 1581 B11R1.189 COc1cccc(c1)SCF 62a_100015361967_100000170001 [1,1,0,0,0,0|2,0,0]=4 1582 B11R1.189 CSCc1cccc(c1)CO 62a_100010188025_200000210301 [1,1,0,0,0,0|2,0,0]=4 1583 B11R1.189 CSCc1cccc(c1)CO 62a_200000210301_100010188025 [1,1,0,0,0,0|2,0,0]=4 1584 B11R1.189 CSc1cccc(c1)CCN 62a_100011207229_200000210301 [1,1,0,0,0,0|0,1,0]=3 1585 B11R1.189 CSc1cccc(c1)CCN 62a_200000210301_100011207229 [1,1,0,0,0,0|0,1,0]=3 1586 B11R1.189 CSc1cccc(c1)CCO 62a_100011217444_200000210301 [1,1,0,0,0,0|1,1,0]=4 1587 B11R1.189 CSc1cccc(c1)CCO 62a_200000210301_100011217444 [1,1,0,0,0,0|1,1,0]=4 1588 B11R1.189 CSc1cccc(c1)CNN 62a_100000686200_200000210301 [1,1,0,0,0,0|1,1,0]=4 1589 B11R1.189 CSc1cccc(c1)CNN 62a_200000210301_100000686200 [1,1,0,0,0,0|1,1,0]=4 1590 B11R1.189 OCc1cccc(c1)NCF 34a_100000211919_100015361967 [1,1,0,0,0,0|2,0,0]=4 1591 B11R1.189 OCc1cccc(c1)OCF 34a_100011214949_100015361967 [1,1,0,0,0,0|2,0,0]=4 1592 B11R1.189 OCc1cccc(c1)OCF 7a_100011214949_100015361967 [1,1,0,0,0,0|2,0,0]=4 1593 B11R1.189 OCc1cccc(c1)SCF 62a_100000687537_100015361967 [1,1,0,0,0,0|2,0,0]=4 1594 B11R1.189 OCc1cccc(c1)SCF 62a_100015361967_100000687537 [1,1,0,0,0,0|2,0,0]=4 1595 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,1,0,0,0,0|2,0,0]=4 1596 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,1,0,0,0,0|2,0,0]=4 1597 B11R1.189 [13CH3]Nc1cccc(c1)CCO 2230a_100011996697_200025704644 [1,1,0,0,0,0|2,0,0]=4 1598 B11R1.189 [13CH3]Nc1cccc(c1)CCO 34a_100011996697_200025704644 [1,1,0,0,0,0|2,0,0]=4 1599 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [1,1,0,0,0,0|0,0,2]=4 1600 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [1,1,0,0,0,0|0,0,0]=2 1601 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [1,1,0,0,0,0|1,0,0]=3 1602 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [1,1,0,0,0,0|1,0,0]=3 1603 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [1,1,0,0,0,0|1,0,0]=3 1604 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_100010188025_200025704644 [1,1,0,0,0,0|2,0,0]=4 1605 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_200025704644_100010188025 [1,1,0,0,0,0|2,0,0]=4 1606 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_100011207229_200025704644 [1,1,0,0,0,0|0,1,0]=3 1607 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_200025704644_100011207229 [1,1,0,0,0,0|0,1,0]=3 1608 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_100011217444_200025704644 [1,1,0,0,0,0|1,1,0]=4 1609 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_200025704644_100011217444 [1,1,0,0,0,0|1,1,0]=4 1610 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_100000686200_200025704644 [1,1,0,0,0,0|1,1,0]=4 1611 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_200025704644_100000686200 [1,1,0,0,0,0|1,1,0]=4 1612 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,1,0,0,0,0|2,0,0]=4 1613 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [1,1,0,0,0,0|2,0,0]=4 1614 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [1,1,0,0,0,0|2,0,0]=4 1615 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [1,1,0,0,0,0|2,0,0]=4 1616 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [1,1,0,0,0,0|2,0,0]=4 1617 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [1,1,0,0,0,0|2,0,0]=4 1618 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,1,0,0,0,0|2,0,0]=4 1619 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [1,1,0,0,0,0|2,0,0]=4 1620 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [1,1,0,0,0,0|2,0,0]=4 1621 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [1,1,0,0,0,0|2,0,0]=4 1622 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [1,1,0,0,0,0|2,0,0]=4 1623 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [1,1,0,0,0,0|2,0,0]=4 1624 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [1,1,0,0,0,0|2,0,0]=4 1625 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [1,1,0,0,0,0|2,0,0]=4 1626 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [1,1,0,0,0,0|2,0,0]=4 1627 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [1,1,0,0,0,0|2,0,0]=4 1628 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [1,1,0,0,0,0|2,0,0]=4 1629 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [1,1,0,0,0,0|2,0,0]=4 1630 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,1,0,0,0,0|2,0,0]=4 1631 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,1,0,0,0,0|2,0,0]=4 1632 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,1,0,0,0,0|2,0,0]=4 1633 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,1,0,0,0,0|2,0,0]=4 1634 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,1,0,0,0,0|2,0,0]=4 1635 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,1,0,0,0,0|2,0,0]=4 1636 B11R1.192 Cc1ccc(cc1O)NCF 34a_100000759471_100015361967 [1,1,0,0,0,0|2,0,0]=4 1637 B11R1.192 Cc1ccc(cc1O)NCF 7a_100000759471_100015361967 [1,1,0,0,0,0|2,0,0]=4 1638 B11R1.192 Cc1ccc(cc1O)SCF 62a_100000685420_100015361967 [1,1,0,0,0,0|2,0,0]=4 1639 B11R1.192 Cc1ccc(cc1O)SCF 62a_100015361967_100000685420 [1,1,0,0,0,0|2,0,0]=4 1640 B11R1.192 N#CCc1ccc(c(c1)O)F 271570a_203496583355_100000742998 [1,1,0,0,0,0|0,0,2]=4 1641 B11R1.192 N#CCc1ccc(c(c1)O)N 271570a_203496583355_100010188563 [1,1,0,0,0,0|0,0,2]=4 1642 B11R1.192 Nc1ccc(cc1O)SCF 62a_100000739049_100015361967 [1,1,0,0,0,0|2,0,0]=4 1643 B11R1.192 Nc1ccc(cc1O)SCF 62a_100015361967_100000739049 [1,1,0,0,0,0|2,0,0]=4 1644 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [1,1,0,0,0,0|2,0,0]=4 1645 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100012356990_100015361967 [1,1,0,0,0,0|2,0,0]=4 1646 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100015361967_100012356990 [1,1,0,0,0,0|2,0,0]=4 1647 B11R1.192 Oc1cc(ccc1Cl)NCF 34a_100011934209_100015361967 [1,1,0,0,0,0|2,0,0]=4 1648 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100011356854_100015361967 [1,1,0,0,0,0|2,0,0]=4 1649 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100015361967_100011356854 [1,1,0,0,0,0|2,0,0]=4 1650 B11R1.192 Oc1cc(ccc1F)NCF 34a_100012017398_100015361967 [1,1,0,0,0,0|2,0,0]=4 1651 B11R1.192 Oc1cc(ccc1F)NCF 7a_100012017398_100015361967 [1,1,0,0,0,0|2,0,0]=4 1652 B11R1.192 Oc1cc(ccc1F)SCF 62a_100000686035_100015361967 [1,1,0,0,0,0|2,0,0]=4 1653 B11R1.192 Oc1cc(ccc1F)SCF 62a_100015361967_100000686035 [1,1,0,0,0,0|2,0,0]=4 1654 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [1,1,0,0,0,0|2,0,0]=4 1655 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [1,1,0,0,0,0|2,0,0]=4 1656 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,1,0,0,0,0|2,0,0]=4 1657 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,1,0,0,0,0|2,0,0]=4 1658 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,1,0,0,0,0|2,0,0]=4 1659 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 1660 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [1,1,0,0,0,0|1,0,1]=4 1661 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 1662 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [1,1,0,0,0,0|1,0,1]=4 1663 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 1664 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [1,1,0,0,0,0|1,0,1]=4 1665 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 1666 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [1,1,0,0,0,0|1,0,1]=4 1667 B11R1.12 CCC(NC)c1ccccc1 2230a_100000737752_200000210301 [1,1,0,0,0,0|2,0,0]=4 1668 B11R1.12 CCC(NC)c1ccccc1 269862a_106832991636_100000210124 [1,1,0,0,0,0|2,0,0]=4 1669 B11R1.12 CCC(N[13CH3])c1ccccc1 2230a_100000737752_200025704644 [1,1,0,0,0,0|2,0,0]=4 1670 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [1,1,0,0,0,0|1,0,0]=3 1671 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [1,1,0,0,0,0|1,0,0]=3 1672 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [1,1,0,0,0,0|1,0,0]=3 1673 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [1,1,0,0,0,0|1,0,0]=3 1674 B11R1.12 CN[C@H](CO)c1ccccc1 2230a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1675 B11R1.12 CN[C@H](CO)c1ccccc1 34a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1676 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [1,1,0,0,0,0|0,0,2]=4 1677 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [1,1,0,0,0,0|1,0,0]=3 1678 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [1,1,0,0,0,0|0,0,0]=2 1679 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1680 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1681 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 2230a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1682 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 34a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1683 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [1,1,0,0,0,0|0,0,2]=4 1684 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [1,1,0,0,0,0|1,0,0]=3 1685 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [1,1,0,0,0,0|0,0,0]=2 1686 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1687 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1688 B11R1.16 CC(CN[13CH3])c1ccccc1 2230a_100000701038_200025704644 [1,1,0,0,0,0|1,0,0]=3 1689 B11R1.16 CC(CN[13CH3])c1ccccc1 34a_100000701038_200025704644 [1,1,0,0,0,0|1,0,0]=3 1690 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [1,1,0,0,0,0|2,0,0]=4 1691 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [1,1,0,0,0,0|2,0,0]=4 1692 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [1,1,0,0,0,0|2,0,0]=4 1693 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [1,1,0,0,0,0|2,0,0]=4 1694 B11R1.16 CC(SCF)c1ccccc1 62a_100000230085_100015361967 [1,1,0,0,0,0|2,0,0]=4 1695 B11R1.16 CC(SCF)c1ccccc1 62a_100015361967_100000230085 [1,1,0,0,0,0|2,0,0]=4 1696 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [1,1,0,0,0,0|2,0,0]=4 1697 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [1,1,0,0,0,0|2,0,0]=4 1698 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [1,1,0,0,0,0|2,0,0]=4 1699 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [1,1,0,0,0,0|2,0,0]=4 1700 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [1,1,0,0,0,0|2,0,0]=4 1701 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [1,1,0,0,0,0|2,0,0]=4 1702 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [1,1,0,0,0,0|2,0,0]=4 1703 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [1,1,0,0,0,0|2,0,0]=4 1704 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [1,1,0,0,0,0|0,0,2]=4 1705 B11R1.16 CNCC(C)c1ccccc1 2230a_100000701038_200000210301 [1,1,0,0,0,0|1,0,0]=3 1706 B11R1.16 CNCC(C)c1ccccc1 2230a_106832991635_100000756946 [1,1,0,0,0,0|1,0,0]=3 1707 B11R1.16 CNCC(C)c1ccccc1 270004a_106832991635_100000212034 [1,1,0,0,0,0|1,0,0]=3 1708 B11R1.16 CNCC(C)c1ccccc1 34a_100000701038_200000210301 [1,1,0,0,0,0|1,0,0]=3 1709 B11R1.16 CNCC(C)c1ccccc1 34a_100102657272_100000756946 [1,1,0,0,0,0|1,0,0]=3 1710 B11R1.16 CNCC(C)c1ccccc1 7a_106832991635_100000756946 [1,1,0,0,0,0|1,0,0]=3 1711 B11R1.16 CNCC(O)c1ccccc1 2230a_100000210709_200000210301 [1,1,0,0,0,0|0,0,0]=2 1712 B11R1.16 CNCC(O)c1ccccc1 2230a_106832991635_100000185958 [1,1,0,0,0,0|0,0,0]=2 1713 B11R1.16 CNCC(O)c1ccccc1 34a_100102657272_100000185958 [1,1,0,0,0,0|0,0,0]=2 1714 B11R1.16 CNCC(O)c1ccccc1 7a_106832991635_100000185958 [1,1,0,0,0,0|0,0,0]=2 1715 B11R1.16 CNCC(O)c1ccccn1 2230a_100000691469_200000210301 [1,1,0,0,0,0|1,0,0]=3 1716 B11R1.16 CNCC(O)c1cccnc1 2230a_100020605170_200000210301 [1,1,0,0,0,0|1,0,0]=3 1717 B11R1.16 CNC[C@@H](O)c1ccccc1 2230a_106832991635_100011933945 [1,1,0,0,0,0|0,0,0]=2 1718 B11R1.16 CNC[C@@H](O)c1ccccc1 34a_100102657272_100011933945 [1,1,0,0,0,0|0,0,0]=2 1719 B11R1.16 CNC[C@@H](O)c1ccccc1 7a_106832991635_100011933945 [1,1,0,0,0,0|0,0,0]=2 1720 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [1,1,0,0,0,0|2,0,0]=4 1721 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [1,1,0,0,0,0|2,0,0]=4 1722 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [1,1,0,0,0,0|2,0,0]=4 1723 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [1,1,0,0,0,0|1,0,0]=3 1724 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [1,1,0,0,0,0|2,0,0]=4 1725 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [1,1,0,0,0,0|1,0,0]=3 1726 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [1,1,0,0,0,0|2,0,0]=4 1727 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [1,1,0,0,0,0|2,0,0]=4 1728 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [1,1,0,0,0,0|1,0,0]=3 1729 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [1,1,0,0,0,0|1,0,0]=3 1730 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [1,1,0,0,0,0|1,0,0]=3 1731 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [1,1,0,0,0,0|1,0,0]=3 1732 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [1,1,0,0,0,0|2,0,0]=4 1733 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [1,1,0,0,0,0|2,0,0]=4 1734 B11R1.16 [13CH3]NCC(O)c1ccccc1 2230a_100000210709_200025704644 [1,1,0,0,0,0|0,0,0]=2 1735 B11R1.16 [13CH3]NCC(O)c1ccccn1 2230a_100000691469_200025704644 [1,1,0,0,0,0|1,0,0]=3 1736 B11R1.16 [13CH3]NCC(O)c1cccnc1 2230a_100020605170_200025704644 [1,1,0,0,0,0|1,0,0]=3 1737 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [1,1,0,0,0,0|2,0,0]=4 1738 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [1,1,0,0,0,0|1,0,0]=3 1739 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [1,1,0,0,0,0|1,0,0]=3 1740 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [1,1,0,0,0,0|1,0,0]=3 1741 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [1,1,0,0,0,0|1,0,0]=3 1742 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [1,1,0,0,0,0|2,0,0]=4 1743 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [1,1,0,0,0,0|1,0,0]=3 1744 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [1,1,0,0,0,0|2,0,0]=4 1745 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [1,1,0,0,0,0|2,0,0]=4 1746 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [1,1,0,0,0,0|0,0,2]=4 1747 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [1,1,0,0,0,0|0,0,0]=2 1748 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [1,1,0,0,0,0|1,0,0]=3 1749 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,1,0,0,0,0|1,0,1]=4 1750 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,1,0,0,0,0|1,0,1]=4 1751 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [1,1,0,0,0,0|0,0,0]=2 1752 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [1,1,0,0,0,0|2,0,0]=4 1753 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,1,0,0,0,0|1,0,1]=4 1754 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,1,0,0,0,0|1,0,1]=4 1755 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,1,0,0,0,0|1,0,1]=4 1756 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,1,0,0,0,0|1,0,1]=4 1757 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,1,0,0,0,0|1,0,1]=4 1758 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,1,0,0,0,0|1,0,1]=4 1759 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,1,0,0,0,0|0,0,2]=4 1760 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,1,0,0,0,0|0,0,2]=4 1761 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,1,0,0,0,0|0,0,2]=4 1762 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,1,0,0,0,0|0,0,2]=4 1763 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,1,0,0,0,0|0,0,2]=4 1764 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,1,0,0,0,0|0,0,2]=4 1765 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,1,0,0,0,0|0,0,2]=4 1766 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,1,0,0,0,0|0,0,2]=4 1767 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,1,0,0,0,0|0,0,2]=4 1768 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,1,0,0,0,0|0,0,2]=4 1769 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,1,0,0,0,0|0,0,2]=4 1770 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [1,1,0,0,0,0|2,0,0]=4 1771 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [1,1,0,0,0,0|1,0,0]=3 1772 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [1,1,0,0,0,0|0,0,0]=2 1773 B11R1.21 CN(C)c1ccc(c(c1)O)N 271570a_203496583355_200013039233 [1,1,0,0,0,0|2,0,0]=4 1774 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [1,1,0,0,0,0|2,0,0]=4 1775 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [1,1,0,0,0,0|1,0,0]=3 1776 B11R1.21 Cc1ccc(cc1O)B(O)O 271570a_203496583355_200010223333 [1,1,0,0,0,0|2,0,0]=4 1777 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,1,0,0,0,0|0,0,2]=4 1778 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,1,0,0,0,0|0,0,2]=4 1779 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,1,0,0,0,0|0,0,2]=4 1780 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,1,0,0,0,0|0,0,2]=4 1781 B11R1.21 OB(O)c1ccc(c(c1)O)F 271570a_203496583355_100010175509 [1,1,0,0,0,0|2,0,0]=4 1782 B11R1.21 Oc1cc(ccc1F)C(F)F 271570a_203496583355_100010188717 [1,1,0,0,0,0|2,0,0]=4 1783 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,1,0,0,0,0|0,0,2]=4 1784 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,1,0,0,0,0|0,0,2]=4 1785 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,1,0,0,0,0|0,0,2]=4 1786 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,1,0,0,0,0|0,0,2]=4 1787 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,1,0,0,0,0|0,0,2]=4 1788 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [1,1,0,0,0,0|1,0,1]=4 1789 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [1,1,0,0,0,0|1,0,1]=4 1790 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [1,1,0,0,0,0|1,0,1]=4 1791 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [1,1,0,0,0,0|1,0,1]=4 1792 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [1,1,0,0,0,0|1,0,1]=4 1793 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [1,1,0,0,0,0|0,0,2]=4 1794 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [1,1,0,0,0,0|0,0,2]=4 1795 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [1,1,0,0,0,0|0,0,2]=4 1796 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [1,1,0,0,0,0|0,0,2]=4 1797 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [1,1,0,0,0,0|0,0,2]=4 1798 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [1,1,0,0,0,0|0,0,2]=4 1799 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [1,1,0,0,0,0|0,0,2]=4 1800 B11R1.74 CC(C)c1cc(cc(c1)Br)O 271570a_203496583355_200015473176 [1,1,0,0,0,0|1,0,0]=3 1801 B11R1.74 CC(C)c1cc(cc(c1)O)N 271570a_203496583355_100010369243 [1,1,0,0,0,0|1,0,0]=3 1802 B11R1.74 Cc1cc(cc(c1)B(O)O)O 271570a_203496583355_100009814731 [1,1,0,0,0,0|2,0,0]=4 1803 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,1,0,0,0,0|0,0,2]=4 1804 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [1,1,0,0,0,0|0,0,2]=4 1805 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [1,1,0,0,0,0|0,0,2]=4 1806 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [1,1,0,0,0,0|0,0,2]=4 1807 B11R1.74 OB(O)c1cc(cc(c1)F)O 271570a_203496583355_100009814746 [1,1,0,0,0,0|2,0,0]=4 1808 B11R1.74 OB(O)c1cc(cc(c1)O)O 271570a_203496583355_100010062373 [1,1,0,0,0,0|2,0,0]=4 1809 B11R1.74 Oc1cc(cc(c1)C(F)F)F 271570a_203496583355_100010204260 [1,1,0,0,0,0|2,0,0]=4 1810 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [1,1,0,0,0,0|0,0,2]=4 1811 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [1,1,0,0,0,0|0,0,2]=4 1812 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [1,1,0,0,0,0|0,0,2]=4 1813 B11R1.155 CC(C)(C)c1cc(ccn1)O 271570a_203496583355_100010237918 [1,1,0,0,0,0|2,0,0]=4 1814 B11R1.155 CC(C)(C)c1cccc(c1)O 271570a_203496583355_100009816526 [1,1,0,0,0,0|1,0,0]=3 1815 B11R1.155 CC(C)(C)c1cccc(n1)O 271570a_203496583355_100010205033 [1,1,0,0,0,0|2,0,0]=4 1816 B11R1.155 CC(C)(C)c1ccnc(c1)O 271570a_203496583355_100009878675 [1,1,0,0,0,0|2,0,0]=4 1817 B11R1.155 CC(C)(C)c1cncc(c1)O 271570a_203496583355_100010191215 [1,1,0,0,0,0|2,0,0]=4 1818 B11R1.155 CC(C)(F)c1cc(ccn1)O 271570a_203496583355_100015973028 [1,1,0,0,0,0|2,0,0]=4 1819 B11R1.155 CC(C)(N)c1cccc(c1)O 271570a_203496583355_100016995529 [1,1,0,0,0,0|1,0,0]=3 1820 B11R1.155 CC(C)(O)c1cc(ccn1)O 271570a_203496583355_100010174121 [1,1,0,0,0,0|1,0,0]=3 1821 B11R1.155 CC(C)(O)c1cccc(c1)O 271570a_203496583355_100011346009 [1,1,0,0,0,0|0,0,0]=2 1822 B11R1.155 CC(C)(O)c1cccc(n1)O 271570a_203496583355_100010074359 [1,1,0,0,0,0|1,0,0]=3 1823 B11R1.155 CC(C)(O)c1cncc(c1)O 271570a_203496583355_100010080784 [1,1,0,0,0,0|1,0,0]=3 1824 B11R1.155 CC(C)(O)c1cncc(n1)O 271570a_203496583355_106818305711 [1,1,0,0,0,0|2,0,0]=4 1825 B11R1.155 CC(F)(F)c1cccc(c1)O 271570a_203496583355_100010232180 [1,1,0,0,0,0|1,0,0]=3 1826 B11R1.155 CC(F)(F)c1cccc(n1)O 271570a_203496583355_100010208558 [1,1,0,0,0,0|2,0,0]=4 1827 B11R1.155 CC(F)(F)c1ccnc(c1)O 271570a_203496583355_100009884415 [1,1,0,0,0,0|2,0,0]=4 1828 B11R1.155 CC(F)(F)c1cncc(c1)O 271570a_203496583355_100010135167 [1,1,0,0,0,0|2,0,0]=4 1829 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [1,1,0,0,0,0|1,0,1]=4 1830 B11R1.155 C[Si](C)(C)c1cccc(c1)O 271570a_203496583355_100009816414 [1,1,0,0,0,0|1,1,0]=4 1831 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [1,1,0,0,0,0|1,0,1]=4 1832 B11R1.155 Oc1cccc(c1)C(F)(F)F 271570a_203496583355_100000211837 [1,1,0,0,0,0|2,0,0]=4 1833 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,1,0,0,0,0|1,0,1]=4 1834 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,1,0,0,0,0|1,0,1]=4 1835 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,1,0,0,0,0|1,0,1]=4 1836 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,1,0,0,0,0|1,0,1]=4 1837 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,1,0,0,0,0|1,0,1]=4 1838 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,1,0,0,0,0|1,0,1]=4 1839 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,1,0,0,0,0|0,0,2]=4 1840 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,1,0,0,0,0|0,0,2]=4 1841 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,1,0,0,0,0|0,0,2]=4 1842 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,1,0,0,0,0|0,0,2]=4 1843 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,1,0,0,0,0|0,0,2]=4 1844 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,1,0,0,0,0|0,0,2]=4 1845 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,1,0,0,0,0|0,0,2]=4 1846 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,1,0,0,0,0|0,0,2]=4 1847 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,1,0,0,0,0|0,0,2]=4 1848 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [1,1,0,0,0,0|1,0,0]=3 1849 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [1,1,0,0,0,0|0,0,0]=2 1850 B11R1.159 Cc1c(cccc1B(O)O)O 271570a_203496583355_100000724322 [1,1,0,0,0,0|2,0,0]=4 1851 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [1,1,0,0,0,0|0,0,2]=4 1852 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,1,0,0,0,0|0,0,2]=4 1853 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [1,1,0,0,0,0|0,0,2]=4 1854 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [1,1,0,0,0,0|0,0,2]=4 1855 B11R1.159 OB(O)c1cccc(c1F)O 271570a_203496583355_100011934463 [1,1,0,0,0,0|2,0,0]=4 1856 B11R1.159 Oc1cccc(c1F)C(F)F 271570a_203496583355_100010189892 [1,1,0,0,0,0|2,0,0]=4 1857 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,1,0,0,0,0|0,0,2]=4 1858 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,1,0,0,0,0|0,0,2]=4 1859 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,1,0,0,0,0|0,0,2]=4 1860 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,1,0,0,0,0|0,0,2]=4 1861 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,1,0,0,0,0|0,0,2]=4 1862 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [1,1,0,0,0,0|1,0,1]=4 1863 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [1,1,0,0,0,0|1,0,1]=4 1864 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [1,1,0,0,0,0|1,0,1]=4 1865 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [1,1,0,0,0,0|1,0,1]=4 1866 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [1,1,0,0,0,0|1,0,1]=4 1867 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [1,1,0,0,0,0|1,0,1]=4 1868 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [1,1,0,0,0,0|0,0,2]=4 1869 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [1,1,0,0,0,0|0,0,2]=4 1870 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [1,1,0,0,0,0|0,0,2]=4 1871 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [1,1,0,0,0,0|0,0,2]=4 1872 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [1,1,0,0,0,0|0,0,2]=4 1873 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [1,1,0,0,0,0|0,0,2]=4 1874 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [1,1,0,0,0,0|0,0,2]=4 1875 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [1,1,0,0,0,0|0,0,2]=4 1876 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [1,1,0,0,0,0|0,0,2]=4 1877 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [1,1,0,0,0,0|0,0,2]=4 1878 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [1,1,0,0,0,0|0,0,2]=4 1879 B11R1.167 CC(C)c1cc(ccc1F)O 271570a_203496583355_200053017515 [1,1,0,0,0,0|1,0,0]=3 1880 B11R1.167 CC(C)c1cc(ccc1N)O 271570a_203496583355_100000694223 [1,1,0,0,0,0|1,0,0]=3 1881 B11R1.167 CC(C)c1cc(ccc1O)Br 271570a_203496583355_100010244561 [1,1,0,0,0,0|2,0,0]=4 1882 B11R1.167 CC(C)c1cc(ccc1O)O 271570a_203496583355_100000691460 [1,1,0,0,0,0|1,0,0]=3 1883 B11R1.167 CC(C)n1cc(ccc1=O)O 271570a_203496583355_100016995121 [1,1,0,0,0,0|2,0,0]=4 1884 B11R1.167 CC(N)c1cc(ccc1O)F 271570a_203496583355_100012343209 [1,1,0,0,0,0|2,0,0]=4 1885 B11R1.167 CC(O)c1cc(ccc1F)O 271570a_203496583355_100011943926 [1,1,0,0,0,0|0,0,0]=2 1886 B11R1.167 CN(C)c1cc(ccc1F)O 271570a_203496583355_100010288836 [1,1,0,0,0,0|2,0,0]=4 1887 B11R1.167 CN(C)c1cc(ccc1O)O 271570a_203496583355_200010083878 [1,1,0,0,0,0|2,0,0]=4 1888 B11R1.167 C[C@H](O)c1cc(ccc1O)F 271570a_203496583355_100134768474 [1,1,0,0,0,0|1,0,0]=3 1889 B11R1.167 Cc1ccc(cc1B(O)O)O 271570a_203496583355_100010223188 [1,1,0,0,0,0|2,0,0]=4 1890 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [1,1,0,0,0,0|0,0,2]=4 1891 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [1,1,0,0,0,0|0,0,2]=4 1892 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [1,1,0,0,0,0|0,0,2]=4 1893 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [1,1,0,0,0,0|0,0,2]=4 1894 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [1,1,0,0,0,0|0,0,2]=4 1895 B11R1.167 OB(O)c1cc(ccc1Br)O 271570a_203496583355_200010171685 [1,1,0,0,0,0|2,0,0]=4 1896 B11R1.167 OB(O)c1cc(ccc1F)O 271570a_203496583355_100011356809 [1,1,0,0,0,0|2,0,0]=4 1897 B11R1.167 OB(O)c1cc(ccc1O)O 271570a_203496583355_200009814749 [1,1,0,0,0,0|2,0,0]=4 1898 B11R1.167 Oc1ccc(c(c1)C(F)F)F 271570a_203496583355_100010167061 [1,1,0,0,0,0|2,0,0]=4 1899 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [1,1,0,0,0,0|0,0,2]=4 1900 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [1,1,0,0,0,0|0,0,2]=4 1901 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [1,1,0,0,0,0|0,0,2]=4 1902 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [1,1,0,0,0,0|0,0,2]=4 1903 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [1,1,0,0,0,0|0,0,2]=4 1904 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [1,1,0,0,0,0|1,0,1]=4 1905 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,1,0,0,0,0|1,0,1]=4 1906 B11R1.266 C=Cc1cccc(c1)C(C)C 271570a_100011290941_100011214899 [1,1,0,0,0,0|2,0,0]=4 1907 B11R1.266 C=Cc1cccc(c1)C(C)N 271570a_100011290941_100020642005 [1,1,0,0,0,0|2,0,0]=4 1908 B11R1.266 C=Cc1cccc(c1)C(C)O 271570a_100011290941_100000246457 [1,1,0,0,0,0|1,0,0]=3 1909 B11R1.266 C=Cc1cccc(n1)C(C)O 271570a_100011290941_100009820884 [1,1,0,0,0,0|2,0,0]=4 1910 B11R1.266 C=Cc1ccnc(c1)C(C)O 271570a_100011290941_100000144657 [1,1,0,0,0,0|2,0,0]=4 1911 B11R1.266 C=Cc1cncc(c1)C(C)O 271570a_100011290941_100012351597 [1,1,0,0,0,0|2,0,0]=4 1912 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [1,1,0,0,0,0|0,0,2]=4 1913 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,1,0,0,0,0|0,0,2]=4 1914 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,1,0,0,0,0|0,0,2]=4 1915 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 2230a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1916 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 34a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1917 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 7a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1918 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [1,1,0,0,0,0|1,0,0]=3 1919 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [1,1,0,0,0,0|1,0,0]=3 1920 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_100011214899_200025704644 [1,1,0,0,0,0|1,1,0]=4 1921 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011214899 [1,1,0,0,0,0|1,1,0]=4 1922 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [1,1,0,0,0,0|1,0,0]=3 1923 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [1,1,0,0,0,0|1,0,0]=3 1924 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [1,1,0,0,0,0|1,1,0]=4 1925 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [1,1,0,0,0,0|1,1,0]=4 1926 B11R1.266 CC(O)c1cc(ccn1)S[13CH3] 62a_100000144657_200025704644 [1,1,0,0,0,0|1,1,0]=4 1927 B11R1.266 CC(O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000144657 [1,1,0,0,0,0|1,1,0]=4 1928 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 2230a_100011217120_200025704644 [1,1,0,0,0,0|1,0,0]=3 1929 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 34a_100011217120_200025704644 [1,1,0,0,0,0|1,0,0]=3 1930 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [1,1,0,0,0,0|0,0,0]=2 1931 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [1,1,0,0,0,0|0,0,0]=2 1932 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_100000246457_200025704644 [1,1,0,0,0,0|0,1,0]=3 1933 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_200025704644_100000246457 [1,1,0,0,0,0|0,1,0]=3 1934 B11R1.266 CC(O)c1cccc(n1)S[13CH3] 62a_100009820884_200025704644 [1,1,0,0,0,0|1,1,0]=4 1935 B11R1.266 CC(O)c1cccc(n1)S[13CH3] 62a_200025704644_100009820884 [1,1,0,0,0,0|1,1,0]=4 1936 B11R1.266 CC(O)c1cncc(c1)S[13CH3] 62a_100012351597_200025704644 [1,1,0,0,0,0|1,1,0]=4 1937 B11R1.266 CC(O)c1cncc(c1)S[13CH3] 62a_200025704644_100012351597 [1,1,0,0,0,0|1,1,0]=4 1938 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [1,1,0,0,0,0|2,0,0]=4 1939 B11R1.266 CNc1cccc(c1)C(C)C 2230a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1940 B11R1.266 CNc1cccc(c1)C(C)C 34a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1941 B11R1.266 CNc1cccc(c1)C(C)C 7a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1942 B11R1.266 CNc1cccc(c1)C(C)O 2230a_100011217120_200000210301 [1,1,0,0,0,0|1,0,0]=3 1943 B11R1.266 CNc1cccc(c1)C(C)O 34a_100011217120_200000210301 [1,1,0,0,0,0|1,0,0]=3 1944 B11R1.266 CNc1cccc(n1)C(C)O 27a_100102657272_100009820884 [1,1,0,0,0,0|2,0,0]=4 1945 B11R1.266 CNc1ccnc(c1)C(C)O 27a_100102657272_100000144657 [1,1,0,0,0,0|2,0,0]=4 1946 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,1,0,0,0,0|0,0,2]=4 1947 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,1,0,0,0,0|0,0,2]=4 1948 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,1,0,0,0,0|0,0,2]=4 1949 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,1,0,0,0,0|0,0,2]=4 1950 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,1,0,0,0,0|0,0,2]=4 1951 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,1,0,0,0,0|0,0,2]=4 1952 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,1,0,0,0,0|0,1,1]=4 1953 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [1,1,0,0,0,0|1,0,0]=3 1954 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [1,1,0,0,0,0|1,0,0]=3 1955 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [1,1,0,0,0,0|1,0,0]=3 1956 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [1,1,0,0,0,0|1,0,0]=3 1957 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [1,1,0,0,0,0|0,0,0]=2 1958 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [1,1,0,0,0,0|0,0,0]=2 1959 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 1960 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 1961 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 1962 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [1,1,0,0,0,0|2,0,0]=4 1963 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 1964 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 1965 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 1966 B11R1.266 CSc1cccc(c1)C(C)C 62a_100011214899_200000210301 [1,1,0,0,0,0|1,1,0]=4 1967 B11R1.266 CSc1cccc(c1)C(C)C 62a_200000210301_100011214899 [1,1,0,0,0,0|1,1,0]=4 1968 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [1,1,0,0,0,0|1,1,0]=4 1969 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [1,1,0,0,0,0|1,1,0]=4 1970 B11R1.266 CSc1cccc(c1)C(C)O 62a_100000246457_200000210301 [1,1,0,0,0,0|0,1,0]=3 1971 B11R1.266 CSc1cccc(c1)C(C)O 62a_200000210301_100000246457 [1,1,0,0,0,0|0,1,0]=3 1972 B11R1.266 CSc1cccc(n1)C(C)O 62a_100009820884_200000210301 [1,1,0,0,0,0|1,1,0]=4 1973 B11R1.266 CSc1cccc(n1)C(C)O 62a_200000210301_100009820884 [1,1,0,0,0,0|1,1,0]=4 1974 B11R1.266 CSc1ccnc(c1)C(C)O 62a_100000144657_200000210301 [1,1,0,0,0,0|1,1,0]=4 1975 B11R1.266 CSc1ccnc(c1)C(C)O 62a_200000210301_100000144657 [1,1,0,0,0,0|1,1,0]=4 1976 B11R1.266 CSc1cncc(c1)C(C)O 62a_100012351597_200000210301 [1,1,0,0,0,0|1,1,0]=4 1977 B11R1.266 CSc1cncc(c1)C(C)O 62a_200000210301_100012351597 [1,1,0,0,0,0|1,1,0]=4 1978 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [1,1,0,0,0,0|0,0,2]=4 1979 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,1,0,0,0,0|0,0,2]=4 1980 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,1,0,0,0,0|0,0,2]=4 1981 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,1,0,0,0,0|0,1,1]=4 1982 B13R1.20 CC(CC#N)Sc1cccc(c1)O 62a_100009813641_100000211634 [0,1,0,0,0,1|1,0,1]=4 1983 B13R1.20 CC(CCO)Nc1cccc(c1)O 34a_100000210217_100009893172 [0,1,0,0,0,1|2,0,0]=4 1984 B13R1.20 CC(CCO)Sc1cccc(c1)O 62a_100009893172_100000211634 [0,1,0,0,0,1|2,0,0]=4 1985 B13R1.20 CCCC(C)Nc1cccc(c1)O 34a_100000210217_100000766640 [0,1,0,0,0,1|2,0,0]=4 1986 B13R1.20 CCCC(C)Sc1cccc(c1)O 62a_100000766640_100000211634 [0,1,0,0,0,1|2,0,0]=4 1987 B13R1.20 CNCC(=O)Nc1cccc(c1)O 2230a_106832991635_100011236192 [0,1,0,0,0,1|0,0,2]=4 1988 B13R1.20 CNCC(=O)Nc1cccc(c1)O 34a_100102657272_100011236192 [0,1,0,0,0,1|0,0,2]=4 1989 B13R1.20 CNCC(=O)Nc1cccc(c1)O 7a_106832991635_100011236192 [0,1,0,0,0,1|0,0,2]=4 1990 B13R1.20 COCC(C)Nc1cccc(c1)O 34a_100000210217_100000765312 [0,1,0,0,0,1|2,0,0]=4 1991 B13R1.20 COCC(C)Sc1cccc(c1)O 62a_100000765312_100000211634 [0,1,0,0,0,1|2,0,0]=4 1992 B13R1.22 CC(CO)N(C)c1cccc(c1)O 2230a_100000756613_100012180447 [0,1,0,0,0,1|2,0,0]=4 1993 B13R1.22 CC(CO)N(C)c1cccc(c1)O 34a_100000756613_100012180447 [0,1,0,0,0,1|2,0,0]=4 1994 B13R1.22 CCC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000758301 [0,1,0,0,0,1|2,0,0]=4 1995 B13R1.22 CCC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000758301 [0,1,0,0,0,1|2,0,0]=4 1996 B13R1.22 CCC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000758301 [0,1,0,0,0,1|2,0,0]=4 1997 B13R1.22 CCC(C)N(C)c1cccc(c1)O 34a_100000756613_100011215416 [0,1,0,0,0,1|2,0,0]=4 1998 B13R1.22 C[C@H](CO)N(C)c1cccc(c1)O 269982a_100000756613_100016084084 [0,1,0,0,0,1|2,0,0]=4 1999 B13R1.40 CC(CO)Nc1cccc(c1Br)O 34a_100012183704_100012180447 [0,1,0,0,0,1|2,0,0]=4 2000 B13R1.40 CC(CO)Nc1cccc(c1Br)O 7a_100012183704_100012180447 [0,1,0,0,0,1|2,0,0]=4 2001 B13R1.40 CC(CO)Nc1cccc(c1Cl)O 34a_100012002038_100012180447 [0,1,0,0,0,1|2,0,0]=4 2002 B13R1.40 CC(CO)Nc1cccc(c1Cl)O 7a_100012002038_100012180447 [0,1,0,0,0,1|2,0,0]=4 2003 B13R1.40 CC(CO)Sc1cccc(c1Br)O 62a_100012180447_100010187914 [0,1,0,0,0,1|2,0,0]=4 2004 B13R1.40 CC(CO)Sc1cccc(c1Cl)O 62a_100012180447_100000049636 [0,1,0,0,0,1|2,0,0]=4 2005 B13R1.40 CC(CO)Sc1cccc(c1F)O 62a_100012180447_100009817021 [0,1,0,0,0,1|2,0,0]=4 2006 B13R1.40 CC(CO)Sc1cccc(c1N)O 62a_100012180447_100011934926 [0,1,0,0,0,1|2,0,0]=4 2007 B13R1.40 CC(CO)Sc1cccc(c1O)O 62a_100012180447_100009815950 [0,1,0,0,0,1|2,0,0]=4 2008 B13R1.40 CCC(C)Nc1cccc(c1Br)O 34a_100012183704_100011215416 [0,1,0,0,0,1|2,0,0]=4 2009 B13R1.40 CCC(C)Nc1cccc(c1Br)O 7a_100012183704_100000758301 [0,1,0,0,0,1|2,0,0]=4 2010 B13R1.40 CCC(C)Nc1cccc(c1C)O 34a_100011216573_100011215416 [0,1,0,0,0,1|2,0,0]=4 2011 B13R1.40 CCC(C)Nc1cccc(c1C)O 7a_100011216573_100000758301 [0,1,0,0,0,1|2,0,0]=4 2012 B13R1.40 CCC(C)Nc1cccc(c1Cl)O 34a_100012002038_100011215416 [0,1,0,0,0,1|2,0,0]=4 2013 B13R1.40 CCC(C)Nc1cccc(c1Cl)O 7a_100012002038_100000758301 [0,1,0,0,0,1|2,0,0]=4 2014 B13R1.40 CCC(C)Sc1cccc(c1Br)O 62a_100000758301_100010187914 [0,1,0,0,0,1|2,0,0]=4 2015 B13R1.40 CCC(C)Sc1cccc(c1Br)O 62a_100010187914_100000758301 [0,1,0,0,0,1|2,0,0]=4 2016 B13R1.40 CCC(C)Sc1cccc(c1C)O 62a_100000758301_100012002258 [0,1,0,0,0,1|2,0,0]=4 2017 B13R1.40 CCC(C)Sc1cccc(c1C)O 62a_100012002258_100000758301 [0,1,0,0,0,1|2,0,0]=4 2018 B13R1.40 CCC(C)Sc1cccc(c1Cl)O 62a_100000758301_100000049636 [0,1,0,0,0,1|2,0,0]=4 2019 B13R1.40 CCC(C)Sc1cccc(c1F)O 62a_100000758301_100009817021 [0,1,0,0,0,1|2,0,0]=4 2020 B13R1.40 CCC(C)Sc1cccc(c1F)O 62a_100009817021_100000758301 [0,1,0,0,0,1|2,0,0]=4 2021 B13R1.40 CCC(C)Sc1cccc(c1N)O 62a_100000758301_100011934926 [0,1,0,0,0,1|2,0,0]=4 2022 B13R1.40 CCC(C)Sc1cccc(c1O)O 62a_100000758301_100009815950 [0,1,0,0,0,1|2,0,0]=4 2023 B13R1.40 C[C@H](CO)Sc1cccc(c1Br)O 62a_100010187914_100016084084 [0,1,0,0,0,1|2,0,0]=4 2024 B13R1.40 C[C@H](CO)Sc1cccc(c1Br)O 62a_100016084084_100010187914 [0,1,0,0,0,1|2,0,0]=4 2025 B13R1.40 C[C@H](CO)Sc1cccc(c1Cl)O 62a_100016084084_100000049636 [0,1,0,0,0,1|2,0,0]=4 2026 B13R1.40 C[C@H](CO)Sc1cccc(c1F)O 62a_100009817021_100016084084 [0,1,0,0,0,1|2,0,0]=4 2027 B13R1.40 C[C@H](CO)Sc1cccc(c1F)O 62a_100016084084_100009817021 [0,1,0,0,0,1|2,0,0]=4 2028 B13R1.40 C[C@H](CO)Sc1cccc(c1N)O 62a_100016084084_100011934926 [0,1,0,0,0,1|2,0,0]=4 2029 B13R1.40 C[C@H](CO)Sc1cccc(c1O)O 62a_100016084084_100009815950 [0,1,0,0,0,1|2,0,0]=4 2030 B13R1.40 Cc1c(cccc1NC(C)CO)O 34a_100011216573_100012180447 [0,1,0,0,0,1|2,0,0]=4 2031 B13R1.40 Cc1c(cccc1NC(C)CO)O 7a_100011216573_100012180447 [0,1,0,0,0,1|2,0,0]=4 2032 B13R1.40 Cc1c(cccc1SC(C)CO)O 62a_100012180447_100012002258 [0,1,0,0,0,1|2,0,0]=4 2033 B13R1.40 Cc1c(cccc1S[C@H](C)CO)O 62a_100012002258_100016084084 [0,1,0,0,0,1|2,0,0]=4 2034 B13R1.40 Cc1c(cccc1S[C@H](C)CO)O 62a_100016084084_100012002258 [0,1,0,0,0,1|2,0,0]=4 2035 B13R1.81 CC(CO)Nc1cccc(c1)CO 2230a_100000211919_100012180447 [0,1,0,0,0,1|2,0,0]=4 2036 B13R1.81 CC(CO)Nc1cccc(c1)CO 34a_100000211919_100012180447 [0,1,0,0,0,1|2,0,0]=4 2037 B13R1.81 CC(CO)Oc1cccc(c1)CO 34a_100011214949_100012180447 [0,1,0,0,0,1|2,0,0]=4 2038 B13R1.81 CC(CO)Oc1cccc(c1)CO 7a_100011214949_100012180447 [0,1,0,0,0,1|2,0,0]=4 2039 B13R1.81 CC(CO)Sc1cccc(c1)CO 62a_100012180447_100000687537 [0,1,0,0,0,1|2,0,0]=4 2040 B13R1.81 CCC(C)Nc1cccc(c1)CO 2230a_100000211919_100000758301 [0,1,0,0,0,1|2,0,0]=4 2041 B13R1.81 CCC(C)Nc1cccc(c1)CO 34a_100000211919_100011215416 [0,1,0,0,0,1|2,0,0]=4 2042 B13R1.81 CCC(C)Nc1cccc(c1)OC 34a_100000210024_100011215416 [0,1,0,0,0,1|2,0,0]=4 2043 B13R1.81 CCC(C)Oc1cccc(c1)CO 34a_100011214949_100011215416 [0,1,0,0,0,1|2,0,0]=4 2044 B13R1.81 CCC(C)Oc1cccc(c1)CO 7a_100011214949_100000758301 [0,1,0,0,0,1|2,0,0]=4 2045 B13R1.81 CCC(C)Oc1cccc(c1)OC 34a_100000211255_100011215416 [0,1,0,0,0,1|2,0,0]=4 2046 B13R1.81 CCC(C)Oc1cccc(c1)OC 7a_100000211255_100000758301 [0,1,0,0,0,1|2,0,0]=4 2047 B13R1.81 CCC(C)Sc1cccc(c1)CO 62a_100000687537_100000758301 [0,1,0,0,0,1|2,0,0]=4 2048 B13R1.81 CCC(C)Sc1cccc(c1)CO 62a_100000758301_100000687537 [0,1,0,0,0,1|2,0,0]=4 2049 B13R1.81 CCC(C)Sc1cccc(c1)OC 62a_100000758301_100000170001 [0,1,0,0,0,1|2,0,0]=4 2050 B13R1.81 COc1cccc(c1)NC(C)CO 34a_100000210024_100012180447 [0,1,0,0,0,1|2,0,0]=4 2051 B13R1.81 COc1cccc(c1)OC(C)CO 34a_100000211255_100012180447 [0,1,0,0,0,1|2,0,0]=4 2052 B13R1.81 COc1cccc(c1)OC(C)CO 7a_100000211255_100012180447 [0,1,0,0,0,1|2,0,0]=4 2053 B13R1.81 COc1cccc(c1)SC(C)CO 62a_100012180447_100000170001 [0,1,0,0,0,1|2,0,0]=4 2054 B13R1.81 COc1cccc(c1)S[C@H](C)CO 62a_100016084084_100000170001 [0,1,0,0,0,1|2,0,0]=4 2055 B13R1.81 C[C@H](CO)Sc1cccc(c1)CO 62a_100000687537_100016084084 [0,1,0,0,0,1|2,0,0]=4 2056 B13R1.81 C[C@H](CO)Sc1cccc(c1)CO 62a_100016084084_100000687537 [0,1,0,0,0,1|2,0,0]=4 2057 B13R1.146 CCC(CC)Sc1cccc(c1)O 62a_100000210505_100000211634 [0,1,0,0,0,1|2,0,0]=4 2058 B13R1.148 CC(Nc1cccc(c1)O)C(=O)N 34a_100000210217_100000702099 [0,1,0,0,0,1|1,0,1]=4 2059 B13R1.148 CC(Oc1cccc(c1)O)C(=O)N 271570a_203496583355_200000150601 [0,1,0,0,0,1|1,0,1]=4 2060 B13R1.148 CC(Sc1cccc(c1)O)C(=O)N 62a_100000702099_100000211634 [0,1,0,0,0,1|1,0,1]=4 2061 B13R1.148 NC(=O)C(F)Nc1cccc(c1)O 34a_100000210217_100009813875 [0,1,0,0,0,1|1,0,1]=4 2062 B13R1.148 NC(=O)C(F)Sc1cccc(c1)O 62a_100009813875_100000211634 [0,1,0,0,0,1|1,0,1]=4 2063 B13R1.250 CCC(C)(C)Sc1cccc(c1)O 62a_100000032637_100000211634 [0,1,0,0,0,1|2,0,0]=4 2064 B13R1.250 OCC(F)(F)Sc1cccc(c1)O 62a_100011217949_100000211634 [0,1,0,0,0,1|2,0,0]=4 2065 B13R1.2872 CC(CO)Nc1cc(ccc1Br)O 34a_100011999798_100012180447 [0,1,0,0,0,1|2,0,0]=4 2066 B13R1.2872 CC(CO)Nc1cc(ccc1Cl)O 34a_100011934297_100012180447 [0,1,0,0,0,1|2,0,0]=4 2067 B13R1.2872 CC(CO)Nc1cc(ccc1F)O 34a_100012017239_100012180447 [0,1,0,0,0,1|2,0,0]=4 2068 B13R1.2872 CC(CO)Sc1cc(ccc1Br)O 62a_100012180447_100012339312 [0,1,0,0,0,1|2,0,0]=4 2069 B13R1.2872 CC(CO)Sc1cc(ccc1Cl)O 62a_100012180447_100000049588 [0,1,0,0,0,1|2,0,0]=4 2070 B13R1.2872 CC(CO)Sc1cc(ccc1F)O 62a_100012180447_100000693481 [0,1,0,0,0,1|2,0,0]=4 2071 B13R1.2872 CC(CO)Sc1cc(ccc1N)O 62a_100012180447_100012001276 [0,1,0,0,0,1|2,0,0]=4 2072 B13R1.2872 CC(CO)Sc1cc(ccc1O)O 62a_100012180447_100009813629 [0,1,0,0,0,1|2,0,0]=4 2073 B13R1.2872 CCC(C)Nc1cc(ccc1Br)O 34a_100011999798_100011215416 [0,1,0,0,0,1|2,0,0]=4 2074 B13R1.2872 CCC(C)Nc1cc(ccc1C)O 34a_100011216113_100011215416 [0,1,0,0,0,1|2,0,0]=4 2075 B13R1.2872 CCC(C)Nc1cc(ccc1Cl)O 34a_100011934297_100011215416 [0,1,0,0,0,1|2,0,0]=4 2076 B13R1.2872 CCC(C)Nc1cc(ccc1F)O 34a_100012017239_100011215416 [0,1,0,0,0,1|2,0,0]=4 2077 B13R1.2872 CCC(C)Sc1cc(ccc1Br)O 62a_100000758301_100012339312 [0,1,0,0,0,1|2,0,0]=4 2078 B13R1.2872 CCC(C)Sc1cc(ccc1Br)O 62a_100012339312_100000758301 [0,1,0,0,0,1|2,0,0]=4 2079 B13R1.2872 CCC(C)Sc1cc(ccc1C)O 62a_100000758301_100011380479 [0,1,0,0,0,1|2,0,0]=4 2080 B13R1.2872 CCC(C)Sc1cc(ccc1C)O 62a_100011380479_100000758301 [0,1,0,0,0,1|2,0,0]=4 2081 B13R1.2872 CCC(C)Sc1cc(ccc1Cl)O 62a_100000049588_100000758301 [0,1,0,0,0,1|2,0,0]=4 2082 B13R1.2872 CCC(C)Sc1cc(ccc1Cl)O 62a_100000758301_100000049588 [0,1,0,0,0,1|2,0,0]=4 2083 B13R1.2872 CCC(C)Sc1cc(ccc1F)O 62a_100000693481_100000758301 [0,1,0,0,0,1|2,0,0]=4 2084 B13R1.2872 CCC(C)Sc1cc(ccc1F)O 62a_100000758301_100000693481 [0,1,0,0,0,1|2,0,0]=4 2085 B13R1.2872 CCC(C)Sc1cc(ccc1N)O 62a_100000758301_100012001276 [0,1,0,0,0,1|2,0,0]=4 2086 B13R1.2872 CCC(C)Sc1cc(ccc1N)O 62a_100012001276_100000758301 [0,1,0,0,0,1|2,0,0]=4 2087 B13R1.2872 CCC(C)Sc1cc(ccc1O)O 62a_100000758301_100009813629 [0,1,0,0,0,1|2,0,0]=4 2088 B13R1.2872 C[C@H](CO)Sc1cc(ccc1Br)O 62a_100012339312_100016084084 [0,1,0,0,0,1|2,0,0]=4 2089 B13R1.2872 C[C@H](CO)Sc1cc(ccc1Br)O 62a_100016084084_100012339312 [0,1,0,0,0,1|2,0,0]=4 2090 B13R1.2872 C[C@H](CO)Sc1cc(ccc1Cl)O 62a_100000049588_100016084084 [0,1,0,0,0,1|2,0,0]=4 2091 B13R1.2872 C[C@H](CO)Sc1cc(ccc1Cl)O 62a_100016084084_100000049588 [0,1,0,0,0,1|2,0,0]=4 2092 B13R1.2872 C[C@H](CO)Sc1cc(ccc1F)O 62a_100000693481_100016084084 [0,1,0,0,0,1|2,0,0]=4 2093 B13R1.2872 C[C@H](CO)Sc1cc(ccc1F)O 62a_100016084084_100000693481 [0,1,0,0,0,1|2,0,0]=4 2094 B13R1.2872 C[C@H](CO)Sc1cc(ccc1N)O 62a_100012001276_100016084084 [0,1,0,0,0,1|2,0,0]=4 2095 B13R1.2872 C[C@H](CO)Sc1cc(ccc1N)O 62a_100016084084_100012001276 [0,1,0,0,0,1|2,0,0]=4 2096 B13R1.2872 C[C@H](CO)Sc1cc(ccc1O)O 62a_100016084084_100009813629 [0,1,0,0,0,1|2,0,0]=4 2097 B13R1.2872 Cc1ccc(cc1NC(C)CO)O 34a_100011216113_100012180447 [0,1,0,0,0,1|2,0,0]=4 2098 B13R1.2872 Cc1ccc(cc1SC(C)CO)O 62a_100012180447_100011380479 [0,1,0,0,0,1|2,0,0]=4 2099 B13R1.2872 Cc1ccc(cc1S[C@H](C)CO)O 62a_100011380479_100016084084 [0,1,0,0,0,1|2,0,0]=4 2100 B13R1.2872 Cc1ccc(cc1S[C@H](C)CO)O 62a_100016084084_100011380479 [0,1,0,0,0,1|2,0,0]=4 2101 B13R1.2874 CC(CO)Nc1cc(cc(c1)Cl)O 34a_100000123917_100012180447 [0,1,0,0,0,1|2,0,0]=4 2102 B13R1.2874 CC(CO)Nc1cc(cc(c1)Cl)O 7a_100000123917_100012180447 [0,1,0,0,0,1|2,0,0]=4 2103 B13R1.2874 CC(CO)Nc1cc(cc(c1)O)O 34a_100000043371_100012180447 [0,1,0,0,0,1|2,0,0]=4 2104 B13R1.2874 CC(CO)Sc1cc(cc(c1)Br)O 62a_100012180447_100010068917 [0,1,0,0,0,1|2,0,0]=4 2105 B13R1.2874 CC(CO)Sc1cc(cc(c1)Cl)O 62a_100012180447_100010068924 [0,1,0,0,0,1|2,0,0]=4 2106 B13R1.2874 CC(CO)Sc1cc(cc(c1)F)O 62a_100012180447_100000688818 [0,1,0,0,0,1|2,0,0]=4 2107 B13R1.2874 CC(CO)Sc1cc(cc(c1)O)O 62a_100012180447_100009868816 [0,1,0,0,0,1|2,0,0]=4 2108 B13R1.2874 CCC(C)Nc1cc(cc(c1)Cl)O 34a_100000123917_100011215416 [0,1,0,0,0,1|2,0,0]=4 2109 B13R1.2874 CCC(C)Nc1cc(cc(c1)Cl)O 7a_100000123917_100000758301 [0,1,0,0,0,1|2,0,0]=4 2110 B13R1.2874 CCC(C)Nc1cc(cc(c1)O)C 34a_100011995906_100011215416 [0,1,0,0,0,1|2,0,0]=4 2111 B13R1.2874 CCC(C)Nc1cc(cc(c1)O)C 7a_100011995906_100000758301 [0,1,0,0,0,1|2,0,0]=4 2112 B13R1.2874 CCC(C)Nc1cc(cc(c1)O)O 34a_100000043371_100011215416 [0,1,0,0,0,1|2,0,0]=4 2113 B13R1.2874 CCC(C)Sc1cc(cc(c1)Br)O 62a_100000758301_100010068917 [0,1,0,0,0,1|2,0,0]=4 2114 B13R1.2874 CCC(C)Sc1cc(cc(c1)Br)O 62a_100010068917_100000758301 [0,1,0,0,0,1|2,0,0]=4 2115 B13R1.2874 CCC(C)Sc1cc(cc(c1)Cl)O 62a_100000758301_100010068924 [0,1,0,0,0,1|2,0,0]=4 2116 B13R1.2874 CCC(C)Sc1cc(cc(c1)Cl)O 62a_100010068924_100000758301 [0,1,0,0,0,1|2,0,0]=4 2117 B13R1.2874 CCC(C)Sc1cc(cc(c1)F)O 62a_100000688818_100000758301 [0,1,0,0,0,1|2,0,0]=4 2118 B13R1.2874 CCC(C)Sc1cc(cc(c1)F)O 62a_100000758301_100000688818 [0,1,0,0,0,1|2,0,0]=4 2119 B13R1.2874 CCC(C)Sc1cc(cc(c1)O)C 62a_100000758301_100011999630 [0,1,0,0,0,1|2,0,0]=4 2120 B13R1.2874 CCC(C)Sc1cc(cc(c1)O)O 62a_100000758301_100009868816 [0,1,0,0,0,1|2,0,0]=4 2121 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)Br)O 62a_100010068917_100016084084 [0,1,0,0,0,1|2,0,0]=4 2122 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)Br)O 62a_100016084084_100010068917 [0,1,0,0,0,1|2,0,0]=4 2123 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)Cl)O 62a_100010068924_100016084084 [0,1,0,0,0,1|2,0,0]=4 2124 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)Cl)O 62a_100016084084_100010068924 [0,1,0,0,0,1|2,0,0]=4 2125 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)F)O 62a_100000688818_100016084084 [0,1,0,0,0,1|2,0,0]=4 2126 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)F)O 62a_100016084084_100000688818 [0,1,0,0,0,1|2,0,0]=4 2127 B13R1.2874 C[C@H](CO)Sc1cc(cc(c1)O)O 62a_100016084084_100009868816 [0,1,0,0,0,1|2,0,0]=4 2128 B13R1.2874 Cc1cc(cc(c1)NC(C)CO)O 34a_100011995906_100012180447 [0,1,0,0,0,1|2,0,0]=4 2129 B13R1.2874 Cc1cc(cc(c1)NC(C)CO)O 7a_100011995906_100012180447 [0,1,0,0,0,1|2,0,0]=4 2130 B13R1.2874 Cc1cc(cc(c1)SC(C)CO)O 62a_100012180447_100011999630 [0,1,0,0,0,1|2,0,0]=4 2131 B13R1.2874 Cc1cc(cc(c1)S[C@H](C)CO)O 62a_100016084084_100011999630 [0,1,0,0,0,1|2,0,0]=4 2132 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)Cl 34a_100011934209_100012180447 [0,1,0,0,0,1|2,0,0]=4 2133 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)F 34a_100012017398_100012180447 [0,1,0,0,0,1|2,0,0]=4 2134 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)F 7a_100012017398_100012180447 [0,1,0,0,0,1|2,0,0]=4 2135 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [0,1,0,0,0,1|2,0,0]=4 2136 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)Br 62a_100012180447_100012356990 [0,1,0,0,0,1|2,0,0]=4 2137 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)Cl 62a_100012180447_100011356854 [0,1,0,0,0,1|2,0,0]=4 2138 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)F 62a_100012180447_100000686035 [0,1,0,0,0,1|2,0,0]=4 2139 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)N 62a_100012180447_100000739049 [0,1,0,0,0,1|2,0,0]=4 2140 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [0,1,0,0,0,1|2,0,0]=4 2141 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100011215416 [0,1,0,0,0,1|2,0,0]=4 2142 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000758301 [0,1,0,0,0,1|2,0,0]=4 2143 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100011215416 [0,1,0,0,0,1|2,0,0]=4 2144 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100011215416 [0,1,0,0,0,1|2,0,0]=4 2145 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000758301 [0,1,0,0,0,1|2,0,0]=4 2146 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011215416 [0,1,0,0,0,1|2,0,0]=4 2147 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Br 62a_100000758301_100012356990 [0,1,0,0,0,1|2,0,0]=4 2148 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000758301 [0,1,0,0,0,1|2,0,0]=4 2149 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000758301 [0,1,0,0,0,1|2,0,0]=4 2150 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)C 62a_100000758301_100000685420 [0,1,0,0,0,1|2,0,0]=4 2151 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Cl 62a_100000758301_100011356854 [0,1,0,0,0,1|2,0,0]=4 2152 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000758301 [0,1,0,0,0,1|2,0,0]=4 2153 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000758301 [0,1,0,0,0,1|2,0,0]=4 2154 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)F 62a_100000758301_100000686035 [0,1,0,0,0,1|2,0,0]=4 2155 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000758301 [0,1,0,0,0,1|2,0,0]=4 2156 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)N 62a_100000758301_100000739049 [0,1,0,0,0,1|2,0,0]=4 2157 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)O 62a_100000758301_100009813601 [0,1,0,0,0,1|2,0,0]=4 2158 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)Br 62a_100012356990_100016084084 [0,1,0,0,0,1|2,0,0]=4 2159 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)Br 62a_100016084084_100012356990 [0,1,0,0,0,1|2,0,0]=4 2160 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)Cl 62a_100011356854_100016084084 [0,1,0,0,0,1|2,0,0]=4 2161 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)Cl 62a_100016084084_100011356854 [0,1,0,0,0,1|2,0,0]=4 2162 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)F 62a_100000686035_100016084084 [0,1,0,0,0,1|2,0,0]=4 2163 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)F 62a_100016084084_100000686035 [0,1,0,0,0,1|2,0,0]=4 2164 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)N 62a_100000739049_100016084084 [0,1,0,0,0,1|2,0,0]=4 2165 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)N 62a_100016084084_100000739049 [0,1,0,0,0,1|2,0,0]=4 2166 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [0,1,0,0,0,1|2,0,0]=4 2167 B13R1.2879 Cc1ccc(cc1O)NC(C)CO 34a_100000759471_100012180447 [0,1,0,0,0,1|2,0,0]=4 2168 B13R1.2879 Cc1ccc(cc1O)NC(C)CO 7a_100000759471_100012180447 [0,1,0,0,0,1|2,0,0]=4 2169 B13R1.2879 Cc1ccc(cc1O)SC(C)CO 62a_100012180447_100000685420 [0,1,0,0,0,1|2,0,0]=4 2170 B13R1.2879 Cc1ccc(cc1O)S[C@H](C)CO 62a_100000685420_100016084084 [0,1,0,0,0,1|2,0,0]=4 2171 B13R1.2879 Cc1ccc(cc1O)S[C@H](C)CO 62a_100016084084_100000685420 [0,1,0,0,0,1|2,0,0]=4 2172 B13R1.30 CC(C)(CN[13CH3])c1cccc(c1)Br 2230a_100000749542_200025704644 [0,2,0,0,0,0|2,0,0]=4 2173 B13R1.30 CC(C)(CN[13CH3])c1cccc(c1)Cl 2230a_100000747265_200025704644 [0,2,0,0,0,0|2,0,0]=4 2174 B13R1.30 CC(C)(CN[13CH3])c1cccc(c1)F 2230a_100000757675_200025704644 [0,2,0,0,0,0|2,0,0]=4 2175 B13R1.30 CC(C)(CN[13CH3])c1cccc(c1)F 34a_100000757675_200025704644 [0,2,0,0,0,0|2,0,0]=4 2176 B13R1.30 CNCC(C)(C)c1cccc(c1)Br 2230a_100000749542_200000210301 [0,2,0,0,0,0|2,0,0]=4 2177 B13R1.30 CNCC(C)(C)c1cccc(c1)Cl 2230a_100000747265_200000210301 [0,2,0,0,0,0|2,0,0]=4 2178 B13R1.30 CNCC(C)(C)c1cccc(c1)F 2230a_100000757675_200000210301 [0,2,0,0,0,0|2,0,0]=4 2179 B13R1.30 CNCC(C)(C)c1cccc(c1)F 34a_100000757675_200000210301 [0,2,0,0,0,0|2,0,0]=4 2180 B13R1.3040 C=Cc1cccc(c1)C(C)(C)CN 271570a_100011290941_100000749542 [0,2,0,0,0,0|2,0,0]=4 2181 B13R1.3040 CC(C)(CN)c1cccc(c1)S[13CH3] 62a_100000749542_200025704644 [0,2,0,0,0,0|1,1,0]=4 2182 B13R1.3040 CC(C)(CN)c1cccc(c1)S[13CH3] 62a_200025704644_100000749542 [0,2,0,0,0,0|1,1,0]=4 2183 B13R1.3040 CSc1cccc(c1)C(C)(C)CN 62a_100000749542_200000210301 [0,2,0,0,0,0|1,1,0]=4 2184 B13R1.3040 CSc1cccc(c1)C(C)(C)CN 62a_200000210301_100000749542 [0,2,0,0,0,0|1,1,0]=4 2185 B13R1.3493 CC(C)(C(=O)N)c1cccc(c1)O 271570a_203496583355_200009815690 [0,2,0,0,0,0|1,0,1]=4 2186 B13R1.2 CCC(NCF)c1cccc(c1)O 34a_100159312145_100015361967 [0,2,0,0,0,0|2,0,0]=4 2187 B13R1.2 CCC(OCF)c1cccc(c1)Cl 34a_100000766619_100015361967 [0,2,0,0,0,0|2,0,0]=4 2188 B13R1.2 CCC(OCF)c1cccc(c1)Cl 7a_100000766619_100015361967 [0,2,0,0,0,0|2,0,0]=4 2189 B13R1.2 CCC(OCF)c1cccc(c1)F 34a_100011350881_100015361967 [0,2,0,0,0,0|2,0,0]=4 2190 B13R1.2 CCC(OCF)c1cccc(c1)F 7a_100011350881_100015361967 [0,2,0,0,0,0|2,0,0]=4 2191 B13R1.2 CCC(OCF)c1cccc(c1)I 34a_200013212081_100015361967 [0,2,0,0,0,0|2,0,0]=4 2192 B13R1.2 CCC(OCF)c1cccc(c1)I 7a_200013212081_100015361967 [0,2,0,0,0,0|2,0,0]=4 2193 B13R1.2 CCN(CCO)c1cccc(c1)O 2230a_100000717746_100000211926 [0,2,0,0,0,0|2,0,0]=4 2194 B13R1.2 CCN(CCO)c1cccc(c1)O 269982a_100000717746_100000211926 [0,2,0,0,0,0|2,0,0]=4 2195 B13R1.2 CCN(CCO)c1cccc(c1)O 34a_100000717746_100000211926 [0,2,0,0,0,0|2,0,0]=4 2196 B13R1.2 CCN(COC)c1cccc(c1)O 2230a_100000717746_100000766300 [0,2,0,0,0,0|2,0,0]=4 2197 B13R1.2 CCN(COC)c1cccc(c1)O 269982a_100000717746_100000766300 [0,2,0,0,0,0|2,0,0]=4 2198 B13R1.2 CCNC(CC)c1cccc(c1)O 2230a_100159312145_100000210202 [0,2,0,0,0,0|2,0,0]=4 2199 B13R1.2 CCNC(CC)c1cccc(c1)O 269862a_100015525214_100011996911 [0,2,0,0,0,0|2,0,0]=4 2200 B13R1.2 CCNC(CC)c1cccc(c1)O 34a_100159312145_100000210202 [0,2,0,0,0,0|2,0,0]=4 2201 B13R1.2 CCNC(CO)c1cccc(c1)Br 2230a_100000690078_100000210202 [0,2,0,0,0,0|2,0,0]=4 2202 B13R1.2 CCNC(CO)c1cccc(c1)Br 34a_100000690078_100000210202 [0,2,0,0,0,0|2,0,0]=4 2203 B13R1.2 CCNC(CO)c1cccc(c1)O 2230a_100025717460_100000210202 [0,2,0,0,0,0|1,0,0]=3 2204 B13R1.2 CCNC(CO)c1cccc(c1)O 34a_100025717460_100000210202 [0,2,0,0,0,0|1,0,0]=3 2205 B13R1.2 CCN[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_100000210202 [0,2,0,0,0,0|2,0,0]=4 2206 B13R1.2 CCN[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_100000210202 [0,2,0,0,0,0|2,0,0]=4 2207 B13R1.2 CCN[C@H](CO)c1cccc(c1)C 2230a_100009818812_100000210202 [0,2,0,0,0,0|2,0,0]=4 2208 B13R1.2 CCN[C@H](CO)c1cccc(c1)C 34a_100009818812_100000210202 [0,2,0,0,0,0|2,0,0]=4 2209 B13R1.2 CCN[C@H](CO)c1cccc(c1)F 2230a_100020641251_100000210202 [0,2,0,0,0,0|2,0,0]=4 2210 B13R1.2 CCN[C@H](CO)c1cccc(c1)F 34a_100020641251_100000210202 [0,2,0,0,0,0|2,0,0]=4 2211 B13R1.2 CCOC(CC)c1cccc(c1)Cl 34a_100000766619_100000210202 [0,2,0,0,0,0|2,0,0]=4 2212 B13R1.2 CCOC(CC)c1cccc(c1)Cl 7a_100000766619_100000210202 [0,2,0,0,0,0|2,0,0]=4 2213 B13R1.2 CCOC(CC)c1cccc(c1)F 34a_100011350881_100000210202 [0,2,0,0,0,0|2,0,0]=4 2214 B13R1.2 CCOC(CC)c1cccc(c1)F 7a_100011350881_100000210202 [0,2,0,0,0,0|2,0,0]=4 2215 B13R1.2 CCOC(CC)c1cccc(c1)I 34a_200013212081_100000210202 [0,2,0,0,0,0|2,0,0]=4 2216 B13R1.2 CCOC(CC)c1cccc(c1)I 7a_200013212081_100000210202 [0,2,0,0,0,0|2,0,0]=4 2217 B13R1.2 CNCC(OC)c1cccc(c1)Br 34a_200000733937_200000210301 [0,2,0,0,0,0|1,0,0]=3 2218 B13R1.2 CNCC(O[13CH3])c1cccc(c1)Br 34a_200000733937_200025704644 [0,2,0,0,0,0|1,0,0]=3 2219 B13R1.2 CN[C@@H](CCO)c1cccc(c1)O 2230a_100025705919_200000210301 [0,2,0,0,0,0|2,0,0]=4 2220 B13R1.2 CN[C@@H](CCO)c1cccc(c1)O 34a_100025705919_200000210301 [0,2,0,0,0,0|2,0,0]=4 2221 B13R1.2 Cc1cccc(c1)[C@@H](CO)NCF 34a_100009818812_100015361967 [0,2,0,0,0,0|2,0,0]=4 2222 B13R1.2 OCC(NCF)c1cccc(c1)Br 34a_100000690078_100015361967 [0,2,0,0,0,0|2,0,0]=4 2223 B13R1.2 OCC(NCF)c1cccc(c1)O 34a_100025717460_100015361967 [0,2,0,0,0,0|1,0,0]=3 2224 B13R1.2 OC[C@@H](NCF)c1cccc(c1)F 34a_100020641251_100015361967 [0,2,0,0,0,0|2,0,0]=4 2225 B13R1.2 OC[C@H](NCF)c1cccc(c1)Cl 34a_100032004910_100015361967 [0,2,0,0,0,0|2,0,0]=4 2226 B13R1.2 [13CH3]N[C@@H](CCO)c1cccc(c1)O 2230a_100025705919_200025704644 [0,2,0,0,0,0|2,0,0]=4 2227 B13R1.2 [13CH3]N[C@@H](CCO)c1cccc(c1)O 34a_100025705919_200025704644 [0,2,0,0,0,0|2,0,0]=4 2228 B13R1.317 CCC(OC)c1cc(ccc1C)Cl 34a_200012002771_200000210301 [0,2,0,0,0,0|2,0,0]=4 2229 B13R1.317 CCC(OC)c1cc(ccc1C)Cl 7a_200012002771_200000210301 [0,2,0,0,0,0|2,0,0]=4 2230 B13R1.317 CCC(O[13CH3])c1cc(ccc1C)Cl 34a_200012002771_200025704644 [0,2,0,0,0,0|2,0,0]=4 2231 B13R1.317 CCC(O[13CH3])c1cc(ccc1C)Cl 7a_200012002771_200025704644 [0,2,0,0,0,0|2,0,0]=4 2232 B13R1.321 CCC(OC)c1cc(cc(c1)F)F 34a_200011518859_200000210301 [0,2,0,0,0,0|2,0,0]=4 2233 B13R1.321 CCC(OC)c1cc(cc(c1)F)F 7a_200011518859_200000210301 [0,2,0,0,0,0|2,0,0]=4 2234 B13R1.321 CCC(O[13CH3])c1cc(cc(c1)F)F 34a_200011518859_200025704644 [0,2,0,0,0,0|2,0,0]=4 2235 B13R1.321 CCC(O[13CH3])c1cc(cc(c1)F)F 7a_200011518859_200025704644 [0,2,0,0,0,0|2,0,0]=4 2236 B13R1.331 CO[C@H](CCl)c1ccc(c(c1)F)F 34a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2237 B13R1.331 CO[C@H](CCl)c1ccc(c(c1)F)F 7a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2238 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 2239 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 2240 B13R1.646 CCC(NC)c1cccc(c1)OC 269862a_106832991636_100000759430 [0,2,0,0,0,0|2,0,0]=4 2241 B13R1.646 CC[C@@H](NC)c1cccc(c1)OC 2230a_100015193793_200000210301 [0,2,0,0,0,0|2,0,0]=4 2242 B13R1.646 CC[C@@H](N[13CH3])c1cccc(c1)OC 2230a_100015193793_200025704644 [0,2,0,0,0,0|2,0,0]=4 2243 B13R1.646 CNC(CO)c1cccc(c1)OC 2230a_100020589383_200000210301 [0,2,0,0,0,0|2,0,0]=4 2244 B13R1.646 CNC(CO)c1cccc(c1)OC 34a_100020589383_200000210301 [0,2,0,0,0,0|2,0,0]=4 2245 B13R1.646 COc1cccc(c1)C(CO)N[13CH3] 2230a_100020589383_200025704644 [0,2,0,0,0,0|2,0,0]=4 2246 B13R1.646 COc1cccc(c1)C(CO)N[13CH3] 34a_100020589383_200025704644 [0,2,0,0,0,0|2,0,0]=4 2247 B13R1.18 C#CCNC(C)c1cccc(c1)O 2230a_100000740644_100000038162 [0,2,0,0,0,0|2,0,0]=4 2248 B13R1.18 C=CCNC(C)c1cccc(c1)O 2230a_100000740644_100000210623 [0,2,0,0,0,0|2,0,0]=4 2249 B13R1.18 CC(NCC#N)c1cccc(c1)O 2230a_100000740644_100011215382 [0,2,0,0,0,0|1,0,1]=4 2250 B13R1.18 CC(NCC=O)c1cccc(c1)O 2230a_100000740644_200015260668 [0,2,0,0,0,0|2,0,0]=4 2251 B13R1.18 CC(NCCF)c1cccc(c1)O 2230a_100000740644_100011217306 [0,2,0,0,0,0|2,0,0]=4 2252 B13R1.18 CC(NCCF)c1cccc(c1)O 269862a_100000724931_100000211620 [0,2,0,0,0,0|2,0,0]=4 2253 B13R1.18 CC(NCCO)c1cccc(c1)O 2230a_100000740644_100000211926 [0,2,0,0,0,0|2,0,0]=4 2254 B13R1.18 CC(NCCO)c1cccc(c1)O 269862a_100000210304_100000211620 [0,2,0,0,0,0|2,0,0]=4 2255 B13R1.18 CCCNC(C)c1cccc(c1)O 2230a_100000740644_100000210303 [0,2,0,0,0,0|2,0,0]=4 2256 B13R1.18 CCCNC(C)c1cccc(c1)O 269862a_100020643023_100000211620 [0,2,0,0,0,0|2,0,0]=4 2257 B13R1.18 CCNCC(O)c1cccc(c1)O 2230a_100020657549_100000210202 [0,2,0,0,0,0|0,0,0]=2 2258 B13R1.18 CCNCC(O)c1cccc(c1)O 34a_100020657549_100000210202 [0,2,0,0,0,0|0,0,0]=2 2259 B13R1.18 COCNC(C)c1cccc(c1)O 2230a_100000740644_100000766300 [0,2,0,0,0,0|2,0,0]=4 2260 B13R1.18 CSCNC(C)c1cccc(c1)O 2230a_100000740644_100011218213 [0,2,0,0,0,0|2,0,0]=4 2261 B13R1.18 Oc1cccc(c1)C(O)CNCF 34a_100020657549_100015361967 [0,2,0,0,0,0|0,0,0]=2 2262 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [0,2,0,0,0,0|2,0,0]=4 2263 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [0,2,0,0,0,0|2,0,0]=4 2264 B13R1.147 CC(C)NC(C)c1cccc(c1)O 2230a_100000740644_100000210206 [0,2,0,0,0,0|2,0,0]=4 2265 B13R1.147 CN(C)CC(=O)c1cccc(c1)O 269982a_100102631434_100009813753 [0,2,0,0,0,0|0,0,2]=4 2266 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 2230a_200000733937_200000210301 [0,2,0,0,0,0|1,0,0]=3 2267 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 269982a_200000733937_200000210301 [0,2,0,0,0,0|1,0,0]=3 2268 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_200000210301 [0,2,0,0,0,0|0,0,0]=2 2269 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_200000210301 [0,2,0,0,0,0|0,0,0]=2 2270 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 2230a_100000756613_100000747473 [0,2,0,0,0,0|2,0,0]=4 2271 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 269982a_100000756613_100000187820 [0,2,0,0,0,0|2,0,0]=4 2272 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 34a_100000756613_100000187820 [0,2,0,0,0,0|2,0,0]=4 2273 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 2230a_200000733937_200025704644 [0,2,0,0,0,0|1,0,0]=3 2274 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 269982a_200000733937_200025704644 [0,2,0,0,0,0|1,0,0]=3 2275 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 2230a_100009815823_200025704644 [0,2,0,0,0,0|0,0,0]=2 2276 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 269982a_100009815823_200025704644 [0,2,0,0,0,0|0,0,0]=2 2277 B13R1.147 NC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000187820 [0,2,0,0,0,0|0,0,2]=4 2278 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [0,2,0,0,0,0|2,0,0]=4 2279 B13R1.446 CNCC(=O)c1cc(ccc1O)O 34a_100102657272_100009814097 [0,2,0,0,0,0|0,0,2]=4 2280 B13R1.446 CNCC(=O)c1cc(ccc1O)O 7a_106832991635_100009814097 [0,2,0,0,0,0|0,0,2]=4 2281 B13R1.450 CCNC(C)c1cc(cc(c1)O)C 269862a_100015525214_100009855872 [0,2,0,0,0,0|2,0,0]=4 2282 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 2230a_106832991635_100010006762 [0,2,0,0,0,0|0,0,2]=4 2283 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 34a_100102657272_100010006762 [0,2,0,0,0,0|0,0,2]=4 2284 B13R1.460 C=Cc1cccc(c1)C(O)CNC 271570a_100011290941_200000733937 [0,2,0,0,0,0|1,0,0]=3 2285 B13R1.460 CCNC(C)c1cccc(c1)OC 2230a_100000737859_100000210202 [0,2,0,0,0,0|2,0,0]=4 2286 B13R1.460 CCNC(C)c1cccc(c1)OC 269862a_100015525214_100000171656 [0,2,0,0,0,0|2,0,0]=4 2287 B13R1.460 CCOC(C)c1cccc(c1)OC 34a_100000246466_100000210202 [0,2,0,0,0,0|2,0,0]=4 2288 B13R1.460 CCOC(C)c1cccc(c1)OC 7a_100000246466_100000210202 [0,2,0,0,0,0|2,0,0]=4 2289 B13R1.460 CNCC(=O)c1cccc(c1)OC 34a_100102657272_100000211451 [0,2,0,0,0,0|0,0,2]=4 2290 B13R1.460 CNCC(=O)c1cccc(c1)OC 7a_106832991635_100000211451 [0,2,0,0,0,0|0,0,2]=4 2291 B13R1.460 CNCC(O)c1cccc(c1)SC 62a_200000210301_200000733937 [0,2,0,0,0,0|0,1,0]=3 2292 B13R1.460 CNCC(O)c1cccc(c1)SC 62a_200000733937_200000210301 [0,2,0,0,0,0|0,1,0]=3 2293 B13R1.460 CNCC(O)c1cccc(c1)S[13CH3] 62a_200000733937_200025704644 [0,2,0,0,0,0|0,1,0]=3 2294 B13R1.460 CNCC(O)c1cccc(c1)S[13CH3] 62a_200025704644_200000733937 [0,2,0,0,0,0|0,1,0]=3 2295 B13R1.460 CNC[C@H](O)c1cccc(c1)OC 34a_100009815823_200000210301 [0,2,0,0,0,0|0,0,0]=2 2296 B13R1.460 CNC[C@H](O)c1cccc(c1)O[13CH3] 34a_100009815823_200025704644 [0,2,0,0,0,0|0,0,0]=2 2297 B13R1.460 COCC(N)c1cccc(c1)OC 34a_100020589383_200000210301 [0,2,0,0,0,0|2,0,0]=4 2298 B13R1.460 COc1cccc(c1)C(C)OCF 34a_100000246466_100015361967 [0,2,0,0,0,0|2,0,0]=4 2299 B13R1.460 COc1cccc(c1)C(C)OCF 7a_100000246466_100015361967 [0,2,0,0,0,0|2,0,0]=4 2300 B13R1.460 COc1cccc(c1)C(N)CO[13CH3] 34a_100020589383_200025704644 [0,2,0,0,0,0|2,0,0]=4 2301 B13R1.460 COc1cccc(c1)[C@@H](N)CCO 34a_100025705919_200000210301 [0,2,0,0,0,0|2,0,0]=4 2302 B13R1.460 [13CH3]Oc1cccc(c1)[C@@H](N)CCO 34a_100025705919_200025704644 [0,2,0,0,0,0|2,0,0]=4 2303 B13R1.466 CCNC(C)c1ccc(c(c1)O)C 269862a_100015525214_100000084092 [0,2,0,0,0,0|2,0,0]=4 2304 B13R1.466 CCNC(C)c1ccc(c(c1)O)F 269862a_100015525214_100000117923 [0,2,0,0,0,0|2,0,0]=4 2305 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [0,2,0,0,0,0|0,0,2]=4 2306 B13R1.466 CNCC(O)c1ccc(c(c1)O)O 34a_100000106456_200000210301 [0,2,0,0,0,0|0,0,0]=2 2307 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 2230a_106832991635_100000761251 [0,2,0,0,0,0|1,0,0]=3 2308 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 34a_100102657272_100000761251 [0,2,0,0,0,0|1,0,0]=3 2309 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 7a_106832991635_100000761251 [0,2,0,0,0,0|1,0,0]=3 2310 B13R1.466 COC[C@@H](O)c1ccc(c(c1)F)F 34a_100138415774_100000761251 [0,2,0,0,0,0|2,0,0]=4 2311 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200000210301 [0,2,0,0,0,0|2,0,0]=4 2312 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_200000210301_100000761251 [0,2,0,0,0,0|2,0,0]=4 2313 B13R1.466 [13CH3]NCC(O)c1ccc(c(c1)O)O 34a_100000106456_200025704644 [0,2,0,0,0,0|0,0,0]=2 2314 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 2315 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 2316 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,2,0,0,0,0|1,0,1]=4 2317 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 2318 B13R1.3492 N[C@H](c1cccc(c1)O)C(F)(F)F 271570a_203496583355_100025709620 [0,2,0,0,0,0|2,0,0]=4 2319 B13R1.3492 Oc1cccc(c1)C(O)C(F)(F)F 271570a_203496583355_100000766643 [0,2,0,0,0,0|1,0,0]=3 2320 B13R1.3492 Oc1cccc(n1)C(O)C(F)(F)F 271570a_203496583355_100010074360 [0,2,0,0,0,0|2,0,0]=4 2321 B13R1.3492 Oc1cncc(c1)[C@H](O)C(F)(F)F 271570a_203496583355_100103104144 [0,2,0,0,0,0|2,0,0]=4 2322 B13R1.374 C=C=Cc1cccc(c1)C(O)CC 271570a_100015277604_200013212081 [0,2,0,0,0,0|2,0,0]=4 2323 B13R1.374 CC=Cc1cccc(c1)C(O)CC 271570a_100016259895_200013212081 [0,2,0,0,0,0|2,0,0]=4 2324 B13R1.374 CCC(N)c1cccc(c1)OCF 34a_100159312145_100015361967 [0,2,0,0,0,0|2,0,0]=4 2325 B13R1.374 CCC(O)c1cccc(c1)SCF 62a_100015361967_200013212081 [0,2,0,0,0,0|1,1,0]=4 2326 B13R1.374 CCC(O)c1cccc(c1)SCF 62a_200013212081_100015361967 [0,2,0,0,0,0|1,1,0]=4 2327 B13R1.374 CCOc1cccc(c1)C(N)CC 34a_100159312145_100000210202 [0,2,0,0,0,0|2,0,0]=4 2328 B13R1.374 CCOc1cccc(c1)C(N)CO 34a_100025717460_100000210202 [0,2,0,0,0,0|2,0,0]=4 2329 B13R1.374 CCOc1cccc(c1)C(O)CN 34a_100020657549_100000210202 [0,2,0,0,0,0|0,0,0]=2 2330 B13R1.374 CCSc1cccc(c1)C(O)CC 62a_100000210202_200013212081 [0,2,0,0,0,0|1,1,0]=4 2331 B13R1.374 CCSc1cccc(c1)C(O)CC 62a_200013212081_100000210202 [0,2,0,0,0,0|1,1,0]=4 2332 B13R1.374 CNCc1cccc(c1)C(O)CN 26a_100102657272_100020657549 [0,2,0,0,0,0|1,0,0]=3 2333 B13R1.374 NC(CO)c1cccc(c1)OCF 34a_100025717460_100015361967 [0,2,0,0,0,0|2,0,0]=4 2334 B13R1.374 NCC(O)c1cccc(c1)OCF 34a_100020657549_100015361967 [0,2,0,0,0,0|0,0,0]=2 2335 B13R1.543 C=C(C)c1cccc(c1)C(O)CC 271570a_100000694244_200013212081 [0,2,0,0,0,0|2,0,0]=4 2336 B11R2.35 Brc1cccc(c1)C2CC2 271570a_100011220607_100000691529 [1,0,0,1,0,0|2,0,0]=4 2337 B11R2.35 Cc1cccc(c1)C2CC2 271570a_100011220607_100011215228 [1,0,0,1,0,0|2,0,0]=4 2338 B11R2.35 Clc1cccc(c1)C2CC2 271570a_100011220607_100000699651 [1,0,0,1,0,0|2,0,0]=4 2339 B11R2.35 Fc1cccc(c1)C2CC2 271570a_100011220607_100000685547 [1,0,0,1,0,0|2,0,0]=4 2340 B11R2.35 Nc1cccc(c1)C2CC2 271570a_100011220607_100000210019 [1,0,0,1,0,0|2,0,0]=4 2341 B11R2.35 Oc1cc(ccn1)C2CC2 271570a_203496583355_100009863080 [1,0,0,1,0,0|2,0,0]=4 2342 B11R2.35 Oc1cccc(c1)C2CC2 271570a_100011220607_100000211634 [1,0,0,1,0,0|1,0,0]=3 2343 B11R2.35 Oc1cccc(c1)C2CC2 271570a_203496583355_100009816567 [1,0,0,1,0,0|1,0,0]=3 2344 B11R2.35 Oc1ccnc(c1)C2CC2 271570a_100011220607_100000762945 [1,0,0,1,0,0|2,0,0]=4 2345 B11R2.35 Oc1ccnc(c1)C2CC2 271570a_203496583355_100009820009 [1,0,0,1,0,0|2,0,0]=4 2346 B11R2.35 Oc1cncc(c1)C2CC2 271570a_100011220607_100000754920 [1,0,0,1,0,0|2,0,0]=4 2347 B11R2.35 Oc1cncc(c1)C2CC2 271570a_203496583355_200009866503 [1,0,0,1,0,0|2,0,0]=4 2348 B11R2.35 [S]c1cccc(c1)C2CC2 271570a_100011220607_114929384022 [1,0,0,1,0,0|1,1,0]=4 2349 B11R2.36 Oc1cc2c(cn1)NCC2 271570a_203496583355_100009884275 [1,0,0,1,0,0|1,0,0]=3 2350 B11R2.36 Oc1cc2c(cn1)OCC2 271570a_203496583355_102495363667 [1,0,0,1,0,0|2,0,0]=4 2351 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,0,0,1,0,0|0,0,2]=4 2352 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,0,0,1,0,0|1,0,1]=4 2353 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,0,0,1,0,0|1,0,1]=4 2354 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,1,0,0|1,0,1]=4 2355 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,0,0,1,0,0|1,0,0]=3 2356 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,0,0,1,0,0|0,0,0]=2 2357 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,0,0,1,0,0|1,0,0]=3 2358 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,0,0,1,0,0|2,0,0]=4 2359 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,0,0,1,0,0|2,0,0]=4 2360 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,0,0,1,0,0|2,0,0]=4 2361 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,0,0,1,0,0|2,0,0]=4 2362 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,0,0,1,0,0|2,0,0]=4 2363 B11R2.36 Oc1ccc2c(n1)CCC2 271570a_203496583355_100000046531 [1,0,0,1,0,0|2,0,0]=4 2364 B11R2.36 Oc1ccc2c(n1)CCN2 271570a_203496583355_100009872833 [1,0,0,1,0,0|1,0,0]=3 2365 B11R2.36 Oc1cnc2c(c1)CCC2 271570a_203496583355_100000693888 [1,0,0,1,0,0|2,0,0]=4 2366 B11R2.36 Oc1cnc2c(c1)CCN2 271570a_203496583355_100009817725 [1,0,0,1,0,0|1,0,0]=3 2367 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [1,0,0,1,0,0|1,0,0]=3 2368 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [1,0,0,1,0,0|2,0,0]=4 2369 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,0,0,1,0,0|2,0,0]=4 2370 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [1,0,0,1,0,0|2,0,0]=4 2371 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [1,0,0,1,0,0|2,0,0]=4 2372 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [1,0,0,1,0,0|0,0,0]=2 2373 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,0,0,1,0,0|1,0,0]=3 2374 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [1,0,0,1,0,0|2,0,0]=4 2375 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,0,0,1,0,0|0,0,2]=4 2376 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,0,0,1,0,0|1,0,1]=4 2377 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [1,0,0,1,0,0|2,0,0]=4 2378 B11R2.106 Oc1ccnc2c1CCC2 271570a_203496583355_100000102697 [1,0,0,1,0,0|2,0,0]=4 2379 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,0,0,1,0,0|1,0,1]=4 2380 B13R2.43 CCc1cc2cc(ccc2o1)O 271570a_203496583355_200010233821 [0,0,0,1,0,1|1,0,1]=4 2381 B13R2.43 CCc1nc2cc(ccc2o1)O 271570a_203496583355_100009817032 [0,0,0,1,0,1|1,0,1]=4 2382 B13R2.43 OCc1cc2cc(ccc2o1)O 271570a_203496583355_100011934623 [0,0,0,1,0,1|1,0,1]=4 2383 B13R2.54 OCC1Cc2cccc(c2O1)O 271570a_203496583355_200102525175 [0,0,0,1,0,1|1,0,0]=3 2384 B13R2.155 CC1CNc2ccc(cc2O1)O 271570a_203496583355_200010108538 [0,0,0,1,0,1|1,0,0]=3 2385 B13R2.3021 Oc1cccc(c1)NC2CCC2 34a_100000210217_100000749161 [0,0,0,1,0,1|2,0,0]=4 2386 B13R2.3021 Oc1cccc(c1)NC2COC2 34a_100000210217_100009818527 [0,0,0,1,0,1|2,0,0]=4 2387 B13R2.3021 Oc1cccc(c1)OC2CCC2 271570a_203496583355_200010986888 [0,0,0,1,0,1|2,0,0]=4 2388 B13R2.100 N#CC1(CC1)c2cccc(c2)O 271570a_203496583355_100000723992 [0,1,0,1,0,0|2,0,0]=4 2389 B13R2.3018 Oc1cccc(c1)C2(CCC2)O 271570a_203496583355_200010765678 [0,1,0,1,0,0|1,0,0]=3 2390 B13R2.3791 CC1(CNc2c1cc(cc2)O)C 271570a_203496583355_100000756796 [0,1,0,1,0,0|1,0,0]=3 2391 B13R2.9 CN[C@H]1CCc2c1cccc2O 2230a_100134616730_200000210301 [0,1,0,1,0,0|2,0,0]=4 2392 B13R2.9 CN[C@H]1CCc2c1cccc2O 34a_100134616730_200000210301 [0,1,0,1,0,0|2,0,0]=4 2393 B13R2.9 COC1CCc2c1cccc2C 34a_100011467954_200000210301 [0,1,0,1,0,0|2,0,0]=4 2394 B13R2.9 COC1CCc2c1cccc2C 7a_100011467954_200000210301 [0,1,0,1,0,0|2,0,0]=4 2395 B13R2.9 CO[C@H]1CCc2c1cccc2Br 34a_100010080924_200000210301 [0,1,0,1,0,0|2,0,0]=4 2396 B13R2.9 CO[C@H]1CCc2c1cccc2Br 7a_100010080924_200000210301 [0,1,0,1,0,0|2,0,0]=4 2397 B13R2.9 Cc1cccc2c1CCC2O[13CH3] 34a_100011467954_200025704644 [0,1,0,1,0,0|2,0,0]=4 2398 B13R2.9 Cc1cccc2c1CCC2O[13CH3] 7a_100011467954_200025704644 [0,1,0,1,0,0|2,0,0]=4 2399 B13R2.9 [13CH3]N[C@H]1CCc2c1cccc2O 2230a_100134616730_200025704644 [0,1,0,1,0,0|2,0,0]=4 2400 B13R2.9 [13CH3]N[C@H]1CCc2c1cccc2O 34a_100134616730_200025704644 [0,1,0,1,0,0|2,0,0]=4 2401 B13R2.9 [13CH3]O[C@H]1CCc2c1cccc2Br 34a_100010080924_200025704644 [0,1,0,1,0,0|2,0,0]=4 2402 B13R2.9 [13CH3]O[C@H]1CCc2c1cccc2Br 7a_100010080924_200025704644 [0,1,0,1,0,0|2,0,0]=4 2403 B13R2.13 Oc1cccc(c1)C2=COCC2 271570a_100000118173_100000211634 [0,1,0,1,0,0|1,0,1]=4 2404 B13R2.13 Oc1cccc(c1)C2CCCN2 271570a_203496583355_100015187783 [0,1,0,1,0,0|2,0,0]=4 2405 B13R2.13 Oc1cccc(c1)C2OCCO2 271570a_203496583355_100009813323 [0,1,0,1,0,0|1,0,0]=3 2406 B13R2.13 Oc1ccnc(c1)C2OCCO2 271570a_203496583355_100010879467 [0,1,0,1,0,0|2,0,0]=4 2407 B13R2.13 Oc1cncc(c1)C2OCCO2 271570a_203496583355_100010134100 [0,1,0,1,0,0|2,0,0]=4 2408 B13R2.2136 COC1CCc2c1cc(cc2)Br 34a_100011836024_200000210301 [0,1,0,1,0,0|2,0,0]=4 2409 B13R2.2136 COC1CCc2c1cc(cc2)Br 7a_100011836024_200000210301 [0,1,0,1,0,0|2,0,0]=4 2410 B13R2.2136 N#CC1CCc2c1cc(cc2)O 271570a_203496583355_100012360268 [0,1,0,1,0,0|2,0,0]=4 2411 B13R2.2136 [13CH3]OC1CCc2c1cc(cc2)Br 34a_100011836024_200025704644 [0,1,0,1,0,0|2,0,0]=4 2412 B13R2.2136 [13CH3]OC1CCc2c1cc(cc2)Br 7a_100011836024_200025704644 [0,1,0,1,0,0|2,0,0]=4 2413 B13R2.162 CC1CCNc2c1cc(cc2)O 271570a_203496583355_200013856564 [0,1,0,1,0,0|1,0,0]=3 2414 B13R2.162 NC1CCCc2c1cc(cc2)O 271570a_203496583355_100011742594 [0,1,0,1,0,0|2,0,0]=4 2415 B13R2.162 NC1CCSc2c1cc(cc2)O 271570a_203496583355_100000744474 [0,1,0,1,0,0|2,0,0]=4 2416 B13R2.162 N[C@H]1CCOc2c1cc(cc2)O 271570a_203496583355_100020639276 [0,1,0,1,0,0|2,0,0]=4 2417 B13R2.162 O=C1CCNc2c1cc(cc2)O 271570a_203496583355_100000697366 [0,1,0,1,0,0|0,0,2]=4 2418 B13R2.162 Oc1ccc2c(c1)C(CCC2)O 271570a_203496583355_100011660633 [0,1,0,1,0,0|1,0,0]=3 2419 B13R2.162 Oc1ccc2c(c1)C(CCO2)O 271570a_203496583355_100000760992 [0,1,0,1,0,0|1,0,0]=3 2420 B13R2.342 NC1CCCc2c1cccc2O 271570a_203496583355_100020639248 [0,1,0,1,0,0|2,0,0]=4 2421 B13R2.342 NC1CCOc2c1cccc2O 271570a_203496583355_100000727345 [0,1,0,1,0,0|2,0,0]=4 2422 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [0,1,0,1,0,0|0,0,2]=4 2423 B13R2.342 Oc1cccc2c1CCCC2O 271570a_203496583355_100009815610 [0,1,0,1,0,0|1,0,0]=3 2424 B13R2.5187 Cn1nc(c2c1ccc(c2)O)O 271570a_203496583355_100015481540 [0,1,0,1,0,0|1,0,1]=4 2425 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,1,0,1,0,0|1,0,1]=4 2426 B13R2.573 C=Cc1cccc2c1CC[C@@H]2O 271570a_100011290941_100010080924 [0,1,0,1,0,0|2,0,0]=4 2427 B13R2.573 COc1cccc2c1CC[C@@H]2N 34a_100134616730_200000210301 [0,1,0,1,0,0|2,0,0]=4 2428 B13R2.573 COc1cccc2c1[nH]nc2O 271570a_203496583355_100010231496 [0,1,0,1,0,0|1,0,1]=4 2429 B13R2.573 CSc1cccc2c1CC[C@@H]2O 62a_100010080924_200000210301 [0,1,0,1,0,0|1,1,0]=4 2430 B13R2.573 CSc1cccc2c1CC[C@@H]2O 62a_200000210301_100010080924 [0,1,0,1,0,0|1,1,0]=4 2431 B13R2.573 [13CH3]Oc1cccc2c1CC[C@@H]2N 34a_100134616730_200025704644 [0,1,0,1,0,0|2,0,0]=4 2432 B13R2.573 [13CH3]Sc1cccc2c1CC[C@@H]2O 62a_100010080924_200025704644 [0,1,0,1,0,0|1,1,0]=4 2433 B13R2.573 [13CH3]Sc1cccc2c1CC[C@@H]2O 62a_200025704644_100010080924 [0,1,0,1,0,0|1,1,0]=4 2434 B13R2.669 C=Cc1ccc2c(c1)C(CC2)O 271570a_100011290941_100011836024 [0,1,0,1,0,0|2,0,0]=4 2435 B13R2.669 COc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353730 [0,1,0,1,0,0|1,0,1]=4 2436 B13R2.669 CSc1ccc2c(c1)C(CC2)O 62a_100011836024_200000210301 [0,1,0,1,0,0|1,1,0]=4 2437 B13R2.669 CSc1ccc2c(c1)C(CC2)O 62a_200000210301_100011836024 [0,1,0,1,0,0|1,1,0]=4 2438 B13R2.669 [13CH3]Sc1ccc2c(c1)C(CC2)O 62a_100011836024_200025704644 [0,1,0,1,0,0|1,1,0]=4 2439 B13R2.669 [13CH3]Sc1ccc2c(c1)C(CC2)O 62a_200025704644_100011836024 [0,1,0,1,0,0|1,1,0]=4 2440 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [1,0,0,0,1,0|2,0,0]=4 2441 B9R1.7 NCCn1cc(cn1)O 271570a_203496583355_100000730845 [1,0,0,0,1,0|2,0,0]=4 2442 B9R1.35 CC(N)c1cc(cs1)O 271570a_203496583355_100159270200 [1,0,0,0,1,0|2,0,0]=4 2443 B9R1.35 CC(N)c1ccc(s1)O 271570a_203496583355_100102723530 [1,0,0,0,1,0|2,0,0]=4 2444 B11R1.40 CC(CO)Nc1ccccc1 34a_100000106764_100012180447 [1,0,0,0,0,1|2,0,0]=4 2445 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [1,0,0,0,0,1|2,0,0]=4 2446 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [1,0,0,0,0,1|2,0,0]=4 2447 B11R1.40 CC(CO)Sc1ccccc1 62a_100012180447_100000041952 [1,0,0,0,0,1|2,0,0]=4 2448 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [1,0,0,0,0,1|2,0,0]=4 2449 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [1,0,0,0,0,1|2,0,0]=4 2450 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [1,0,0,0,0,1|2,0,0]=4 2451 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [1,0,0,0,0,1|2,0,0]=4 2452 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [1,0,0,0,0,1|2,0,0]=4 2453 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100000719477_100016084084 [1,0,0,0,0,1|2,0,0]=4 2454 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100016084084_100000041952 [1,0,0,0,0,1|2,0,0]=4 2455 B13R1.15 C=CC(O)CNc1cccc(c1)O 34a_100000210217_100000730141 [0,0,0,0,0,2|1,0,1]=4 2456 B13R1.15 C=CC(O)CSc1cccc(c1)O 62a_100000730141_100000211634 [0,0,0,0,0,2|1,0,1]=4 2457 B13R1.15 CC(CF)OCc1cccc(c1)O 34a_100016041109_100011660834 [0,0,0,0,0,2|2,0,0]=4 2458 B13R1.15 CC(CF)OCc1cccc(c1)O 7a_100016041109_100000084143 [0,0,0,0,0,2|2,0,0]=4 2459 B13R1.15 CC(CN)OCc1cccc(c1)Br 34a_100000210904_100000698116 [0,0,0,0,0,2|2,0,0]=4 2460 B13R1.15 CC(CN)OCc1cccc(c1)Cl 34a_100000210904_100000187163 [0,0,0,0,0,2|2,0,0]=4 2461 B13R1.15 CC(CN)OCc1cccc(c1)F 34a_100000210904_100000187166 [0,0,0,0,0,2|2,0,0]=4 2462 B13R1.15 CC(CN)OCc1cccc(c1)I 34a_100000210904_100011218688 [0,0,0,0,0,2|2,0,0]=4 2463 B13R1.15 CC(CN)OCc1cccc(c1)O 34a_100000210904_100011660834 [0,0,0,0,0,2|1,0,0]=3 2464 B13R1.15 CC(CO)NCc1cccc(c1)O 2230a_100000743036_100012180447 [0,0,0,0,0,2|2,0,0]=4 2465 B13R1.15 CC(CO)NCc1cccc(c1)O 34a_100000743036_100012180447 [0,0,0,0,0,2|2,0,0]=4 2466 B13R1.15 CC(CO)SCc1cccc(c1)O 62a_100012180447_100011660834 [0,0,0,0,0,2|2,0,0]=4 2467 B13R1.15 CCC(C)CNc1cccc(c1)O 34a_100000210217_100000748023 [0,0,0,0,0,2|2,0,0]=4 2468 B13R1.15 CCC(C)CSc1cccc(c1)O 62a_100000748023_100000211634 [0,0,0,0,0,2|2,0,0]=4 2469 B13R1.15 CCC(C)NCc1cccc(c1)O 207a_100000209981_100000188321 [0,0,0,0,0,2|2,0,0]=4 2470 B13R1.15 CCC(C)NCc1cccc(c1)O 2230a_100000209981_100011660834 [0,0,0,0,0,2|2,0,0]=4 2471 B13R1.15 CCC(C)NCc1cccc(c1)O 2230a_100000743036_100000758301 [0,0,0,0,0,2|2,0,0]=4 2472 B13R1.15 CCC(C)NCc1cccc(c1)O 270004a_100000209981_100000188321 [0,0,0,0,0,2|2,0,0]=4 2473 B13R1.15 CCC(C)NCc1cccc(c1)O 271570a_203496583355_100015184642 [0,0,0,0,0,2|2,0,0]=4 2474 B13R1.15 CCC(C)NCc1cccc(c1)O 34a_100000743036_100011215416 [0,0,0,0,0,2|2,0,0]=4 2475 B13R1.15 CCC(C)OCc1cccc(c1)O 7a_100000210228_100000084143 [0,0,0,0,0,2|2,0,0]=4 2476 B13R1.15 CCC(C)SCc1cccc(c1)O 62a_100000758301_100011660834 [0,0,0,0,0,2|2,0,0]=4 2477 B13R1.15 CCC(C)SCc1cccc(c1)O 62a_100011660834_100000758301 [0,0,0,0,0,2|2,0,0]=4 2478 B13R1.15 CCC(O)CNc1cccc(c1)Br 34a_100000210019_100011218378 [0,0,0,0,0,2|2,0,0]=4 2479 B13R1.15 CCC(O)CNc1cccc(c1)C 2230a_100000188690_100011218378 [0,0,0,0,0,2|2,0,0]=4 2480 B13R1.15 CCC(O)CNc1cccc(c1)C 34a_100000188690_100011218378 [0,0,0,0,0,2|2,0,0]=4 2481 B13R1.15 CCC(O)CNc1cccc(c1)Cl 34a_100000185859_100011218378 [0,0,0,0,0,2|2,0,0]=4 2482 B13R1.15 CCC(O)CNc1cccc(c1)F 34a_100000210047_100011218378 [0,0,0,0,0,2|2,0,0]=4 2483 B13R1.15 CCC(O)CNc1cccc(c1)I 34a_100000211102_100011218378 [0,0,0,0,0,2|2,0,0]=4 2484 B13R1.15 CCC(O)CNc1cccc(c1)O 34a_100000210217_100011218378 [0,0,0,0,0,2|1,0,0]=3 2485 B13R1.15 CCC(O)COc1cccc(c1)Br 34a_100000210342_100011218378 [0,0,0,0,0,2|2,0,0]=4 2486 B13R1.15 CCC(O)COc1cccc(c1)Br 7a_100000210342_100011218378 [0,0,0,0,0,2|2,0,0]=4 2487 B13R1.15 CCC(O)COc1cccc(c1)C 34a_100000210337_100011218378 [0,0,0,0,0,2|2,0,0]=4 2488 B13R1.15 CCC(O)COc1cccc(c1)C 7a_100000210337_100011218378 [0,0,0,0,0,2|2,0,0]=4 2489 B13R1.15 CCC(O)COc1cccc(c1)Cl 34a_100000210295_100011218378 [0,0,0,0,0,2|2,0,0]=4 2490 B13R1.15 CCC(O)COc1cccc(c1)Cl 7a_100000210295_100011218378 [0,0,0,0,0,2|2,0,0]=4 2491 B13R1.15 CCC(O)COc1cccc(c1)F 34a_100000210426_100011218378 [0,0,0,0,0,2|2,0,0]=4 2492 B13R1.15 CCC(O)COc1cccc(c1)F 7a_100000210426_100011218378 [0,0,0,0,0,2|2,0,0]=4 2493 B13R1.15 CCC(O)COc1cccc(c1)I 34a_100000211634_100011218378 [0,0,0,0,0,2|2,0,0]=4 2494 B13R1.15 CCC(O)COc1cccc(c1)I 7a_100000211634_100011218378 [0,0,0,0,0,2|2,0,0]=4 2495 B13R1.15 CCC(O)COc1cccc(c1)N 34a_100000210217_100011218378 [0,0,0,0,0,2|2,0,0]=4 2496 B13R1.15 CCC(O)CSc1cc(ccn1)O 62a_100011218378_100000762945 [0,0,0,0,0,2|2,0,0]=4 2497 B13R1.15 CCC(O)CSc1cccc(c1)Br 62a_100000691529_100011218378 [0,0,0,0,0,2|2,0,0]=4 2498 B13R1.15 CCC(O)CSc1cccc(c1)Br 62a_100011218378_100000691529 [0,0,0,0,0,2|2,0,0]=4 2499 B13R1.15 CCC(O)CSc1cccc(c1)C 62a_100011215228_100011218378 [0,0,0,0,0,2|2,0,0]=4 2500 B13R1.15 CCC(O)CSc1cccc(c1)C 62a_100011218378_100011215228 [0,0,0,0,0,2|2,0,0]=4 2501 B13R1.15 CCC(O)CSc1cccc(c1)Cl 62a_100000699651_100011218378 [0,0,0,0,0,2|2,0,0]=4 2502 B13R1.15 CCC(O)CSc1cccc(c1)Cl 62a_100011218378_100000699651 [0,0,0,0,0,2|2,0,0]=4 2503 B13R1.15 CCC(O)CSc1cccc(c1)F 62a_100000685547_100011218378 [0,0,0,0,0,2|2,0,0]=4 2504 B13R1.15 CCC(O)CSc1cccc(c1)F 62a_100011218378_100000685547 [0,0,0,0,0,2|2,0,0]=4 2505 B13R1.15 CCC(O)CSc1cccc(c1)N 62a_100000210019_100011218378 [0,0,0,0,0,2|2,0,0]=4 2506 B13R1.15 CCC(O)CSc1cccc(c1)N 62a_100011218378_100000210019 [0,0,0,0,0,2|2,0,0]=4 2507 B13R1.15 CCC(O)CSc1cccc(c1)O 62a_100011218378_100000211634 [0,0,0,0,0,2|1,0,0]=3 2508 B13R1.15 CCC(O)CSc1cccc(c1)[S] 62a_100011218378_114929384022 [0,0,0,0,0,2|1,1,0]=4 2509 B13R1.15 CCC(O)CSc1cccc(c1)[S] 62a_114929384022_100011218378 [0,0,0,0,0,2|1,1,0]=4 2510 B13R1.15 CCC(O)CSc1cncc(c1)O 62a_100000754920_100011218378 [0,0,0,0,0,2|2,0,0]=4 2511 B13R1.15 CCC(O)CSc1cncc(c1)O 62a_100011218378_100000754920 [0,0,0,0,0,2|2,0,0]=4 2512 B13R1.15 CC[C@H](C)CNc1cccc(c1)O 34a_100000210217_100009816398 [0,0,0,0,0,2|2,0,0]=4 2513 B13R1.15 CC[C@H](C)CSc1cccc(c1)O 62a_100009816398_100000211634 [0,0,0,0,0,2|2,0,0]=4 2514 B13R1.15 C[C@@H](CO)CNc1cccc(c1)O 34a_100000210217_100000059175 [0,0,0,0,0,2|2,0,0]=4 2515 B13R1.15 C[C@@H](CO)CSc1cccc(c1)O 62a_100000059175_100000211634 [0,0,0,0,0,2|2,0,0]=4 2516 B13R1.15 C[C@H](CF)NCc1cccc(c1)O 207a_100102880703_100000188321 [0,0,0,0,0,2|2,0,0]=4 2517 B13R1.15 C[C@H](CF)NCc1cccc(c1)O 270004a_100102880703_100000188321 [0,0,0,0,0,2|2,0,0]=4 2518 B13R1.15 C[C@H](CO)NCc1cccc(c1)O 207a_100000737577_100000188321 [0,0,0,0,0,2|2,0,0]=4 2519 B13R1.15 C[C@H](CO)NCc1cccc(c1)O 2230a_100000737577_100011660834 [0,0,0,0,0,2|2,0,0]=4 2520 B13R1.15 C[C@H](CO)NCc1cccc(c1)O 270004a_100000737577_100000188321 [0,0,0,0,0,2|2,0,0]=4 2521 B13R1.15 C[C@H](CO)SCc1cccc(c1)O 62a_100011660834_100016084084 [0,0,0,0,0,2|2,0,0]=4 2522 B13R1.15 C[C@H](CO)SCc1cccc(c1)O 62a_100016084084_100011660834 [0,0,0,0,0,2|2,0,0]=4 2523 B13R1.15 Cc1cccc(c1)COC(C)CN 34a_100000210904_100000211840 [0,0,0,0,0,2|2,0,0]=4 2524 B13R1.15 Cc1cccc(c1)NCC(O)CO 2230a_100000188690_100011219619 [0,0,0,0,0,2|2,0,0]=4 2525 B13R1.15 Cc1cccc(c1)NCC(O)CO 34a_100000188690_100011219619 [0,0,0,0,0,2|2,0,0]=4 2526 B13R1.15 Cc1cccc(c1)NC[C@@H](O)CF 2230a_100000188690_100015614560 [0,0,0,0,0,2|2,0,0]=4 2527 B13R1.15 Cc1cccc(c1)NC[C@@H](O)CF 34a_100000188690_100015614560 [0,0,0,0,0,2|2,0,0]=4 2528 B13R1.15 Cc1cccc(c1)NC[C@@H](O)CO 2230a_100000188690_100009815848 [0,0,0,0,0,2|2,0,0]=4 2529 B13R1.15 Cc1cccc(c1)NC[C@@H](O)CO 34a_100000188690_100009815848 [0,0,0,0,0,2|2,0,0]=4 2530 B13R1.15 Cc1cccc(c1)OCC(O)CO 34a_100000210337_100011219619 [0,0,0,0,0,2|2,0,0]=4 2531 B13R1.15 Cc1cccc(c1)OCC(O)CO 7a_100000210337_100011219619 [0,0,0,0,0,2|2,0,0]=4 2532 B13R1.15 Cc1cccc(c1)OC[C@@H](O)CF 34a_100000210337_100015614560 [0,0,0,0,0,2|2,0,0]=4 2533 B13R1.15 Cc1cccc(c1)OC[C@@H](O)CF 7a_100000210337_100015614560 [0,0,0,0,0,2|2,0,0]=4 2534 B13R1.15 Cc1cccc(c1)OC[C@@H](O)CO 34a_100000210337_100009815848 [0,0,0,0,0,2|2,0,0]=4 2535 B13R1.15 Cc1cccc(c1)OC[C@@H](O)CO 7a_100000210337_100009815848 [0,0,0,0,0,2|2,0,0]=4 2536 B13R1.15 Cc1cccc(c1)SCC(O)CO 62a_100011215228_100011219619 [0,0,0,0,0,2|2,0,0]=4 2537 B13R1.15 Cc1cccc(c1)SCC(O)CO 62a_100011219619_100011215228 [0,0,0,0,0,2|2,0,0]=4 2538 B13R1.15 Cc1cccc(c1)SC[C@@H](O)CF 62a_100011215228_100015614560 [0,0,0,0,0,2|2,0,0]=4 2539 B13R1.15 Cc1cccc(c1)SC[C@@H](O)CF 62a_100015614560_100011215228 [0,0,0,0,0,2|2,0,0]=4 2540 B13R1.15 Cc1cccc(c1)SC[C@@H](O)CO 62a_100009815848_100011215228 [0,0,0,0,0,2|2,0,0]=4 2541 B13R1.15 Cc1cccc(c1)SC[C@@H](O)CO 62a_100011215228_100009815848 [0,0,0,0,0,2|2,0,0]=4 2542 B13R1.15 Nc1cccc(c1)OCC(O)CO 34a_100000210217_100011219619 [0,0,0,0,0,2|2,0,0]=4 2543 B13R1.15 Nc1cccc(c1)OC[C@@H](O)CF 34a_100000210217_100015614560 [0,0,0,0,0,2|2,0,0]=4 2544 B13R1.15 Nc1cccc(c1)OC[C@@H](O)CO 34a_100000210217_100009815848 [0,0,0,0,0,2|2,0,0]=4 2545 B13R1.15 Nc1cccc(c1)SCC(O)CO 62a_100000210019_100011219619 [0,0,0,0,0,2|2,0,0]=4 2546 B13R1.15 Nc1cccc(c1)SCC(O)CO 62a_100011219619_100000210019 [0,0,0,0,0,2|2,0,0]=4 2547 B13R1.15 Nc1cccc(c1)SC[C@@H](O)CF 62a_100000210019_100015614560 [0,0,0,0,0,2|2,0,0]=4 2548 B13R1.15 Nc1cccc(c1)SC[C@@H](O)CF 62a_100015614560_100000210019 [0,0,0,0,0,2|2,0,0]=4 2549 B13R1.15 Nc1cccc(c1)SC[C@@H](O)CO 62a_100000210019_100009815848 [0,0,0,0,0,2|2,0,0]=4 2550 B13R1.15 Nc1cccc(c1)SC[C@@H](O)CO 62a_100009815848_100000210019 [0,0,0,0,0,2|2,0,0]=4 2551 B13R1.15 OCC(O)CNc1cccc(c1)Br 34a_100000210019_100011219619 [0,0,0,0,0,2|2,0,0]=4 2552 B13R1.15 OCC(O)CNc1cccc(c1)Cl 34a_100000185859_100011219619 [0,0,0,0,0,2|2,0,0]=4 2553 B13R1.15 OCC(O)CNc1cccc(c1)F 34a_100000210047_100011219619 [0,0,0,0,0,2|2,0,0]=4 2554 B13R1.15 OCC(O)CNc1cccc(c1)I 34a_100000211102_100011219619 [0,0,0,0,0,2|2,0,0]=4 2555 B13R1.15 OCC(O)CNc1cccc(c1)O 34a_100000210217_100011219619 [0,0,0,0,0,2|1,0,0]=3 2556 B13R1.15 OCC(O)COc1cccc(c1)Br 34a_100000210342_100011219619 [0,0,0,0,0,2|2,0,0]=4 2557 B13R1.15 OCC(O)COc1cccc(c1)Br 7a_100000210342_100011219619 [0,0,0,0,0,2|2,0,0]=4 2558 B13R1.15 OCC(O)COc1cccc(c1)Cl 34a_100000210295_100011219619 [0,0,0,0,0,2|2,0,0]=4 2559 B13R1.15 OCC(O)COc1cccc(c1)Cl 7a_100000210295_100011219619 [0,0,0,0,0,2|2,0,0]=4 2560 B13R1.15 OCC(O)COc1cccc(c1)F 34a_100000210426_100011219619 [0,0,0,0,0,2|2,0,0]=4 2561 B13R1.15 OCC(O)COc1cccc(c1)F 7a_100000210426_100011219619 [0,0,0,0,0,2|2,0,0]=4 2562 B13R1.15 OCC(O)COc1cccc(c1)I 34a_100000211634_100011219619 [0,0,0,0,0,2|2,0,0]=4 2563 B13R1.15 OCC(O)COc1cccc(c1)I 7a_100000211634_100011219619 [0,0,0,0,0,2|2,0,0]=4 2564 B13R1.15 OCC(O)CSc1cc(ccn1)O 62a_100011219619_100000762945 [0,0,0,0,0,2|2,0,0]=4 2565 B13R1.15 OCC(O)CSc1cccc(c1)Br 62a_100000691529_100011219619 [0,0,0,0,0,2|2,0,0]=4 2566 B13R1.15 OCC(O)CSc1cccc(c1)Br 62a_100011219619_100000691529 [0,0,0,0,0,2|2,0,0]=4 2567 B13R1.15 OCC(O)CSc1cccc(c1)Cl 62a_100000699651_100011219619 [0,0,0,0,0,2|2,0,0]=4 2568 B13R1.15 OCC(O)CSc1cccc(c1)Cl 62a_100011219619_100000699651 [0,0,0,0,0,2|2,0,0]=4 2569 B13R1.15 OCC(O)CSc1cccc(c1)F 62a_100000685547_100011219619 [0,0,0,0,0,2|2,0,0]=4 2570 B13R1.15 OCC(O)CSc1cccc(c1)F 62a_100011219619_100000685547 [0,0,0,0,0,2|2,0,0]=4 2571 B13R1.15 OCC(O)CSc1cccc(c1)O 62a_100011219619_100000211634 [0,0,0,0,0,2|1,0,0]=3 2572 B13R1.15 OCC(O)CSc1cccc(c1)[S] 62a_100011219619_114929384022 [0,0,0,0,0,2|1,1,0]=4 2573 B13R1.15 OCC(O)CSc1cccc(c1)[S] 62a_114929384022_100011219619 [0,0,0,0,0,2|1,1,0]=4 2574 B13R1.15 OCC(O)CSc1cncc(c1)O 62a_100000754920_100011219619 [0,0,0,0,0,2|2,0,0]=4 2575 B13R1.15 OCC(O)CSc1cncc(c1)O 62a_100011219619_100000754920 [0,0,0,0,0,2|2,0,0]=4 2576 B13R1.15 OC[C@H](O)CNc1cccc(c1)Br 34a_100000210019_100009815848 [0,0,0,0,0,2|2,0,0]=4 2577 B13R1.15 OC[C@H](O)CNc1cccc(c1)Cl 34a_100000185859_100009815848 [0,0,0,0,0,2|2,0,0]=4 2578 B13R1.15 OC[C@H](O)CNc1cccc(c1)F 34a_100000210047_100009815848 [0,0,0,0,0,2|2,0,0]=4 2579 B13R1.15 OC[C@H](O)CNc1cccc(c1)I 34a_100000211102_100009815848 [0,0,0,0,0,2|2,0,0]=4 2580 B13R1.15 OC[C@H](O)CNc1cccc(c1)O 34a_100000210217_100009815848 [0,0,0,0,0,2|1,0,0]=3 2581 B13R1.15 OC[C@H](O)COc1cccc(c1)Br 34a_100000210342_100009815848 [0,0,0,0,0,2|2,0,0]=4 2582 B13R1.15 OC[C@H](O)COc1cccc(c1)Br 7a_100000210342_100009815848 [0,0,0,0,0,2|2,0,0]=4 2583 B13R1.15 OC[C@H](O)COc1cccc(c1)Cl 34a_100000210295_100009815848 [0,0,0,0,0,2|2,0,0]=4 2584 B13R1.15 OC[C@H](O)COc1cccc(c1)Cl 7a_100000210295_100009815848 [0,0,0,0,0,2|2,0,0]=4 2585 B13R1.15 OC[C@H](O)COc1cccc(c1)F 34a_100000210426_100009815848 [0,0,0,0,0,2|2,0,0]=4 2586 B13R1.15 OC[C@H](O)COc1cccc(c1)F 7a_100000210426_100009815848 [0,0,0,0,0,2|2,0,0]=4 2587 B13R1.15 OC[C@H](O)COc1cccc(c1)I 34a_100000211634_100009815848 [0,0,0,0,0,2|2,0,0]=4 2588 B13R1.15 OC[C@H](O)COc1cccc(c1)I 7a_100000211634_100009815848 [0,0,0,0,0,2|2,0,0]=4 2589 B13R1.15 OC[C@H](O)CSc1cc(ccn1)O 62a_100009815848_100000762945 [0,0,0,0,0,2|2,0,0]=4 2590 B13R1.15 OC[C@H](O)CSc1cccc(c1)Br 62a_100000691529_100009815848 [0,0,0,0,0,2|2,0,0]=4 2591 B13R1.15 OC[C@H](O)CSc1cccc(c1)Br 62a_100009815848_100000691529 [0,0,0,0,0,2|2,0,0]=4 2592 B13R1.15 OC[C@H](O)CSc1cccc(c1)Cl 62a_100000699651_100009815848 [0,0,0,0,0,2|2,0,0]=4 2593 B13R1.15 OC[C@H](O)CSc1cccc(c1)Cl 62a_100009815848_100000699651 [0,0,0,0,0,2|2,0,0]=4 2594 B13R1.15 OC[C@H](O)CSc1cccc(c1)F 62a_100000685547_100009815848 [0,0,0,0,0,2|2,0,0]=4 2595 B13R1.15 OC[C@H](O)CSc1cccc(c1)F 62a_100009815848_100000685547 [0,0,0,0,0,2|2,0,0]=4 2596 B13R1.15 OC[C@H](O)CSc1cccc(c1)O 62a_100009815848_100000211634 [0,0,0,0,0,2|1,0,0]=3 2597 B13R1.15 OC[C@H](O)CSc1cccc(c1)[S] 62a_100009815848_114929384022 [0,0,0,0,0,2|1,1,0]=4 2598 B13R1.15 OC[C@H](O)CSc1cccc(c1)[S] 62a_114929384022_100009815848 [0,0,0,0,0,2|1,1,0]=4 2599 B13R1.15 OC[C@H](O)CSc1cncc(c1)O 62a_100000754920_100009815848 [0,0,0,0,0,2|2,0,0]=4 2600 B13R1.15 OC[C@H](O)CSc1cncc(c1)O 62a_100009815848_100000754920 [0,0,0,0,0,2|2,0,0]=4 2601 B13R1.15 O[C@@H](CF)CNc1cccc(c1)Br 34a_100000210019_100015614560 [0,0,0,0,0,2|2,0,0]=4 2602 B13R1.15 O[C@@H](CF)CNc1cccc(c1)Cl 34a_100000185859_100015614560 [0,0,0,0,0,2|2,0,0]=4 2603 B13R1.15 O[C@@H](CF)CNc1cccc(c1)F 34a_100000210047_100015614560 [0,0,0,0,0,2|2,0,0]=4 2604 B13R1.15 O[C@@H](CF)CNc1cccc(c1)I 34a_100000211102_100015614560 [0,0,0,0,0,2|2,0,0]=4 2605 B13R1.15 O[C@@H](CF)COc1cccc(c1)Br 34a_100000210342_100015614560 [0,0,0,0,0,2|2,0,0]=4 2606 B13R1.15 O[C@@H](CF)COc1cccc(c1)Br 7a_100000210342_100015614560 [0,0,0,0,0,2|2,0,0]=4 2607 B13R1.15 O[C@@H](CF)COc1cccc(c1)Cl 34a_100000210295_100015614560 [0,0,0,0,0,2|2,0,0]=4 2608 B13R1.15 O[C@@H](CF)COc1cccc(c1)Cl 7a_100000210295_100015614560 [0,0,0,0,0,2|2,0,0]=4 2609 B13R1.15 O[C@@H](CF)COc1cccc(c1)F 34a_100000210426_100015614560 [0,0,0,0,0,2|2,0,0]=4 2610 B13R1.15 O[C@@H](CF)COc1cccc(c1)F 7a_100000210426_100015614560 [0,0,0,0,0,2|2,0,0]=4 2611 B13R1.15 O[C@@H](CF)COc1cccc(c1)I 34a_100000211634_100015614560 [0,0,0,0,0,2|2,0,0]=4 2612 B13R1.15 O[C@@H](CF)COc1cccc(c1)I 7a_100000211634_100015614560 [0,0,0,0,0,2|2,0,0]=4 2613 B13R1.15 O[C@@H](CF)CSc1cccc(c1)Br 62a_100000691529_100015614560 [0,0,0,0,0,2|2,0,0]=4 2614 B13R1.15 O[C@@H](CF)CSc1cccc(c1)Br 62a_100015614560_100000691529 [0,0,0,0,0,2|2,0,0]=4 2615 B13R1.15 O[C@@H](CF)CSc1cccc(c1)Cl 62a_100000699651_100015614560 [0,0,0,0,0,2|2,0,0]=4 2616 B13R1.15 O[C@@H](CF)CSc1cccc(c1)Cl 62a_100015614560_100000699651 [0,0,0,0,0,2|2,0,0]=4 2617 B13R1.15 O[C@@H](CF)CSc1cccc(c1)F 62a_100000685547_100015614560 [0,0,0,0,0,2|2,0,0]=4 2618 B13R1.15 O[C@@H](CF)CSc1cccc(c1)F 62a_100015614560_100000685547 [0,0,0,0,0,2|2,0,0]=4 2619 B13R1.15 O[C@@H](CF)CSc1cccc(c1)[S] 62a_100015614560_114929384022 [0,0,0,0,0,2|1,1,0]=4 2620 B13R1.15 O[C@@H](CF)CSc1cccc(c1)[S] 62a_114929384022_100015614560 [0,0,0,0,0,2|1,1,0]=4 2621 B13R1.15 Oc1cccc(c1)NC[C@@H](O)CF 34a_100000210217_100015614560 [0,0,0,0,0,2|1,0,0]=3 2622 B13R1.15 Oc1cccc(c1)SC[C@@H](O)CF 62a_100015614560_100000211634 [0,0,0,0,0,2|1,0,0]=3 2623 B13R1.15 Oc1ccnc(c1)SC[C@@H](O)CF 62a_100015614560_100000762945 [0,0,0,0,0,2|2,0,0]=4 2624 B13R1.15 Oc1cncc(c1)SC[C@@H](O)CF 62a_100000754920_100015614560 [0,0,0,0,0,2|2,0,0]=4 2625 B13R1.15 Oc1cncc(c1)SC[C@@H](O)CF 62a_100015614560_100000754920 [0,0,0,0,0,2|2,0,0]=4