0 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.225 CC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_200000210301 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.225 CC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_200000210301 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.225 CC(=O)C(C)c1cccc(c1)F 1458a_100000762896_200000210301 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.225 CC(=O)N(C)c1cccc(c1)O 527a_100000756613_100103153847 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.225 CC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_200000210301 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000722698_200025704644 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000762818_200025704644 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)F 1458a_100000762896_200025704644 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.225 CC(C)C(=O)c1cccc(c1)Br 1458a_100000210664_100000210206 [0,0,0,0,0,0|2,0,2]=4 13 B12R1.225 CC(C)C(=O)c1cccc(c1)Cl 1458a_100000210390_100000210206 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.225 CC(C)C(=O)c1cccc(c1)F 1458a_100000210950_100000210206 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.225 CC(C)C(=O)c1cccc(c1)I 1458a_100000184098_100000210206 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [0,0,0,0,0,0|1,0,2]=3 17 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [0,0,0,0,0,0|1,0,2]=3 18 B12R1.225 CC(C)N(C)c1cccc(c1)Br 2230a_100000219648_100000210206 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.225 CC(C)N(C)c1cccc(c1)Br 269982a_100000219648_100000210206 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.225 CC(C)N(C)c1cccc(c1)Br 269982a_100000219649_200000210301 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.225 CC(C)N(C)c1cccc(c1)Br 34a_100000219648_100000210206 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.225 CC(C)N(C)c1cccc(c1)Br 34a_100000219649_200000210301 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.225 CC(C)N(C)c1cccc(c1)Br 7a_100000219649_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B12R1.225 CC(C)N(C)c1cccc(c1)Cl 2230a_100000220044_100000210206 [0,0,0,0,0,0|4,0,0]=4 25 B12R1.225 CC(C)N(C)c1cccc(c1)Cl 269982a_100000220044_100000210206 [0,0,0,0,0,0|4,0,0]=4 26 B12R1.225 CC(C)N(C)c1cccc(c1)Cl 34a_100000220044_100000210206 [0,0,0,0,0,0|4,0,0]=4 27 B12R1.225 CC(C)N(C)c1cccc(c1)F 2230a_100000220071_200000210301 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.225 CC(C)N(C)c1cccc(c1)F 2230a_100020633736_100000210206 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.225 CC(C)N(C)c1cccc(c1)F 269982a_100000220071_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.225 CC(C)N(C)c1cccc(c1)F 269982a_100020633736_100000210206 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.225 CC(C)N(C)c1cccc(c1)F 34a_100000220071_200000210301 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.225 CC(C)N(C)c1cccc(c1)F 34a_100020633736_100000210206 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.225 CC(C)N(C)c1cccc(c1)F 7a_100000220071_200000210301 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.225 CC(C)N(C)c1cccc(c1)I 2230a_100000221217_100000210206 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.225 CC(C)N(C)c1cccc(c1)I 269982a_100000221217_100000210206 [0,0,0,0,0,0|4,0,0]=4 36 B12R1.225 CC(C)N(C)c1cccc(c1)I 34a_100000221217_100000210206 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.225 CC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000210206 [0,0,0,0,0,0|3,0,0]=3 38 B12R1.225 CC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000210206 [0,0,0,0,0,0|3,0,0]=3 39 B12R1.225 CC(C)N(C)c1cccc(c1)O 34a_100000756613_100000210206 [0,0,0,0,0,0|3,0,0]=3 40 B12R1.225 CC(C)N([13CH3])c1cccc(c1)Br 269982a_100000219649_200025704644 [0,0,0,0,0,0|4,0,0]=4 41 B12R1.225 CC(C)N([13CH3])c1cccc(c1)Br 34a_100000219649_200025704644 [0,0,0,0,0,0|4,0,0]=4 42 B12R1.225 CC(C)N([13CH3])c1cccc(c1)Br 7a_100000219649_200025704644 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.225 CC(C)N([13CH3])c1cccc(c1)F 2230a_100000220071_200025704644 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.225 CC(C)N([13CH3])c1cccc(c1)F 269982a_100000220071_200025704644 [0,0,0,0,0,0|4,0,0]=4 45 B12R1.225 CC(C)N([13CH3])c1cccc(c1)F 34a_100000220071_200025704644 [0,0,0,0,0,0|4,0,0]=4 46 B12R1.225 CC(C)N([13CH3])c1cccc(c1)F 7a_100000220071_200025704644 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.225 CC(c1cccc(c1)Br)N(C)C 2230a_100025717457_200000210301 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.225 CC(c1cccc(c1)Br)N(C)C 269982a_100025717457_200000210301 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 2230a_100025717457_200025704644 [0,0,0,0,0,0|4,0,0]=4 50 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 269982a_100025717457_200025704644 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.225 CC(c1cccc(c1)F)N(C)C 2230a_100000231114_200000210301 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.225 CC(c1cccc(c1)F)N(C)C 269982a_100000231114_200000210301 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.225 CC(c1cccc(c1)F)N(C)C 34a_100000231114_200000210301 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 2230a_100000231114_200025704644 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 269982a_100000231114_200025704644 [0,0,0,0,0,0|4,0,0]=4 56 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 34a_100000231114_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B12R1.225 CN(C)C(=O)c1cccc(c1)O 240690a_100102631434_100000183914 [0,0,0,0,0,0|2,0,2]=4 58 B12R1.225 CN(C)C(=O)c1cccc(c1)O 271570a_203496583355_100000159571 [0,0,0,0,0,0|2,0,2]=4 59 B12R1.225 CN(C)C(=O)c1cccc(c1)O 527a_100102631434_100000183914 [0,0,0,0,0,0|2,0,2]=4 60 B12R1.225 Cc1cccc(c1)C(=O)C(C)C 1458a_100000189346_100000210206 [0,0,0,0,0,0|2,0,2]=4 61 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,0,0,0,0,0|2,0,1]=3 62 B12R1.225 Cc1cccc(c1)N(C)C(C)C 2230a_100000219674_100000210206 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.225 Cc1cccc(c1)N(C)C(C)C 269982a_100000219674_100000210206 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.225 Cc1cccc(c1)N(C)C(C)C 34a_100000219674_100000210206 [0,0,0,0,0,0|4,0,0]=4 65 B12R1.225 Cc1cccc(c1)[C@@H](C)C(=O)[13CH3] 1458a_200009911544_200025704644 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,0,0,0,0,0|2,0,1]=3 67 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,0,0,0,0,0|2,0,1]=3 68 B11R1.23 CC(N[13CH3])c1cccc(c1)Br 2230a_100020642005_200025704644 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 2230a_100102723534_200025704644 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 34a_100102723534_200025704644 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [1,0,0,0,0,0|3,0,0]=4 73 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [1,0,0,0,0,0|3,0,0]=4 80 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [1,0,0,0,0,0|1,0,2]=4 81 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [1,0,0,0,0,0|1,0,2]=4 82 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [1,0,0,0,0,0|1,0,2]=4 83 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [1,0,0,0,0,0|1,0,2]=4 84 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [1,0,0,0,0,0|1,0,2]=4 85 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [1,0,0,0,0,0|1,0,2]=4 86 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [1,0,0,0,0,0|0,0,2]=3 87 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [1,0,0,0,0,0|0,0,2]=3 88 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [1,0,0,0,0,0|1,0,2]=4 89 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [1,0,0,0,0,0|0,0,0]=1 90 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000219648_100000210202 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000738899_200000210301 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000219648_100000204670 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000738899_200000210301 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000219648_100000210202 [1,0,0,0,0,0|3,0,0]=4 95 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000738899_200000210301 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [1,0,0,0,0,0|3,0,0]=4 100 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.23 CCN(C)c1cccc(c1)Cl 2230a_100000220044_100000210202 [1,0,0,0,0,0|3,0,0]=4 104 B11R1.23 CCN(C)c1cccc(c1)Cl 269982a_100000220044_100000204670 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.23 CCN(C)c1cccc(c1)Cl 34a_100000220044_100000210202 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.23 CCN(C)c1cccc(c1)F 2230a_100020633736_100000210202 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.23 CCN(C)c1cccc(c1)F 269982a_100020633736_100000204670 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.23 CCN(C)c1cccc(c1)F 34a_100020633736_100000210202 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.23 CCN(C)c1cccc(c1)I 2230a_100000221217_100000210202 [1,0,0,0,0,0|3,0,0]=4 110 B11R1.23 CCN(C)c1cccc(c1)I 269982a_100000221217_100000204670 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.23 CCN(C)c1cccc(c1)I 34a_100000221217_100000210202 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [1,0,0,0,0,0|2,0,0]=3 113 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [1,0,0,0,0,0|2,0,0]=3 114 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [1,0,0,0,0,0|2,0,0]=3 115 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [1,0,0,0,0,0|2,0,0]=3 116 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [1,0,0,0,0,0|2,0,0]=3 117 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [1,0,0,0,0,0|2,0,0]=3 118 B11R1.23 CCN([13CH3])c1cccc(c1)Br 2230a_100000738899_200025704644 [1,0,0,0,0,0|3,0,0]=4 119 B11R1.23 CCN([13CH3])c1cccc(c1)Br 269982a_100000738899_200025704644 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.23 CCN([13CH3])c1cccc(c1)Br 34a_100000738899_200025704644 [1,0,0,0,0,0|3,0,0]=4 121 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [1,0,0,0,0,0|3,0,0]=4 122 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [1,0,0,0,0,0|3,0,0]=4 123 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [1,0,0,0,0,0|3,0,0]=4 124 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [1,0,0,0,0,0|2,0,0]=3 126 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [1,0,0,0,0,0|2,0,0]=3 127 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [1,0,0,0,0,0|1,0,0]=2 129 B11R1.23 CN(CF)c1cccc(c1)O 269982a_100000756613_100015361967 [1,0,0,0,0,0|3,0,0]=4 130 B11R1.23 CN(CF)c1cccc(c1)O 34a_100000756613_100015361967 [1,0,0,0,0,0|3,0,0]=4 131 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [1,0,0,0,0,0|1,0,2]=4 132 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [1,0,0,0,0,0|1,0,2]=4 133 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [1,0,0,0,0,0|1,0,2]=4 134 B11R1.23 CNC(C)c1cccc(c1)Br 2230a_100020642005_200000210301 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.23 CNC(C)c1cccc(c1)Br 269862a_106832991636_100000210093 [1,0,0,0,0,0|3,0,0]=4 136 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [1,0,0,0,0,0|3,0,0]=4 137 B11R1.23 CNC(C)c1cccc(c1)Cl 2230a_100102723534_200000210301 [1,0,0,0,0,0|3,0,0]=4 138 B11R1.23 CNC(C)c1cccc(c1)Cl 269862a_106832991636_200000210964 [1,0,0,0,0,0|3,0,0]=4 139 B11R1.23 CNC(C)c1cccc(c1)Cl 34a_100102723534_200000210301 [1,0,0,0,0,0|3,0,0]=4 140 B11R1.23 CNC(C)c1cccc(c1)F 269862a_106832991636_100000187083 [1,0,0,0,0,0|3,0,0]=4 141 B11R1.23 CNC(C)c1cccc(c1)I 269862a_106832991636_100011356966 [1,0,0,0,0,0|3,0,0]=4 142 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [1,0,0,0,0,0|2,0,0]=3 143 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [1,0,0,0,0,0|2,0,0]=3 144 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [1,0,0,0,0,0|2,0,0]=3 145 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [1,0,0,0,0,0|3,0,0]=4 146 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.23 CN[C@H](C)c1cccc(c1)F 2230a_100015193778_200000210301 [1,0,0,0,0,0|3,0,0]=4 148 B11R1.23 CN[C@H](C)c1cccc(c1)F 34a_100015193778_200000210301 [1,0,0,0,0,0|3,0,0]=4 149 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [1,0,0,0,0,0|1,0,2]=4 150 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [1,0,0,0,0,0|3,0,0]=4 151 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [1,0,0,0,0,0|3,0,0]=4 152 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [1,0,0,0,0,0|3,0,0]=4 153 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [1,0,0,0,0,0|3,0,0]=4 154 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [1,0,0,0,0,0|3,0,0]=4 155 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [1,0,0,0,0,0|3,0,0]=4 156 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [1,0,0,0,0,0|3,0,0]=4 158 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [1,0,0,0,0,0|3,0,0]=4 159 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [1,0,0,0,0,0|3,0,0]=4 160 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [1,0,0,0,0,0|3,0,0]=4 161 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [1,0,0,0,0,0|3,0,0]=4 162 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 2230a_100015193778_200025704644 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 34a_100015193778_200025704644 [1,0,0,0,0,0|3,0,0]=4 164 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [1,0,0,0,0,0|3,0,0]=4 165 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [1,0,0,0,0,0|3,0,0]=4 166 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [1,0,0,0,0,0|3,0,0]=4 167 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [1,0,0,0,0,0|3,0,0]=4 168 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [1,0,0,0,0,0|3,0,0]=4 169 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [1,0,0,0,0,0|3,0,0]=4 170 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [1,0,0,0,0,0|2,0,0]=3 171 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [1,0,0,0,0,0|0,0,2]=3 172 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [1,0,0,0,0,0|1,0,2]=4 173 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [1,0,0,0,0,0|1,0,2]=4 174 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [1,0,0,0,0,0|2,0,1]=4 175 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [1,0,0,0,0,0|2,0,1]=4 176 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [1,0,0,0,0,0|2,0,1]=4 177 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,0,0,0,0,0|1,0,1]=3 178 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [1,0,0,0,0,0|1,0,2]=4 179 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 182 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 183 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 186 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 188 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 189 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 190 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [1,0,0,0,0,0|3,0,0]=4 192 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [1,0,0,0,0,0|3,0,0]=4 193 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [1,0,0,0,0,0|3,0,0]=4 194 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [1,0,0,0,0,0|3,0,0]=4 195 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [1,0,0,0,0,0|3,0,0]=4 196 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [1,0,0,0,0,0|2,0,1]=4 197 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [1,0,0,0,0,0|2,0,1]=4 198 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,0,0,0,0,0|1,0,1]=3 199 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [1,0,0,0,0,0|1,0,2]=4 200 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [1,0,0,0,0,0|2,0,1]=4 201 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [1,0,0,0,0,0|2,0,1]=4 202 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [1,0,0,0,0,0|2,0,1]=4 203 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [1,0,0,0,0,0|2,0,1]=4 204 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [1,0,0,0,0,0|2,0,1]=4 205 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [1,0,0,0,0,0|2,0,1]=4 206 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [1,0,0,0,0,0|2,0,1]=4 207 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [1,0,0,0,0,0|2,0,1]=4 208 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [1,0,0,0,0,0|2,0,1]=4 209 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [1,0,0,0,0,0|2,0,1]=4 210 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,0,0,0,0,0|1,0,1]=3 211 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,0,0,0,0,0|1,0,1]=3 212 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,0,0,0,0,0|1,0,1]=3 213 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [1,0,0,0,0,0|2,0,1]=4 215 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [1,0,0,0,0,0|2,0,1]=4 216 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [1,0,0,0,0,0|2,0,1]=4 217 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [1,0,0,0,0,0|2,0,1]=4 218 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [1,0,0,0,0,0|1,0,0]=2 219 B11R1.157 CC(C)Nc1cc(ccn1)O 271570a_203496583355_200012354261 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.157 CC(C)Nc1cccc(c1)Br 34a_100000210019_100000210206 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.157 CC(C)Nc1cccc(c1)Cl 34a_100000185859_100000210206 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.157 CC(C)Nc1cccc(c1)F 34a_100000210047_100000210206 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.157 CC(C)Nc1cccc(c1)I 34a_100000211102_100000210206 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [1,0,0,0,0,0|2,0,0]=3 225 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.157 CC(C)Oc1cc(ccn1)O 271570a_203496583355_100010247003 [1,0,0,0,0,0|3,0,0]=4 227 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [1,0,0,0,0,0|3,0,0]=4 228 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [1,0,0,0,0,0|3,0,0]=4 229 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [1,0,0,0,0,0|3,0,0]=4 230 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [1,0,0,0,0,0|3,0,0]=4 231 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [1,0,0,0,0,0|3,0,0]=4 232 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [1,0,0,0,0,0|3,0,0]=4 233 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [1,0,0,0,0,0|3,0,0]=4 235 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [1,0,0,0,0,0|3,0,0]=4 236 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [1,0,0,0,0,0|2,0,0]=3 237 B11R1.157 CC(C)Oc1cccc(n1)O 271570a_203496583355_100000703025 [1,0,0,0,0,0|3,0,0]=4 238 B11R1.157 CC(C)Oc1cncc(c1)O 271570a_203496583355_100012029599 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.157 CC(C)Sc1cc(ccn1)O 62a_100000210206_100000762945 [1,0,0,0,0,0|3,0,0]=4 240 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000210206_100000691529 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000691529_100000210206 [1,0,0,0,0,0|3,0,0]=4 242 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000210206_100000699651 [1,0,0,0,0,0|3,0,0]=4 243 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000699651_100000210206 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000210206_100000685547 [1,0,0,0,0,0|3,0,0]=4 245 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000685547_100000210206 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210019_100000210206 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210206_100000210019 [1,0,0,0,0,0|3,0,0]=4 248 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [1,0,0,0,0,0|2,0,0]=3 249 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [1,0,0,0,0,0|2,0,0]=3 250 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_100000210206_114929384022 [1,0,0,0,0,0|2,1,0]=4 251 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_114929384022_100000210206 [1,0,0,0,0,0|2,1,0]=4 252 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000210206_100000754920 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000754920_100000210206 [1,0,0,0,0,0|3,0,0]=4 254 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [1,0,0,0,0,0|3,0,0]=4 258 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [1,0,0,0,0,0|3,0,0]=4 259 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [1,0,0,0,0,0|3,0,0]=4 262 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [1,0,0,0,0,0|3,0,0]=4 263 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [1,0,0,0,0,0|3,0,0]=4 265 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [1,0,0,0,0,0|3,0,0]=4 266 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [1,0,0,0,0,0|3,0,0]=4 272 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [1,0,0,0,0,0|3,0,0]=4 273 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [1,0,0,0,0,0|2,0,0]=3 274 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [1,0,0,0,0,0|2,0,0]=3 275 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [1,0,0,0,0,0|2,0,0]=3 276 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [1,0,0,0,0,0|2,0,0]=3 277 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [1,0,0,0,0,0|2,0,0]=3 278 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [1,0,0,0,0,0|2,0,0]=3 279 B11R1.157 CN(C)Cc1cncc(c1)O 270004a_100102631434_100012187055 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [1,0,0,0,0,0|3,0,0]=4 281 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [1,0,0,0,0,0|3,0,0]=4 285 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [1,0,0,0,0,0|2,0,0]=3 288 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [1,0,0,0,0,0|2,0,1]=4 290 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [1,0,0,0,0,0|3,0,0]=4 291 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [1,0,0,0,0,0|3,0,0]=4 292 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [1,0,0,0,0,0|3,0,0]=4 293 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [1,0,0,0,0,0|3,0,0]=4 294 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [1,0,0,0,0,0|3,0,0]=4 295 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [1,0,0,0,0,0|3,0,0]=4 296 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [1,0,0,0,0,0|3,0,0]=4 298 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [1,0,0,0,0,0|3,0,0]=4 300 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [1,0,0,0,0,0|3,0,0]=4 301 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [1,0,0,0,0,0|3,0,0]=4 302 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [1,0,0,0,0,0|1,0,1]=3 306 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [1,0,0,0,0,0|2,0,1]=4 307 B11R1.157 Oc1cccc(c1)OC(F)F 271570a_203496583355_100000179092 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [1,0,0,0,0,0|2,0,1]=4 309 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [1,0,0,0,0,0|2,0,1]=4 311 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [1,0,0,0,0,0|2,0,1]=4 312 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,0,0,0,0,0|1,0,1]=3 313 B13R1.22 C#CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_200000035995 [0,1,0,0,0,0|1,0,2]=4 314 B13R1.22 C#CC(C)N(C)c1cccc(c1)O 34a_100000756613_200000035995 [0,1,0,0,0,0|3,0,0]=4 315 B13R1.22 C=CC(C)N(C)c1cccc(c1)O 269982a_100000756613_100011215867 [0,1,0,0,0,0|3,0,0]=4 316 B13R1.22 CC(C#N)C(=O)c1cccc(c1)O 1458a_100000183914_100000703298 [0,1,0,0,0,0|0,0,3]=4 317 B13R1.22 CC(C#N)N(C)c1cccc(c1)O 2230a_100000756613_100000184139 [0,1,0,0,0,0|2,0,1]=4 318 B13R1.22 CC(C#N)N(C)c1cccc(c1)O 269982a_100000756613_100000703298 [0,1,0,0,0,0|2,0,1]=4 319 B13R1.22 CC(CO)N(C)c1cccc(c1)O 2230a_100000756613_100012180447 [0,1,0,0,0,0|3,0,0]=4 320 B13R1.22 CC(CO)N(C)c1cccc(c1)O 34a_100000756613_100012180447 [0,1,0,0,0,0|3,0,0]=4 321 B13R1.22 CCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000210202 [0,1,0,0,0,0|2,0,1]=4 322 B13R1.22 CCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210202 [0,1,0,0,0,0|2,0,1]=4 323 B13R1.22 CCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210202 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.22 CCC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000758301 [0,1,0,0,0,0|1,0,2]=4 325 B13R1.22 CCC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000758301 [0,1,0,0,0,0|3,0,0]=4 326 B13R1.22 CCC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000758301 [0,1,0,0,0,0|3,0,0]=4 327 B13R1.22 CCC(C)N(C)c1cccc(c1)O 34a_100000756613_100011215416 [0,1,0,0,0,0|3,0,0]=4 328 B13R1.22 CNC(=O)C(O)c1cccc(c1)C 240690a_100102657272_100011434945 [0,1,0,0,0,0|2,0,1]=4 329 B13R1.22 CNC(=O)C(O)c1cccc(c1)Cl 240690a_100102657272_100011216955 [0,1,0,0,0,0|2,0,1]=4 330 B13R1.22 CNC(=O)C(O)c1cccc(c1)F 240690a_100102657272_100011434943 [0,1,0,0,0,0|2,0,1]=4 331 B13R1.22 CNC(C)C(=O)c1cccc(c1)Br 2230a_106832991635_100012349134 [0,1,0,0,0,0|1,0,2]=4 332 B13R1.22 CNC(C)C(=O)c1cccc(c1)Br 34a_100102657272_100012349134 [0,1,0,0,0,0|1,0,2]=4 333 B13R1.22 CNC(C)C(=O)c1cccc(c1)Br 7a_106832991635_100012349134 [0,1,0,0,0,0|1,0,2]=4 334 B13R1.22 CNC(C)C(=O)c1cccc(c1)Cl 2230a_106832991635_100000184413 [0,1,0,0,0,0|1,0,2]=4 335 B13R1.22 CNC(C)C(=O)c1cccc(c1)Cl 34a_100102657272_100000184413 [0,1,0,0,0,0|1,0,2]=4 336 B13R1.22 CNC(C)C(=O)c1cccc(c1)Cl 7a_106832991635_100000184413 [0,1,0,0,0,0|1,0,2]=4 337 B13R1.22 CNC(C)C(=O)c1cccc(c1)F 2230a_106832991635_100012356231 [0,1,0,0,0,0|1,0,2]=4 338 B13R1.22 CNC(C)C(=O)c1cccc(c1)F 34a_100102657272_100012356231 [0,1,0,0,0,0|1,0,2]=4 339 B13R1.22 CNC(C)C(=O)c1cccc(c1)F 7a_106832991635_100012356231 [0,1,0,0,0,0|1,0,2]=4 340 B13R1.22 COC(=O)C(C)c1cccc(c1)O 271570a_203496583355_100010077029 [0,1,0,0,0,0|2,0,1]=4 341 B13R1.22 COC(=O)C(N)c1cccc(c1)O 271570a_203496583355_100015207118 [0,1,0,0,0,0|2,0,1]=4 342 B13R1.22 COC(C)N(C)c1cccc(c1)O 269982a_100000756613_100009879195 [0,1,0,0,0,0|3,0,0]=4 343 B13R1.22 C[C@H](CO)N(C)c1cccc(c1)O 269982a_100000756613_100016084084 [0,1,0,0,0,0|3,0,0]=4 344 B13R1.22 Cc1cccc(c1)C(O)C(=O)CF 1458a_100011434945_100015361967 [0,1,0,0,0,0|2,0,1]=4 345 B13R1.22 O=C(CF)C(O)c1cccc(c1)Cl 1458a_100011216955_100015361967 [0,1,0,0,0,0|2,0,1]=4 346 B13R1.22 O=C(CF)C(O)c1cccc(c1)F 1458a_100011434943_100015361967 [0,1,0,0,0,0|2,0,1]=4 347 B13R1.510 CC(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200000210301 [0,1,0,0,0,0|2,0,1]=4 348 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,1,0,0,0,0|1,0,1]=3 349 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210206 [0,1,0,0,0,0|1,0,2]=4 350 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210206 [0,1,0,0,0,0|1,0,2]=4 351 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210206 [0,1,0,0,0,0|1,0,2]=4 352 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210206 [0,1,0,0,0,0|1,0,2]=4 353 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [0,1,0,0,0,0|1,0,2]=4 354 B13R1.510 Cc1ccc(cc1O)C(=O)C(C)C 1458a_100000233767_100000210206 [0,1,0,0,0,0|1,0,2]=4 355 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200025704644 [0,1,0,0,0,0|2,0,1]=4 356 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,1,0,0,0,0|1,0,1]=3 357 B13R1.642 CC(C)C(=O)c1cccc(c1)CO 1458a_100000746274_100000210206 [0,1,0,0,0,0|1,0,2]=4 358 B13R1.642 CC(c1cccc(c1)O[13CH3])N(C)C 34a_100011952145_200025704644 [0,1,0,0,0,0|3,0,0]=4 359 B13R1.642 CC(c1cccc(c1)O[13CH3])N(C)C 7a_100011952145_200025704644 [0,1,0,0,0,0|3,0,0]=4 360 B13R1.642 COc1cccc(c1)C(=O)C(C)C 1458a_100000188888_100000210206 [0,1,0,0,0,0|1,0,2]=4 361 B13R1.642 COc1cccc(c1)C(C)N(C)C 2230a_100011194365_200000210301 [0,1,0,0,0,0|3,0,0]=4 362 B13R1.642 COc1cccc(c1)C(C)N(C)C 269982a_100011194365_200000210301 [0,1,0,0,0,0|3,0,0]=4 363 B13R1.642 COc1cccc(c1)C(C)N(C)C 34a_100011952145_200000210301 [0,1,0,0,0,0|3,0,0]=4 364 B13R1.642 COc1cccc(c1)C(C)N(C)C 7a_100011952145_200000210301 [0,1,0,0,0,0|3,0,0]=4 365 B13R1.642 COc1cccc(c1)C(C)N(C)[13CH3] 2230a_100011194365_200025704644 [0,1,0,0,0,0|3,0,0]=4 366 B13R1.642 COc1cccc(c1)C(C)N(C)[13CH3] 269982a_100011194365_200025704644 [0,1,0,0,0,0|3,0,0]=4 367 B13R1.642 COc1cccc(c1)N(C)C(C)C 2230a_100000219725_100000210206 [0,1,0,0,0,0|3,0,0]=4 368 B13R1.642 COc1cccc(c1)N(C)C(C)C 269982a_100000219725_100000210206 [0,1,0,0,0,0|3,0,0]=4 369 B13R1.642 COc1cccc(c1)N(C)C(C)C 34a_100000219725_100000210206 [0,1,0,0,0,0|3,0,0]=4 370 B13R1.716 CC(C)[C@@H](N[13CH3])c1cccc(c1)Cl 2230a_100009818290_200025704644 [0,1,0,0,0,0|3,0,0]=4 371 B13R1.716 CC(C)[C@@H](N[13CH3])c1cccc(c1)Cl 34a_100009818290_200025704644 [0,1,0,0,0,0|3,0,0]=4 372 B13R1.716 CCN(c1cccc(c1)O)C(C)C 2230a_100000717746_100000210206 [0,1,0,0,0,0|3,0,0]=4 373 B13R1.716 CCN(c1cccc(c1)O)C(C)C 269982a_100000717746_100000210206 [0,1,0,0,0,0|3,0,0]=4 374 B13R1.716 CCN(c1cccc(c1)O)C(C)C 34a_100000717746_100000210206 [0,1,0,0,0,0|3,0,0]=4 375 B13R1.716 CNC(c1cccc(c1)Br)C(C)C 269862a_106832991636_100011350656 [0,1,0,0,0,0|3,0,0]=4 376 B13R1.716 CN[C@@H](c1cccc(c1)Cl)C(C)C 2230a_100009818290_200000210301 [0,1,0,0,0,0|3,0,0]=4 377 B13R1.716 CN[C@@H](c1cccc(c1)Cl)C(C)C 34a_100009818290_200000210301 [0,1,0,0,0,0|3,0,0]=4 378 B13R1.716 COC(C(=O)C)c1cccc(c1)Cl 1458a_100012350482_200000210301 [0,1,0,0,0,0|2,0,1]=4 379 B13R1.716 COC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100012350482_200025704644 [0,1,0,0,0,0|2,0,1]=4 380 B13R1.897 CC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_200000210301 [0,1,0,0,0,0|2,0,1]=4 381 B13R1.897 CC(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200000210301 [0,1,0,0,0,0|2,0,1]=4 382 B13R1.897 CC(C)C(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210206 [0,1,0,0,0,0|1,0,2]=4 383 B13R1.897 CC(C)C(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210206 [0,1,0,0,0,0|1,0,2]=4 384 B13R1.897 CC(C)C(=O)c1cc(ccc1F)O 1458a_100000037260_100000210206 [0,1,0,0,0,0|1,0,2]=4 385 B13R1.897 CC(C)C(=O)c1cc(ccc1I)O 1458a_200009995701_100000210206 [0,1,0,0,0,0|1,0,2]=4 386 B13R1.897 CC(C)C(=O)c1cc(ccc1O)O 1458a_100000758025_100000210206 [0,1,0,0,0,0|1,0,2]=4 387 B13R1.897 Cc1ccc(c(c1)C(O)C(=O)[13CH3])C 1458a_100011497465_200025704644 [0,1,0,0,0,0|2,0,1]=4 388 B13R1.897 Cc1ccc(cc1C(=O)C(C)C)O 1458a_100000687834_100000210206 [0,1,0,0,0,0|1,0,2]=4 389 B13R1.897 [13CH3]C(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200025704644 [0,1,0,0,0,0|2,0,1]=4 390 B13R1.3423 CC(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200000210301 [0,1,0,0,0,0|2,0,1]=4 391 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210206 [0,1,0,0,0,0|1,0,2]=4 392 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210206 [0,1,0,0,0,0|1,0,2]=4 393 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210206 [0,1,0,0,0,0|1,0,2]=4 394 B13R1.3423 CC(C)C(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012353570 [0,1,0,0,0,0|1,0,2]=4 395 B13R1.3423 Cc1cc(cc(c1)C(=O)C(C)C)O 1458a_100000094094_100000210206 [0,1,0,0,0,0|1,0,2]=4 396 B13R1.3423 [13CH3]C(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200025704644 [0,1,0,0,0,0|2,0,1]=4 397 B13R1.3492 CC(C)(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011667116 [0,1,0,0,0,0|1,0,2]=4 398 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 269982a_100000756613_100000210625 [0,1,0,0,0,0|3,0,0]=4 399 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 34a_100000756613_100000210625 [0,1,0,0,0,0|3,0,0]=4 400 B13R1.3492 N[C@H](c1cccc(c1)O)C(F)(F)F 271570a_203496583355_100025709620 [0,1,0,0,0,0|3,0,0]=4 401 B13R1.3492 Oc1cccc(c1)C(O)C(F)(F)F 271570a_203496583355_100000766643 [0,1,0,0,0,0|2,0,0]=3 402 B13R1.3492 Oc1cccc(n1)C(O)C(F)(F)F 271570a_203496583355_100010074360 [0,1,0,0,0,0|3,0,0]=4 403 B13R1.3492 Oc1cncc(c1)[C@H](O)C(F)(F)F 271570a_203496583355_100103104144 [0,1,0,0,0,0|3,0,0]=4 404 B13R1.3493 CC(C)(C(=O)N)c1cccc(c1)O 271570a_203496583355_200009815690 [0,1,0,0,0,0|2,0,1]=4 405 B13R1.3493 CC(C)S(=O)(=O)c1cccc(c1)O 271570a_203496583355_100010273687 [0,1,0,0,0,0|2,0,1]=4 406 B13R1.3768 CC(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200000210301 [0,1,0,0,0,0|2,0,1]=4 407 B13R1.3768 CC(C)C(=O)c1cccc(c1Br)O 1458a_100010230362_100000210206 [0,1,0,0,0,0|1,0,2]=4 408 B13R1.3768 CC(C)C(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210206 [0,1,0,0,0,0|1,0,2]=4 409 B13R1.3768 CC(C)C(=O)c1cccc(c1F)O 1458a_100000037433_100000210206 [0,1,0,0,0,0|1,0,2]=4 410 B13R1.3768 CC(C)C(=O)c1cccc(c1I)O 1458a_100010084636_100000210206 [0,1,0,0,0,0|1,0,2]=4 411 B13R1.3768 CC(C)C(=O)c1cccc(c1O)O 1458a_100000690420_100000210206 [0,1,0,0,0,0|1,0,2]=4 412 B13R1.3768 Cc1c(cccc1C(=O)C(C)C)O 1458a_100000766327_100000210206 [0,1,0,0,0,0|1,0,2]=4 413 B13R1.3768 [13CH3]C(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200025704644 [0,1,0,0,0,0|2,0,1]=4 414 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,0,0,1,0,0|2,0,1]=4 415 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [0,0,0,1,0,0|1,0,2]=4 416 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,0,0,1,0,0|1,0,2]=4 417 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,0,0,1,0,0|1,0,2]=4 418 B13R2.5324 C=C(c1cccc(c1)O)C2CC2 271570a_100010895485_100000211634 [0,0,0,1,0,0|2,0,1]=4 419 B13R2.5324 CN(c1cccc(c1)O)C2CC2 269982a_100000756613_100000211595 [0,0,0,1,0,0|3,0,0]=4 420 B13R2.5324 CN(c1cccc(c1)O)C2CC2 34a_100000756613_100000211595 [0,0,0,1,0,0|3,0,0]=4 421 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [0,0,0,0,0,1|2,0,1]=4 422 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 240690a_100000740644_100015343762 [0,0,0,0,0,1|2,0,1]=4 423 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 527a_100000740644_100103153847 [0,0,0,0,0,1|2,0,1]=4 424 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000210624 [0,0,0,0,0,1|1,0,2]=4 425 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 271570a_203496583355_100000723889 [0,0,0,0,0,1|1,0,2]=4 426 B13R1.147 CC(C)CN(C)c1cccc(c1)O 2230a_100000756613_100000210760 [0,0,0,0,0,1|3,0,0]=4 427 B13R1.147 CC(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000210624 [0,0,0,0,0,1|3,0,0]=4 428 B13R1.147 CC(C)CN(C)c1cccc(c1)O 34a_100000756613_100000210624 [0,0,0,0,0,1|3,0,0]=4 429 B13R1.147 CC(C)C[C@H](N)c1cc(ccn1)O 271570a_100015190218_100000762945 [0,0,0,0,0,1|3,0,0]=4 430 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Br 271570a_100015190218_100000691529 [0,0,0,0,0,1|3,0,0]=4 431 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Cl 271570a_100015190218_100000699651 [0,0,0,0,0,1|3,0,0]=4 432 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)F 271570a_100015190218_100000685547 [0,0,0,0,0,1|3,0,0]=4 433 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)N 271570a_100015190218_100000210019 [0,0,0,0,0,1|3,0,0]=4 434 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [0,0,0,0,0,1|2,0,0]=3 435 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)[S] 271570a_100015190218_114929384022 [0,0,0,0,0,1|2,1,0]=4 436 B13R1.147 CC(C)C[C@H](N)c1cncc(c1)O 271570a_100015190218_100000754920 [0,0,0,0,0,1|3,0,0]=4 437 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 240690a_100138425928_100000183914 [0,0,0,0,0,1|1,0,2]=4 438 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 271570a_203496583355_200000152632 [0,0,0,0,0,1|1,0,2]=4 439 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 527a_100138425928_100000183914 [0,0,0,0,0,1|1,0,2]=4 440 B13R1.147 CC(C)NC(C)c1cccc(c1)Br 2230a_100020642005_100000210206 [0,0,0,0,0,1|3,0,0]=4 441 B13R1.147 CC(C)NC(C)c1cccc(c1)Cl 2230a_100102723534_100000210206 [0,0,0,0,0,1|3,0,0]=4 442 B13R1.147 CC(C)NC(C)c1cccc(c1)Cl 34a_100102723534_100000210206 [0,0,0,0,0,1|3,0,0]=4 443 B13R1.147 CC(C)NC(C)c1cccc(c1)O 2230a_100000740644_100000210206 [0,0,0,0,0,1|2,0,0]=3 444 B13R1.147 CC(C)N[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210206 [0,0,0,0,0,1|3,0,0]=4 445 B13R1.147 CC(C)N[C@H](C)c1cccc(c1)F 34a_100015193778_100000210206 [0,0,0,0,0,1|3,0,0]=4 446 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 34a_100000246457_100000210206 [0,0,0,0,0,1|3,0,0]=4 447 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 7a_100000246457_100000210206 [0,0,0,0,0,1|3,0,0]=4 448 B13R1.147 CC(C)OC(C)c1cccc(c1)F 34a_100000744526_100000210206 [0,0,0,0,0,1|3,0,0]=4 449 B13R1.147 CC(C)OC(C)c1cccc(c1)F 7a_100000744526_100000210206 [0,0,0,0,0,1|3,0,0]=4 450 B13R1.147 CC(C)OC(C)c1cccc(c1)I 34a_100013085317_100000210206 [0,0,0,0,0,1|3,0,0]=4 451 B13R1.147 CC(C)OC(C)c1cccc(c1)I 7a_100013085317_100000210206 [0,0,0,0,0,1|3,0,0]=4 452 B13R1.147 CC(C)OC(C)c1cccc(c1)N 34a_100011217120_100000210206 [0,0,0,0,0,1|3,0,0]=4 453 B13R1.147 CC(C)OC(C)c1cccc(c1)N 7a_100011217120_100000210206 [0,0,0,0,0,1|3,0,0]=4 454 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210206 [0,0,0,0,0,1|3,0,0]=4 455 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210206 [0,0,0,0,0,1|3,0,0]=4 456 B13R1.147 CC(O)CC(=O)c1cccc(c1)O 1458a_100000183914_100011218427 [0,0,0,0,0,1|1,0,2]=4 457 B13R1.147 CC(O)CN(C)c1cccc(c1)O 2230a_100000756613_100011218427 [0,0,0,0,0,1|3,0,0]=4 458 B13R1.147 CC(O)CN(C)c1cccc(c1)O 269982a_100000756613_100011218427 [0,0,0,0,0,1|3,0,0]=4 459 B13R1.147 CC(O)CN(C)c1cccc(c1)O 34a_100000756613_100011218427 [0,0,0,0,0,1|3,0,0]=4 460 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 2230a_200000733937_200000210301 [0,0,0,0,0,1|3,0,0]=4 461 B13R1.147 CN(C)CC(O)c1cccc(c1)Br 269982a_200000733937_200000210301 [0,0,0,0,0,1|3,0,0]=4 462 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_200000210301 [0,0,0,0,0,1|2,0,0]=3 463 B13R1.147 CN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_200000210301 [0,0,0,0,0,1|2,0,0]=3 464 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 2230a_200000733937_200025704644 [0,0,0,0,0,1|3,0,0]=4 465 B13R1.147 CN([13CH3])CC(O)c1cccc(c1)Br 269982a_200000733937_200025704644 [0,0,0,0,0,1|3,0,0]=4 466 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 2230a_100009815823_200025704644 [0,0,0,0,0,1|2,0,0]=3 467 B13R1.147 CN([13CH3])C[C@H](O)c1cccc(c1)O 269982a_100009815823_200025704644 [0,0,0,0,0,1|2,0,0]=3 468 B13R1.147 C[C@@H](O)CN(C)c1cccc(c1)O 2230a_100000756613_100009817552 [0,0,0,0,0,1|3,0,0]=4 469 B13R1.147 C[C@@H](O)CN(C)c1cccc(c1)O 269982a_100000756613_100009817552 [0,0,0,0,0,1|3,0,0]=4 470 B13R1.147 C[C@@H](O)CN(C)c1cccc(c1)O 34a_100000756613_100009817552 [0,0,0,0,0,1|3,0,0]=4 471 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 34a_100000757818_100000210206 [0,0,0,0,0,1|3,0,0]=4 472 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 7a_100000757818_100000210206 [0,0,0,0,0,1|3,0,0]=4 473 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 2230a_100000698126_100000210206 [0,0,0,0,0,1|3,0,0]=4 474 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 34a_100000698126_100000210206 [0,0,0,0,0,1|3,0,0]=4 475 B13R1.147 Cc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100011215228 [0,0,0,0,0,1|3,0,0]=4 476 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [0,0,0,0,0,1|2,0,1]=4 477 B13R1.148 CC(=O)C(C)Sc1cccc(c1)O 62a_100009814033_100000211634 [0,0,0,0,0,1|2,0,1]=4 478 B13R1.148 CC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200000210301 [0,0,0,0,0,1|2,0,1]=4 479 B13R1.148 CC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200000210301 [0,0,0,0,0,1|2,0,1]=4 480 B13R1.148 CC(C)C(=O)Cc1cccc(c1)O 1458a_100000210198_100011660834 [0,0,0,0,0,1|1,0,2]=4 481 B13R1.148 CC(C)C(=O)Cc1cccc(c1)O 1458a_100000745134_100000210206 [0,0,0,0,0,1|1,0,2]=4 482 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000210198 [0,0,0,0,0,1|1,0,2]=4 483 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000210198 [0,0,0,0,0,1|1,0,2]=4 484 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 271570a_203496583355_200000153619 [0,0,0,0,0,1|1,0,2]=4 485 B13R1.148 CC(C)C(=O)Nc1cccc(c1)O 527a_100000210217_100000210198 [0,0,0,0,0,1|1,0,2]=4 486 B13R1.148 CC(C)N(C)Cc1cccc(c1)O 2230a_100000207540_100000210206 [0,0,0,0,0,1|3,0,0]=4 487 B13R1.148 CC(C)N(C)Cc1cccc(c1)O 269982a_100000207540_100000210206 [0,0,0,0,0,1|3,0,0]=4 488 B13R1.148 CC(C)N(C)Cc1cccc(c1)O 269982a_200000211004_100000084143 [0,0,0,0,0,1|3,0,0]=4 489 B13R1.148 CC(C)N(C)Cc1cccc(c1)O 270004a_200000211004_100000188321 [0,0,0,0,0,1|3,0,0]=4 490 B13R1.148 CC(F)C(=O)Cc1cccc(c1)O 1458a_100000062450_100011660834 [0,0,0,0,0,1|1,0,2]=4 491 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000062450 [0,0,0,0,0,1|1,0,2]=4 492 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 22a_100000210217_100000062450 [0,0,0,0,0,1|1,0,2]=4 493 B13R1.148 CC(F)C(=O)Nc1cccc(c1)O 527a_100000210217_100000062450 [0,0,0,0,0,1|1,0,2]=4 494 B13R1.148 CC(Nc1cccc(c1)O)C(=O)N 34a_100000210217_100000702099 [0,0,0,0,0,1|2,0,1]=4 495 B13R1.148 CC(Oc1cccc(c1)O)C(=O)N 271570a_203496583355_200000150601 [0,0,0,0,0,1|2,0,1]=4 496 B13R1.148 CC(Sc1cccc(c1)O)C(=O)N 62a_100000702099_100000211634 [0,0,0,0,0,1|2,0,1]=4 497 B13R1.148 C[C@@H](O)C(=O)Cc1cccc(c1)O 1458a_100000717761_100011660834 [0,0,0,0,0,1|1,0,2]=4 498 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)O 22a_100000210217_100000717761 [0,0,0,0,0,1|1,0,2]=4 499 B13R1.148 C[C@H](O)C(=O)Cc1cccc(c1)O 1458a_217856618621_100011660834 [0,0,0,0,0,1|1,0,2]=4 500 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)O 1626a_100000210217_217856618621 [0,0,0,0,0,1|1,0,2]=4 501 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)O 22a_100000210217_217856618621 [0,0,0,0,0,1|1,0,2]=4 502 B13R1.148 NC(=O)C(F)Nc1cccc(c1)O 34a_100000210217_100009813875 [0,0,0,0,0,1|2,0,1]=4 503 B13R1.148 NC(=O)C(F)Sc1cccc(c1)O 62a_100009813875_100000211634 [0,0,0,0,0,1|2,0,1]=4 504 B13R1.148 [13CH3]C(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200025704644 [0,0,0,0,0,1|2,0,1]=4 505 B13R1.148 [13CH3]C(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200025704644 [0,0,0,0,0,1|2,0,1]=4 506 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [2,0,0,0,0,0|0,0,2]=4 507 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [2,0,0,0,0,0|0,0,2]=4 508 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [2,0,0,0,0,0|0,0,2]=4 509 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [2,0,0,0,0,0|0,0,0]=2 510 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 511 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [2,0,0,0,0,0|2,0,0]=4 512 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [2,0,0,0,0,0|2,0,0]=4 513 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [2,0,0,0,0,0|2,0,0]=4 514 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [2,0,0,0,0,0|2,0,0]=4 515 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [2,0,0,0,0,0|2,0,0]=4 516 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [2,0,0,0,0,0|1,0,0]=3 517 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [2,0,0,0,0,0|1,0,0]=3 518 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [2,0,0,0,0,0|2,0,0]=4 519 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [2,0,0,0,0,0|2,0,0]=4 520 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 521 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 522 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [2,0,0,0,0,0|2,0,0]=4 523 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [2,0,0,0,0,0|2,0,0]=4 524 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 525 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 526 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 527 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 528 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 529 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 530 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [2,0,0,0,0,0|2,0,0]=4 531 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [2,0,0,0,0,0|1,0,0]=3 532 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [2,0,0,0,0,0|2,0,0]=4 533 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [2,0,0,0,0,0|2,0,0]=4 534 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [2,0,0,0,0,0|2,0,0]=4 535 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [2,0,0,0,0,0|2,0,0]=4 536 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [2,0,0,0,0,0|2,0,0]=4 537 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [2,0,0,0,0,0|2,0,0]=4 538 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [2,0,0,0,0,0|2,0,0]=4 539 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [2,0,0,0,0,0|2,0,0]=4 540 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [2,0,0,0,0,0|2,0,0]=4 541 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [2,0,0,0,0,0|2,0,0]=4 542 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [2,0,0,0,0,0|2,0,0]=4 543 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [2,0,0,0,0,0|2,0,0]=4 544 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 545 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [2,0,0,0,0,0|2,0,0]=4 546 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [2,0,0,0,0,0|1,0,0]=3 547 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [2,0,0,0,0,0|1,0,0]=3 548 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [2,0,0,0,0,0|1,1,0]=4 549 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [2,0,0,0,0,0|1,1,0]=4 550 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [2,0,0,0,0,0|2,0,0]=4 551 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [2,0,0,0,0,0|2,0,0]=4 552 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [2,0,0,0,0,0|2,0,0]=4 553 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [2,0,0,0,0,0|2,0,0]=4 554 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [2,0,0,0,0,0|2,0,0]=4 555 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [2,0,0,0,0,0|2,0,0]=4 556 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [2,0,0,0,0,0|2,0,0]=4 557 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [2,0,0,0,0,0|2,0,0]=4 558 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [2,0,0,0,0,0|2,0,0]=4 559 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [2,0,0,0,0,0|2,0,0]=4 560 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [2,0,0,0,0,0|2,0,0]=4 561 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [2,0,0,0,0,0|2,0,0]=4 562 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [2,0,0,0,0,0|2,0,0]=4 563 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [2,0,0,0,0,0|2,0,0]=4 564 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [2,0,0,0,0,0|2,0,0]=4 565 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [2,0,0,0,0,0|2,0,0]=4 566 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [2,0,0,0,0,0|2,0,0]=4 567 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [2,0,0,0,0,0|2,0,0]=4 568 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [2,0,0,0,0,0|2,0,0]=4 569 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [2,0,0,0,0,0|2,0,0]=4 570 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [2,0,0,0,0,0|2,0,0]=4 571 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [2,0,0,0,0,0|2,0,0]=4 572 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [2,0,0,0,0,0|2,0,0]=4 573 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [2,0,0,0,0,0|2,0,0]=4 574 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [2,0,0,0,0,0|2,0,0]=4 575 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [2,0,0,0,0,0|2,0,0]=4 576 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [2,0,0,0,0,0|2,0,0]=4 577 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [2,0,0,0,0,0|2,0,0]=4 578 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [2,0,0,0,0,0|2,0,0]=4 579 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [2,0,0,0,0,0|2,0,0]=4 580 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [2,0,0,0,0,0|2,0,0]=4 581 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [2,0,0,0,0,0|2,0,0]=4 582 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [2,0,0,0,0,0|2,0,0]=4 583 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [2,0,0,0,0,0|2,0,0]=4 584 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [2,0,0,0,0,0|2,0,0]=4 585 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [2,0,0,0,0,0|2,0,0]=4 586 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [2,0,0,0,0,0|2,0,0]=4 587 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [2,0,0,0,0,0|2,0,0]=4 588 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [2,0,0,0,0,0|2,0,0]=4 589 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [2,0,0,0,0,0|1,0,0]=3 590 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [2,0,0,0,0,0|1,0,0]=3 591 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [2,0,0,0,0,0|1,0,0]=3 592 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [2,0,0,0,0,0|1,0,0]=3 593 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [2,0,0,0,0,0|1,0,0]=3 594 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [2,0,0,0,0,0|1,0,0]=3 595 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [2,0,0,0,0,0|1,0,0]=3 596 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [2,0,0,0,0,0|1,0,0]=3 597 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [2,0,0,0,0,0|2,0,0]=4 598 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [2,0,0,0,0,0|2,0,0]=4 599 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [2,0,0,0,0,0|2,0,0]=4 600 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [2,0,0,0,0,0|2,0,0]=4 601 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [2,0,0,0,0,0|2,0,0]=4 602 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 603 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [2,0,0,0,0,0|2,0,0]=4 604 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 605 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [2,0,0,0,0,0|2,0,0]=4 606 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [2,0,0,0,0,0|2,0,0]=4 607 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [2,0,0,0,0,0|2,0,0]=4 608 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 609 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [2,0,0,0,0,0|2,0,0]=4 610 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 611 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 612 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [2,0,0,0,0,0|2,0,0]=4 613 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 614 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 615 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [2,0,0,0,0,0|2,0,0]=4 616 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 617 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [2,0,0,0,0,0|2,0,0]=4 618 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [2,0,0,0,0,0|1,0,0]=3 619 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [2,0,0,0,0,0|1,0,0]=3 620 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [2,0,0,0,0,0|2,0,0]=4 621 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [2,0,0,0,0,0|2,0,0]=4 622 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [2,0,0,0,0,0|2,0,0]=4 623 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [2,0,0,0,0,0|2,0,0]=4 624 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [2,0,0,0,0,0|2,0,0]=4 625 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [2,0,0,0,0,0|2,0,0]=4 626 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [2,0,0,0,0,0|2,0,0]=4 627 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [2,0,0,0,0,0|2,0,0]=4 628 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [2,0,0,0,0,0|2,0,0]=4 629 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [2,0,0,0,0,0|2,0,0]=4 630 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [2,0,0,0,0,0|1,0,0]=3 631 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [2,0,0,0,0,0|1,0,0]=3 632 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [2,0,0,0,0,0|2,0,0]=4 633 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [2,0,0,0,0,0|2,0,0]=4 634 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [2,0,0,0,0,0|2,0,0]=4 635 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [2,0,0,0,0,0|2,0,0]=4 636 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [2,0,0,0,0,0|2,0,0]=4 637 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [2,0,0,0,0,0|2,0,0]=4 638 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [2,0,0,0,0,0|0,0,2]=4 639 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [2,0,0,0,0,0|0,0,0]=2 640 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [2,0,0,0,0,0|1,0,0]=3 641 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [2,0,0,0,0,0|1,0,1]=4 642 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [2,0,0,0,0,0|1,0,0]=3 643 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [2,0,0,0,0,0|2,0,0]=4 644 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [2,0,0,0,0,0|2,0,0]=4 645 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [2,0,0,0,0,0|2,0,0]=4 646 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [2,0,0,0,0,0|2,0,0]=4 647 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [2,0,0,0,0,0|2,0,0]=4 648 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [2,0,0,0,0,0|2,0,0]=4 649 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [2,0,0,0,0,0|2,0,0]=4 650 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [2,0,0,0,0,0|2,0,0]=4 651 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [2,0,0,0,0,0|2,0,0]=4 652 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [2,0,0,0,0,0|2,0,0]=4 653 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [2,0,0,0,0,0|2,0,0]=4 654 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [2,0,0,0,0,0|1,0,0]=3 655 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [2,0,0,0,0,0|1,0,0]=3 656 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 657 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 658 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 659 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 660 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 661 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 662 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 663 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 664 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [2,0,0,0,0,0|2,0,0]=4 665 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [2,0,0,0,0,0|2,0,0]=4 666 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [2,0,0,0,0,0|2,0,0]=4 667 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [2,0,0,0,0,0|2,0,0]=4 668 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [2,0,0,0,0,0|2,0,0]=4 669 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [2,0,0,0,0,0|2,0,0]=4 670 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [2,0,0,0,0,0|2,0,0]=4 671 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [2,0,0,0,0,0|2,0,0]=4 672 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [2,0,0,0,0,0|2,0,0]=4 673 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [2,0,0,0,0,0|1,0,0]=3 674 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [2,0,0,0,0,0|1,0,0]=3 675 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [2,0,0,0,0,0|2,0,0]=4 676 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [2,0,0,0,0,0|2,0,0]=4 677 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [2,0,0,0,0,0|0,0,2]=4 678 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 679 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 680 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [2,0,0,0,0,0|2,0,0]=4 681 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 682 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 683 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 684 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 685 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 686 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 687 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [2,0,0,0,0,0|2,0,0]=4 688 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [2,0,0,0,0,0|2,0,0]=4 689 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [2,0,0,0,0,0|2,0,0]=4 690 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [2,0,0,0,0,0|2,0,0]=4 691 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [2,0,0,0,0,0|2,0,0]=4 692 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [2,0,0,0,0,0|2,0,0]=4 693 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [2,0,0,0,0,0|2,0,0]=4 694 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [2,0,0,0,0,0|2,0,0]=4 695 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [2,0,0,0,0,0|2,0,0]=4 696 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [2,0,0,0,0,0|2,0,0]=4 697 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [2,0,0,0,0,0|2,0,0]=4 698 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [2,0,0,0,0,0|2,0,0]=4 699 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [2,0,0,0,0,0|2,0,0]=4 700 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [2,0,0,0,0,0|1,0,1]=4 701 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [2,0,0,0,0,0|1,0,1]=4 702 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [2,0,0,0,0,0|0,0,2]=4 703 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [2,0,0,0,0,0|0,0,2]=4 704 B10R1.113 CC(C)c1cc(ccn1)O 271570a_203496583355_100010237922 [2,0,0,0,0,0|2,0,0]=4 705 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [2,0,0,0,0,0|1,0,0]=3 706 B10R1.113 CC(C)c1cccc(n1)O 271570a_203496583355_100012318657 [2,0,0,0,0,0|2,0,0]=4 707 B10R1.113 CC(C)c1ccnc(c1)O 271570a_203496583355_100010237925 [2,0,0,0,0,0|2,0,0]=4 708 B10R1.113 CC(C)c1cncc(c1)O 271570a_203496583355_200010191214 [2,0,0,0,0,0|2,0,0]=4 709 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [2,0,0,0,0,0|1,0,0]=3 710 B10R1.113 CC(N)c1cccc(n1)O 271570a_203496583355_200010173468 [2,0,0,0,0,0|2,0,0]=4 711 B10R1.113 CC(O)c1cc(ccn1)O 271570a_203496583355_100000144657 [2,0,0,0,0,0|1,0,0]=3 712 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [2,0,0,0,0,0|0,0,0]=2 713 B10R1.113 CC(O)c1cccc(n1)O 271570a_203496583355_100009820884 [2,0,0,0,0,0|1,0,0]=3 714 B10R1.113 CC(O)c1cncc(c1)O 271570a_203496583355_100012351597 [2,0,0,0,0,0|1,0,0]=3 715 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [2,0,0,0,0,0|2,0,0]=4 716 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [2,0,0,0,0,0|2,0,0]=4 717 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [2,0,0,0,0,0|2,0,0]=4 718 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [2,0,0,0,0,0|2,0,0]=4 719 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [2,0,0,0,0,0|2,0,0]=4 720 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [2,0,0,0,0,0|2,0,0]=4 721 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [2,0,0,0,0,0|2,0,0]=4 722 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [2,0,0,0,0,0|1,0,1]=4 723 B10R1.113 C[C@@H](N)c1cncc(c1)O 271570a_203496583355_100012350620 [2,0,0,0,0,0|2,0,0]=4 724 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [2,0,0,0,0,0|0,0,2]=4 725 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [2,0,0,0,0,0|2,0,0]=4 726 B10R1.113 Oc1cccc(c1)C(F)F 271570a_203496583355_100009892619 [2,0,0,0,0,0|2,0,0]=4 727 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [2,0,0,0,0,0|0,0,2]=4 728 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [2,0,0,0,0,0|1,0,1]=4 729 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [2,0,0,0,0,0|2,0,0]=4 730 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [2,0,0,0,0,0|2,0,0]=4 731 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [2,0,0,0,0,0|2,0,0]=4 732 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [2,0,0,0,0,0|2,0,0]=4 733 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [2,0,0,0,0,0|2,0,0]=4 734 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 735 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [2,0,0,0,0,0|2,0,0]=4 736 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 737 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [2,0,0,0,0,0|2,0,0]=4 738 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [2,0,0,0,0,0|2,0,0]=4 739 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 740 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 741 B12R1.10 CC(C)(CN)c1cccc(c1)O 271570a_203496583355_100000749542 [1,1,0,0,0,0|1,0,0]=3 742 B12R1.10 CC(C)(CO)c1cccc(c1)O 271570a_203496583355_200010233077 [1,1,0,0,0,0|2,0,0]=4 743 B12R1.10 CCS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815775 [1,1,0,0,0,0|1,0,1]=4 744 B12R1.13 CCC(NC)c1cccc(c1)Br 269862a_106832991636_100000211677 [1,1,0,0,0,0|2,0,0]=4 745 B12R1.13 CCC(NC)c1cccc(c1)C 269862a_106832991636_100000730664 [1,1,0,0,0,0|2,0,0]=4 746 B12R1.13 CCC(NC)c1cccc(c1)Cl 2230a_100000737531_200000210301 [1,1,0,0,0,0|2,0,0]=4 747 B12R1.13 CCC(NC)c1cccc(c1)Cl 269862a_106832991636_100000211052 [1,1,0,0,0,0|2,0,0]=4 748 B12R1.13 CCC(NC)c1cccc(c1)Cl 34a_100000737531_200000210301 [1,1,0,0,0,0|2,0,0]=4 749 B12R1.13 CCC(NC)c1cccc(c1)F 2230a_100159265421_200000210301 [1,1,0,0,0,0|2,0,0]=4 750 B12R1.13 CCC(NC)c1cccc(c1)F 269862a_106832991636_100000687998 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.13 CCC(NC)c1cccc(c1)F 34a_100159265421_200000210301 [1,1,0,0,0,0|2,0,0]=4 752 B12R1.13 CCC(NC)c1cccc(c1)O 2230a_100159312145_200000210301 [1,1,0,0,0,0|1,0,0]=3 753 B12R1.13 CCC(NC)c1cccc(c1)O 269862a_106832991636_100011996911 [1,1,0,0,0,0|1,0,0]=3 754 B12R1.13 CCC(NC)c1cccc(c1)O 34a_100159312145_200000210301 [1,1,0,0,0,0|1,0,0]=3 755 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 2230a_100000737531_200025704644 [1,1,0,0,0,0|2,0,0]=4 756 B12R1.13 CCC(N[13CH3])c1cccc(c1)Cl 34a_100000737531_200025704644 [1,1,0,0,0,0|2,0,0]=4 757 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 2230a_100159265421_200025704644 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.13 CCC(N[13CH3])c1cccc(c1)F 34a_100159265421_200025704644 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 2230a_100159312145_200025704644 [1,1,0,0,0,0|1,0,0]=3 760 B12R1.13 CCC(N[13CH3])c1cccc(c1)O 34a_100159312145_200025704644 [1,1,0,0,0,0|1,0,0]=3 761 B12R1.13 CCC(OC)c1cccc(c1)Cl 34a_100000766619_200000210301 [1,1,0,0,0,0|1,0,0]=3 762 B12R1.13 CCC(OC)c1cccc(c1)Cl 7a_100000766619_200000210301 [1,1,0,0,0,0|1,0,0]=3 763 B12R1.13 CCC(OC)c1cccc(c1)F 34a_100011350881_200000210301 [1,1,0,0,0,0|1,0,0]=3 764 B12R1.13 CCC(OC)c1cccc(c1)F 7a_100011350881_200000210301 [1,1,0,0,0,0|1,0,0]=3 765 B12R1.13 CCC(OC)c1cccc(c1)I 34a_200013212081_200000210301 [1,1,0,0,0,0|1,0,0]=3 766 B12R1.13 CCC(OC)c1cccc(c1)I 7a_200013212081_200000210301 [1,1,0,0,0,0|1,0,0]=3 767 B12R1.13 CCC(O[13CH3])c1cccc(c1)Cl 34a_100000766619_200025704644 [1,1,0,0,0,0|1,0,0]=3 768 B12R1.13 CCC(O[13CH3])c1cccc(c1)Cl 7a_100000766619_200025704644 [1,1,0,0,0,0|1,0,0]=3 769 B12R1.13 CCC(O[13CH3])c1cccc(c1)F 34a_100011350881_200025704644 [1,1,0,0,0,0|1,0,0]=3 770 B12R1.13 CCC(O[13CH3])c1cccc(c1)F 7a_100011350881_200025704644 [1,1,0,0,0,0|1,0,0]=3 771 B12R1.13 CCC(O[13CH3])c1cccc(c1)I 34a_200013212081_200025704644 [1,1,0,0,0,0|1,0,0]=3 772 B12R1.13 CCC(O[13CH3])c1cccc(c1)I 7a_200013212081_200025704644 [1,1,0,0,0,0|1,0,0]=3 773 B12R1.13 CCN(CC)c1cccc(c1)O 2230a_100000717746_100000210202 [1,1,0,0,0,0|2,0,0]=4 774 B12R1.13 CCN(CC)c1cccc(c1)O 269982a_100000717746_100000204670 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.13 CCN(CC)c1cccc(c1)O 34a_100000717746_100000210202 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.13 CCN(CF)c1cccc(c1)O 269982a_100000717746_100015361967 [1,1,0,0,0,0|2,0,0]=4 777 B12R1.13 CCN(CF)c1cccc(c1)O 34a_100000717746_100015361967 [1,1,0,0,0,0|2,0,0]=4 778 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 2230a_200016991486_200000210301 [1,1,0,0,0,0|2,0,0]=4 779 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 34a_200016991486_200000210301 [1,1,0,0,0,0|2,0,0]=4 780 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 2230a_200016991486_200025704644 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 34a_200016991486_200025704644 [1,1,0,0,0,0|2,0,0]=4 782 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 2230a_100102422761_200000210301 [1,1,0,0,0,0|2,0,0]=4 783 B12R1.13 CC[C@H](NC)c1cccc(c1)Br 34a_100102422761_200000210301 [1,1,0,0,0,0|2,0,0]=4 784 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 2230a_100102422761_200025704644 [1,1,0,0,0,0|2,0,0]=4 785 B12R1.13 CC[C@H](N[13CH3])c1cccc(c1)Br 34a_100102422761_200025704644 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.13 CNC(CO)c1cccc(c1)Br 2230a_100000690078_200000210301 [1,1,0,0,0,0|2,0,0]=4 787 B12R1.13 CNC(CO)c1cccc(c1)Br 34a_100000690078_200000210301 [1,1,0,0,0,0|2,0,0]=4 788 B12R1.13 CNC(CO)c1cccc(c1)O 2230a_100025717460_200000210301 [1,1,0,0,0,0|1,0,0]=3 789 B12R1.13 CNC(CO)c1cccc(c1)O 34a_100025717460_200000210301 [1,1,0,0,0,0|1,0,0]=3 790 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200000210301 [1,1,0,0,0,0|2,0,0]=4 791 B12R1.13 CN[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200000210301 [1,1,0,0,0,0|2,0,0]=4 792 B12R1.13 CN[C@H](CO)c1cccc(c1)C 2230a_100009818812_200000210301 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.13 CN[C@H](CO)c1cccc(c1)C 34a_100009818812_200000210301 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.13 CN[C@H](CO)c1cccc(c1)F 2230a_100020641251_200000210301 [1,1,0,0,0,0|2,0,0]=4 795 B12R1.13 CN[C@H](CO)c1cccc(c1)F 34a_100020641251_200000210301 [1,1,0,0,0,0|2,0,0]=4 796 B12R1.13 COC(OC)c1cccc(c1)O 271570a_203496583355_100009816312 [1,1,0,0,0,0|1,0,0]=3 797 B12R1.13 COC(OC)c1cncc(c1)O 271570a_203496583355_100010232022 [1,1,0,0,0,0|2,0,0]=4 798 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 2230a_100009818812_200025704644 [1,1,0,0,0,0|2,0,0]=4 799 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 34a_100009818812_200025704644 [1,1,0,0,0,0|2,0,0]=4 800 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 2230a_100000690078_200025704644 [1,1,0,0,0,0|2,0,0]=4 801 B12R1.13 [13CH3]NC(CO)c1cccc(c1)Br 34a_100000690078_200025704644 [1,1,0,0,0,0|2,0,0]=4 802 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 2230a_100025717460_200025704644 [1,1,0,0,0,0|1,0,0]=3 803 B12R1.13 [13CH3]NC(CO)c1cccc(c1)O 34a_100025717460_200025704644 [1,1,0,0,0,0|1,0,0]=3 804 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_200025704644 [1,1,0,0,0,0|2,0,0]=4 805 B12R1.13 [13CH3]N[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_200025704644 [1,1,0,0,0,0|2,0,0]=4 806 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 2230a_100020641251_200025704644 [1,1,0,0,0,0|2,0,0]=4 807 B12R1.13 [13CH3]N[C@H](CO)c1cccc(c1)F 34a_100020641251_200025704644 [1,1,0,0,0,0|2,0,0]=4 808 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [1,1,0,0,0,0|0,0,2]=4 809 B12R1.17 CCCN(C)c1cccc(c1)O 2230a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 810 B12R1.17 CCCN(C)c1cccc(c1)O 269982a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 811 B12R1.17 CCCN(C)c1cccc(c1)O 34a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 812 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [1,1,0,0,0,0|0,0,2]=4 813 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [1,1,0,0,0,0|0,0,2]=4 814 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [1,1,0,0,0,0|0,0,2]=4 815 B12R1.17 CCNC(C)c1cccc(c1)Br 2230a_100020642005_100000210202 [1,1,0,0,0,0|2,0,0]=4 816 B12R1.17 CCNC(C)c1cccc(c1)Br 269862a_100015525214_100000210093 [1,1,0,0,0,0|2,0,0]=4 817 B12R1.17 CCNC(C)c1cccc(c1)C 269862a_100015525214_100000211476 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.17 CCNC(C)c1cccc(c1)Cl 2230a_100102723534_100000210202 [1,1,0,0,0,0|2,0,0]=4 819 B12R1.17 CCNC(C)c1cccc(c1)Cl 269862a_100015525214_200000210964 [1,1,0,0,0,0|2,0,0]=4 820 B12R1.17 CCNC(C)c1cccc(c1)Cl 34a_100102723534_100000210202 [1,1,0,0,0,0|2,0,0]=4 821 B12R1.17 CCNC(C)c1cccc(c1)F 269862a_100015525214_100000187083 [1,1,0,0,0,0|2,0,0]=4 822 B12R1.17 CCNC(C)c1cccc(c1)I 269862a_100015525214_100011356966 [1,1,0,0,0,0|2,0,0]=4 823 B12R1.17 CCNC(C)c1cccc(c1)O 2230a_100000740644_100000210202 [1,1,0,0,0,0|1,0,0]=3 824 B12R1.17 CCNC(C)c1cccc(c1)O 269862a_100015525214_100000211620 [1,1,0,0,0,0|1,0,0]=3 825 B12R1.17 CCN[C@H](C)c1cccc(c1)C 2230a_100000698126_100000210202 [1,1,0,0,0,0|2,0,0]=4 826 B12R1.17 CCN[C@H](C)c1cccc(c1)C 34a_100000698126_100000210202 [1,1,0,0,0,0|2,0,0]=4 827 B12R1.17 CCN[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210202 [1,1,0,0,0,0|2,0,0]=4 828 B12R1.17 CCN[C@H](C)c1cccc(c1)F 34a_100015193778_100000210202 [1,1,0,0,0,0|2,0,0]=4 829 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [1,1,0,0,0,0|0,0,2]=4 830 B12R1.17 CCOC(C)c1cccc(c1)Br 34a_100000246457_100000210202 [1,1,0,0,0,0|2,0,0]=4 831 B12R1.17 CCOC(C)c1cccc(c1)Br 7a_100000246457_100000210202 [1,1,0,0,0,0|2,0,0]=4 832 B12R1.17 CCOC(C)c1cccc(c1)C 34a_100000757818_100000210202 [1,1,0,0,0,0|2,0,0]=4 833 B12R1.17 CCOC(C)c1cccc(c1)C 7a_100000757818_100000210202 [1,1,0,0,0,0|2,0,0]=4 834 B12R1.17 CCOC(C)c1cccc(c1)F 34a_100000744526_100000210202 [1,1,0,0,0,0|2,0,0]=4 835 B12R1.17 CCOC(C)c1cccc(c1)F 7a_100000744526_100000210202 [1,1,0,0,0,0|2,0,0]=4 836 B12R1.17 CCOC(C)c1cccc(c1)I 34a_100013085317_100000210202 [1,1,0,0,0,0|2,0,0]=4 837 B12R1.17 CCOC(C)c1cccc(c1)I 7a_100013085317_100000210202 [1,1,0,0,0,0|2,0,0]=4 838 B12R1.17 CCOC(C)c1cccc(c1)N 34a_100011217120_100000210202 [1,1,0,0,0,0|2,0,0]=4 839 B12R1.17 CCOC(C)c1cccc(c1)N 7a_100011217120_100000210202 [1,1,0,0,0,0|2,0,0]=4 840 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210202 [1,1,0,0,0,0|2,0,0]=4 841 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210202 [1,1,0,0,0,0|2,0,0]=4 842 B12R1.17 CN(CCF)c1cccc(c1)O 2230a_100000756613_100011217306 [1,1,0,0,0,0|2,0,0]=4 843 B12R1.17 CN(CCF)c1cccc(c1)O 269982a_100000756613_100011217306 [1,1,0,0,0,0|2,0,0]=4 844 B12R1.17 CN(CCF)c1cccc(c1)O 34a_100000756613_100011217306 [1,1,0,0,0,0|2,0,0]=4 845 B12R1.17 CN(CCO)c1cccc(c1)O 2230a_100000756613_100000211926 [1,1,0,0,0,0|2,0,0]=4 846 B12R1.17 CN(CCO)c1cccc(c1)O 269982a_100000756613_100000211926 [1,1,0,0,0,0|2,0,0]=4 847 B12R1.17 CN(CCO)c1cccc(c1)O 34a_100000756613_100000211926 [1,1,0,0,0,0|2,0,0]=4 848 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [1,1,0,0,0,0|0,0,2]=4 849 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [1,1,0,0,0,0|0,0,2]=4 850 B12R1.17 CNCC(O)c1cccc(c1)O 2230a_100020657549_200000210301 [1,1,0,0,0,0|0,0,0]=2 851 B12R1.17 CNCC(O)c1cccc(c1)O 271570a_203496583355_200000733937 [1,1,0,0,0,0|0,0,0]=2 852 B12R1.17 CNCC(O)c1cccc(c1)O 34a_100020657549_200000210301 [1,1,0,0,0,0|0,0,0]=2 853 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [1,1,0,0,0,0|0,0,2]=4 854 B12R1.17 COCC(N)c1cccc(c1)Br 34a_100000690078_200000210301 [1,1,0,0,0,0|2,0,0]=4 855 B12R1.17 COCN(C)c1cccc(c1)O 2230a_100000756613_100000766300 [1,1,0,0,0,0|2,0,0]=4 856 B12R1.17 COCN(C)c1cccc(c1)O 269982a_100000756613_100000766300 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.17 COC[C@@H](N)c1cccc(c1)C 34a_100009818812_200000210301 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.17 COC[C@@H](N)c1cccc(c1)F 34a_100020641251_200000210301 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.17 COC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200000210301 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [1,1,0,0,0,0|0,0,2]=4 861 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [1,1,0,0,0,0|0,0,2]=4 862 B12R1.17 CSCN(C)c1cccc(c1)O 2230a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 863 B12R1.17 CSCN(C)c1cccc(c1)O 269982a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.17 CSCN(C)c1cccc(c1)O 34a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.17 Cc1cccc(c1)[C@H](N)CO[13CH3] 34a_100009818812_200025704644 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.17 NC(CCO)c1cccc(c1)O 271570a_203496583355_200011661555 [1,1,0,0,0,0|1,0,0]=3 867 B12R1.17 O=C(CCF)c1cccc(c1)O 1458a_100000183914_100011217306 [1,1,0,0,0,0|0,0,2]=4 868 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [1,1,0,0,0,0|0,0,2]=4 869 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 2230a_100020657549_200025704644 [1,1,0,0,0,0|0,0,0]=2 870 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 34a_100020657549_200025704644 [1,1,0,0,0,0|0,0,0]=2 871 B12R1.17 [13CH3]OCC(N)c1cccc(c1)Br 34a_100000690078_200025704644 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.17 [13CH3]OC[C@@H](N)c1cccc(c1)F 34a_100020641251_200025704644 [1,1,0,0,0,0|2,0,0]=4 873 B12R1.17 [13CH3]OC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200025704644 [1,1,0,0,0,0|2,0,0]=4 874 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [1,1,0,0,0,0|0,0,2]=4 875 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [1,1,0,0,0,0|0,0,2]=4 876 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [1,1,0,0,0,0|0,0,2]=4 877 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [1,1,0,0,0,0|0,0,2]=4 878 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [1,1,0,0,0,0|0,0,2]=4 879 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [1,1,0,0,0,0|0,0,2]=4 880 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [1,1,0,0,0,0|0,0,2]=4 881 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [1,1,0,0,0,0|0,0,2]=4 882 B12R1.24 COC(C)c1cccc(c1F)O 271570a_203496583355_200010365929 [1,1,0,0,0,0|2,0,0]=4 883 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [1,1,0,0,0,0|0,0,2]=4 884 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [1,1,0,0,0,0|0,0,2]=4 885 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [1,1,0,0,0,0|0,0,2]=4 886 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [1,1,0,0,0,0|0,0,2]=4 887 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [1,1,0,0,0,0|0,0,2]=4 888 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [1,1,0,0,0,0|0,0,2]=4 889 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [1,1,0,0,0,0|0,0,2]=4 890 B12R1.354 CCN(C)c1cc(ccc1C)O 269982a_100000211784_200000210301 [1,1,0,0,0,0|2,0,0]=4 891 B12R1.354 CCN(C)c1cc(ccc1C)O 34a_100000211784_200000210301 [1,1,0,0,0,0|2,0,0]=4 892 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 269982a_100000211784_200025704644 [1,1,0,0,0,0|2,0,0]=4 893 B12R1.354 CCN([13CH3])c1cc(ccc1C)O 34a_100000211784_200025704644 [1,1,0,0,0,0|2,0,0]=4 894 B12R1.354 N[C@H](CO)c1cc(ccc1F)O 271570a_203496583355_100010142275 [1,1,0,0,0,0|2,0,0]=4 895 B12R1.358 CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210202 [1,1,0,0,0,0|0,0,2]=4 896 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210202 [1,1,0,0,0,0|0,0,2]=4 897 B12R1.358 CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210202 [1,1,0,0,0,0|0,0,2]=4 898 B12R1.358 CCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210202 [1,1,0,0,0,0|0,0,2]=4 899 B12R1.358 CNC(C)c1cc(cc(c1)O)C 269862a_106832991636_100009855872 [1,1,0,0,0,0|2,0,0]=4 900 B12R1.358 N[C@H](CO)c1cc(cc(c1)F)O 271570a_203496583355_100138412358 [1,1,0,0,0,0|2,0,0]=4 901 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [1,1,0,0,0,0|0,0,2]=4 902 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,1,0,0,0,0|0,0,2]=4 903 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [1,1,0,0,0,0|0,0,2]=4 904 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [1,1,0,0,0,0|0,0,2]=4 905 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [1,1,0,0,0,0|0,0,2]=4 906 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [1,1,0,0,0,0|0,0,2]=4 907 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,1,0,0,0,0|0,0,2]=4 908 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.435 C=Cc1cccc(c1)C(O)CC 271570a_100011290941_200013212081 [1,1,0,0,0,0|1,0,0]=3 911 B12R1.435 C=Cc1cccc(c1)[C@@H](N)CC 271570a_100011290941_100102422761 [1,1,0,0,0,0|2,0,0]=4 912 B12R1.435 CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210202 [1,1,0,0,0,0|0,0,2]=4 913 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [1,1,0,0,0,0|0,0,2]=4 914 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [1,1,0,0,0,0|0,0,2]=4 915 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [1,1,0,0,0,0|0,0,2]=4 916 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [1,1,0,0,0,0|0,0,2]=4 917 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [1,1,0,0,0,0|0,0,2]=4 918 B12R1.435 CCC(N)c1cccc(c1)OC 34a_100159312145_200000210301 [1,1,0,0,0,0|1,0,0]=3 919 B12R1.435 CCC(N)c1cccc(c1)O[13CH3] 34a_100159312145_200025704644 [1,1,0,0,0,0|1,0,0]=3 920 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200000210301_200013212081 [1,1,0,0,0,0|0,1,0]=3 921 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200013212081_200000210301 [1,1,0,0,0,0|0,1,0]=3 922 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200013212081_200025704644 [1,1,0,0,0,0|0,1,0]=3 923 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200025704644_200013212081 [1,1,0,0,0,0|0,1,0]=3 924 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219725_100000210202 [1,1,0,0,0,0|2,0,0]=4 925 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219733_200000210301 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219725_100000204670 [1,1,0,0,0,0|2,0,0]=4 927 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219733_200000210301 [1,1,0,0,0,0|2,0,0]=4 928 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219725_100000210202 [1,1,0,0,0,0|2,0,0]=4 929 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219733_200000210301 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.435 CCN([13CH3])c1cccc(c1)OC 2230a_100000219733_200025704644 [1,1,0,0,0,0|2,0,0]=4 931 B12R1.435 CCN([13CH3])c1cccc(c1)OC 269982a_100000219733_200025704644 [1,1,0,0,0,0|2,0,0]=4 932 B12R1.435 CCN([13CH3])c1cccc(c1)OC 34a_100000219733_200025704644 [1,1,0,0,0,0|2,0,0]=4 933 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_100102422761_200000210301 [1,1,0,0,0,0|1,1,0]=4 934 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_200000210301_100102422761 [1,1,0,0,0,0|1,1,0]=4 935 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_100102422761_200025704644 [1,1,0,0,0,0|1,1,0]=4 936 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_200025704644_100102422761 [1,1,0,0,0,0|1,1,0]=4 937 B12R1.435 CNC(C)c1cccc(c1)OC 2230a_100000737859_200000210301 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.435 CNC(C)c1cccc(c1)OC 269862a_106832991636_100000171656 [1,1,0,0,0,0|2,0,0]=4 939 B12R1.435 COc1cccc(c1)C(C)N[13CH3] 2230a_100000737859_200025704644 [1,1,0,0,0,0|2,0,0]=4 940 B12R1.435 COc1cccc(c1)C(C)OC 34a_100000246466_200000210301 [1,1,0,0,0,0|2,0,0]=4 941 B12R1.435 COc1cccc(c1)C(C)OC 7a_100000246466_200000210301 [1,1,0,0,0,0|2,0,0]=4 942 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 34a_100000246466_200025704644 [1,1,0,0,0,0|2,0,0]=4 943 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 7a_100000246466_200025704644 [1,1,0,0,0,0|2,0,0]=4 944 B12R1.435 COc1cccc(c1)C(N)CO 34a_100025717460_200000210301 [1,1,0,0,0,0|2,0,0]=4 945 B12R1.435 COc1cccc(c1)C(O)CN 34a_100020657549_200000210301 [1,1,0,0,0,0|0,0,0]=2 946 B12R1.435 [13CH3]Oc1cccc(c1)C(N)CO 34a_100025717460_200025704644 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.435 [13CH3]Oc1cccc(c1)C(O)CN 34a_100020657549_200025704644 [1,1,0,0,0,0|0,0,0]=2 948 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [1,1,0,0,0,0|1,0,1]=4 949 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [1,1,0,0,0,0|1,0,1]=4 950 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [1,1,0,0,0,0|1,0,1]=4 951 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [1,1,0,0,0,0|1,0,1]=4 952 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [1,1,0,0,0,0|1,0,1]=4 953 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [1,1,0,0,0,0|2,0,0]=4 954 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [1,1,0,0,0,0|1,0,1]=4 955 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [1,1,0,0,0,0|1,0,1]=4 956 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [1,1,0,0,0,0|1,0,1]=4 957 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [1,1,0,0,0,0|1,0,1]=4 958 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [1,1,0,0,0,0|1,0,1]=4 959 B12R1.34 CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210202 [1,1,0,0,0,0|1,0,1]=4 960 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 240690a_100102657272_100000684486 [1,1,0,0,0,0|1,0,1]=4 961 B12R1.34 CNC(C)C(=O)c1ccccc1 2230a_106832991635_100000239700 [1,1,0,0,0,0|0,0,2]=4 962 B12R1.34 CNC(C)C(=O)c1ccccc1 7a_106832991635_100000239700 [1,1,0,0,0,0|0,0,2]=4 963 B12R1.34 CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_200000210301 [1,1,0,0,0,0|2,0,0]=4 964 B12R1.34 C[C@H](O[13CH3])[C@@H](N)c1ccccc1 34a_100134616770_200025704644 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.34 O=C(CF)[C@H](O)c1ccccc1 1458a_100000684486_100015361967 [1,1,0,0,0,0|1,0,1]=4 966 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [1,1,0,0,0,0|1,0,1]=4 967 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [1,1,0,0,0,0|1,0,1]=4 968 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [1,1,0,0,0,0|1,0,1]=4 969 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [1,1,0,0,0,0|1,0,1]=4 970 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [1,1,0,0,0,0|1,0,1]=4 971 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [1,1,0,0,0,0|1,0,1]=4 972 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_200000210301 [1,1,0,0,0,0|1,0,1]=4 973 B12R1.253 C[C@](O)(C(=O)[13CH3])c1ccccc1 1458a_100000753667_200025704644 [1,1,0,0,0,0|1,0,1]=4 974 B12R1.478 C=C(C)C(OC)c1ccccc1 34a_200011216824_200000210301 [1,1,0,0,0,0|1,0,1]=4 975 B12R1.478 C=C(C)C(OC)c1ccccc1 7a_200011216824_200000210301 [1,1,0,0,0,0|1,0,1]=4 976 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 34a_200011216824_200025704644 [1,1,0,0,0,0|1,0,1]=4 977 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 7a_200011216824_200025704644 [1,1,0,0,0,0|1,0,1]=4 978 B12R1.478 CC(=O)C(CO)c1ccccc1 1458a_100011218805_200000210301 [1,1,0,0,0,0|1,0,1]=4 979 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 34a_200011217822_200025704644 [1,1,0,0,0,0|1,0,0]=3 980 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 7a_200011217822_200025704644 [1,1,0,0,0,0|1,0,0]=3 981 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 2230a_100015186014_200025704644 [1,1,0,0,0,0|2,0,0]=4 982 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 34a_100015186014_200025704644 [1,1,0,0,0,0|2,0,0]=4 983 B12R1.478 CN[C@@H](c1ccccc1)[C@H](C)O 2230a_100134616770_200000210301 [1,1,0,0,0,0|2,0,0]=4 984 B12R1.478 CN[C@H](c1ccccc1)C(C)C 2230a_100015186014_200000210301 [1,1,0,0,0,0|2,0,0]=4 985 B12R1.478 CN[C@H](c1ccccc1)C(C)C 34a_100015186014_200000210301 [1,1,0,0,0,0|2,0,0]=4 986 B12R1.478 COC(C(=O)N)c1ccccc1 34a_100011200849_200000210301 [1,1,0,0,0,0|1,0,1]=4 987 B12R1.478 COC(C(=O)N)c1ccccc1 7a_100011200849_200000210301 [1,1,0,0,0,0|1,0,1]=4 988 B12R1.478 COC(c1ccccc1)C(C)C 34a_200011217822_200000210301 [1,1,0,0,0,0|1,0,0]=3 989 B12R1.478 COC(c1ccccc1)C(C)C 7a_200011217822_200000210301 [1,1,0,0,0,0|1,0,0]=3 990 B12R1.478 CO[C@@H](C(=O)C)c1ccccc1 1458a_100000698336_200000210301 [1,1,0,0,0,0|1,0,1]=4 991 B12R1.478 CO[C@@H](C(=O)[13CH3])c1ccccc1 1458a_100000698336_200025704644 [1,1,0,0,0,0|1,0,1]=4 992 B12R1.478 C[C@H](O)[C@@H](N[13CH3])c1ccccc1 2230a_100134616770_200025704644 [1,1,0,0,0,0|2,0,0]=4 993 B12R1.478 [13CH3]C(=O)C(CO)c1ccccc1 1458a_100011218805_200025704644 [1,1,0,0,0,0|1,0,1]=4 994 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 34a_100011200849_200025704644 [1,1,0,0,0,0|1,0,1]=4 995 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 7a_100011200849_200025704644 [1,1,0,0,0,0|1,0,1]=4 996 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,1,0,0,0,0|1,0,1]=4 997 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,1,0,0,0,0|1,0,1]=4 998 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,1,0,0,0,0|1,0,1]=4 999 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [1,1,0,0,0,0|2,0,0]=4 1000 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 1001 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 1002 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,1,0,0,0,0|2,0,0]=4 1003 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [1,1,0,0,0,0|2,0,0]=4 1004 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [1,1,0,0,0,0|2,0,0]=4 1005 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [1,1,0,0,0,0|2,0,0]=4 1006 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [1,1,0,0,0,0|2,0,0]=4 1007 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [1,1,0,0,0,0|2,0,0]=4 1008 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [1,1,0,0,0,0|2,0,0]=4 1009 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [1,1,0,0,0,0|2,0,0]=4 1010 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [1,1,0,0,0,0|2,0,0]=4 1011 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,1,0,0,0,0|2,0,0]=4 1012 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,1,0,0,0,0|1,0,1]=4 1013 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 1014 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 1015 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,1,0,0,0,0|2,0,0]=4 1016 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,1,0,0,0,0|2,0,0]=4 1017 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,1,0,0,0,0|2,0,0]=4 1018 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,1,0,0,0,0|1,0,1]=4 1019 B12R1.50 C#CC(C)Nc1cccc(c1)O 34a_100000210217_200000035995 [1,1,0,0,0,0|2,0,0]=4 1020 B12R1.50 C#CC(C)Sc1cccc(c1)O 62a_200000035995_100000211634 [1,1,0,0,0,0|2,0,0]=4 1021 B12R1.50 C=CC(C)Sc1cccc(c1)O 62a_100011215867_100000211634 [1,1,0,0,0,0|2,0,0]=4 1022 B12R1.50 CC(C#N)Sc1cccc(c1)O 62a_100000703298_100000211634 [1,1,0,0,0,0|1,0,1]=4 1023 B12R1.50 CC(CO)Nc1cccc(c1)O 34a_100000210217_100012180447 [1,1,0,0,0,0|2,0,0]=4 1024 B12R1.50 CC(CO)Sc1cccc(c1)O 62a_100012180447_100000211634 [1,1,0,0,0,0|2,0,0]=4 1025 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [1,1,0,0,0,0|1,0,1]=4 1026 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [1,1,0,0,0,0|1,0,1]=4 1027 B12R1.50 CCC(C)Nc1cccc(c1)O 34a_100000210217_100011215416 [1,1,0,0,0,0|2,0,0]=4 1028 B12R1.50 CCC(C)Oc1cccc(c1)O 271570a_203496583355_200011236628 [1,1,0,0,0,0|2,0,0]=4 1029 B12R1.50 CCC(C)Sc1cccc(c1)O 62a_100000758301_100000211634 [1,1,0,0,0,0|2,0,0]=4 1030 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000201218_200000210301 [1,1,0,0,0,0|2,0,0]=4 1031 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210202 [1,1,0,0,0,0|2,0,0]=4 1032 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000225621_100011660834 [1,1,0,0,0,0|2,0,0]=4 1033 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000201218_200000210301 [1,1,0,0,0,0|2,0,0]=4 1034 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000204670 [1,1,0,0,0,0|2,0,0]=4 1035 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000225621_100000084143 [1,1,0,0,0,0|2,0,0]=4 1036 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 2230a_100000201218_200025704644 [1,1,0,0,0,0|2,0,0]=4 1037 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 269982a_100000201218_200025704644 [1,1,0,0,0,0|2,0,0]=4 1038 B12R1.50 CN(CF)Cc1cccc(c1)O 269982a_100000207540_100015361967 [1,1,0,0,0,0|2,0,0]=4 1039 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [1,1,0,0,0,0|1,0,1]=4 1040 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [1,1,0,0,0,0|1,0,1]=4 1041 B12R1.50 CNC(C)Cc1cc(ccn1)C 270004a_106832991635_200015184229 [1,1,0,0,0,0|2,0,0]=4 1042 B12R1.50 CNC(C)Cc1cccc(c1)Br 270004a_106832991635_100000689217 [1,1,0,0,0,0|1,0,0]=3 1043 B12R1.50 CNC(C)Cc1cccc(c1)Cl 270004a_106832991635_100000727212 [1,1,0,0,0,0|1,0,0]=3 1044 B12R1.50 CNC(C)Cc1cccc(c1)F 270004a_106832991635_100000687711 [1,1,0,0,0,0|1,0,0]=3 1045 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [1,1,0,0,0,0|1,0,1]=4 1046 B12R1.50 COC(C)Sc1cccc(c1)O 62a_100009879195_100000211634 [1,1,0,0,0,0|2,0,0]=4 1047 B12R1.50 C[C@H](CO)Sc1cccc(c1)O 62a_100016084084_100000211634 [1,1,0,0,0,0|2,0,0]=4 1048 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [1,1,0,0,0,0|0,0,0]=2 1049 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [1,1,0,0,0,0|1,0,1]=4 1050 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [1,1,0,0,0,0|1,0,1]=4 1051 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)O 34a_100000123917_100000210206 [1,1,0,0,0,0|2,0,0]=4 1052 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)O 7a_100000123917_100000210206 [1,1,0,0,0,0|2,0,0]=4 1053 B12R1.101 CC(C)Nc1cc(cc(c1)O)O 34a_100000043371_100000210206 [1,1,0,0,0,0|2,0,0]=4 1054 B12R1.101 CC(C)Sc1cc(cc(c1)Br)O 62a_100000210206_100010068917 [1,1,0,0,0,0|2,0,0]=4 1055 B12R1.101 CC(C)Sc1cc(cc(c1)Br)O 62a_100010068917_100000210206 [1,1,0,0,0,0|2,0,0]=4 1056 B12R1.101 CC(C)Sc1cc(cc(c1)Cl)O 62a_100000210206_100010068924 [1,1,0,0,0,0|2,0,0]=4 1057 B12R1.101 CC(C)Sc1cc(cc(c1)Cl)O 62a_100010068924_100000210206 [1,1,0,0,0,0|2,0,0]=4 1058 B12R1.101 CC(C)Sc1cc(cc(c1)F)O 62a_100000210206_100000688818 [1,1,0,0,0,0|2,0,0]=4 1059 B12R1.101 CC(C)Sc1cc(cc(c1)F)O 62a_100000688818_100000210206 [1,1,0,0,0,0|2,0,0]=4 1060 B12R1.101 CC(C)Sc1cc(cc(c1)O)O 62a_100000210206_100009868816 [1,1,0,0,0,0|2,0,0]=4 1061 B12R1.101 CN(C)Cc1cc(cc(c1)Br)O 270004a_100102631434_100010176088 [1,1,0,0,0,0|2,0,0]=4 1062 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)O 270004a_100102631434_100000050827 [1,1,0,0,0,0|2,0,0]=4 1063 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 270004a_100102631434_100000703664 [1,1,0,0,0,0|2,0,0]=4 1064 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 271570a_203496583355_100012630382 [1,1,0,0,0,0|2,0,0]=4 1065 B12R1.101 Cc1cc(cc(c1)CN(C)C)O 270004a_100102631434_100009853434 [1,1,0,0,0,0|2,0,0]=4 1066 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 34a_100011995906_100000210206 [1,1,0,0,0,0|2,0,0]=4 1067 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 7a_100011995906_100000210206 [1,1,0,0,0,0|2,0,0]=4 1068 B12R1.101 Cc1cc(cc(c1)SC(C)C)O 62a_100000210206_100011999630 [1,1,0,0,0,0|2,0,0]=4 1069 B12R1.119 CC(C)(C)Nc1cccc(c1)O 34a_100000210217_100000210625 [1,1,0,0,0,0|2,0,0]=4 1070 B12R1.119 CC(C)(C)Oc1cccc(c1)O 271570a_203496583355_100010078498 [1,1,0,0,0,0|2,0,0]=4 1071 B12R1.119 CC(C)(C)Sc1cccc(c1)O 62a_100000211941_100000211634 [1,1,0,0,0,0|2,0,0]=4 1072 B12R1.119 CC(C)(O)Cc1cccc(n1)O 271570a_203496583355_100010253926 [1,1,0,0,0,0|2,0,0]=4 1073 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [1,1,0,0,0,0|2,0,0]=4 1074 B12R1.119 NS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_100000725052 [1,1,0,0,0,0|2,0,0]=4 1075 B12R1.119 Oc1cccc(c1)CC(F)(F)F 271570a_203496583355_100010231778 [1,1,0,0,0,0|2,0,0]=4 1076 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [1,1,0,0,0,0|1,0,1]=4 1077 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [1,1,0,0,0,0|1,0,1]=4 1078 B12R1.127 CC(C)Nc1cc(ccc1Br)O 34a_100011999798_100000210206 [1,1,0,0,0,0|2,0,0]=4 1079 B12R1.127 CC(C)Nc1cc(ccc1Cl)O 34a_100011934297_100000210206 [1,1,0,0,0,0|2,0,0]=4 1080 B12R1.127 CC(C)Nc1cc(ccc1F)O 34a_100012017239_100000210206 [1,1,0,0,0,0|2,0,0]=4 1081 B12R1.127 CC(C)Oc1cc(ccc1F)O 271570a_203496583355_200012350295 [1,1,0,0,0,0|2,0,0]=4 1082 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100000210206_100012339312 [1,1,0,0,0,0|2,0,0]=4 1083 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100012339312_100000210206 [1,1,0,0,0,0|2,0,0]=4 1084 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000049588_100000210206 [1,1,0,0,0,0|2,0,0]=4 1085 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000210206_100000049588 [1,1,0,0,0,0|2,0,0]=4 1086 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000210206_100000693481 [1,1,0,0,0,0|2,0,0]=4 1087 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000693481_100000210206 [1,1,0,0,0,0|2,0,0]=4 1088 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100000210206_100012001276 [1,1,0,0,0,0|2,0,0]=4 1089 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100012001276_100000210206 [1,1,0,0,0,0|2,0,0]=4 1090 B12R1.127 CC(C)Sc1cc(ccc1O)O 62a_100000210206_100009813629 [1,1,0,0,0,0|2,0,0]=4 1091 B12R1.127 CN(C)Cc1cc(ccc1F)O 271570a_203496583355_100011597561 [1,1,0,0,0,0|2,0,0]=4 1092 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [1,1,0,0,0,0|2,0,0]=4 1093 B12R1.127 Cc1ccc(cc1NC(C)C)O 271570a_203496583355_200000714908 [1,1,0,0,0,0|2,0,0]=4 1094 B12R1.127 Cc1ccc(cc1NC(C)C)O 34a_100011216113_100000210206 [1,1,0,0,0,0|2,0,0]=4 1095 B12R1.127 Cc1ccc(cc1OC(C)C)O 271570a_203496583355_200012359587 [1,1,0,0,0,0|2,0,0]=4 1096 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100000210206_100011380479 [1,1,0,0,0,0|2,0,0]=4 1097 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100011380479_100000210206 [1,1,0,0,0,0|2,0,0]=4 1098 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [1,1,0,0,0,0|1,0,1]=4 1099 B12R1.224 CC(C)Nc1cccc(c1Br)O 34a_100012183704_100000210206 [1,1,0,0,0,0|2,0,0]=4 1100 B12R1.224 CC(C)Nc1cccc(c1Br)O 7a_100012183704_100000210206 [1,1,0,0,0,0|2,0,0]=4 1101 B12R1.224 CC(C)Nc1cccc(c1Cl)O 34a_100012002038_100000210206 [1,1,0,0,0,0|2,0,0]=4 1102 B12R1.224 CC(C)Nc1cccc(c1Cl)O 7a_100012002038_100000210206 [1,1,0,0,0,0|2,0,0]=4 1103 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100000210206_100010187914 [1,1,0,0,0,0|2,0,0]=4 1104 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100010187914_100000210206 [1,1,0,0,0,0|2,0,0]=4 1105 B12R1.224 CC(C)Sc1cccc(c1Cl)O 62a_100000210206_100000049636 [1,1,0,0,0,0|2,0,0]=4 1106 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100000210206_100009817021 [1,1,0,0,0,0|2,0,0]=4 1107 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100009817021_100000210206 [1,1,0,0,0,0|2,0,0]=4 1108 B12R1.224 CC(C)Sc1cccc(c1N)O 62a_100000210206_100011934926 [1,1,0,0,0,0|2,0,0]=4 1109 B12R1.224 CC(C)Sc1cccc(c1O)O 62a_100000210206_100009815950 [1,1,0,0,0,0|2,0,0]=4 1110 B12R1.224 CN(C)Cc1cccc(c1Cl)O 270004a_100102631434_100000050521 [1,1,0,0,0,0|2,0,0]=4 1111 B12R1.224 Cc1c(cccc1CN(C)C)O 270004a_100102631434_100009868165 [1,1,0,0,0,0|2,0,0]=4 1112 B12R1.224 Cc1c(cccc1NC(C)C)O 34a_100011216573_100000210206 [1,1,0,0,0,0|2,0,0]=4 1113 B12R1.224 Cc1c(cccc1NC(C)C)O 7a_100011216573_100000210206 [1,1,0,0,0,0|2,0,0]=4 1114 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100000210206_100012002258 [1,1,0,0,0,0|2,0,0]=4 1115 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100012002258_100000210206 [1,1,0,0,0,0|2,0,0]=4 1116 B12R1.438 C=Cc1cccc(c1)CC(C)C 271570a_100011290941_100010883412 [1,1,0,0,0,0|2,0,0]=4 1117 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [1,1,0,0,0,0|1,0,1]=4 1118 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [1,1,0,0,0,0|1,1,0]=4 1119 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [1,1,0,0,0,0|1,1,0]=4 1120 B12R1.438 CC(C)Nc1cccc(c1)CO 2230a_100000211919_100000210206 [1,1,0,0,0,0|2,0,0]=4 1121 B12R1.438 CC(C)Nc1cccc(c1)CO 34a_100000211919_100000210206 [1,1,0,0,0,0|2,0,0]=4 1122 B12R1.438 CC(C)Oc1cccc(c1)CO 34a_100011214949_100000210206 [1,1,0,0,0,0|2,0,0]=4 1123 B12R1.438 CC(C)Oc1cccc(c1)CO 7a_100011214949_100000210206 [1,1,0,0,0,0|2,0,0]=4 1124 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [1,1,0,0,0,0|2,0,0]=4 1125 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [1,1,0,0,0,0|2,0,0]=4 1126 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000210206_100000687537 [1,1,0,0,0,0|2,0,0]=4 1127 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000687537_100000210206 [1,1,0,0,0,0|2,0,0]=4 1128 B12R1.438 CN(C)Cc1cccc(c1)CO 2230a_100102631434_100010188025 [1,1,0,0,0,0|2,0,0]=4 1129 B12R1.438 CN(C)Cc1cccc(c1)CO 269982a_100102631434_100010188025 [1,1,0,0,0,0|2,0,0]=4 1130 B12R1.438 CN(C)Cc1cccc(c1)CO 270004a_100102631434_200000050894 [1,1,0,0,0,0|2,0,0]=4 1131 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,1,0,0,0,0|1,0,1]=4 1132 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,1,0,0,0,0|1,0,1]=4 1133 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,1,0,0,0,0|1,0,1]=4 1134 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,1,0,0,0,0|1,0,1]=4 1135 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,1,0,0,0,0|1,0,1]=4 1136 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1137 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [1,1,0,0,0,0|2,0,0]=4 1138 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1139 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [1,1,0,0,0,0|2,0,0]=4 1140 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [1,1,0,0,0,0|2,0,0]=4 1141 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [1,1,0,0,0,0|2,0,0]=4 1142 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [1,1,0,0,0,0|2,0,0]=4 1143 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [1,1,0,0,0,0|2,0,0]=4 1144 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [1,1,0,0,0,0|2,0,0]=4 1145 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [1,1,0,0,0,0|2,0,0]=4 1146 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [1,1,0,0,0,0|2,0,0]=4 1147 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [1,1,0,0,0,0|2,0,0]=4 1148 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [1,1,0,0,0,0|2,0,0]=4 1149 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [1,1,0,0,0,0|1,1,0]=4 1150 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [1,1,0,0,0,0|1,1,0]=4 1151 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,1,0,0,0,0|1,0,1]=4 1152 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,1,0,0,0,0|1,0,1]=4 1153 B14R1.11 CC(C#N)NC(C)c1cccc(c1)O 2230a_100000740644_100000184139 [0,1,0,0,0,1|1,0,1]=4 1154 B14R1.11 CC(CO)NC(C)c1cccc(c1)O 2230a_100000740644_100012180447 [0,1,0,0,0,1|2,0,0]=4 1155 B14R1.11 CC(N[C@H](C)CF)c1cccc(c1)O 269862a_100102880703_100000211620 [0,1,0,0,0,1|2,0,0]=4 1156 B14R1.11 CC(N[C@H](C)CO)c1cccc(c1)O 269862a_100000737577_100000211620 [0,1,0,0,0,1|2,0,0]=4 1157 B14R1.11 CCC(C)NC(C)c1cccc(c1)O 2230a_100000740644_100000758301 [0,1,0,0,0,1|2,0,0]=4 1158 B14R1.11 CCC(C)NC(C)c1cccc(c1)O 269862a_100000209981_100000211620 [0,1,0,0,0,1|2,0,0]=4 1159 B14R1.11 CCN(C)CC(O)c1cccc(c1)O 2230a_100000737735_200000210301 [0,1,0,0,0,1|2,0,0]=4 1160 B14R1.11 CCN(C)CC(O)c1cccc(c1)O 269982a_100000737735_200000210301 [0,1,0,0,0,1|2,0,0]=4 1161 B14R1.11 CCN(C)C[C@H](O)c1cccc(c1)O 2230a_100009815823_100000210202 [0,1,0,0,0,1|2,0,0]=4 1162 B14R1.11 CCN(C)C[C@H](O)c1cccc(c1)O 269982a_100009815823_100000204670 [0,1,0,0,0,1|2,0,0]=4 1163 B14R1.11 CCN([13CH3])CC(O)c1cccc(c1)O 2230a_100000737735_200025704644 [0,1,0,0,0,1|2,0,0]=4 1164 B14R1.11 CCN([13CH3])CC(O)c1cccc(c1)O 269982a_100000737735_200025704644 [0,1,0,0,0,1|2,0,0]=4 1165 B14R1.11 CN(CF)C[C@H](O)c1cccc(c1)O 269982a_100009815823_100015361967 [0,1,0,0,0,1|2,0,0]=4 1166 B14R1.74 CC(C)C[C@H](N)c1cccc(c1)CO 271570a_100015190218_100000687537 [0,1,0,0,0,1|2,0,0]=4 1167 B14R1.74 COc1cccc(c1)C(C)NC(C)C 2230a_100000737859_100000210206 [0,1,0,0,0,1|2,0,0]=4 1168 B14R1.74 COc1cccc(c1)C(C)OC(C)C 34a_100000246466_100000210206 [0,1,0,0,0,1|2,0,0]=4 1169 B14R1.74 COc1cccc(c1)C(C)OC(C)C 7a_100000246466_100000210206 [0,1,0,0,0,1|2,0,0]=4 1170 B14R1.74 COc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000170001 [0,1,0,0,0,1|2,0,0]=4 1171 B14R1.150 CC(C)C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210206 [0,1,0,0,0,1|2,0,0]=4 1172 B14R1.150 CC(C)C(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210206 [0,1,0,0,0,1|2,0,0]=4 1173 B14R1.150 Cc1cccc(c1)C(O)C(=O)C(C)C 1458a_100011434945_100000210206 [0,1,0,0,0,1|2,0,0]=4 1174 B14R1.152 CC(C)C[C@H](N)c1cccc(c1Br)O 271570a_100015190218_100010187914 [0,1,0,0,0,1|2,0,0]=4 1175 B14R1.152 CC(C)C[C@H](N)c1cccc(c1Cl)O 271570a_100015190218_100000049636 [0,1,0,0,0,1|2,0,0]=4 1176 B14R1.152 CC(C)C[C@H](N)c1cccc(c1F)O 271570a_100015190218_100009817021 [0,1,0,0,0,1|2,0,0]=4 1177 B14R1.152 CC(C)C[C@H](N)c1cccc(c1N)O 271570a_100015190218_100011934926 [0,1,0,0,0,1|2,0,0]=4 1178 B14R1.152 CC(C)C[C@H](N)c1cccc(c1O)O 271570a_100015190218_100009815950 [0,1,0,0,0,1|2,0,0]=4 1179 B14R1.152 Cc1c(cccc1[C@@H](N)CC(C)C)O 271570a_100015190218_100012002258 [0,1,0,0,0,1|2,0,0]=4 1180 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Br 271570a_100015190218_100012356990 [0,1,0,0,0,1|2,0,0]=4 1181 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Cl 271570a_100015190218_100011356854 [0,1,0,0,0,1|2,0,0]=4 1182 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)F 271570a_100015190218_100000686035 [0,1,0,0,0,1|2,0,0]=4 1183 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)N 271570a_100015190218_100000739049 [0,1,0,0,0,1|2,0,0]=4 1184 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)O 271570a_100015190218_100009813601 [0,1,0,0,0,1|2,0,0]=4 1185 B14R1.685 Cc1ccc(cc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000766334 [0,1,0,0,0,1|2,0,0]=4 1186 B14R1.1020 CC(=O)NC(CO)c1cccc(c1)O 240690a_100025717460_100015343762 [0,1,0,0,0,1|1,0,1]=4 1187 B14R1.1020 CC(=O)NC(CO)c1cccc(c1)O 527a_100025717460_100103153847 [0,1,0,0,0,1|1,0,1]=4 1188 B14R1.1020 CC(C)NC(CO)c1cccc(c1)Br 2230a_100000690078_100000210206 [0,1,0,0,0,1|2,0,0]=4 1189 B14R1.1020 CC(C)NC(CO)c1cccc(c1)Br 34a_100000690078_100000210206 [0,1,0,0,0,1|2,0,0]=4 1190 B14R1.1020 CC(C)NC(CO)c1cccc(c1)O 2230a_100025717460_100000210206 [0,1,0,0,0,1|1,0,0]=3 1191 B14R1.1020 CC(C)NC(CO)c1cccc(c1)O 34a_100025717460_100000210206 [0,1,0,0,0,1|1,0,0]=3 1192 B14R1.1020 CC(C)N[C@@H](CO)c1cccc(c1)Cl 2230a_100032004910_100000210206 [0,1,0,0,0,1|2,0,0]=4 1193 B14R1.1020 CC(C)N[C@@H](CO)c1cccc(c1)Cl 34a_100032004910_100000210206 [0,1,0,0,0,1|2,0,0]=4 1194 B14R1.1020 CC(C)N[C@H](CO)c1cccc(c1)F 2230a_100020641251_100000210206 [0,1,0,0,0,1|2,0,0]=4 1195 B14R1.1020 CC(C)N[C@H](CO)c1cccc(c1)F 34a_100020641251_100000210206 [0,1,0,0,0,1|2,0,0]=4 1196 B14R1.1020 CCC(NC(C)C)c1cccc(c1)O 2230a_100159312145_100000210206 [0,1,0,0,0,1|2,0,0]=4 1197 B14R1.1020 CCC(NC(C)C)c1cccc(c1)O 34a_100159312145_100000210206 [0,1,0,0,0,1|2,0,0]=4 1198 B14R1.1020 Cc1cccc(c1)[C@@H](CO)NC(C)C 2230a_100009818812_100000210206 [0,1,0,0,0,1|2,0,0]=4 1199 B14R1.1020 Cc1cccc(c1)[C@@H](CO)NC(C)C 34a_100009818812_100000210206 [0,1,0,0,0,1|2,0,0]=4 1200 B14R1.4252 CC(C)C[C@H](N)c1cc(cc(c1)Br)O 271570a_100015190218_100010068917 [0,1,0,0,0,1|2,0,0]=4 1201 B14R1.4252 CC(C)C[C@H](N)c1cc(cc(c1)Cl)O 271570a_100015190218_100010068924 [0,1,0,0,0,1|2,0,0]=4 1202 B14R1.4252 CC(C)C[C@H](N)c1cc(cc(c1)F)O 271570a_100015190218_100000717995 [0,1,0,0,0,1|2,0,0]=4 1203 B14R1.4252 CC(C)C[C@H](N)c1cc(cc(c1)O)O 271570a_100015190218_100009868816 [0,1,0,0,0,1|2,0,0]=4 1204 B14R1.4252 Cc1cc(cc(c1)[C@@H](N)CC(C)C)O 271570a_100015190218_100011999630 [0,1,0,0,0,1|2,0,0]=4 1205 B14R1.6052 CC(C)C[C@H](N)c1cc(ccc1Br)O 271570a_100015190218_100012339312 [0,1,0,0,0,1|2,0,0]=4 1206 B14R1.6052 CC(C)C[C@H](N)c1cc(ccc1Cl)O 271570a_100015190218_100000049588 [0,1,0,0,0,1|2,0,0]=4 1207 B14R1.6052 CC(C)C[C@H](N)c1cc(ccc1F)O 271570a_100015190218_100000693481 [0,1,0,0,0,1|2,0,0]=4 1208 B14R1.6052 CC(C)C[C@H](N)c1cc(ccc1N)O 271570a_100015190218_100012001276 [0,1,0,0,0,1|2,0,0]=4 1209 B14R1.6052 CC(C)C[C@H](N)c1cc(ccc1O)O 271570a_100015190218_100009813629 [0,1,0,0,0,1|2,0,0]=4 1210 B14R1.6052 Cc1ccc(cc1[C@@H](N)CC(C)C)O 271570a_100015190218_100011380479 [0,1,0,0,0,1|2,0,0]=4 1211 B14R1.75 COc1cccc(c1)CC(O)C(=O)C 1458a_100000693103_200000210301 [0,1,0,0,0,1|1,0,1]=4 1212 B14R1.75 COc1cccc(c1)CC(O)C(=O)[13CH3] 1458a_100000693103_200025704644 [0,1,0,0,0,1|1,0,1]=4 1213 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,1,0,0,0,1|1,0,1]=4 1214 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,1,0,0,0,1|1,0,1]=4 1215 B14R1.1003 CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210202 [0,2,0,0,0,0|1,0,1]=4 1216 B14R1.1003 CNC(=O)C(O)c1ccc(c(c1)O)O 240690a_100102657272_200000032065 [0,2,0,0,0,0|1,0,1]=4 1217 B14R1.1003 O=C(CF)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100015361967 [0,2,0,0,0,0|1,0,1]=4 1218 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,2,0,0,0,0|1,0,1]=4 1219 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,2,0,0,0,0|1,0,1]=4 1220 B14R1.704 Oc1cc(ccc1F)C(O)C(F)(F)F 271570a_203496583355_200011517459 [0,2,0,0,0,0|2,0,0]=4 1221 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [1,0,0,1,0,0|1,0,0]=3 1222 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [1,0,0,1,0,0|0,0,2]=4 1223 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [1,0,0,1,0,0|0,0,0]=2 1224 B12R2.196 NC1CCc2c1cccc2O 271570a_203496583355_100000751068 [1,0,0,1,0,0|1,0,0]=3 1225 B12R2.196 NC1COc2c1cccc2O 271570a_203496583355_100025715106 [1,0,0,1,0,0|2,0,0]=4 1226 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [1,0,0,1,0,0|0,0,2]=4 1227 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [1,0,0,1,0,0|0,0,0]=2 1228 B12R2.196 Oc1ccnc2c1CCC2O 271570a_203496583355_100009868430 [1,0,0,1,0,0|1,0,0]=3 1229 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [1,0,0,1,0,0|1,0,1]=4 1230 B12R2.1282 NC1(CC1)c2cccc(c2)O 271570a_203496583355_100000759329 [1,0,0,1,0,0|1,0,0]=3 1231 B12R2.1282 NC1(CC1)c2cncc(c2)O 271570a_203496583355_200025708055 [1,0,0,1,0,0|2,0,0]=4 1232 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [1,0,0,1,0,0|2,0,0]=4 1233 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [1,0,0,1,0,0|2,0,0]=4 1234 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [1,0,0,1,0,0|1,0,1]=4 1235 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [1,0,0,1,0,0|1,0,1]=4 1236 B12R2.202 Oc1cccc2c1CC(C2)O 271570a_203496583355_100010752598 [1,0,0,1,0,0|1,0,0]=3 1237 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [1,0,0,1,0,0|2,0,0]=4 1238 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [1,0,0,1,0,0|2,0,0]=4 1239 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1240 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1241 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1242 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [1,0,0,1,0,0|0,0,2]=4 1243 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [1,0,0,1,0,0|1,0,1]=4 1244 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [1,0,0,1,0,0|0,0,0]=2 1245 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [1,0,0,1,0,0|1,0,1]=4 1246 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [1,0,0,1,0,0|1,0,1]=4 1247 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [1,0,0,1,0,0|1,0,0]=3 1248 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1249 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1250 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1251 B12R2.1286 Oc1cccc(c1)NC2CC2 34a_100000210217_100000211595 [1,0,0,1,0,0|2,0,0]=4 1252 B12R2.1286 Oc1cccc(c1)OC2CC2 271570a_203496583355_100012344912 [1,0,0,1,0,0|2,0,0]=4 1253 B12R2.1286 Oc1cccc(c1)SC2CC2 271570a_203496583355_200010157562 [1,0,0,1,0,0|2,0,0]=4 1254 B14R2.9036 CC(NC1CC1)c2cccc(c2)O 271570a_203496583355_100160470767 [0,0,0,1,0,1|2,0,0]=4 1255 B14R2.4529 CC(=O)C1Cc2cc(ccc2O1)O 1458a_200009830173_200000210301 [0,0,0,1,0,1|1,0,1]=4 1256 B14R2.4529 CC(O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000246534 [0,0,0,1,0,1|1,0,1]=4 1257 B14R2.4529 [13CH3]C(=O)C1Cc2cc(ccc2O1)O 1458a_200009830173_200025704644 [0,0,0,1,0,1|1,0,1]=4 1258 B14R2.4504 CC1(Cc2ccc(cc2C1N)O)C 271570a_203496583355_100000734495 [0,1,0,1,0,0|2,0,0]=4 1259 B14R2.30096 N[C@@H](c1cc(ccc1F)O)C2CC2 271570a_203496583355_100015929066 [0,1,0,1,0,0|2,0,0]=4 1260 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [1,0,0,0,0,1|1,0,1]=4 1261 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [1,0,0,0,0,1|1,0,1]=4 1262 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,0,0,0,0,1|1,0,1]=4 1263 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,0,0,0,0,1|1,0,1]=4 1264 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,0,0,0,0,1|1,0,1]=4 1265 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [1,0,0,0,0,1|2,0,0]=4 1266 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [1,0,0,0,0,1|2,0,0]=4 1267 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [1,0,0,0,0,1|2,0,0]=4 1268 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [1,0,0,0,0,1|2,0,0]=4 1269 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [1,0,0,0,0,1|2,0,0]=4 1270 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [1,0,0,0,0,1|2,0,0]=4 1271 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [1,0,0,0,0,1|2,0,0]=4 1272 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000210206_100000230085 [1,0,0,0,0,1|2,0,0]=4 1273 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000230085_100000210206 [1,0,0,0,0,1|2,0,0]=4 1274 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [1,0,0,0,0,1|2,0,0]=4 1275 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [1,0,0,0,0,1|2,0,0]=4 1276 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [1,0,0,0,0,1|2,0,0]=4 1277 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [1,0,0,0,0,1|2,0,0]=4 1278 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [1,0,0,0,0,1|2,0,0]=4 1279 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [1,0,0,0,0,1|2,0,0]=4 1280 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,0,0,0,0,1|1,0,1]=4 1281 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [1,0,0,0,0,1|1,0,1]=4 1282 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [1,0,0,0,0,1|1,0,1]=4 1283 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [1,0,0,0,0,1|1,0,1]=4 1284 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [1,0,0,0,0,1|1,0,1]=4 1285 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [1,0,0,0,0,1|1,0,1]=4 1286 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [1,0,0,0,0,1|1,0,1]=4 1287 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [1,0,0,0,0,1|1,0,1]=4 1288 B12R1.226 CC(C)C=Cc1cccc(c1)O 271570a_100016257149_100000211634 [1,0,0,0,0,1|1,0,1]=4 1289 B12R1.226 CC(C)CNc1cccc(c1)Br 34a_100000210019_100000210624 [1,0,0,0,0,1|2,0,0]=4 1290 B12R1.226 CC(C)CNc1cccc(c1)Cl 34a_100000185859_100000210624 [1,0,0,0,0,1|2,0,0]=4 1291 B12R1.226 CC(C)CNc1cccc(c1)F 34a_100000210047_100000210624 [1,0,0,0,0,1|2,0,0]=4 1292 B12R1.226 CC(C)CNc1cccc(c1)I 34a_100000211102_100000210624 [1,0,0,0,0,1|2,0,0]=4 1293 B12R1.226 CC(C)CNc1cccc(c1)O 34a_100000210217_100000210624 [1,0,0,0,0,1|1,0,0]=3 1294 B12R1.226 CC(C)COc1cccc(c1)Br 34a_100000210342_100000210624 [1,0,0,0,0,1|2,0,0]=4 1295 B12R1.226 CC(C)COc1cccc(c1)Br 7a_100000210342_100000210760 [1,0,0,0,0,1|2,0,0]=4 1296 B12R1.226 CC(C)COc1cccc(c1)Cl 34a_100000210295_100000210624 [1,0,0,0,0,1|2,0,0]=4 1297 B12R1.226 CC(C)COc1cccc(c1)Cl 7a_100000210295_100000210760 [1,0,0,0,0,1|2,0,0]=4 1298 B12R1.226 CC(C)COc1cccc(c1)F 34a_100000210426_100000210624 [1,0,0,0,0,1|2,0,0]=4 1299 B12R1.226 CC(C)COc1cccc(c1)F 7a_100000210426_100000210760 [1,0,0,0,0,1|2,0,0]=4 1300 B12R1.226 CC(C)COc1cccc(c1)I 34a_100000211634_100000210624 [1,0,0,0,0,1|2,0,0]=4 1301 B12R1.226 CC(C)COc1cccc(c1)I 7a_100000211634_100000210760 [1,0,0,0,0,1|2,0,0]=4 1302 B12R1.226 CC(C)COc1cccc(c1)N 34a_100000210217_100000210624 [1,0,0,0,0,1|2,0,0]=4 1303 B12R1.226 CC(C)COc1cccc(c1)O 271570a_203496583355_200000170005 [1,0,0,0,0,1|1,0,0]=3 1304 B12R1.226 CC(C)CSc1cc(ccn1)O 62a_100000210624_100000762945 [1,0,0,0,0,1|2,0,0]=4 1305 B12R1.226 CC(C)CSc1cccc(c1)Br 62a_100000210624_100000691529 [1,0,0,0,0,1|2,0,0]=4 1306 B12R1.226 CC(C)CSc1cccc(c1)Br 62a_100000691529_100000210760 [1,0,0,0,0,1|2,0,0]=4 1307 B12R1.226 CC(C)CSc1cccc(c1)Cl 62a_100000210624_100000699651 [1,0,0,0,0,1|2,0,0]=4 1308 B12R1.226 CC(C)CSc1cccc(c1)Cl 62a_100000699651_100000210760 [1,0,0,0,0,1|2,0,0]=4 1309 B12R1.226 CC(C)CSc1cccc(c1)F 62a_100000210624_100000685547 [1,0,0,0,0,1|2,0,0]=4 1310 B12R1.226 CC(C)CSc1cccc(c1)F 62a_100000685547_100000210760 [1,0,0,0,0,1|2,0,0]=4 1311 B12R1.226 CC(C)CSc1cccc(c1)N 62a_100000210019_100000210760 [1,0,0,0,0,1|2,0,0]=4 1312 B12R1.226 CC(C)CSc1cccc(c1)N 62a_100000210624_100000210019 [1,0,0,0,0,1|2,0,0]=4 1313 B12R1.226 CC(C)CSc1cccc(c1)O 62a_100000210624_100000211634 [1,0,0,0,0,1|1,0,0]=3 1314 B12R1.226 CC(C)CSc1cccc(c1)[S] 62a_100000210624_114929384022 [1,0,0,0,0,1|1,1,0]=4 1315 B12R1.226 CC(C)CSc1cccc(c1)[S] 62a_114929384022_100000210760 [1,0,0,0,0,1|1,1,0]=4 1316 B12R1.226 CC(C)CSc1cncc(c1)O 62a_100000210624_100000754920 [1,0,0,0,0,1|2,0,0]=4 1317 B12R1.226 CC(C)CSc1cncc(c1)O 62a_100000754920_100000210760 [1,0,0,0,0,1|2,0,0]=4 1318 B12R1.226 CC(C)NCc1cccc(c1)Br 207a_100138425928_100000210085 [1,0,0,0,0,1|2,0,0]=4 1319 B12R1.226 CC(C)NCc1cccc(c1)Br 2230a_100000174977_100000210206 [1,0,0,0,0,1|2,0,0]=4 1320 B12R1.226 CC(C)NCc1cccc(c1)Br 2230a_100138425928_100000698116 [1,0,0,0,0,1|2,0,0]=4 1321 B12R1.226 CC(C)NCc1cccc(c1)Br 34a_100000174977_100000210206 [1,0,0,0,0,1|2,0,0]=4 1322 B12R1.226 CC(C)NCc1cccc(c1)Br 34a_100138425928_100000698116 [1,0,0,0,0,1|2,0,0]=4 1323 B12R1.226 CC(C)NCc1cccc(c1)Cl 207a_100138425928_100000210801 [1,0,0,0,0,1|2,0,0]=4 1324 B12R1.226 CC(C)NCc1cccc(c1)Cl 2230a_100000174878_100000210206 [1,0,0,0,0,1|2,0,0]=4 1325 B12R1.226 CC(C)NCc1cccc(c1)Cl 2230a_100138425928_100000181238 [1,0,0,0,0,1|2,0,0]=4 1326 B12R1.226 CC(C)NCc1cccc(c1)Cl 34a_100000174878_100000210206 [1,0,0,0,0,1|2,0,0]=4 1327 B12R1.226 CC(C)NCc1cccc(c1)Cl 34a_100138425928_100000187163 [1,0,0,0,0,1|2,0,0]=4 1328 B12R1.226 CC(C)NCc1cccc(c1)F 207a_100138425928_100000210812 [1,0,0,0,0,1|2,0,0]=4 1329 B12R1.226 CC(C)NCc1cccc(c1)F 2230a_100000174948_100000210206 [1,0,0,0,0,1|2,0,0]=4 1330 B12R1.226 CC(C)NCc1cccc(c1)F 2230a_100138425928_100000230114 [1,0,0,0,0,1|2,0,0]=4 1331 B12R1.226 CC(C)NCc1cccc(c1)F 34a_100000174948_100000210206 [1,0,0,0,0,1|2,0,0]=4 1332 B12R1.226 CC(C)NCc1cccc(c1)F 34a_100138425928_100000187166 [1,0,0,0,0,1|2,0,0]=4 1333 B12R1.226 CC(C)NCc1cccc(c1)I 207a_100138425928_100000014684 [1,0,0,0,0,1|2,0,0]=4 1334 B12R1.226 CC(C)NCc1cccc(c1)I 2230a_100000106179_100000210206 [1,0,0,0,0,1|2,0,0]=4 1335 B12R1.226 CC(C)NCc1cccc(c1)I 2230a_100138425928_100011218688 [1,0,0,0,0,1|2,0,0]=4 1336 B12R1.226 CC(C)NCc1cccc(c1)I 34a_100000106179_100000210206 [1,0,0,0,0,1|2,0,0]=4 1337 B12R1.226 CC(C)NCc1cccc(c1)I 34a_100138425928_100011218688 [1,0,0,0,0,1|2,0,0]=4 1338 B12R1.226 CC(C)NCc1cccc(c1)O 207a_100138425928_100000188321 [1,0,0,0,0,1|1,0,0]=3 1339 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100000743036_100000210206 [1,0,0,0,0,1|1,0,0]=3 1340 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100138425928_100011660834 [1,0,0,0,0,1|1,0,0]=3 1341 B12R1.226 CC(C)NCc1cccc(c1)O 271570a_203496583355_100000195767 [1,0,0,0,0,1|1,0,0]=3 1342 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100000743036_100000210206 [1,0,0,0,0,1|1,0,0]=3 1343 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100138425928_100011660834 [1,0,0,0,0,1|1,0,0]=3 1344 B12R1.226 CC(C)NCc1ccnc(c1)O 207a_100138425928_100000688113 [1,0,0,0,0,1|2,0,0]=4 1345 B12R1.226 CC(C)NCc1cncc(c1)O 207a_100138425928_100012187055 [1,0,0,0,0,1|2,0,0]=4 1346 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000212225_100000698116 [1,0,0,0,0,1|2,0,0]=4 1347 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000687537_100000210206 [1,0,0,0,0,1|2,0,0]=4 1348 B12R1.226 CC(C)OCc1cccc(c1)Br 7a_100000687537_100000210206 [1,0,0,0,0,1|2,0,0]=4 1349 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000212225_100000187163 [1,0,0,0,0,1|2,0,0]=4 1350 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000241301_100000210206 [1,0,0,0,0,1|2,0,0]=4 1351 B12R1.226 CC(C)OCc1cccc(c1)Cl 7a_100000241301_100000210206 [1,0,0,0,0,1|2,0,0]=4 1352 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000210976_100000210206 [1,0,0,0,0,1|2,0,0]=4 1353 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000212225_100000187166 [1,0,0,0,0,1|2,0,0]=4 1354 B12R1.226 CC(C)OCc1cccc(c1)F 7a_100000210976_100000210206 [1,0,0,0,0,1|2,0,0]=4 1355 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100000212225_100011218688 [1,0,0,0,0,1|2,0,0]=4 1356 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100011215336_100000210206 [1,0,0,0,0,1|2,0,0]=4 1357 B12R1.226 CC(C)OCc1cccc(c1)I 7a_100011215336_100000210206 [1,0,0,0,0,1|2,0,0]=4 1358 B12R1.226 CC(C)OCc1cccc(c1)N 34a_100000211919_100000210206 [1,0,0,0,0,1|2,0,0]=4 1359 B12R1.226 CC(C)OCc1cccc(c1)O 34a_100000212225_100011660834 [1,0,0,0,0,1|1,0,0]=3 1360 B12R1.226 CC(C)SCc1cccc(c1)Br 62a_100000210206_100000211773 [1,0,0,0,0,1|2,0,0]=4 1361 B12R1.226 CC(C)SCc1cccc(c1)Br 62a_100000211773_100000210206 [1,0,0,0,0,1|2,0,0]=4 1362 B12R1.226 CC(C)SCc1cccc(c1)Cl 62a_100000187163_100000210206 [1,0,0,0,0,1|2,0,0]=4 1363 B12R1.226 CC(C)SCc1cccc(c1)Cl 62a_100000210206_100000187163 [1,0,0,0,0,1|2,0,0]=4 1364 B12R1.226 CC(C)SCc1cccc(c1)F 62a_100000210206_100000230114 [1,0,0,0,0,1|2,0,0]=4 1365 B12R1.226 CC(C)SCc1cccc(c1)F 62a_100000230114_100000210206 [1,0,0,0,0,1|2,0,0]=4 1366 B12R1.226 CC(C)SCc1cccc(c1)I 62a_100000210206_100011218688 [1,0,0,0,0,1|2,0,0]=4 1367 B12R1.226 CC(C)SCc1cccc(c1)I 62a_100011218688_100000210206 [1,0,0,0,0,1|2,0,0]=4 1368 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100000210206_100011660834 [1,0,0,0,0,1|1,0,0]=3 1369 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100011660834_100000210206 [1,0,0,0,0,1|1,0,0]=3 1370 B12R1.226 CC(O)C=Cc1cccc(c1)O 271570a_200011019289_100000211634 [1,0,0,0,0,1|1,0,1]=4 1371 B12R1.226 CC(O)CNc1cccc(c1)Br 34a_100000210019_100011218427 [1,0,0,0,0,1|2,0,0]=4 1372 B12R1.226 CC(O)CNc1cccc(c1)Cl 34a_100000185859_100011218427 [1,0,0,0,0,1|2,0,0]=4 1373 B12R1.226 CC(O)CNc1cccc(c1)F 34a_100000210047_100011218427 [1,0,0,0,0,1|2,0,0]=4 1374 B12R1.226 CC(O)CNc1cccc(c1)I 34a_100000211102_100011218427 [1,0,0,0,0,1|2,0,0]=4 1375 B12R1.226 CC(O)CNc1cccc(c1)O 34a_100000210217_100011218427 [1,0,0,0,0,1|1,0,0]=3 1376 B12R1.226 CC(O)COc1cccc(c1)Br 34a_100000210342_100011218427 [1,0,0,0,0,1|2,0,0]=4 1377 B12R1.226 CC(O)COc1cccc(c1)Br 7a_100000210342_100011218427 [1,0,0,0,0,1|2,0,0]=4 1378 B12R1.226 CC(O)COc1cccc(c1)Cl 34a_100000210295_100011218427 [1,0,0,0,0,1|2,0,0]=4 1379 B12R1.226 CC(O)COc1cccc(c1)Cl 7a_100000210295_100011218427 [1,0,0,0,0,1|2,0,0]=4 1380 B12R1.226 CC(O)COc1cccc(c1)F 34a_100000210426_100011218427 [1,0,0,0,0,1|2,0,0]=4 1381 B12R1.226 CC(O)COc1cccc(c1)F 7a_100000210426_100011218427 [1,0,0,0,0,1|2,0,0]=4 1382 B12R1.226 CC(O)COc1cccc(c1)I 34a_100000211634_100011218427 [1,0,0,0,0,1|2,0,0]=4 1383 B12R1.226 CC(O)COc1cccc(c1)I 7a_100000211634_100011218427 [1,0,0,0,0,1|2,0,0]=4 1384 B12R1.226 CC(O)COc1cccc(c1)N 34a_100000210217_100011218427 [1,0,0,0,0,1|2,0,0]=4 1385 B12R1.226 CC(O)CSc1cc(ccn1)O 62a_100011218427_100000762945 [1,0,0,0,0,1|2,0,0]=4 1386 B12R1.226 CC(O)CSc1cccc(c1)Br 62a_100000691529_100011218427 [1,0,0,0,0,1|2,0,0]=4 1387 B12R1.226 CC(O)CSc1cccc(c1)Br 62a_100011218427_100000691529 [1,0,0,0,0,1|2,0,0]=4 1388 B12R1.226 CC(O)CSc1cccc(c1)Cl 62a_100000699651_100011218427 [1,0,0,0,0,1|2,0,0]=4 1389 B12R1.226 CC(O)CSc1cccc(c1)Cl 62a_100011218427_100000699651 [1,0,0,0,0,1|2,0,0]=4 1390 B12R1.226 CC(O)CSc1cccc(c1)F 62a_100000685547_100011218427 [1,0,0,0,0,1|2,0,0]=4 1391 B12R1.226 CC(O)CSc1cccc(c1)F 62a_100011218427_100000685547 [1,0,0,0,0,1|2,0,0]=4 1392 B12R1.226 CC(O)CSc1cccc(c1)N 62a_100000210019_100011218427 [1,0,0,0,0,1|2,0,0]=4 1393 B12R1.226 CC(O)CSc1cccc(c1)N 62a_100011218427_100000210019 [1,0,0,0,0,1|2,0,0]=4 1394 B12R1.226 CC(O)CSc1cccc(c1)O 62a_100011218427_100000211634 [1,0,0,0,0,1|1,0,0]=3 1395 B12R1.226 CC(O)CSc1cccc(c1)[S] 62a_100011218427_114929384022 [1,0,0,0,0,1|1,1,0]=4 1396 B12R1.226 CC(O)CSc1cccc(c1)[S] 62a_114929384022_100011218427 [1,0,0,0,0,1|1,1,0]=4 1397 B12R1.226 CC(O)CSc1cncc(c1)O 62a_100000754920_100011218427 [1,0,0,0,0,1|2,0,0]=4 1398 B12R1.226 CC(O)CSc1cncc(c1)O 62a_100011218427_100000754920 [1,0,0,0,0,1|2,0,0]=4 1399 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 34a_100000210019_100009817552 [1,0,0,0,0,1|2,0,0]=4 1400 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 34a_100000185859_100009817552 [1,0,0,0,0,1|2,0,0]=4 1401 B12R1.226 C[C@@H](O)CNc1cccc(c1)F 34a_100000210047_100009817552 [1,0,0,0,0,1|2,0,0]=4 1402 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 34a_100000211102_100009817552 [1,0,0,0,0,1|2,0,0]=4 1403 B12R1.226 C[C@@H](O)CNc1cccc(c1)O 34a_100000210217_100009817552 [1,0,0,0,0,1|1,0,0]=3 1404 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 34a_100000210342_100009817552 [1,0,0,0,0,1|2,0,0]=4 1405 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 7a_100000210342_100009817552 [1,0,0,0,0,1|2,0,0]=4 1406 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 34a_100000210295_100009817552 [1,0,0,0,0,1|2,0,0]=4 1407 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 7a_100000210295_100009817552 [1,0,0,0,0,1|2,0,0]=4 1408 B12R1.226 C[C@@H](O)COc1cccc(c1)F 34a_100000210426_100009817552 [1,0,0,0,0,1|2,0,0]=4 1409 B12R1.226 C[C@@H](O)COc1cccc(c1)F 7a_100000210426_100009817552 [1,0,0,0,0,1|2,0,0]=4 1410 B12R1.226 C[C@@H](O)COc1cccc(c1)I 34a_100000211634_100009817552 [1,0,0,0,0,1|2,0,0]=4 1411 B12R1.226 C[C@@H](O)COc1cccc(c1)I 7a_100000211634_100009817552 [1,0,0,0,0,1|2,0,0]=4 1412 B12R1.226 C[C@@H](O)COc1cccc(c1)N 34a_100000210217_100009817552 [1,0,0,0,0,1|2,0,0]=4 1413 B12R1.226 C[C@@H](O)CSc1cc(ccn1)O 62a_100009817552_100000762945 [1,0,0,0,0,1|2,0,0]=4 1414 B12R1.226 C[C@@H](O)CSc1cccc(c1)Br 62a_100000691529_100009817552 [1,0,0,0,0,1|2,0,0]=4 1415 B12R1.226 C[C@@H](O)CSc1cccc(c1)Br 62a_100009817552_100000691529 [1,0,0,0,0,1|2,0,0]=4 1416 B12R1.226 C[C@@H](O)CSc1cccc(c1)Cl 62a_100000699651_100009817552 [1,0,0,0,0,1|2,0,0]=4 1417 B12R1.226 C[C@@H](O)CSc1cccc(c1)Cl 62a_100009817552_100000699651 [1,0,0,0,0,1|2,0,0]=4 1418 B12R1.226 C[C@@H](O)CSc1cccc(c1)F 62a_100000685547_100009817552 [1,0,0,0,0,1|2,0,0]=4 1419 B12R1.226 C[C@@H](O)CSc1cccc(c1)F 62a_100009817552_100000685547 [1,0,0,0,0,1|2,0,0]=4 1420 B12R1.226 C[C@@H](O)CSc1cccc(c1)N 62a_100000210019_100009817552 [1,0,0,0,0,1|2,0,0]=4 1421 B12R1.226 C[C@@H](O)CSc1cccc(c1)N 62a_100009817552_100000210019 [1,0,0,0,0,1|2,0,0]=4 1422 B12R1.226 C[C@@H](O)CSc1cccc(c1)O 62a_100009817552_100000211634 [1,0,0,0,0,1|1,0,0]=3 1423 B12R1.226 C[C@@H](O)CSc1cccc(c1)[S] 62a_100009817552_114929384022 [1,0,0,0,0,1|1,1,0]=4 1424 B12R1.226 C[C@@H](O)CSc1cccc(c1)[S] 62a_114929384022_100009817552 [1,0,0,0,0,1|1,1,0]=4 1425 B12R1.226 C[C@@H](O)CSc1cncc(c1)O 62a_100000754920_100009817552 [1,0,0,0,0,1|2,0,0]=4 1426 B12R1.226 C[C@@H](O)CSc1cncc(c1)O 62a_100009817552_100000754920 [1,0,0,0,0,1|2,0,0]=4 1427 B12R1.226 Cc1cccc(c1)CNC(C)C 207a_100138425928_100000211157 [1,0,0,0,0,1|2,0,0]=4 1428 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100000185548_100000210206 [1,0,0,0,0,1|2,0,0]=4 1429 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100138425928_100000211840 [1,0,0,0,0,1|2,0,0]=4 1430 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100000185548_100000210206 [1,0,0,0,0,1|2,0,0]=4 1431 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100138425928_100000211840 [1,0,0,0,0,1|2,0,0]=4 1432 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100000212225_100000211840 [1,0,0,0,0,1|2,0,0]=4 1433 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100011217746_100000210206 [1,0,0,0,0,1|2,0,0]=4 1434 B12R1.226 Cc1cccc(c1)COC(C)C 7a_100011217746_100000210206 [1,0,0,0,0,1|2,0,0]=4 1435 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000210206_100000211840 [1,0,0,0,0,1|2,0,0]=4 1436 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000211840_100000210206 [1,0,0,0,0,1|2,0,0]=4 1437 B12R1.226 Cc1cccc(c1)NCC(C)C 2230a_100000188690_100000210760 [1,0,0,0,0,1|2,0,0]=4 1438 B12R1.226 Cc1cccc(c1)NCC(C)C 34a_100000188690_100000210624 [1,0,0,0,0,1|2,0,0]=4 1439 B12R1.226 Cc1cccc(c1)NCC(C)O 2230a_100000188690_100011218427 [1,0,0,0,0,1|2,0,0]=4 1440 B12R1.226 Cc1cccc(c1)NCC(C)O 34a_100000188690_100011218427 [1,0,0,0,0,1|2,0,0]=4 1441 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 2230a_100000188690_100009817552 [1,0,0,0,0,1|2,0,0]=4 1442 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 34a_100000188690_100009817552 [1,0,0,0,0,1|2,0,0]=4 1443 B12R1.226 Cc1cccc(c1)OCC(C)C 34a_100000210337_100000210624 [1,0,0,0,0,1|2,0,0]=4 1444 B12R1.226 Cc1cccc(c1)OCC(C)C 7a_100000210337_100000210760 [1,0,0,0,0,1|2,0,0]=4 1445 B12R1.226 Cc1cccc(c1)OCC(C)O 34a_100000210337_100011218427 [1,0,0,0,0,1|2,0,0]=4 1446 B12R1.226 Cc1cccc(c1)OCC(C)O 7a_100000210337_100011218427 [1,0,0,0,0,1|2,0,0]=4 1447 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 34a_100000210337_100009817552 [1,0,0,0,0,1|2,0,0]=4 1448 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 7a_100000210337_100009817552 [1,0,0,0,0,1|2,0,0]=4 1449 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100000210624_100011215228 [1,0,0,0,0,1|2,0,0]=4 1450 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100011215228_100000210760 [1,0,0,0,0,1|2,0,0]=4 1451 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011215228_100011218427 [1,0,0,0,0,1|2,0,0]=4 1452 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011218427_100011215228 [1,0,0,0,0,1|2,0,0]=4 1453 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011215228 [1,0,0,0,0,1|2,0,0]=4 1454 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100011215228_100009817552 [1,0,0,0,0,1|2,0,0]=4 1455 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [1,0,0,0,0,1|1,0,1]=4 1456 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [1,0,0,0,0,1|1,0,1]=4 1457 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [1,0,0,0,0,1|1,0,1]=4 1458 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [1,0,0,0,0,1|1,0,1]=4 1459 B12R1.226 Oc1cccc(c1)NCC(F)F 34a_100000210217_100011934356 [1,0,0,0,0,1|2,0,0]=4 1460 B12R1.226 Oc1cccc(c1)OCC(F)F 271570a_203496583355_100000763112 [1,0,0,0,0,1|2,0,0]=4 1461 B12R1.226 Oc1cccc(c1)SCC(F)F 62a_100011934356_100000211634 [1,0,0,0,0,1|2,0,0]=4 1462 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [1,0,0,0,0,1|1,0,1]=4 1463 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O 240690a_100020657549_100015343762 [0,0,0,0,0,2|1,0,1]=4 1464 B14R1.149 CC(=O)NCC(O)c1cccc(c1)O 527a_100020657549_100103153847 [0,0,0,0,0,2|1,0,1]=4 1465 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 2230a_100000740644_100000210760 [0,0,0,0,0,2|2,0,0]=4 1466 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 269862a_100000210953_100000211620 [0,0,0,0,0,2|2,0,0]=4 1467 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 270004a_100000740644_100000210432 [0,0,0,0,0,2|2,0,0]=4 1468 B14R1.149 CC(C)NCC(O)c1cccc(c1)O 2230a_100020657549_100000210206 [0,0,0,0,0,2|1,0,0]=3 1469 B14R1.149 CC(C)NCC(O)c1cccc(c1)O 34a_100020657549_100000210206 [0,0,0,0,0,2|1,0,0]=3 1470 B14R1.149 CC(NC[C@@H](C)O)c1cccc(c1)O 2230a_100000740644_100009817552 [0,0,0,0,0,2|2,0,0]=4 1471 B14R1.149 CC(O)CNC(C)c1cccc(c1)O 2230a_100000740644_100011218427 [0,0,0,0,0,2|2,0,0]=4 1472 B14R1.149 CC(O)CNC(C)c1cccc(c1)O 269862a_100000210904_100000211620 [0,0,0,0,0,2|2,0,0]=4 1473 B14R1.5978 CC(C)CC(C)Nc1cccc(c1)O 34a_100000210217_100000731052 [0,0,0,0,0,2|2,0,0]=4 1474 B14R1.5978 CC(C)CC(C)Sc1cccc(c1)O 62a_100000731052_100000211634 [0,0,0,0,0,2|2,0,0]=4 1475 B14R1.5956 CC(C)C(C)NCc1cccc(c1)O 207a_100000211541_100000188321 [0,0,0,0,0,2|2,0,0]=4 1476 B14R1.5956 CC(C)C(C)NCc1cccc(c1)O 2230a_100000211541_100011660834 [0,0,0,0,0,2|2,0,0]=4 1477 B14R1.5956 CC(C)C(C)NCc1cccc(c1)O 270004a_100000211541_100000188321 [0,0,0,0,0,2|2,0,0]=4 1478 B14R1.5956 CC(C)C(C)OCc1cccc(c1)O 7a_100000748068_100000084143 [0,0,0,0,0,2|2,0,0]=4