0 B10R1.113 C=C(C)c1c[n+](ccn1)[O-] 271570a_100000694244_100009880115 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.113 C=C(C)c1cc(cnn1)C 271570a_100000694244_100000070100 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.113 C=C(C)c1cc(cnn1)O 271570a_100000694244_200010734679 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.113 C=C(C)c1cc(ncn1)F 271570a_100000694244_200009880791 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.113 C=C(C)c1cc(ncn1)N 271570a_100000694244_100000701291 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.113 C=C(C)c1cc(ncn1)O 271570a_100000694244_100000765262 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.113 C=C(C)c1cc[nH]c(=O)n1 271570a_100000694244_200000134032 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.113 C=C(C)c1ccnc(n1)N 271570a_100000694244_100009820717 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.113 C=C(C)c1cn[nH]c(=O)c1 271570a_100000694244_100010197405 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.113 C=C(C)c1cncc(n1)C 271570a_100000694244_100009842155 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.113 C=C(C)c1cncc(n1)F 271570a_100000694244_200009863489 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.113 C=C(C)c1cncc(n1)N 271570a_100000694244_100009819714 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.113 C=C(C)c1cncc(n1)O 271570a_100000694244_100011269956 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.113 C=C(C)c1cnnc(c1)N 271570a_100000694244_100000130277 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.113 C=C(C)c1nccc(n1)C 271570a_100000694244_100011243806 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.113 C=C(C)c1nccc(n1)N 271570a_100000694244_100000757536 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.113 C=C(C)c1nccc(n1)O 271570a_100000694244_100011649813 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.113 CC(=O)N1CCC=C(C1)C 11a_100000725631_100015343762 [0,0,0,0,0,0|1,0,3]=4 53 B10R1.113 CC(=O)N1CCC=C(C1)C 1626a_100000725631_100015343762 [0,0,0,0,0,0|1,0,3]=4 54 B10R1.113 CC(=O)N1CCC=C(C1)C 240690a_100000725631_100015343762 [0,0,0,0,0,0|1,0,3]=4 55 B10R1.113 CC(=O)N1CCC=C(C1)C 527a_100000725631_100103153847 [0,0,0,0,0,0|1,0,3]=4 56 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [0,0,0,0,0,0|1,0,0]=1 58 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [0,0,0,0,0,0|0,0,0]=0 59 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [0,0,0,0,0,0|1,0,0]=1 60 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [0,0,0,0,0,0|1,0,0]=1 61 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [0,0,0,0,0,0|1,0,0]=1 62 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [0,0,0,0,0,0|1,0,0]=1 63 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [0,0,0,0,0,0|1,0,0]=1 64 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.113 CC(C)c1cc(ccn1)O 271570a_203496583355_100010237922 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [0,0,0,0,0,0|2,0,1]=3 70 B10R1.113 CC(C)c1cccc(n1)O 271570a_203496583355_100012318657 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.113 CC(C)c1ccnc(c1)O 271570a_203496583355_100010237925 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.113 CC(C)c1cncc(c1)O 271570a_203496583355_200010191214 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [0,0,0,0,0,0|2,0,1]=3 74 B10R1.113 CC(N)c1cccc(n1)O 271570a_203496583355_200010173468 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.113 CC(O)c1cc(ccn1)O 271570a_203496583355_100000144657 [0,0,0,0,0,0|2,0,2]=4 76 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [0,0,0,0,0,0|1,0,2]=3 77 B10R1.113 CC(O)c1cccc(n1)O 271570a_203496583355_100009820884 [0,0,0,0,0,0|2,0,2]=4 78 B10R1.113 CC(O)c1cncc(c1)O 271570a_203496583355_100012351597 [0,0,0,0,0,0|2,0,2]=4 79 B10R1.113 CN(C)c1cc(ccn1)F 27a_100102631434_100000764206 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.113 CN(C)c1cc(ccn1)O 271570a_203496583355_100012361627 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.113 CN(C)c1cc[nH]c(=O)c1 27a_100102631434_100000061649 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [0,0,0,0,0,0|3,0,0]=3 91 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.113 CN(C)c1cccc(n1)F 27a_100102631434_100009815982 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.113 CN(C)c1cccc(n1)O 271570a_203496583355_100011960435 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.113 CN(C)c1ccnc(c1)F 27a_100102631434_100009816116 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.113 CN(C)c1ccnc(c1)O 271570a_203496583355_100000766659 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.113 CN(C)c1cncc(c1)O 271570a_203496583355_100012350714 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [0,0,0,0,0,0|3,0,0]=3 107 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [0,0,0,0,0,0|3,0,0]=3 113 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [0,0,0,0,0,0|3,0,0]=3 114 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [0,0,0,0,0,0|3,0,0]=3 115 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [0,0,0,0,0,0|3,0,0]=3 116 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [0,0,0,0,0,0|3,0,0]=3 117 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [0,0,0,0,0,0|3,0,0]=3 118 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [0,0,0,0,0,0|2,0,0]=2 119 B10R1.113 C[C@@H](N)c1cncc(c1)O 271570a_203496583355_100012350620 [0,0,0,0,0,0|3,0,1]=4 120 B10R1.113 Cc1cc(ccn1)N(C)C 27a_100102631434_100000758586 [0,0,0,0,0,0|3,0,0]=3 121 B10R1.113 Cc1cc(ncn1)N(C)C 27a_100102631434_100000744208 [0,0,0,0,0,0|4,0,0]=4 122 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [0,0,0,0,0,0|0,0,0]=0 123 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [0,0,0,0,0,0|2,0,0]=2 124 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [0,0,0,0,0,0|2,0,0]=2 125 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [0,0,0,0,0,0|2,0,0]=2 126 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [0,0,0,0,0,0|2,0,0]=2 127 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [0,0,0,0,0,0|2,0,0]=2 128 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [0,0,0,0,0,0|2,0,0]=2 129 B10R1.113 Cc1ccnc(n1)N(C)C 27a_100102631434_100000750684 [0,0,0,0,0,0|4,0,0]=4 130 B10R1.113 Cc1cncc(n1)N(C)C 27a_100102631434_100000754123 [0,0,0,0,0,0|4,0,0]=4 131 B10R1.113 Cc1cnnc(c1)N(C)C 27a_100102631434_100000070100 [0,0,0,0,0,0|4,0,0]=4 132 B10R1.113 Cc1nccc(n1)N(C)C 27a_100102631434_100000749937 [0,0,0,0,0,0|4,0,0]=4 133 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [0,0,0,0,0,0|3,0,0]=3 134 B10R1.113 NC(=O)c1cc(ncn1)O 271570a_203496583355_100000725265 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [0,0,0,0,0,0|2,0,0]=2 136 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [0,0,0,0,0,0|3,0,0]=3 138 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [0,0,0,0,0,0|4,0,0]=4 139 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [0,0,0,0,0,0|3,0,0]=3 140 B10R1.113 NC(=O)c1cncc(n1)O 271570a_203496583355_100000764846 [0,0,0,0,0,0|4,0,0]=4 141 B10R1.113 NC(=O)c1cnnc(c1)O 271570a_203496583355_100015785749 [0,0,0,0,0,0|4,0,0]=4 142 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.113 Oc1cccc(c1)C(F)F 271570a_203496583355_100009892619 [0,0,0,0,0,0|3,0,1]=4 144 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [0,0,0,0,0,0|1,0,0]=1 145 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [0,0,0,0,0,0|1,0,0]=1 146 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [0,0,0,0,0,0|1,0,0]=1 147 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [0,0,0,0,0,0|1,0,0]=1 148 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [0,0,0,0,0,0|1,0,0]=1 149 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [1,0,0,0,0,0|1,0,1]=3 150 B9R1.2 C=Cc1cc(ccn1)Cl 271570a_100011290941_100010167805 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.2 C=Cc1cc(ccn1)F 271570a_100011290941_100009817058 [1,0,0,0,0,0|2,0,1]=4 152 B9R1.2 C=Cc1cc(ccn1)N 271570a_100011290941_100009814236 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.2 C=Cc1cc(cnn1)C 271570a_100011290941_100000070100 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.2 C=Cc1cc(ncn1)C 271570a_100011290941_100000744208 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.2 C=Cc1cc[nH]c(=O)c1 271570a_100011290941_100009816521 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.2 C=Cc1ccc[n+](c1)C 271570a_100011290941_100009996589 [1,0,0,0,0,0|1,0,1]=3 158 B9R1.2 C=Cc1ccc[n+](c1)[O-] 271570a_100011290941_100009815978 [1,0,0,0,0,0|2,0,1]=4 159 B9R1.2 C=Cc1cccc(=O)[nH]1 271570a_100011290941_100000761760 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [1,0,0,0,0,0|1,0,1]=3 161 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [1,0,0,0,0,0|0,0,1]=2 162 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [1,0,0,0,0,0|1,0,1]=3 163 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [1,0,0,0,0,0|1,0,1]=3 164 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [1,0,0,0,0,0|1,0,1]=3 165 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [1,0,0,0,0,0|1,0,1]=3 166 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [1,0,0,0,0,0|1,0,1]=3 167 B9R1.2 C=Cc1cccc(n1)Br 271570a_100011290941_100000684672 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [1,0,0,0,0,0|1,0,1]=3 169 B9R1.2 C=Cc1cccc(n1)F 271570a_100011290941_100009815982 [1,0,0,0,0,0|2,0,1]=4 170 B9R1.2 C=Cc1cccc(n1)N 271570a_100011290941_100000740741 [1,0,0,0,0,0|2,0,1]=4 171 B9R1.2 C=Cc1ccnc(c1)Br 271570a_100011290941_100009814637 [1,0,0,0,0,0|2,0,1]=4 172 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [1,0,0,0,0,0|1,0,1]=3 173 B9R1.2 C=Cc1ccnc(c1)Cl 271570a_100011290941_100000035001 [1,0,0,0,0,0|2,0,1]=4 174 B9R1.2 C=Cc1ccnc(c1)F 271570a_100011290941_100009816116 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.2 C=Cc1ccnc(c1)N 271570a_100011290941_100000744379 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.2 C=Cc1cncc(c1)Br 271570a_100011290941_100000728054 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [1,0,0,0,0,0|1,0,1]=3 179 B9R1.2 C=Cc1cncc(c1)Cl 271570a_100011290941_100000049639 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.2 C=Cc1cncc(c1)F 271570a_100011290941_100000744099 [1,0,0,0,0,0|2,0,1]=4 181 B9R1.2 C=Cc1cncc(c1)N 271570a_100011290941_100000687067 [1,0,0,0,0,0|2,0,1]=4 182 B9R1.2 C=Cc1cncc(c1)O 271570a_100011290941_100000754920 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.2 C=Cc1cncc(n1)C 271570a_100011290941_100009842155 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.2 C=Cc1nccc(n1)C 271570a_100011290941_100011243806 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [1,0,0,0,0,0|1,0,1]=3 187 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.2 CCc1ccnc(c1)O 271570a_203496583355_100009817561 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [1,0,0,0,0,0|2,0,1]=4 190 B9R1.2 CNc1cc(ccn1)F 27a_100102657272_100000764206 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.2 CNc1cc(cnn1)C 27a_100102657272_100000070100 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.2 CNc1cc(ncn1)C 27a_100102657272_100000744208 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.2 CNc1cc[nH]c(=O)c1 27a_100102657272_100000061649 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [1,0,0,0,0,0|2,0,0]=3 196 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [1,0,0,0,0,0|1,0,0]=2 197 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [1,0,0,0,0,0|1,0,0]=2 198 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [1,0,0,0,0,0|2,0,0]=3 199 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [1,0,0,0,0,0|2,0,0]=3 200 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [1,0,0,0,0,0|2,0,0]=3 201 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [1,0,0,0,0,0|2,0,0]=3 202 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [1,0,0,0,0,0|2,0,0]=3 203 B9R1.2 CNc1cccc(n1)F 27a_100102657272_100009815982 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [1,0,0,0,0,0|2,0,0]=3 206 B9R1.2 CNc1ccnc(c1)F 27a_100102657272_100009816116 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.2 CNc1ccnc(c1)O 271570a_203496583355_100009869472 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.2 CNc1ccnc(n1)C 27a_100102657272_100000749937 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.2 CNc1cncc(n1)C 27a_100102657272_100000754123 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.2 CNc1nccc(n1)C 27a_100102657272_100000750684 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.2 COc1cc(cnn1)C 34a_100000766097_200000210301 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.2 COc1cc[nH]c(=O)c1 34a_100000032262_200000210301 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.2 COc1ccc[n+](c1)[O-] 34a_100000039713_200000210301 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.2 COc1ccc[n+](c1)[O-] 7a_100000039713_200000210301 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.2 COc1cccc(=O)[nH]1 34a_100000033347_200000210301 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [1,0,0,0,0,0|2,0,0]=3 219 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [1,0,0,0,0,0|2,0,0]=3 220 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [1,0,0,0,0,0|1,0,0]=2 221 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [1,0,0,0,0,0|1,0,0]=2 222 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [1,0,0,0,0,0|2,0,0]=3 223 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [1,0,0,0,0,0|2,0,0]=3 224 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [1,0,0,0,0,0|2,0,0]=3 225 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [1,0,0,0,0,0|2,0,0]=3 227 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [1,0,0,0,0,0|2,0,0]=3 228 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.2 COc1cccc(n1)F 34a_100011432558_200000210301 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.2 COc1cccc(n1)O 271570a_203496583355_100000760917 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [1,0,0,0,0,0|2,0,0]=3 233 B9R1.2 COc1ccnc(c1)Cl 34a_100000762945_200000210301 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.2 COc1ccnc(c1)F 34a_100000732698_200000210301 [1,0,0,0,0,0|3,0,0]=4 235 B9R1.2 COc1ccnc(c1)N 34a_100011834064_200000210301 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.2 COc1ccnc(c1)O 271570a_203496583355_100011216251 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.2 COc1cncc(c1)Br 34a_100000754920_200000210301 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.2 COc1cncc(c1)Br 7a_100000754920_200000210301 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [1,0,0,0,0,0|2,0,0]=3 241 B9R1.2 COc1cncc(c1)Cl 7a_100000032511_200000210301 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.2 COc1cncc(c1)F 34a_100011830296_200000210301 [1,0,0,0,0,0|3,0,0]=4 243 B9R1.2 COc1cncc(c1)F 7a_100011830296_200000210301 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.2 COc1cncc(c1)N 34a_100011997051_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.2 COc1cncc(c1)O 271570a_203496583355_100000684773 [1,0,0,0,0,0|3,0,0]=4 246 B9R1.2 CSc1cc(=O)cc[nH]1 62a_100009817434_200000210301 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [1,0,0,0,0,0|2,0,0]=3 248 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [1,0,0,0,0,0|2,0,0]=3 249 B9R1.2 CSc1cc(ccn1)Cl 62a_100010167805_200000210301 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.2 CSc1cc(ccn1)Cl 62a_200000210301_100010167805 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.2 CSc1cc(ccn1)F 62a_100000764206_200000210301 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.2 CSc1cc(ccn1)F 62a_200000210301_100000764206 [1,0,0,0,0,0|3,0,0]=4 253 B9R1.2 CSc1cc(ccn1)N 62a_100009814236_200000210301 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.2 CSc1cc(ccn1)N 62a_200000210301_100009814236 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.2 CSc1cc(cnn1)C 62a_100000070100_200000210301 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.2 CSc1cc(cnn1)C 62a_200000210301_100000070100 [1,0,0,0,0,0|3,0,0]=4 258 B9R1.2 CSc1cc(ncn1)C 62a_100000744208_200000210301 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.2 CSc1cc(ncn1)C 62a_200000210301_100000744208 [1,0,0,0,0,0|3,0,0]=4 260 B9R1.2 CSc1cc[nH]c(=O)c1 62a_100009816521_200000210301 [1,0,0,0,0,0|3,0,0]=4 261 B9R1.2 CSc1cc[nH]c(=O)c1 62a_200000210301_100009816521 [1,0,0,0,0,0|3,0,0]=4 262 B9R1.2 CSc1ccc[n+](c1)C 62a_100009996589_200000210301 [1,0,0,0,0,0|2,0,0]=3 263 B9R1.2 CSc1ccc[n+](c1)C 62a_200000210301_100009996589 [1,0,0,0,0,0|2,0,0]=3 264 B9R1.2 CSc1ccc[n+](c1)[O-] 62a_200000210301_100009815978 [1,0,0,0,0,0|3,0,0]=4 265 B9R1.2 CSc1cccc(=O)[nH]1 62a_200000210301_100000752884 [1,0,0,0,0,0|3,0,0]=4 266 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [1,0,0,0,0,0|2,0,0]=3 267 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [1,0,0,0,0,0|2,0,0]=3 268 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [1,0,0,0,0,0|1,0,0]=2 269 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [1,0,0,0,0,0|1,0,0]=2 270 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [1,0,0,0,0,0|2,0,0]=3 271 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [1,0,0,0,0,0|2,0,0]=3 272 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [1,0,0,0,0,0|2,0,0]=3 273 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [1,0,0,0,0,0|2,0,0]=3 274 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [1,0,0,0,0,0|2,0,0]=3 275 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [1,0,0,0,0,0|2,0,0]=3 276 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [1,0,0,0,0,0|2,0,0]=3 277 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [1,0,0,0,0,0|2,0,0]=3 278 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [1,0,0,0,0,0|2,0,0]=3 279 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [1,0,0,0,0,0|2,0,0]=3 280 B9R1.2 CSc1cccc(n1)Br 62a_100000684672_200000210301 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.2 CSc1cccc(n1)Br 62a_200000210301_100000684672 [1,0,0,0,0,0|3,0,0]=4 282 B9R1.2 CSc1cccc(n1)C 62a_100000742759_200000210301 [1,0,0,0,0,0|2,0,0]=3 283 B9R1.2 CSc1cccc(n1)C 62a_200000210301_100000742759 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.2 CSc1cccc(n1)Cl 62a_100000051397_200000210301 [1,0,0,0,0,0|3,0,0]=4 285 B9R1.2 CSc1cccc(n1)Cl 62a_200000210301_100000051397 [1,0,0,0,0,0|3,0,0]=4 286 B9R1.2 CSc1cccc(n1)F 62a_100009815982_200000210301 [1,0,0,0,0,0|3,0,0]=4 287 B9R1.2 CSc1cccc(n1)F 62a_200000210301_100009815982 [1,0,0,0,0,0|3,0,0]=4 288 B9R1.2 CSc1cccc(n1)N 62a_100000740741_200000210301 [1,0,0,0,0,0|3,0,0]=4 289 B9R1.2 CSc1cccc(n1)N 62a_200000210301_100000740741 [1,0,0,0,0,0|3,0,0]=4 290 B9R1.2 CSc1cccc(n1)O 271570a_203496583355_100011960944 [1,0,0,0,0,0|3,0,0]=4 291 B9R1.2 CSc1ccnc(c1)Br 62a_100009814637_200000210301 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.2 CSc1ccnc(c1)Br 62a_200000210301_100009814637 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [1,0,0,0,0,0|2,0,0]=3 294 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [1,0,0,0,0,0|2,0,0]=3 295 B9R1.2 CSc1ccnc(c1)Cl 62a_100000035001_200000210301 [1,0,0,0,0,0|3,0,0]=4 296 B9R1.2 CSc1ccnc(c1)Cl 62a_200000210301_100000035001 [1,0,0,0,0,0|3,0,0]=4 297 B9R1.2 CSc1ccnc(c1)F 62a_100009816116_200000210301 [1,0,0,0,0,0|3,0,0]=4 298 B9R1.2 CSc1ccnc(c1)F 62a_200000210301_100009816116 [1,0,0,0,0,0|3,0,0]=4 299 B9R1.2 CSc1ccnc(c1)N 62a_100000049665_200000210301 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.2 CSc1ccnc(c1)N 62a_200000210301_100000049665 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.2 CSc1ccnc(c1)O 271570a_203496583355_100010883326 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.2 CSc1ccnc(n1)C 62a_100000749937_200000210301 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.2 CSc1ccnc(n1)C 62a_200000210301_100000749937 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.2 CSc1cncc(c1)Br 62a_100000728054_200000210301 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.2 CSc1cncc(c1)Br 62a_200000210301_100000728054 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.2 CSc1cncc(c1)C 62a_100000760492_200000210301 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.2 CSc1cncc(c1)C 62a_200000210301_100000760492 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.2 CSc1cncc(c1)Cl 62a_100000049639_200000210301 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.2 CSc1cncc(c1)Cl 62a_200000210301_100000049639 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.2 CSc1cncc(c1)F 62a_100000744099_200000210301 [1,0,0,0,0,0|3,0,0]=4 311 B9R1.2 CSc1cncc(c1)F 62a_200000210301_100000744099 [1,0,0,0,0,0|3,0,0]=4 312 B9R1.2 CSc1cncc(c1)N 62a_100000687067_200000210301 [1,0,0,0,0,0|3,0,0]=4 313 B9R1.2 CSc1cncc(c1)N 62a_200000210301_100000687067 [1,0,0,0,0,0|3,0,0]=4 314 B9R1.2 CSc1cncc(c1)O 271570a_203496583355_100009816972 [1,0,0,0,0,0|3,0,0]=4 315 B9R1.2 CSc1cncc(c1)O 62a_100000754920_200000210301 [1,0,0,0,0,0|3,0,0]=4 316 B9R1.2 CSc1cncc(c1)O 62a_200000210301_100000754920 [1,0,0,0,0,0|3,0,0]=4 317 B9R1.2 CSc1cncc(n1)C 62a_100000754123_200000210301 [1,0,0,0,0,0|3,0,0]=4 318 B9R1.2 CSc1cncc(n1)C 62a_200000210301_100000754123 [1,0,0,0,0,0|3,0,0]=4 319 B9R1.2 CSc1nccc(n1)C 62a_100011243806_200000210301 [1,0,0,0,0,0|3,0,0]=4 320 B9R1.2 CSc1nccc(n1)C 62a_200000210301_100011243806 [1,0,0,0,0,0|3,0,0]=4 321 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_100009996589_200025704644 [1,0,0,0,0,0|2,0,0]=3 322 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_200025704644_100009996589 [1,0,0,0,0,0|2,0,0]=3 323 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [1,0,0,0,0,0|2,0,0]=3 326 B9R1.2 Cc1cc(ncn1)S[13CH3] 62a_100000744208_200025704644 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.2 Cc1cc(ncn1)S[13CH3] 62a_200025704644_100000744208 [1,0,0,0,0,0|3,0,0]=4 328 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [1,0,0,0,0,0|1,0,0]=2 329 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [1,0,0,0,0,0|1,0,0]=2 330 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [1,0,0,0,0,0|1,0,0]=2 331 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [1,0,0,0,0,0|1,0,0]=2 332 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [1,0,0,0,0,0|1,0,0]=2 333 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [1,0,0,0,0,0|1,0,0]=2 334 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_100000742759_200025704644 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_200025704644_100000742759 [1,0,0,0,0,0|2,0,0]=3 336 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [1,0,0,0,0,0|2,0,0]=3 337 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [1,0,0,0,0,0|2,0,0]=3 338 B9R1.2 Cc1ccnc(n1)S[13CH3] 62a_100011243806_200025704644 [1,0,0,0,0,0|3,0,0]=4 339 B9R1.2 Cc1ccnc(n1)S[13CH3] 62a_200025704644_100011243806 [1,0,0,0,0,0|3,0,0]=4 340 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [1,0,0,0,0,0|2,0,0]=3 341 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [1,0,0,0,0,0|2,0,0]=3 342 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_100000760492_200025704644 [1,0,0,0,0,0|2,0,0]=3 343 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_200025704644_100000760492 [1,0,0,0,0,0|2,0,0]=3 344 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_100000754123_200025704644 [1,0,0,0,0,0|3,0,0]=4 345 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_200025704644_100000754123 [1,0,0,0,0,0|3,0,0]=4 346 B9R1.2 Cc1cnnc(c1)O[13CH3] 34a_100000766097_200025704644 [1,0,0,0,0,0|3,0,0]=4 347 B9R1.2 Cc1cnnc(c1)S[13CH3] 62a_100000070100_200025704644 [1,0,0,0,0,0|3,0,0]=4 348 B9R1.2 Cc1cnnc(c1)S[13CH3] 62a_200025704644_100000070100 [1,0,0,0,0,0|3,0,0]=4 349 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_100000749937_200025704644 [1,0,0,0,0,0|3,0,0]=4 350 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_200025704644_100000749937 [1,0,0,0,0,0|3,0,0]=4 351 B9R1.2 N#Cc1cccc(c1)O 271570a_203496583355_100000189340 [1,0,0,0,0,0|2,0,1]=4 352 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [1,0,0,0,0,0|2,0,1]=4 353 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [1,0,0,0,0,0|3,0,0]=4 354 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [1,0,0,0,0,0|2,0,0]=3 355 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [1,0,0,0,0,0|1,0,0]=2 356 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [1,0,0,0,0,0|2,0,0]=3 357 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [1,0,0,0,0,0|2,0,0]=3 358 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [1,0,0,0,0,0|2,0,0]=3 359 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [1,0,0,0,0,0|1,0,2]=4 360 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [1,0,0,0,0,0|2,0,1]=4 361 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [1,0,0,0,0,0|2,0,0]=3 362 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [1,0,0,0,0,0|2,0,0]=3 363 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [1,0,0,0,0,0|2,0,0]=3 364 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [1,0,0,0,0,0|2,0,0]=3 365 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [1,0,0,0,0,0|2,0,0]=3 366 B9R1.2 [13CH3]Oc1cc[nH]c(=O)c1 34a_100000032262_200025704644 [1,0,0,0,0,0|3,0,0]=4 367 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 34a_100000039713_200025704644 [1,0,0,0,0,0|3,0,0]=4 368 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 7a_100000039713_200025704644 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.2 [13CH3]Oc1cccc(=O)[nH]1 34a_100000033347_200025704644 [1,0,0,0,0,0|3,0,0]=4 370 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [1,0,0,0,0,0|2,0,0]=3 371 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [1,0,0,0,0,0|2,0,0]=3 372 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [1,0,0,0,0,0|2,0,0]=3 373 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [1,0,0,0,0,0|2,0,0]=3 374 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [1,0,0,0,0,0|2,0,0]=3 375 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [1,0,0,0,0,0|2,0,0]=3 376 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [1,0,0,0,0,0|2,0,0]=3 377 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [1,0,0,0,0,0|2,0,0]=3 378 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [1,0,0,0,0,0|2,0,0]=3 379 B9R1.2 [13CH3]Oc1cccc(n1)F 34a_100011432558_200025704644 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.2 [13CH3]Oc1ccnc(c1)Cl 34a_100000762945_200025704644 [1,0,0,0,0,0|3,0,0]=4 381 B9R1.2 [13CH3]Oc1ccnc(c1)F 34a_100000732698_200025704644 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.2 [13CH3]Oc1ccnc(c1)N 34a_100011834064_200025704644 [1,0,0,0,0,0|3,0,0]=4 383 B9R1.2 [13CH3]Oc1cncc(c1)Br 34a_100000754920_200025704644 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.2 [13CH3]Oc1cncc(c1)Br 7a_100000754920_200025704644 [1,0,0,0,0,0|3,0,0]=4 385 B9R1.2 [13CH3]Oc1cncc(c1)Cl 7a_100000032511_200025704644 [1,0,0,0,0,0|3,0,0]=4 386 B9R1.2 [13CH3]Oc1cncc(c1)F 34a_100011830296_200025704644 [1,0,0,0,0,0|3,0,0]=4 387 B9R1.2 [13CH3]Oc1cncc(c1)F 7a_100011830296_200025704644 [1,0,0,0,0,0|3,0,0]=4 388 B9R1.2 [13CH3]Oc1cncc(c1)N 34a_100011997051_200025704644 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.2 [13CH3]Sc1cc(=O)cc[nH]1 62a_100009817434_200025704644 [1,0,0,0,0,0|3,0,0]=4 390 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_100010167805_200025704644 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_200025704644_100010167805 [1,0,0,0,0,0|3,0,0]=4 392 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_100000764206_200025704644 [1,0,0,0,0,0|3,0,0]=4 393 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_200025704644_100000764206 [1,0,0,0,0,0|3,0,0]=4 394 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_100009814236_200025704644 [1,0,0,0,0,0|3,0,0]=4 395 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_200025704644_100009814236 [1,0,0,0,0,0|3,0,0]=4 396 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.2 [13CH3]Sc1cc[nH]c(=O)c1 62a_100009816521_200025704644 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.2 [13CH3]Sc1cc[nH]c(=O)c1 62a_200025704644_100009816521 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.2 [13CH3]Sc1ccc[n+](c1)[O-] 62a_200025704644_100009815978 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.2 [13CH3]Sc1cccc(=O)[nH]1 62a_200025704644_100000752884 [1,0,0,0,0,0|3,0,0]=4 401 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [1,0,0,0,0,0|2,0,0]=3 402 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [1,0,0,0,0,0|2,0,0]=3 403 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [1,0,0,0,0,0|2,0,0]=3 404 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [1,0,0,0,0,0|2,0,0]=3 405 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [1,0,0,0,0,0|2,0,0]=3 407 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [1,0,0,0,0,0|2,0,0]=3 409 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [1,0,0,0,0,0|2,0,0]=3 410 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [1,0,0,0,0,0|2,0,0]=3 411 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [1,0,0,0,0,0|2,0,0]=3 412 B9R1.2 [13CH3]Sc1cccc(n1)Br 62a_100000684672_200025704644 [1,0,0,0,0,0|3,0,0]=4 413 B9R1.2 [13CH3]Sc1cccc(n1)Br 62a_200025704644_100000684672 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.2 [13CH3]Sc1cccc(n1)Cl 62a_100000051397_200025704644 [1,0,0,0,0,0|3,0,0]=4 415 B9R1.2 [13CH3]Sc1cccc(n1)Cl 62a_200025704644_100000051397 [1,0,0,0,0,0|3,0,0]=4 416 B9R1.2 [13CH3]Sc1cccc(n1)F 62a_100009815982_200025704644 [1,0,0,0,0,0|3,0,0]=4 417 B9R1.2 [13CH3]Sc1cccc(n1)F 62a_200025704644_100009815982 [1,0,0,0,0,0|3,0,0]=4 418 B9R1.2 [13CH3]Sc1cccc(n1)N 62a_100000740741_200025704644 [1,0,0,0,0,0|3,0,0]=4 419 B9R1.2 [13CH3]Sc1cccc(n1)N 62a_200025704644_100000740741 [1,0,0,0,0,0|3,0,0]=4 420 B9R1.2 [13CH3]Sc1ccnc(c1)Br 62a_100009814637_200025704644 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.2 [13CH3]Sc1ccnc(c1)Br 62a_200025704644_100009814637 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.2 [13CH3]Sc1ccnc(c1)Cl 62a_100000035001_200025704644 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.2 [13CH3]Sc1ccnc(c1)Cl 62a_200025704644_100000035001 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.2 [13CH3]Sc1ccnc(c1)F 62a_100009816116_200025704644 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.2 [13CH3]Sc1ccnc(c1)F 62a_200025704644_100009816116 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.2 [13CH3]Sc1ccnc(c1)N 62a_100000049665_200025704644 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.2 [13CH3]Sc1ccnc(c1)N 62a_200025704644_100000049665 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.2 [13CH3]Sc1cncc(c1)Br 62a_100000728054_200025704644 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.2 [13CH3]Sc1cncc(c1)Br 62a_200025704644_100000728054 [1,0,0,0,0,0|3,0,0]=4 430 B9R1.2 [13CH3]Sc1cncc(c1)Cl 62a_100000049639_200025704644 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.2 [13CH3]Sc1cncc(c1)Cl 62a_200025704644_100000049639 [1,0,0,0,0,0|3,0,0]=4 432 B9R1.2 [13CH3]Sc1cncc(c1)F 62a_100000744099_200025704644 [1,0,0,0,0,0|3,0,0]=4 433 B9R1.2 [13CH3]Sc1cncc(c1)F 62a_200025704644_100000744099 [1,0,0,0,0,0|3,0,0]=4 434 B9R1.2 [13CH3]Sc1cncc(c1)N 62a_100000687067_200025704644 [1,0,0,0,0,0|3,0,0]=4 435 B9R1.2 [13CH3]Sc1cncc(c1)N 62a_200025704644_100000687067 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_100000754920_200025704644 [1,0,0,0,0,0|3,0,0]=4 437 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_200025704644_100000754920 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,0,0|1,0,0]=2 439 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,0,0,0,0|2,0,0]=3 440 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,0,0,0,0|2,0,0]=3 441 B9R1.6 C=C(C)c1cccnn1 271570a_100000694244_100016991348 [1,0,0,0,0,0|3,0,0]=4 442 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.6 C=C(C)c1ccncn1 271570a_100000694244_100000703185 [1,0,0,0,0,0|3,0,0]=4 444 B9R1.6 C=C(C)c1ccnnc1 271570a_100000694244_100000732662 [1,0,0,0,0,0|3,0,0]=4 445 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [1,0,0,0,0,0|3,0,0]=4 446 B9R1.6 C=C(C)c1cncnc1 271570a_100000694244_100011206942 [1,0,0,0,0,0|3,0,0]=4 447 B9R1.6 C=C(C)c1ncccn1 271570a_100000694244_100000211032 [1,0,0,0,0,0|3,0,0]=4 448 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,0,0|0,0,0]=1 449 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 450 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 451 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 452 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 453 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 454 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 455 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,0,0|0,0,0]=1 456 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)Br 271570a_100000694244_100010125443 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)F 271570a_100000694244_100000723523 [0,1,0,0,0,0|3,0,0]=4 458 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)O 271570a_100000694244_100009814561 [0,1,0,0,0,0|3,0,0]=4 459 B11R1.21 C=C(C)c1c[nH]c(=O)c(n1)C 271570a_100000694244_100010363809 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.21 C=C(C)c1cc(c(=O)[nH]n1)C 271570a_100000694244_100012187101 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.21 C=C(C)c1cc(c(cn1)Br)C 271570a_100000694244_100012356354 [0,1,0,0,0,0|2,0,0]=3 462 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [0,1,0,0,0,0|2,0,0]=3 463 B11R1.21 C=C(C)c1cc(c(cn1)C)F 271570a_100000694244_100009841206 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.21 C=C(C)c1cc(c(cn1)C)N 271570a_100000694244_100000690170 [0,1,0,0,0,0|3,0,0]=4 465 B11R1.21 C=C(C)c1cc(c(cn1)C)O 271570a_100000694244_100000704368 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.21 C=C(C)c1cc(c(cn1)F)C 271570a_100000694244_100009818257 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.21 C=C(C)c1cc(c(cn1)F)N 271570a_100000694244_100000126464 [0,1,0,0,0,0|3,0,0]=4 468 B11R1.21 C=C(C)c1cc(c(cn1)F)O 271570a_100000694244_100009854642 [0,1,0,0,0,0|3,0,0]=4 469 B11R1.21 C=C(C)c1cc(c(cn1)N)C 271570a_100000694244_100000765520 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.21 C=C(C)c1cc(c(cn1)N)N 271570a_100000694244_100000067514 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.21 C=C(C)c1cc(c(cn1)O)N 271570a_100000694244_100009819941 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.21 C=C(C)c1cc(c(nn1)N)C 271570a_100000694244_100153394926 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.21 C=C(C)c1ccc(=O)n(c1)C 271570a_100000694244_100011245003 [0,1,0,0,0,0|2,0,0]=3 475 B11R1.21 C=C(C)c1ccc(=O)n(n1)C 271570a_100000694244_100009820752 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.21 C=C(C)c1ccc([n+](c1)[O-])C 271570a_100000694244_100000703231 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.21 C=C(C)c1ccc(c(=S)[nH]1)N 271570a_100000694244_100116329207 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [0,1,0,0,0,0|2,0,0]=3 479 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,1,0,0,0,0|2,0,0]=3 480 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [0,1,0,0,0,0|2,0,0]=3 483 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [0,1,0,0,0,0|1,0,0]=2 485 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,1,0,0,0,0|1,0,0]=2 486 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [0,1,0,0,0,0|1,0,0]=2 487 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [0,1,0,0,0,0|1,0,0]=2 488 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [0,1,0,0,0,0|1,0,0]=2 489 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [0,1,0,0,0,0|1,0,0]=2 490 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [0,1,0,0,0,0|2,0,0]=3 495 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [0,1,0,0,0,0|2,0,0]=3 497 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,1,0,0,0,0|2,0,0]=3 498 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [0,1,0,0,0,0|2,0,0]=3 500 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [0,1,0,0,0,0|2,0,0]=3 501 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [0,1,0,0,0,0|2,0,0]=3 503 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,1,0,0,0,0|2,0,0]=3 504 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [0,1,0,0,0,0|2,0,0]=3 505 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [0,1,0,0,0,0|2,0,0]=3 513 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.21 C=C(C)c1ccc(c(n1)Br)O 271570a_100000694244_100000725334 [0,1,0,0,0,0|3,0,0]=4 515 B11R1.21 C=C(C)c1ccc(c(n1)C)Br 271570a_100000694244_100012360386 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.21 C=C(C)c1ccc(c(n1)C)F 271570a_100000694244_100009814307 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.21 C=C(C)c1ccc(c(n1)C)N 271570a_100000694244_100000760127 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.21 C=C(C)c1ccc(c(n1)Cl)N 271570a_100000694244_200010233646 [0,1,0,0,0,0|3,0,0]=4 521 B11R1.21 C=C(C)c1ccc(c(n1)Cl)O 271570a_100000694244_100000721234 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.21 C=C(C)c1ccc(c(n1)F)Br 271570a_100000694244_100010134343 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.21 C=C(C)c1ccc(c(n1)F)N 271570a_100000694244_100009856439 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.21 C=C(C)c1ccc(c(n1)F)O 271570a_100000694244_100009819667 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.21 C=C(C)c1ccc(c(n1)N)C 271570a_100000694244_100009857032 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.21 C=C(C)c1ccc(c(n1)N)F 271570a_100000694244_100016091773 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.21 C=C(C)c1ccc(c(n1)N)N 271570a_100000694244_100000747239 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.21 C=C(C)c1ccc(c(n1)N)O 271570a_100000694244_100000685527 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.21 C=C(C)c1ccc(c(n1)O)F 271570a_100000694244_100010729010 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.21 C=C(C)c1ccc(c(n1)O)N 271570a_100000694244_100000718904 [0,1,0,0,0,0|3,0,0]=4 531 B11R1.21 C=C(C)c1ccn(c(=O)c1)C 271570a_100000694244_100009820031 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.21 C=C(C)c1cn(c(=O)cn1)C 271570a_100000694244_100009843036 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.21 C=C(C)c1cnc(=O)n(c1)C 271570a_100000694244_100009819886 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.21 C=C(C)c1cnc(c(c1)Br)Cl 271570a_100000694244_100010172733 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.21 C=C(C)c1cnc(c(c1)Br)N 271570a_100000694244_100012353989 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.21 C=C(C)c1cnc(c(c1)C)Br 271570a_100000694244_100009816107 [0,1,0,0,0,0|2,0,0]=3 537 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [0,1,0,0,0,0|2,0,0]=3 538 B11R1.21 C=C(C)c1cnc(c(c1)C)Cl 271570a_100000694244_100009922867 [0,1,0,0,0,0|2,0,0]=3 539 B11R1.21 C=C(C)c1cnc(c(c1)C)F 271570a_100000694244_100000709442 [0,1,0,0,0,0|2,0,0]=3 540 B11R1.21 C=C(C)c1cnc(c(c1)C)N 271570a_100000694244_100000186686 [0,1,0,0,0,0|2,0,0]=3 541 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [0,1,0,0,0,0|2,0,0]=3 542 B11R1.21 C=C(C)c1cnc(c(c1)Cl)N 271570a_100000694244_100012356299 [0,1,0,0,0,0|3,0,0]=4 543 B11R1.21 C=C(C)c1cnc(c(c1)Cl)O 271570a_100000694244_100010238531 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.21 C=C(C)c1cnc(c(c1)F)C 271570a_100000694244_100009845756 [0,1,0,0,0,0|3,0,0]=4 545 B11R1.21 C=C(C)c1cnc(c(c1)F)F 271570a_100000694244_100009817721 [0,1,0,0,0,0|3,0,0]=4 546 B11R1.21 C=C(C)c1cnc(c(c1)F)N 271570a_100000694244_100000693161 [0,1,0,0,0,0|3,0,0]=4 547 B11R1.21 C=C(C)c1cnc(c(c1)N)C 271570a_100000694244_100011999542 [0,1,0,0,0,0|3,0,0]=4 548 B11R1.21 C=C(C)c1cnc(c(c1)N)Cl 271570a_100000694244_100009828400 [0,1,0,0,0,0|3,0,0]=4 549 B11R1.21 C=C(C)c1cnc(c(c1)N)F 271570a_100000694244_100009816798 [0,1,0,0,0,0|3,0,0]=4 550 B11R1.21 C=C(C)c1cnc(c(c1)N)N 271570a_100000694244_100000184470 [0,1,0,0,0,0|3,0,0]=4 551 B11R1.21 C=C(C)c1cnc(c(c1)N)O 271570a_100000694244_100000743729 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.21 C=C(C)c1cnc(c(c1)O)C 271570a_100000694244_100009864810 [0,1,0,0,0,0|3,0,0]=4 553 B11R1.21 C=C(C)c1cnc(c(c1)O)F 271570a_100000694244_100009819871 [0,1,0,0,0,0|3,0,0]=4 554 B11R1.21 C=C(C)c1cnc(c(c1)O)N 271570a_100000694244_100009819042 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.21 C=C(C)c1cnc(c(n1)C)C 271570a_100000694244_100009878948 [0,1,0,0,0,0|3,0,0]=4 556 B11R1.21 C=C(C)c1cnc(c(n1)C)N 271570a_100000694244_100009818571 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.21 C=C(C)c1ncc(c(n1)C)Cl 271570a_100000694244_100010174973 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.21 C=C(C)c1ncc(c(n1)C)F 271570a_100000694244_100015641512 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.21 C=C(C)c1ncc(c(n1)C)N 271570a_100000694244_100000123670 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [0,1,0,0,0,0|1,0,0]=2 561 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,1,0,0,0,0|1,0,0]=2 562 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,1,0,0,0,0|1,0,0]=2 563 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,1,0,0,0,0|1,0,0]=2 564 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,1,0,0,0,0|1,0,0]=2 565 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,1,0,0,0,0|1,0,0]=2 566 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,1,0,0,0,0|1,0,0]=2 567 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,1,0,0,0,0|1,0,0]=2 568 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,1,0,0,0,0|0,0,0]=1 569 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,1,0,0,0,0|0,0,0]=1 570 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,1,0,0,0,0|0,0,0]=1 571 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,1,0,0,0,0|0,0,0]=1 572 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,1,0,0,0,0|0,0,0]=1 573 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,1,0,0,0,0|0,0,0]=1 574 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,1,0,0,0,0|0,0,0]=1 575 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,1,0,0,0,0|1,0,0]=2 576 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,1,0,0,0,0|1,0,0]=2 577 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,1,0,0,0,0|1,0,0]=2 578 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,1,0,0,0,0|1,0,0]=2 579 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,1,0,0,0,0|1,0,0]=2 580 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,1,0,0,0,0|1,0,0]=2 581 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,1,0,0,0,0|1,0,0]=2 582 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,1,0,0,0,0|1,0,0]=2 583 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,1,0,0,0,0|1,0,0]=2 584 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,1,0,0,0,0|1,0,0]=2 585 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,1,0,0,0,0|1,0,0]=2 586 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,1,0,0,0,0|1,0,0]=2 587 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,1,0,0,0,0|1,0,0]=2 588 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,1,0,0,0,0|1,0,0]=2 589 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,1,0,0,0,0|1,0,0]=2 590 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,1,0,0,0,0|1,0,0]=2 591 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,1,0,0,0,0|1,0,0]=2 592 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,1,0,0,0,0|1,0,0]=2 593 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,1,0,0,0,0|1,0,0]=2 594 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,1,0,0,0,0|1,0,0]=2 595 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,1,0,0,0,0|1,0,0]=2 596 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,1,0,0,0,0|1,0,0]=2 597 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,1,0,0,0,0|1,0,0]=2 598 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,1,0,0,0,0|1,0,0]=2 599 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,1,0,0,0,0|1,0,0]=2 600 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,1,0,0,0,0|1,0,0]=2 601 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,1,0,0,0,0|1,0,0]=2 602 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,1,0,0,0,0|1,0,0]=2 603 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,1,0,0,0,0|1,0,0]=2 604 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,1,0,0,0,0|1,0,0]=2 605 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,1,0,0,0,0|1,0,0]=2 606 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [0,1,0,0,0,0|1,0,0]=2 607 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [0,1,0,0,0,0|2,0,1]=4 609 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [0,1,0,0,0,0|2,0,1]=4 610 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [0,1,0,0,0,0|1,0,2]=4 611 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 34a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 2230a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 269982a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 34a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 38a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 618 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 7a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.21 CN(C)c1ccc(c(c1)F)Br 2230a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.21 CN(C)c1ccc(c(c1)F)Br 269982a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.21 CN(C)c1ccc(c(c1)F)Br 34a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.21 CN(C)c1ccc(c(c1)F)Br 7a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.21 CN(C)c1ccc(c(c1)F)F 2230a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.21 CN(C)c1ccc(c(c1)F)F 269982a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.21 CN(C)c1ccc(c(c1)F)F 34a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.21 CN(C)c1ccc(c(c1)F)F 38a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 627 B11R1.21 CN(C)c1ccc(c(c1)F)F 7a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.21 CN(C)c1ccc(c(c1)O)N 271570a_203496583355_200013039233 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 269982a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 631 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 34a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 2230a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 269982a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 34a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 38a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 7a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 2230a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 638 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 269982a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 34a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 640 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 7a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 641 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 2230a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 269982a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 643 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 34a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 644 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 38a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 7a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [0,1,0,0,0,0|2,0,1]=4 647 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [0,1,0,0,0,0|2,0,1]=4 648 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,1,0,0,0,0|0,0,0]=1 649 B11R1.21 Cc1cc(ccc1Br)N(C)C 2230a_100102888905_200000210301 [0,1,0,0,0,0|2,0,0]=3 650 B11R1.21 Cc1cc(ccc1Br)N(C)C 269982a_100102888905_200000210301 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.21 Cc1cc(ccc1Br)N(C)C 34a_100102888905_200000210301 [0,1,0,0,0,0|2,0,0]=3 652 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 2230a_100102888905_200025704644 [0,1,0,0,0,0|2,0,0]=3 653 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 269982a_100102888905_200025704644 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 34a_100102888905_200025704644 [0,1,0,0,0,0|2,0,0]=3 655 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,1,0,0,0,0|0,0,0]=1 656 B11R1.21 Cc1cc(ccc1Cl)N(C)C 2230a_114849113799_200000210301 [0,1,0,0,0,0|2,0,0]=3 657 B11R1.21 Cc1cc(ccc1Cl)N(C)C 269982a_114849113799_200000210301 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.21 Cc1cc(ccc1Cl)N(C)C 34a_114849113799_200000210301 [0,1,0,0,0,0|2,0,0]=3 659 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 2230a_114849113799_200025704644 [0,1,0,0,0,0|2,0,0]=3 660 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 269982a_114849113799_200025704644 [0,1,0,0,0,0|2,0,0]=3 661 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 34a_114849113799_200025704644 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,1,0,0,0,0|0,0,0]=1 663 B11R1.21 Cc1cc(ccc1F)N(C)C 2230a_100011756966_200000210301 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.21 Cc1cc(ccc1F)N(C)C 269982a_100011756966_200000210301 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.21 Cc1cc(ccc1F)N(C)C 34a_100011756966_200000210301 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.21 Cc1cc(ccc1F)N(C)C 38a_100011756966_200000210301 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.21 Cc1cc(ccc1F)N(C)C 7a_100011756966_200000210301 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 2230a_100011756966_200025704644 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 269982a_100011756966_200025704644 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 34a_100011756966_200025704644 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 38a_100011756966_200025704644 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 7a_100011756966_200025704644 [0,1,0,0,0,0|2,0,0]=3 673 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,1,0,0,0,0|0,0,0]=1 674 B11R1.21 Cc1cc(ccc1O)B(O)O 271570a_203496583355_100010089846 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [0,1,0,0,0,0|1,0,0]=2 676 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,1,0,0,0,0|0,0,0]=1 677 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.21 Cc1cc(ncc1O)C(C)C 271570a_203496583355_100021475462 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,1,0,0,0,0|1,0,0]=2 680 B11R1.21 Cc1ccc(cc1Br)N(C)C 2230a_100000707694_200000210301 [0,1,0,0,0,0|3,0,0]=4 681 B11R1.21 Cc1ccc(cc1Br)N(C)C 269982a_100000707694_200000210301 [0,1,0,0,0,0|3,0,0]=4 682 B11R1.21 Cc1ccc(cc1Br)N(C)C 34a_100000707694_200000210301 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.21 Cc1ccc(cc1Br)N(C)C 38a_100000707694_200000210301 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 2230a_100000707694_200025704644 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 269982a_100000707694_200025704644 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 34a_100000707694_200025704644 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 38a_100000707694_200025704644 [0,1,0,0,0,0|3,0,0]=4 688 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,1,0,0,0,0|0,0,0]=1 689 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,1,0,0,0,0|1,0,0]=2 690 B11R1.21 Cc1ccc(cc1Cl)N(C)C 2230a_100000220120_200000210301 [0,1,0,0,0,0|3,0,0]=4 691 B11R1.21 Cc1ccc(cc1Cl)N(C)C 269982a_100000220120_200000210301 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.21 Cc1ccc(cc1Cl)N(C)C 34a_100000220120_200000210301 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.21 Cc1ccc(cc1Cl)N(C)C 38a_100000220120_200000210301 [0,1,0,0,0,0|3,0,0]=4 694 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 2230a_100000220120_200025704644 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 269982a_100000220120_200025704644 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 34a_100000220120_200025704644 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 38a_100000220120_200025704644 [0,1,0,0,0,0|3,0,0]=4 698 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,1,0,0,0,0|1,0,0]=2 699 B11R1.21 Cc1ccc(cc1F)N(C)C 2230a_100160572069_200000210301 [0,1,0,0,0,0|3,0,0]=4 700 B11R1.21 Cc1ccc(cc1F)N(C)C 269982a_100160572069_200000210301 [0,1,0,0,0,0|3,0,0]=4 701 B11R1.21 Cc1ccc(cc1F)N(C)C 34a_100160572069_200000210301 [0,1,0,0,0,0|3,0,0]=4 702 B11R1.21 Cc1ccc(cc1F)N(C)C 38a_100160572069_200000210301 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.21 Cc1ccc(cc1F)N(C)C 7a_100160572069_200000210301 [0,1,0,0,0,0|3,0,0]=4 704 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 2230a_100160572069_200025704644 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 269982a_100160572069_200025704644 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 34a_100160572069_200025704644 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 38a_100160572069_200025704644 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 7a_100160572069_200025704644 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,1,0,0,0,0|1,0,0]=2 710 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [0,1,0,0,0,0|2,0,0]=3 711 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,1,0,0,0,0|1,0,0]=2 712 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [0,1,0,0,0,0|2,0,0]=3 713 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [0,1,0,0,0,0|2,0,0]=3 714 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [0,1,0,0,0,0|2,0,0]=3 716 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,1,0,0,0,0|1,0,0]=2 717 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,1,0,0,0,0|1,0,0]=2 718 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,1,0,0,0,0|1,0,0]=2 719 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,1,0,0,0,0|1,0,0]=2 720 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,1,0,0,0,0|1,0,0]=2 721 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,1,0,0,0,0|1,0,0]=2 722 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,1,0,0,0,0|1,0,0]=2 723 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,1,0,0,0,0|1,0,0]=2 724 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,1,0,0,0,0|1,0,0]=2 725 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,1,0,0,0,0|1,0,0]=2 726 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,1,0,0,0,0|1,0,0]=2 727 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,1,0,0,0,0|1,0,0]=2 728 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,1,0,0,0,0|1,0,0]=2 729 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,1,0,0,0,0|1,0,0]=2 730 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,1,0,0,0,0|1,0,0]=2 731 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,1,0,0,0,0|1,0,0]=2 732 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,1,0,0,0,0|1,0,0]=2 733 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,1,0,0,0,0|1,0,0]=2 734 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,1,0,0,0,0|1,0,0]=2 735 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,1,0,0,0,0|1,0,0]=2 736 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,1,0,0,0,0|1,0,0]=2 737 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,1,0,0,0,0|1,0,0]=2 738 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,1,0,0,0,0|1,0,0]=2 739 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,1,0,0,0,0|1,0,0]=2 740 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,1,0,0,0,0|1,0,0]=2 741 B11R1.23 CC(N[13CH3])c1cccc(c1)Br 2230a_100020642005_200025704644 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 2230a_100102723534_200025704644 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 34a_100102723534_200025704644 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [0,1,0,0,0,0|1,0,2]=4 746 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [0,1,0,0,0,0|1,0,2]=4 747 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [0,1,0,0,0,0|1,0,2]=4 748 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [0,1,0,0,0,0|1,0,2]=4 749 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [0,1,0,0,0,0|1,0,2]=4 750 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [0,1,0,0,0,0|1,0,2]=4 751 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [0,1,0,0,0,0|1,0,2]=4 752 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [0,1,0,0,0,0|1,0,2]=4 753 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [0,1,0,0,0,0|1,0,0]=2 755 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,1,0,0,0,0|0,0,0]=1 756 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [0,1,0,0,0,0|1,0,0]=2 757 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [0,1,0,0,0,0|1,0,0]=2 758 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [0,1,0,0,0,0|1,0,0]=2 759 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [0,1,0,0,0,0|1,0,0]=2 760 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [0,1,0,0,0,0|1,0,0]=2 761 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [0,1,0,0,0,0|2,0,0]=3 762 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [0,1,0,0,0,0|1,0,2]=4 763 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000219648_100000210202 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.23 CCN(C)c1cccc(c1)Br 2230a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 765 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000219648_100000204670 [0,1,0,0,0,0|3,0,0]=4 766 B11R1.23 CCN(C)c1cccc(c1)Br 269982a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 767 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000219648_100000210202 [0,1,0,0,0,0|3,0,0]=4 768 B11R1.23 CCN(C)c1cccc(c1)Br 34a_100000738899_200000210301 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [0,1,0,0,0,0|2,0,0]=3 771 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [0,1,0,0,0,0|2,0,0]=3 772 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [0,1,0,0,0,0|2,0,0]=3 773 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [0,1,0,0,0,0|2,0,0]=3 774 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [0,1,0,0,0,0|2,0,0]=3 775 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [0,1,0,0,0,0|2,0,0]=3 776 B11R1.23 CCN(C)c1cccc(c1)Cl 2230a_100000220044_100000210202 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.23 CCN(C)c1cccc(c1)Cl 269982a_100000220044_100000204670 [0,1,0,0,0,0|3,0,0]=4 778 B11R1.23 CCN(C)c1cccc(c1)Cl 34a_100000220044_100000210202 [0,1,0,0,0,0|3,0,0]=4 779 B11R1.23 CCN(C)c1cccc(c1)F 2230a_100020633736_100000210202 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.23 CCN(C)c1cccc(c1)F 269982a_100020633736_100000204670 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.23 CCN(C)c1cccc(c1)F 34a_100020633736_100000210202 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.23 CCN(C)c1cccc(c1)I 2230a_100000221217_100000210202 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.23 CCN(C)c1cccc(c1)I 269982a_100000221217_100000204670 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.23 CCN(C)c1cccc(c1)I 34a_100000221217_100000210202 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [0,1,0,0,0,0|3,0,0]=4 789 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.23 CCN([13CH3])c1cccc(c1)Br 2230a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.23 CCN([13CH3])c1cccc(c1)Br 269982a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.23 CCN([13CH3])c1cccc(c1)Br 34a_100000738899_200025704644 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [0,1,0,0,0,0|2,0,0]=3 795 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [0,1,0,0,0,0|2,0,0]=3 796 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [0,1,0,0,0,0|2,0,0]=3 797 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [0,1,0,0,0,0|2,0,0]=3 798 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.23 CN(CF)c1cccc(c1)Br 269982a_100000219648_100015361967 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.23 CN(CF)c1cccc(c1)Br 34a_100000219648_100015361967 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.23 CN(CF)c1cccc(c1)Cl 269982a_100000220044_100015361967 [0,1,0,0,0,0|3,0,0]=4 805 B11R1.23 CN(CF)c1cccc(c1)Cl 34a_100000220044_100015361967 [0,1,0,0,0,0|3,0,0]=4 806 B11R1.23 CN(CF)c1cccc(c1)F 269982a_100020633736_100015361967 [0,1,0,0,0,0|3,0,0]=4 807 B11R1.23 CN(CF)c1cccc(c1)F 34a_100020633736_100015361967 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.23 CN(CF)c1cccc(c1)I 269982a_100000221217_100015361967 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.23 CN(CF)c1cccc(c1)I 34a_100000221217_100015361967 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.23 CN(CF)c1cccc(c1)O 269982a_100000756613_100015361967 [0,1,0,0,0,0|3,0,0]=4 811 B11R1.23 CN(CF)c1cccc(c1)O 34a_100000756613_100015361967 [0,1,0,0,0,0|3,0,0]=4 812 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [0,1,0,0,0,0|2,0,0]=3 813 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [0,1,0,0,0,0|1,0,0]=2 814 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [0,1,0,0,0,0|1,0,0]=2 815 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [0,1,0,0,0,0|1,0,0]=2 816 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [0,1,0,0,0,0|1,0,0]=2 817 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [0,1,0,0,0,0|0,0,0]=1 818 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 819 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 820 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [0,1,0,0,0,0|0,0,0]=1 821 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [0,1,0,0,0,0|1,0,0]=2 822 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [0,1,0,0,0,0|1,0,0]=2 823 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [0,1,0,0,0,0|1,0,0]=2 824 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [0,1,0,0,0,0|1,0,0]=2 825 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [0,1,0,0,0,0|1,0,0]=2 826 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [0,1,0,0,0,0|1,0,0]=2 827 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [0,1,0,0,0,0|1,0,0]=2 828 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [0,1,0,0,0,0|1,0,0]=2 829 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [0,1,0,0,0,0|1,0,0]=2 830 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [0,1,0,0,0,0|1,0,0]=2 831 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [0,1,0,0,0,0|1,0,0]=2 832 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [0,1,0,0,0,0|1,0,0]=2 833 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [0,1,0,0,0,0|1,0,0]=2 834 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [0,1,0,0,0,0|1,0,0]=2 835 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [0,1,0,0,0,0|1,0,0]=2 836 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [0,1,0,0,0,0|2,0,0]=3 837 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [0,1,0,0,0,0|2,0,0]=3 838 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [0,1,0,0,0,0|2,0,0]=3 839 B11R1.23 CNC(C)c1cc(ccn1)C 2230a_100011933787_200000210301 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.23 CNC(C)c1cc(ccn1)C 269862a_106832991636_100000728896 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.23 CNC(C)c1cc(ccn1)C 270004a_106832991635_100000728896 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.23 CNC(C)c1cccc(c1)Br 2230a_100020642005_200000210301 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.23 CNC(C)c1cccc(c1)Br 269862a_106832991636_100000210093 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [0,1,0,0,0,0|1,0,1]=3 845 B11R1.23 CNC(C)c1cccc(c1)Cl 2230a_100102723534_200000210301 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.23 CNC(C)c1cccc(c1)Cl 269862a_106832991636_200000210964 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.23 CNC(C)c1cccc(c1)Cl 34a_100102723534_200000210301 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.23 CNC(C)c1cccc(c1)F 269862a_106832991636_100000187083 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.23 CNC(C)c1cccc(c1)I 269862a_106832991636_100011356966 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.23 CNC(C)c1cccc(n1)C 2230a_100011877385_200000210301 [0,1,0,0,0,0|2,0,1]=4 854 B11R1.23 CNC(C)c1cccc(n1)C 269862a_106832991636_100011877301 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.23 CNC(C)c1ccnc(c1)C 269862a_106832991636_100011998260 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.23 CNC(C)c1cncc(c1)C 269862a_106832991636_100000702010 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [0,1,0,0,0,0|1,0,1]=3 858 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [0,1,0,0,0,0|1,0,1]=3 859 B11R1.23 CN[C@H](C)c1cccc(c1)F 2230a_100015193778_200000210301 [0,1,0,0,0,0|2,0,1]=4 860 B11R1.23 CN[C@H](C)c1cccc(c1)F 34a_100015193778_200000210301 [0,1,0,0,0,0|2,0,1]=4 861 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.23 COC(=O)c1cc(ncn1)O 271570a_203496583355_100000051410 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [0,1,0,0,0,0|1,0,0]=2 864 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [0,1,0,0,0,0|2,0,0]=3 865 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [0,1,0,0,0,0|2,0,0]=3 866 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [0,1,0,0,0,0|3,0,0]=4 869 B11R1.23 COC(=O)c1cnnc(c1)O 271570a_203496583355_100009862058 [0,1,0,0,0,0|3,0,0]=4 870 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [0,1,0,0,0,0|1,0,2]=4 871 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [0,1,0,0,0,0|1,0,2]=4 872 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [0,1,0,0,0,0|0,0,2]=3 873 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [0,1,0,0,0,0|0,0,2]=3 874 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [0,1,0,0,0,0|1,0,2]=4 875 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [0,1,0,0,0,0|1,0,2]=4 876 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [0,1,0,0,0,0|1,0,2]=4 877 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [0,1,0,0,0,0|1,0,2]=4 878 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [0,1,0,0,0,0|1,0,2]=4 879 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [0,1,0,0,0,0|1,0,2]=4 880 B11R1.23 COC(C)c1cccc(n1)C 34a_200011877368_200000210301 [0,1,0,0,0,0|1,0,2]=4 881 B11R1.23 COC(C)c1cccc(n1)C 7a_200011877368_200000210301 [0,1,0,0,0,0|1,0,2]=4 882 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [0,1,0,0,0,0|1,0,2]=4 883 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [0,1,0,0,0,0|1,0,2]=4 884 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 2230a_100015193778_200025704644 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 34a_100015193778_200025704644 [0,1,0,0,0,0|2,0,1]=4 886 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [0,1,0,0,0,0|1,0,2]=4 887 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [0,1,0,0,0,0|1,0,2]=4 888 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [0,1,0,0,0,0|0,0,0]=1 889 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [0,1,0,0,0,0|0,0,2]=3 890 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [0,1,0,0,0,0|0,0,2]=3 891 B11R1.23 Cc1cccc(c1)N(C)CF 269982a_100000219674_100015361967 [0,1,0,0,0,0|2,0,0]=3 892 B11R1.23 Cc1cccc(c1)N(C)CF 34a_100000219674_100015361967 [0,1,0,0,0,0|2,0,0]=3 893 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [0,1,0,0,0,0|1,0,1]=3 894 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [0,1,0,0,0,0|1,0,1]=3 895 B11R1.23 Cc1cccc(n1)C(C)N[13CH3] 2230a_100011877385_200025704644 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.23 Cc1cccc(n1)C(C)O[13CH3] 34a_200011877368_200025704644 [0,1,0,0,0,0|1,0,2]=4 897 B11R1.23 Cc1cccc(n1)C(C)O[13CH3] 7a_200011877368_200025704644 [0,1,0,0,0,0|1,0,2]=4 898 B11R1.23 Cc1ccnc(c1)C(C)N[13CH3] 2230a_100011933787_200025704644 [0,1,0,0,0,0|2,0,1]=4 899 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [0,1,0,0,0,0|1,0,1]=3 900 B11R1.23 NC(CO)c1cccc(c1)O 271570a_203496583355_100000690078 [0,1,0,0,0,0|2,0,1]=4 901 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [0,1,0,0,0,0|1,0,0]=2 902 B11R1.23 NNC(=O)c1cc(ccn1)O 271570a_203496583355_100000017052 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [0,1,0,0,0,0|2,0,0]=3 904 B11R1.23 NNC(=O)c1cccc(n1)O 271570a_203496583355_100011631096 [0,1,0,0,0,0|3,0,0]=4 905 B11R1.23 NNC(=O)c1ccnc(c1)O 271570a_203496583355_100000021280 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.23 NNC(=O)c1cncc(c1)O 271570a_203496583355_100000189809 [0,1,0,0,0,0|3,0,0]=4 907 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [0,1,0,0,0,0|1,0,0]=2 908 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [0,1,0,0,0,0|1,0,0]=2 909 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [0,1,0,0,0,0|1,0,0]=2 910 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [0,1,0,0,0,0|1,0,0]=2 911 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [0,1,0,0,0,0|1,0,0]=2 912 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [0,1,0,0,0,0|1,0,1]=3 913 B11R1.74 C=C(C)c1cc([nH]c(=O)c1)C 271570a_100000694244_100009861981 [0,1,0,0,0,0|2,0,0]=3 914 B11R1.74 C=C(C)c1cc(cc(c1)Br)Br 271570a_100000694244_100009814770 [0,1,0,0,0,0|2,0,0]=3 915 B11R1.74 C=C(C)c1cc(cc(c1)Br)Cl 271570a_100000694244_100009814755 [0,1,0,0,0,0|2,0,0]=3 916 B11R1.74 C=C(C)c1cc(cc(c1)Br)F 271570a_100000694244_100009814764 [0,1,0,0,0,0|2,0,0]=3 917 B11R1.74 C=C(C)c1cc(cc(c1)Br)N 271570a_100000694244_100009814763 [0,1,0,0,0,0|2,0,0]=3 918 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [0,1,0,0,0,0|2,0,0]=3 919 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [0,1,0,0,0,0|1,0,0]=2 920 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [0,1,0,0,0,0|1,0,0]=2 921 B11R1.74 C=C(C)c1cc(cc(c1)Cl)Cl 271570a_100000694244_100000747138 [0,1,0,0,0,0|2,0,0]=3 922 B11R1.74 C=C(C)c1cc(cc(c1)Cl)F 271570a_100000694244_100013859453 [0,1,0,0,0,0|2,0,0]=3 923 B11R1.74 C=C(C)c1cc(cc(c1)Cl)N 271570a_100000694244_100010147676 [0,1,0,0,0,0|2,0,0]=3 924 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [0,1,0,0,0,0|2,0,0]=3 925 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [0,1,0,0,0,0|1,0,0]=2 926 B11R1.74 C=C(C)c1cc(cc(c1)F)F 271570a_100000694244_100011218498 [0,1,0,0,0,0|2,0,0]=3 927 B11R1.74 C=C(C)c1cc(cc(c1)F)N 271570a_100000694244_100011356972 [0,1,0,0,0,0|2,0,0]=3 928 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [0,1,0,0,0,0|2,0,0]=3 929 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [0,1,0,0,0,0|1,0,0]=2 930 B11R1.74 C=C(C)c1cc(cc(c1)N)N 271570a_100000694244_100011999608 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [0,1,0,0,0,0|1,0,0]=2 932 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.74 C=C(C)c1cc(cc(n1)F)C 271570a_100000694244_100009819601 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.74 C=C(C)c1cc(cc(n1)N)C 271570a_100000694244_100009819863 [0,1,0,0,0,0|2,0,0]=3 936 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [0,1,0,0,0,0|2,0,0]=3 937 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [0,1,0,0,0,0|2,0,0]=3 938 B11R1.74 C=C(C)c1cc(nc(c1)F)F 271570a_100000694244_100000049587 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [0,1,0,0,0,0|2,0,0]=3 940 B11R1.74 C=C(C)c1cc(nc(c1)N)N 271570a_100000694244_100009816676 [0,1,0,0,0,0|3,0,0]=4 941 B11R1.74 C=C(C)c1cc(nc(n1)C)C 271570a_100000694244_100000736142 [0,1,0,0,0,0|3,0,0]=4 942 B11R1.74 C=C(C)c1cc(nc(n1)C)N 271570a_100000694244_100012178882 [0,1,0,0,0,0|3,0,0]=4 943 B11R1.74 C=C(C)c1cc(nc(n1)C)O 271570a_100000694244_106741647437 [0,1,0,0,0,0|3,0,0]=4 944 B11R1.74 C=C(C)c1cc(nc(n1)N)C 271570a_100000694244_100000183061 [0,1,0,0,0,0|3,0,0]=4 945 B11R1.74 C=C(C)c1nc(cc(n1)C)C 271570a_100000694244_100000736147 [0,1,0,0,0,0|3,0,0]=4 946 B11R1.74 C=C(C)c1nc(cc(n1)N)C 271570a_100000694244_100000687285 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [0,1,0,0,0,0|1,0,0]=2 948 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [0,1,0,0,0,0|0,0,0]=1 949 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [0,1,0,0,0,0|1,0,0]=2 950 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [0,1,0,0,0,0|1,0,0]=2 951 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [0,1,0,0,0,0|1,0,0]=2 952 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [0,1,0,0,0,0|1,0,0]=2 953 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [0,1,0,0,0,0|0,0,0]=1 954 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [0,1,0,0,0,0|0,0,0]=1 955 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [0,1,0,0,0,0|1,0,0]=2 956 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [0,1,0,0,0,0|1,0,0]=2 957 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [0,1,0,0,0,0|1,0,0]=2 958 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [0,1,0,0,0,0|0,0,0]=1 959 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [0,1,0,0,0,0|1,0,0]=2 960 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [0,1,0,0,0,0|1,0,0]=2 961 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [0,1,0,0,0,0|1,0,0]=2 962 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [0,1,0,0,0,0|1,0,0]=2 963 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [0,1,0,0,0,0|0,0,0]=1 964 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [0,1,0,0,0,0|1,0,0]=2 965 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [0,1,0,0,0,0|1,0,0]=2 966 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [0,1,0,0,0,0|1,0,0]=2 967 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [0,1,0,0,0,0|0,0,0]=1 968 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [0,1,0,0,0,0|0,0,0]=1 969 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [0,1,0,0,0,0|1,0,0]=2 970 B11R1.74 CC(C)c1cc(cc(c1)Br)O 271570a_203496583355_200015473176 [0,1,0,0,0,0|2,0,1]=4 971 B11R1.74 CC(C)c1cc(cc(c1)O)N 271570a_203496583355_100010369243 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.74 CN(C)c1cc(cc(c1)Br)Br 27a_100102631434_100009814770 [0,1,0,0,0,0|3,0,0]=4 973 B11R1.74 CN(C)c1cc(cc(c1)Br)F 269982a_106741647397_200000210301 [0,1,0,0,0,0|3,0,0]=4 974 B11R1.74 CN(C)c1cc(cc(c1)Br)F 34a_106741647397_200000210301 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.74 CN(C)c1cc(cc(c1)Br)F 7a_106741647397_200000210301 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.74 CN(C)c1cc(cc(c1)Cl)Cl 2230a_100000220458_200000210301 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.74 CN(C)c1cc(cc(c1)Cl)Cl 269982a_100000220458_200000210301 [0,1,0,0,0,0|3,0,0]=4 978 B11R1.74 CN(C)c1cc(cc(c1)Cl)Cl 34a_100000220458_200000210301 [0,1,0,0,0,0|3,0,0]=4 979 B11R1.74 CN(C)c1cc(cc(c1)Cl)Cl 7a_100000220458_200000210301 [0,1,0,0,0,0|3,0,0]=4 980 B11R1.74 CN(C)c1cc(cc(c1)F)F 2230a_100011233154_200000210301 [0,1,0,0,0,0|3,0,0]=4 981 B11R1.74 CN(C)c1cc(cc(c1)F)F 269982a_100011233154_200000210301 [0,1,0,0,0,0|3,0,0]=4 982 B11R1.74 CN(C)c1cc(cc(c1)F)F 34a_100011233154_200000210301 [0,1,0,0,0,0|3,0,0]=4 983 B11R1.74 CN(C)c1cc(cc(c1)F)F 7a_100011233154_200000210301 [0,1,0,0,0,0|3,0,0]=4 984 B11R1.74 CN([13CH3])c1cc(cc(c1)Br)F 269982a_106741647397_200025704644 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.74 CN([13CH3])c1cc(cc(c1)Br)F 34a_106741647397_200025704644 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.74 CN([13CH3])c1cc(cc(c1)Br)F 7a_106741647397_200025704644 [0,1,0,0,0,0|3,0,0]=4 987 B11R1.74 CN([13CH3])c1cc(cc(c1)Cl)Cl 2230a_100000220458_200025704644 [0,1,0,0,0,0|3,0,0]=4 988 B11R1.74 CN([13CH3])c1cc(cc(c1)Cl)Cl 269982a_100000220458_200025704644 [0,1,0,0,0,0|3,0,0]=4 989 B11R1.74 CN([13CH3])c1cc(cc(c1)Cl)Cl 34a_100000220458_200025704644 [0,1,0,0,0,0|3,0,0]=4 990 B11R1.74 CN([13CH3])c1cc(cc(c1)Cl)Cl 7a_100000220458_200025704644 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.74 CN([13CH3])c1cc(cc(c1)F)F 2230a_100011233154_200025704644 [0,1,0,0,0,0|3,0,0]=4 992 B11R1.74 CN([13CH3])c1cc(cc(c1)F)F 269982a_100011233154_200025704644 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.74 CN([13CH3])c1cc(cc(c1)F)F 34a_100011233154_200025704644 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.74 CN([13CH3])c1cc(cc(c1)F)F 7a_100011233154_200025704644 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.74 Cc1cc(cc(=O)[nH]1)N(C)C 27a_100102631434_100009861981 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.74 Cc1cc(cc(c1)B(O)O)O 271570a_203496583355_100009814731 [0,1,0,0,0,0|2,0,1]=4 997 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [0,1,0,0,0,0|1,0,0]=2 998 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [0,1,0,0,0,0|0,0,0]=1 999 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [0,1,0,0,0,0|0,0,0]=1 1000 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [0,1,0,0,0,0|0,0,0]=1 1001 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [0,1,0,0,0,0|0,0,0]=1 1002 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [0,1,0,0,0,0|0,0,0]=1 1003 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [0,1,0,0,0,0|0,0,0]=1 1004 B11R1.74 Cc1cc(cc(c1)N(C)C)F 2230a_103496528823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1005 B11R1.74 Cc1cc(cc(c1)N(C)C)F 269982a_103496528823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1006 B11R1.74 Cc1cc(cc(c1)N(C)C)F 34a_103496528823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1007 B11R1.74 Cc1cc(cc(c1)N(C)C)F 38a_103496528823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1008 B11R1.74 Cc1cc(cc(c1)N(C)C)F 7a_103496528823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1009 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 2230a_103496528823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1010 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 269982a_103496528823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1011 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 34a_103496528823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1012 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 38a_103496528823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1013 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 7a_103496528823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1014 B11R1.74 Cc1cc(cc(n1)C)N(C)C 27a_100102631434_100000066820 [0,1,0,0,0,0|3,0,0]=4 1015 B11R1.74 Cc1cc(cc(n1)Cl)N(C)C 27a_100102631434_100010068023 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.74 Cc1cc(cc(n1)F)N(C)C 27a_100102631434_100010006595 [0,1,0,0,0,0|3,0,0]=4 1017 B11R1.74 Cc1cc(nc(c1)N(C)C)C 27a_100102631434_100000069240 [0,1,0,0,0,0|3,0,0]=4 1018 B11R1.74 Cc1cc(nc(c1)N(C)C)F 27a_100102631434_100009819601 [0,1,0,0,0,0|3,0,0]=4 1019 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [0,1,0,0,0,0|2,0,0]=3 1020 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [0,1,0,0,0,0|2,0,0]=3 1021 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [0,1,0,0,0,0|1,0,0]=2 1022 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [0,1,0,0,0,0|1,0,0]=2 1023 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [0,1,0,0,0,0|1,0,0]=2 1024 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [0,1,0,0,0,0|1,0,0]=2 1025 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [0,1,0,0,0,0|1,0,0]=2 1026 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [0,1,0,0,0,0|1,0,0]=2 1027 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [0,1,0,0,0,0|1,0,0]=2 1028 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [0,1,0,0,0,0|1,0,0]=2 1029 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [0,1,0,0,0,0|1,0,0]=2 1030 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [0,1,0,0,0,0|1,0,0]=2 1031 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [0,1,0,0,0,0|1,0,0]=2 1032 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [0,1,0,0,0,0|1,0,0]=2 1033 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [0,1,0,0,0,0|1,0,0]=2 1034 B11R1.155 CC(C)(C)c1cccc(c1)O 271570a_203496583355_100009816526 [0,1,0,0,0,0|2,0,1]=4 1035 B11R1.155 CC(C)(N)c1cccc(c1)O 271570a_203496583355_100016995529 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.155 CC(C)(O)c1cccc(c1)O 271570a_203496583355_100011346009 [0,1,0,0,0,0|1,0,2]=4 1037 B11R1.155 CC(F)(F)c1cccc(c1)O 271570a_203496583355_100010232180 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [0,1,0,0,0,0|2,0,0]=3 1039 B11R1.155 CS(=O)(=O)c1cccc(n1)O 271570a_203496583355_100010191205 [0,1,0,0,0,0|3,0,0]=4 1040 B11R1.155 CS(=O)(=O)c1ccnc(c1)O 271570a_203496583355_100016215246 [0,1,0,0,0,0|3,0,0]=4 1041 B11R1.155 CS(=O)(=O)c1cncc(c1)O 271570a_203496583355_100000702611 [0,1,0,0,0,0|3,0,0]=4 1042 B11R1.155 C[Si](C)(C)c1cccc(c1)O 271570a_203496583355_100009816414 [0,1,0,0,0,0|2,1,0]=4 1043 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [0,1,0,0,0,0|3,0,0]=4 1044 B11R1.159 C=C(C)c1cccc(=O)n1C 271570a_100000694244_100000726605 [0,1,0,0,0,0|3,0,0]=4 1045 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,1,0,0,0,0|1,0,0]=2 1048 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [0,1,0,0,0,0|2,0,0]=3 1049 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [0,1,0,0,0,0|2,0,0]=3 1050 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [0,1,0,0,0,0|2,0,0]=3 1051 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [0,1,0,0,0,0|2,0,0]=3 1052 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [0,1,0,0,0,0|1,0,0]=2 1054 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [0,1,0,0,0,0|2,0,0]=3 1055 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [0,1,0,0,0,0|2,0,0]=3 1056 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [0,1,0,0,0,0|2,0,0]=3 1058 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [0,1,0,0,0,0|1,0,0]=2 1059 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [0,1,0,0,0,0|2,0,0]=3 1060 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [0,1,0,0,0,0|2,0,0]=3 1061 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [0,1,0,0,0,0|2,0,0]=3 1064 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [0,1,0,0,0,0|1,0,0]=2 1065 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [0,1,0,0,0,0|2,0,0]=3 1066 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [0,1,0,0,0,0|2,0,0]=3 1067 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [0,1,0,0,0,0|2,0,0]=3 1068 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,1,0,0,0,0|1,0,0]=2 1071 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [0,1,0,0,0,0|2,0,0]=3 1072 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [0,1,0,0,0,0|2,0,0]=3 1074 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [0,1,0,0,0,0|2,0,0]=3 1075 B11R1.159 C=C(C)c1cccn(c1=O)C 271570a_100000694244_100000687173 [0,1,0,0,0,0|2,0,0]=3 1076 B11R1.159 C=C(C)c1ccnc(c1C)C 271570a_100000694244_100009846815 [0,1,0,0,0,0|2,0,0]=3 1077 B11R1.159 C=C(C)c1ccnc(c1C)Cl 271570a_100000694244_100000047055 [0,1,0,0,0,0|3,0,0]=4 1078 B11R1.159 C=C(C)c1ccnc(c1C)F 271570a_100000694244_100010006593 [0,1,0,0,0,0|3,0,0]=4 1079 B11R1.159 C=C(C)c1ccnc(c1C)N 271570a_100000694244_100009865460 [0,1,0,0,0,0|3,0,0]=4 1080 B11R1.159 C=C(C)c1ccnc(c1C)O 271570a_100000694244_100009858498 [0,1,0,0,0,0|3,0,0]=4 1081 B11R1.159 C=C(C)c1ccnc(c1Cl)C 271570a_100000694244_100000698670 [0,1,0,0,0,0|2,0,0]=3 1082 B11R1.159 C=C(C)c1ccnc(c1Cl)Cl 271570a_100000694244_100010246212 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.159 C=C(C)c1ccnc(c1Cl)F 271570a_100000694244_100010067886 [0,1,0,0,0,0|3,0,0]=4 1084 B11R1.159 C=C(C)c1ccnc(c1Cl)N 271570a_100000694244_100010735111 [0,1,0,0,0,0|3,0,0]=4 1085 B11R1.159 C=C(C)c1ccnc(c1F)Br 271570a_100000694244_200015269031 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.159 C=C(C)c1ccnc(c1F)C 271570a_100000694244_100009849794 [0,1,0,0,0,0|2,0,0]=3 1087 B11R1.159 C=C(C)c1ccnc(c1F)Cl 271570a_100000694244_100010150473 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.159 C=C(C)c1ccnc(c1F)F 271570a_100000694244_100010214882 [0,1,0,0,0,0|3,0,0]=4 1089 B11R1.159 C=C(C)c1ccnc(c1F)N 271570a_100000694244_100010077785 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [0,1,0,0,0,0|2,0,0]=3 1091 B11R1.159 C=C(C)c1ccnc(c1N)N 271570a_100000694244_100000124095 [0,1,0,0,0,0|3,0,0]=4 1092 B11R1.159 C=C(C)c1cncc(c1C)Br 271570a_100000694244_100010109657 [0,1,0,0,0,0|3,0,0]=4 1093 B11R1.159 C=C(C)c1cncc(c1C)C 271570a_100000694244_100009864703 [0,1,0,0,0,0|2,0,0]=3 1094 B11R1.159 C=C(C)c1cncc(c1C)F 271570a_100000694244_100009881546 [0,1,0,0,0,0|3,0,0]=4 1095 B11R1.159 C=C(C)c1cncc(c1C)N 271570a_100000694244_100011998293 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.159 C=C(C)c1cncc(c1N)Br 271570a_100000694244_100011290786 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.159 C=C(C)c1cncc(c1N)C 271570a_100000694244_100009818025 [0,1,0,0,0,0|2,0,0]=3 1098 B11R1.159 C=C(C)c1cncc(c1N)Cl 271570a_100000694244_100000684942 [0,1,0,0,0,0|3,0,0]=4 1099 B11R1.159 C=C(C)c1cncc(c1N)F 271570a_100000694244_100009880649 [0,1,0,0,0,0|3,0,0]=4 1100 B11R1.159 C=C(C)c1cncc(c1N)N 271570a_100000694244_100000694774 [0,1,0,0,0,0|3,0,0]=4 1101 B11R1.159 C=C(C)c1nccc(c1C)C 271570a_100000694244_100009847204 [0,1,0,0,0,0|2,0,0]=3 1102 B11R1.159 C=C(C)c1nccc(c1C)F 271570a_100000694244_100009846374 [0,1,0,0,0,0|3,0,0]=4 1103 B11R1.159 C=C(C)c1nccc(c1C)N 271570a_100000694244_100009980296 [0,1,0,0,0,0|3,0,0]=4 1104 B11R1.159 C=C(C)c1nccc(c1F)C 271570a_100000694244_100009817629 [0,1,0,0,0,0|2,0,0]=3 1105 B11R1.159 C=C(C)c1nccc(c1F)N 271570a_100000694244_100015205195 [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.159 C=C(C)c1nccc(c1F)O 271570a_100000694244_100009876375 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.159 C=C(C)c1nccc(c1N)C 271570a_100000694244_100000763560 [0,1,0,0,0,0|2,0,0]=3 1108 B11R1.159 C=C(C)c1nccc(c1N)N 271570a_100000694244_100000085203 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.159 C=C(C)c1nccc(c1N)O 271570a_100000694244_100000128729 [0,1,0,0,0,0|3,0,0]=4 1110 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [0,1,0,0,0,0|2,0,0]=3 1111 B11R1.159 C=C(C)c1nccc(c1O)F 271570a_100000694244_100009867227 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.159 C=C(C)c1ncnc(c1C)C 271570a_100000694244_100011438038 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.159 C=C(C)c1ncnc(c1F)C 271570a_100000694244_100011671633 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,1,0,0,0,0|1,0,0]=2 1115 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,1,0,0,0,0|0,0,0]=1 1116 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,1,0,0,0,0|1,0,0]=2 1117 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,1,0,0,0,0|1,0,0]=2 1118 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,1,0,0,0,0|1,0,0]=2 1119 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,1,0,0,0,0|1,0,0]=2 1120 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,1,0,0,0,0|1,0,0]=2 1121 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,1,0,0,0,0|0,0,0]=1 1122 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,1,0,0,0,0|1,0,0]=2 1123 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,1,0,0,0,0|1,0,0]=2 1124 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,1,0,0,0,0|1,0,0]=2 1125 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,1,0,0,0,0|1,0,0]=2 1126 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,1,0,0,0,0|1,0,0]=2 1127 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,1,0,0,0,0|1,0,0]=2 1128 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,1,0,0,0,0|0,0,0]=1 1129 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,1,0,0,0,0|1,0,0]=2 1130 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,1,0,0,0,0|1,0,0]=2 1131 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,1,0,0,0,0|1,0,0]=2 1132 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,1,0,0,0,0|1,0,0]=2 1133 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,1,0,0,0,0|1,0,0]=2 1134 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,1,0,0,0,0|0,0,0]=1 1135 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,1,0,0,0,0|1,0,0]=2 1136 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,1,0,0,0,0|1,0,0]=2 1137 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,1,0,0,0,0|1,0,0]=2 1138 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,1,0,0,0,0|1,0,0]=2 1139 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,1,0,0,0,0|1,0,0]=2 1140 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,1,0,0,0,0|1,0,0]=2 1141 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,1,0,0,0,0|0,0,0]=1 1142 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,1,0,0,0,0|1,0,0]=2 1143 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,1,0,0,0,0|1,0,0]=2 1144 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,1,0,0,0,0|1,0,0]=2 1145 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,1,0,0,0,0|1,0,0]=2 1146 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,1,0,0,0,0|0,0,0]=1 1147 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,1,0,0,0,0|1,0,0]=2 1148 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,1,0,0,0,0|1,0,0]=2 1149 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,1,0,0,0,0|1,0,0]=2 1150 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,1,0,0,0,0|1,0,0]=2 1151 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,1,0,0,0,0|1,0,0]=2 1152 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [0,1,0,0,0,0|2,0,0]=3 1153 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [0,1,0,0,0,0|2,0,1]=4 1155 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [0,1,0,0,0,0|1,0,2]=4 1156 B11R1.159 CN(C)c1cccc(c1Cl)Cl 2230a_100000742713_200000210301 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.159 CN(C)c1cccc(c1Cl)Cl 269982a_100000742713_200000210301 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.159 CN(C)c1cccc(c1Cl)Cl 34a_100000742713_200000210301 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.159 CN(C)c1cccc(c1F)Cl 2230a_100020633735_200000210301 [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.159 CN(C)c1cccc(c1F)Cl 269982a_100020633735_200000210301 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.159 CN(C)c1cccc(c1F)Cl 34a_100020633735_200000210301 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.159 CN(C)c1cccc(c1F)Cl 38a_100020633735_200000210301 [0,1,0,0,0,0|3,0,0]=4 1163 B11R1.159 CN([13CH3])c1cccc(c1Cl)Cl 2230a_100000742713_200025704644 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.159 CN([13CH3])c1cccc(c1Cl)Cl 269982a_100000742713_200025704644 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.159 CN([13CH3])c1cccc(c1Cl)Cl 34a_100000742713_200025704644 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.159 CN([13CH3])c1cccc(c1F)Cl 2230a_100020633735_200025704644 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.159 CN([13CH3])c1cccc(c1F)Cl 269982a_100020633735_200025704644 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.159 CN([13CH3])c1cccc(c1F)Cl 34a_100020633735_200025704644 [0,1,0,0,0,0|3,0,0]=4 1169 B11R1.159 CN([13CH3])c1cccc(c1F)Cl 38a_100020633735_200025704644 [0,1,0,0,0,0|3,0,0]=4 1170 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [0,1,0,0,0,0|2,0,0]=3 1171 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,1,0,0,0,0|1,0,0]=2 1172 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,1,0,0,0,0|1,0,0]=2 1173 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,1,0,0,0,0|1,0,0]=2 1174 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,1,0,0,0,0|1,0,0]=2 1175 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,1,0,0,0,0|1,0,0]=2 1176 B11R1.159 Cc1c(cccc1N(C)C)Cl 2230a_100020606106_200000210301 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.159 Cc1c(cccc1N(C)C)Cl 269982a_100020606106_200000210301 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.159 Cc1c(cccc1N(C)C)Cl 34a_100020606106_200000210301 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.159 Cc1c(cccc1N(C)C)Cl 38a_100020606106_200000210301 [0,1,0,0,0,0|3,0,0]=4 1180 B11R1.159 Cc1c(cccc1N(C)[13CH3])Cl 2230a_100020606106_200025704644 [0,1,0,0,0,0|3,0,0]=4 1181 B11R1.159 Cc1c(cccc1N(C)[13CH3])Cl 269982a_100020606106_200025704644 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.159 Cc1c(cccc1N(C)[13CH3])Cl 34a_100020606106_200025704644 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.159 Cc1c(cccc1N(C)[13CH3])Cl 38a_100020606106_200025704644 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,1,0,0,0,0|0,0,0]=1 1185 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,1,0,0,0,0|0,0,0]=1 1186 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,1,0,0,0,0|0,0,0]=1 1187 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,1,0,0,0,0|0,0,0]=1 1188 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,1,0,0,0,0|0,0,0]=1 1189 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,1,0,0,0,0|1,0,0]=2 1190 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,1,0,0,0,0|0,0,0]=1 1191 B11R1.159 Cc1nccc(c1Cl)N(C)C 27a_100102631434_100000698670 [0,1,0,0,0,0|3,0,0]=4 1192 B11R1.159 Cc1nccc(c1F)N(C)C 27a_100102631434_100009849794 [0,1,0,0,0,0|3,0,0]=4 1193 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [0,1,0,0,0,0|2,0,0]=3 1196 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,1,0,0,0,0|1,0,0]=2 1198 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,1,0,0,0,0|1,0,0]=2 1199 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,1,0,0,0,0|1,0,0]=2 1200 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,1,0,0,0,0|1,0,0]=2 1201 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,1,0,0,0,0|1,0,0]=2 1202 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,1,0,0,0,0|1,0,0]=2 1203 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,1,0,0,0,0|1,0,0]=2 1204 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,1,0,0,0,0|1,0,0]=2 1205 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,1,0,0,0,0|1,0,0]=2 1206 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,1,0,0,0,0|1,0,0]=2 1207 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,1,0,0,0,0|1,0,0]=2 1208 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,1,0,0,0,0|1,0,0]=2 1209 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,1,0,0,0,0|1,0,0]=2 1210 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,1,0,0,0,0|1,0,0]=2 1211 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,1,0,0,0,0|1,0,0]=2 1212 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,1,0,0,0,0|1,0,0]=2 1213 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,1,0,0,0,0|1,0,0]=2 1214 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,1,0,0,0,0|1,0,0]=2 1215 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,1,0,0,0,0|1,0,0]=2 1216 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,1,0,0,0,0|1,0,0]=2 1217 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,1,0,0,0,0|1,0,0]=2 1218 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,1,0,0,0,0|1,0,0]=2 1219 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,1,0,0,0,0|1,0,0]=2 1220 B11R1.167 C=C(C)c1cc(=O)[nH]cc1F 271570a_100000694244_100009817642 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.167 C=C(C)c1cc(c[nH]c1=O)F 271570a_100000694244_100009817720 [0,1,0,0,0,0|3,0,0]=4 1222 B11R1.167 C=C(C)c1cc(ccc1Br)Br 271570a_100000694244_100011483371 [0,1,0,0,0,0|2,0,0]=3 1223 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [0,1,0,0,0,0|1,0,0]=2 1224 B11R1.167 C=C(C)c1cc(ccc1Br)Cl 271570a_100000694244_100012339723 [0,1,0,0,0,0|2,0,0]=3 1225 B11R1.167 C=C(C)c1cc(ccc1Br)F 271570a_100000694244_100011217576 [0,1,0,0,0,0|2,0,0]=3 1226 B11R1.167 C=C(C)c1cc(ccc1Br)N 271570a_100000694244_100000750459 [0,1,0,0,0,0|2,0,0]=3 1227 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [0,1,0,0,0,0|2,0,0]=3 1228 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [0,1,0,0,0,0|2,0,0]=3 1229 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,1,0,0,0,0|1,0,0]=2 1230 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [0,1,0,0,0,0|2,0,0]=3 1231 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [0,1,0,0,0,0|2,0,0]=3 1232 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [0,1,0,0,0,0|2,0,0]=3 1233 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [0,1,0,0,0,0|2,0,0]=3 1234 B11R1.167 C=C(C)c1cc(ccc1Cl)Br 271570a_100000694244_100011772130 [0,1,0,0,0,0|2,0,0]=3 1235 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [0,1,0,0,0,0|1,0,0]=2 1236 B11R1.167 C=C(C)c1cc(ccc1Cl)Cl 271570a_100000694244_100000707729 [0,1,0,0,0,0|2,0,0]=3 1237 B11R1.167 C=C(C)c1cc(ccc1Cl)F 271570a_100000694244_100011217299 [0,1,0,0,0,0|2,0,0]=3 1238 B11R1.167 C=C(C)c1cc(ccc1Cl)N 271570a_100000694244_100012360549 [0,1,0,0,0,0|2,0,0]=3 1239 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [0,1,0,0,0,0|2,0,0]=3 1240 B11R1.167 C=C(C)c1cc(ccc1F)Br 271570a_100000694244_100011217312 [0,1,0,0,0,0|2,0,0]=3 1241 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [0,1,0,0,0,0|1,0,0]=2 1242 B11R1.167 C=C(C)c1cc(ccc1F)Cl 271570a_100000694244_100011218116 [0,1,0,0,0,0|2,0,0]=3 1243 B11R1.167 C=C(C)c1cc(ccc1F)F 271570a_100000694244_100000750033 [0,1,0,0,0,0|2,0,0]=3 1244 B11R1.167 C=C(C)c1cc(ccc1F)N 271570a_100000694244_100000760356 [0,1,0,0,0,0|2,0,0]=3 1245 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [0,1,0,0,0,0|2,0,0]=3 1246 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [0,1,0,0,0,0|2,0,0]=3 1247 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [0,1,0,0,0,0|1,0,0]=2 1248 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [0,1,0,0,0,0|2,0,0]=3 1249 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [0,1,0,0,0,0|2,0,0]=3 1250 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [0,1,0,0,0,0|2,0,0]=3 1251 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [0,1,0,0,0,0|2,0,0]=3 1252 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [0,1,0,0,0,0|2,0,0]=3 1253 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,1,0,0,0,0|1,0,0]=2 1254 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [0,1,0,0,0,0|2,0,0]=3 1255 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [0,1,0,0,0,0|2,0,0]=3 1256 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [0,1,0,0,0,0|2,0,0]=3 1257 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [0,1,0,0,0,0|2,0,0]=3 1258 B11R1.167 C=C(C)c1cc(cnc1Br)N 271570a_100000694244_100010201102 [0,1,0,0,0,0|3,0,0]=4 1259 B11R1.167 C=C(C)c1cc(cnc1C)Br 271570a_100000694244_200010090566 [0,1,0,0,0,0|3,0,0]=4 1260 B11R1.167 C=C(C)c1cc(cnc1C)C 271570a_100000694244_100009817436 [0,1,0,0,0,0|2,0,0]=3 1261 B11R1.167 C=C(C)c1cc(cnc1C)F 271570a_100000694244_100009860710 [0,1,0,0,0,0|3,0,0]=4 1262 B11R1.167 C=C(C)c1cc(cnc1C)N 271570a_100000694244_100011998591 [0,1,0,0,0,0|3,0,0]=4 1263 B11R1.167 C=C(C)c1cc(cnc1C)O 271570a_100000694244_100009819603 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.167 C=C(C)c1cc(cnc1Cl)Br 271570a_100000694244_100009814771 [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.167 C=C(C)c1cc(cnc1Cl)C 271570a_100000694244_100010210167 [0,1,0,0,0,0|2,0,0]=3 1266 B11R1.167 C=C(C)c1cc(cnc1Cl)Cl 271570a_100000694244_200000062399 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.167 C=C(C)c1cc(cnc1Cl)N 271570a_100000694244_100010253917 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.167 C=C(C)c1cc(cnc1F)Br 271570a_100000694244_100010172738 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.167 C=C(C)c1cc(cnc1F)C 271570a_100000694244_100000049784 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.167 C=C(C)c1cc(cnc1F)Cl 271570a_100000694244_100010188783 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.167 C=C(C)c1cc(cnc1F)F 271570a_100000694244_100009820768 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.167 C=C(C)c1cc(cnc1F)N 271570a_100000694244_100009840397 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.167 C=C(C)c1cc(cnc1F)O 271570a_100000694244_100009817267 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.167 C=C(C)c1cc(cnc1N)Br 271570a_100000694244_100000760472 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.167 C=C(C)c1cc(cnc1N)C 271570a_100000694244_100000049664 [0,1,0,0,0,0|2,0,0]=3 1276 B11R1.167 C=C(C)c1cc(cnc1N)Cl 271570a_100000694244_100000050159 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.167 C=C(C)c1cc(cnc1N)F 271570a_100000694244_100009814671 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.167 C=C(C)c1cc(cnc1N)N 271570a_100000694244_200011934315 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.167 C=C(C)c1cc(cnc1O)Br 271570a_100000694244_100010197142 [0,1,0,0,0,0|3,0,0]=4 1280 B11R1.167 C=C(C)c1cc(cnc1O)C 271570a_100000694244_100000049931 [0,1,0,0,0,0|2,0,0]=3 1281 B11R1.167 C=C(C)c1cc(cnc1O)Cl 271570a_100000694244_100010188700 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.167 C=C(C)c1cc(n[nH]c1=O)C 271570a_100000694244_100009819039 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.167 C=C(C)c1cc(ncc1Br)Br 271570a_100000694244_100010171693 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.167 C=C(C)c1cc(ncc1Br)Cl 271570a_100000694244_100009815598 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.167 C=C(C)c1cc(ncc1C)Br 271570a_100000694244_100010067628 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [0,1,0,0,0,0|2,0,0]=3 1287 B11R1.167 C=C(C)c1cc(ncc1C)Cl 271570a_100000694244_100010068021 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.167 C=C(C)c1cc(ncc1C)F 271570a_100000694244_100000049870 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.167 C=C(C)c1cc(ncc1C)N 271570a_100000694244_100009819938 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.167 C=C(C)c1cc(ncc1C)O 271570a_100000694244_100009831917 [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.167 C=C(C)c1cc(ncc1Cl)Br 271570a_100000694244_100010223331 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.167 C=C(C)c1cc(ncc1Cl)Cl 271570a_100000694244_100010172835 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.167 C=C(C)c1cc(ncc1Cl)F 271570a_100000694244_100009892587 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.167 C=C(C)c1cc(ncc1Cl)N 271570a_100000694244_100010134119 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.167 C=C(C)c1cc(ncc1F)Br 271570a_100000694244_100010193852 [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [0,1,0,0,0,0|2,0,0]=3 1297 B11R1.167 C=C(C)c1cc(ncc1F)Cl 271570a_100000694244_100000708277 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.167 C=C(C)c1cc(ncc1F)F 271570a_100000694244_100010233071 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.167 C=C(C)c1cc(ncc1F)N 271570a_100000694244_100015713587 [0,1,0,0,0,0|3,0,0]=4 1300 B11R1.167 C=C(C)c1cc(ncc1N)Cl 271570a_100000694244_100000050123 [0,1,0,0,0,0|3,0,0]=4 1301 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.167 C=C(C)c1cc(ncc1O)Cl 271570a_100000694244_100000698892 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.167 C=C(C)c1cn(ccc1=O)C 271570a_100000694244_100010750718 [0,1,0,0,0,0|2,0,0]=3 1304 B11R1.167 C=C(C)c1nc(c[nH]c1=O)C 271570a_100000694244_100009858157 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.167 C=C(C)c1nc(ccc1Br)N 271570a_100000694244_100010192275 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.167 C=C(C)c1nc(ccc1C)C 271570a_100000694244_100009854376 [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.167 C=C(C)c1nc(ccc1C)N 271570a_100000694244_100000126722 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.167 C=C(C)c1nc(ccc1F)C 271570a_100000694244_100009817602 [0,1,0,0,0,0|2,0,0]=3 1309 B11R1.167 C=C(C)c1nc(ccc1F)Cl 271570a_100000694244_100010136221 [0,1,0,0,0,0|3,0,0]=4 1310 B11R1.167 C=C(C)c1nc(ccc1F)F 271570a_100000694244_100010997973 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.167 C=C(C)c1nc(ccc1F)N 271570a_100000694244_100010892222 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.167 C=C(C)c1nc(ccc1N)Br 271570a_100000694244_100010168765 [0,1,0,0,0,0|3,0,0]=4 1313 B11R1.167 C=C(C)c1nc(ccc1N)C 271570a_100000694244_100000685570 [0,1,0,0,0,0|2,0,0]=3 1314 B11R1.167 C=C(C)c1nc(ccc1N)Cl 271570a_100000694244_100010233647 [0,1,0,0,0,0|3,0,0]=4 1315 B11R1.167 C=C(C)c1nc(ccc1N)F 271570a_100000694244_100009879877 [0,1,0,0,0,0|3,0,0]=4 1316 B11R1.167 C=C(C)c1nc(ccc1N)N 271570a_100000694244_200009884323 [0,1,0,0,0,0|3,0,0]=4 1317 B11R1.167 C=C(C)c1nc(ccc1O)Br 271570a_100000694244_100010253912 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.167 C=C(C)c1nc(ccc1O)C 271570a_100000694244_100000702858 [0,1,0,0,0,0|2,0,0]=3 1319 B11R1.167 C=C(C)c1nc(ccc1O)Cl 271570a_100000694244_100000696390 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.167 C=C(C)c1nc(ccc1O)F 271570a_100000694244_100010382442 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.167 C=C(C)c1nc(cnc1C)C 271570a_100000694244_100000211308 [0,1,0,0,0,0|3,0,0]=4 1322 B11R1.167 C=C(C)c1nc(cnc1N)C 271570a_100000694244_100009819049 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.167 C=C(C)c1nc(ncc1F)C 271570a_100000694244_100000059819 [0,1,0,0,0,0|3,0,0]=4 1324 B11R1.167 C=C(C)c1nc(ncc1N)C 271570a_100000694244_100009873743 [0,1,0,0,0,0|3,0,0]=4 1325 B11R1.167 CC(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200000210301 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,1,0,0,0,0|1,0,0]=2 1327 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,1,0,0,0,0|0,0,0]=1 1328 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,1,0,0,0,0|1,0,0]=2 1329 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,1,0,0,0,0|1,0,0]=2 1330 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,1,0,0,0,0|1,0,0]=2 1331 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,1,0,0,0,0|1,0,0]=2 1332 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,1,0,0,0,0|1,0,0]=2 1333 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,1,0,0,0,0|0,0,0]=1 1334 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,1,0,0,0,0|1,0,0]=2 1335 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,1,0,0,0,0|1,0,0]=2 1336 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,1,0,0,0,0|1,0,0]=2 1337 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,1,0,0,0,0|1,0,0]=2 1338 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,1,0,0,0,0|1,0,0]=2 1339 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,1,0,0,0,0|1,0,0]=2 1340 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,1,0,0,0,0|0,0,0]=1 1341 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,1,0,0,0,0|1,0,0]=2 1342 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,1,0,0,0,0|1,0,0]=2 1343 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,1,0,0,0,0|1,0,0]=2 1344 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,1,0,0,0,0|1,0,0]=2 1345 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,1,0,0,0,0|1,0,0]=2 1346 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,1,0,0,0,0|1,0,0]=2 1347 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,1,0,0,0,0|0,0,0]=1 1348 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,1,0,0,0,0|1,0,0]=2 1349 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,1,0,0,0,0|1,0,0]=2 1350 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,1,0,0,0,0|1,0,0]=2 1351 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,1,0,0,0,0|1,0,0]=2 1352 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,1,0,0,0,0|1,0,0]=2 1353 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,1,0,0,0,0|1,0,0]=2 1354 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,1,0,0,0,0|0,0,0]=1 1355 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,1,0,0,0,0|1,0,0]=2 1356 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,1,0,0,0,0|1,0,0]=2 1357 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,1,0,0,0,0|1,0,0]=2 1358 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,1,0,0,0,0|1,0,0]=2 1359 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,1,0,0,0,0|1,0,0]=2 1360 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,1,0,0,0,0|1,0,0]=2 1361 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,1,0,0,0,0|1,0,0]=2 1362 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,1,0,0,0,0|0,0,0]=1 1363 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,1,0,0,0,0|0,0,0]=1 1364 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,1,0,0,0,0|1,0,0]=2 1365 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,1,0,0,0,0|1,0,0]=2 1366 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,1,0,0,0,0|1,0,0]=2 1367 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,1,0,0,0,0|1,0,0]=2 1368 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,1,0,0,0,0|1,0,0]=2 1369 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,1,0,0,0,0|1,0,0]=2 1370 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,1,0,0,0,0|1,0,0]=2 1371 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [0,1,0,0,0,0|2,0,0]=3 1372 B11R1.167 CC(=O)c1cc(cnc1F)O 271570a_203496583355_100010254234 [0,1,0,0,0,0|2,0,0]=3 1373 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [0,1,0,0,0,0|2,0,0]=3 1374 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [0,1,0,0,0,0|2,0,0]=3 1375 B11R1.167 CC(=O)c1cc(ncc1F)O 271570a_203496583355_100000697832 [0,1,0,0,0,0|2,0,0]=3 1376 B11R1.167 CC(=O)c1nc(ccc1F)O 271570a_203496583355_100009887703 [0,1,0,0,0,0|2,0,0]=3 1377 B11R1.167 CC(=O)c1nc(ncc1C)O 271570a_203496583355_100010687370 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.167 CC(C)c1cc(ccc1F)O 271570a_203496583355_200053017515 [0,1,0,0,0,0|2,0,1]=4 1379 B11R1.167 CC(C)c1cc(ccc1N)O 271570a_203496583355_100000694223 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.167 CC(C)c1cc(ccc1O)Br 271570a_203496583355_100010244561 [0,1,0,0,0,0|2,0,1]=4 1381 B11R1.167 CC(C)c1cc(ccc1O)O 271570a_203496583355_100000691460 [0,1,0,0,0,0|2,0,1]=4 1382 B11R1.167 CC(N)c1cc(ccc1O)F 271570a_203496583355_100012343209 [0,1,0,0,0,0|2,0,1]=4 1383 B11R1.167 CC(O)c1cc(ccc1F)O 271570a_203496583355_100011943926 [0,1,0,0,0,0|1,0,2]=4 1384 B11R1.167 CN(C)c1cc(ccc1Br)Cl 269982a_100020633006_200000210301 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.167 CN(C)c1cc(ccc1Br)Cl 34a_100020633006_200000210301 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.167 CN(C)c1cc(ccc1Br)F 2230a_100020633008_200000210301 [0,1,0,0,0,0|3,0,0]=4 1387 B11R1.167 CN(C)c1cc(ccc1Br)F 269982a_100020633008_200000210301 [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.167 CN(C)c1cc(ccc1Br)F 34a_100020633008_200000210301 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.167 CN(C)c1cc(ccc1Cl)Br 269982a_100011772073_200000210301 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.167 CN(C)c1cc(ccc1Cl)Br 34a_100011772073_200000210301 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.167 CN(C)c1cc(ccc1Cl)Cl 269982a_100000742562_200000210301 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.167 CN(C)c1cc(ccc1Cl)Cl 34a_100000742562_200000210301 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.167 CN(C)c1cc(ccc1F)Br 2230a_100011314990_200000210301 [0,1,0,0,0,0|3,0,0]=4 1394 B11R1.167 CN(C)c1cc(ccc1F)Br 269982a_100011314990_200000210301 [0,1,0,0,0,0|3,0,0]=4 1395 B11R1.167 CN(C)c1cc(ccc1F)Br 34a_100011314990_200000210301 [0,1,0,0,0,0|3,0,0]=4 1396 B11R1.167 CN(C)c1cc(ccc1F)Br 38a_100011314990_200000210301 [0,1,0,0,0,0|3,0,0]=4 1397 B11R1.167 CN(C)c1cc(ccc1F)O 271570a_203496583355_100010288836 [0,1,0,0,0,0|3,0,0]=4 1398 B11R1.167 CN(C)c1cc(ccc1O)O 271570a_203496583355_200010083878 [0,1,0,0,0,0|3,0,0]=4 1399 B11R1.167 CN([13CH3])c1cc(ccc1Br)Cl 269982a_100020633006_200025704644 [0,1,0,0,0,0|3,0,0]=4 1400 B11R1.167 CN([13CH3])c1cc(ccc1Br)Cl 34a_100020633006_200025704644 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 2230a_100020633008_200025704644 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 269982a_100020633008_200025704644 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 34a_100020633008_200025704644 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Br 269982a_100011772073_200025704644 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Br 34a_100011772073_200025704644 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Cl 269982a_100000742562_200025704644 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Cl 34a_100000742562_200025704644 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 2230a_100011314990_200025704644 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 269982a_100011314990_200025704644 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 34a_100011314990_200025704644 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 38a_100011314990_200025704644 [0,1,0,0,0,0|3,0,0]=4 1412 B11R1.167 C[C@H](O)c1cc(ccc1O)F 271570a_203496583355_100134768474 [0,1,0,0,0,0|1,0,2]=4 1413 B11R1.167 Cc1cc(c(cn1)F)N(C)C 27a_100102631434_100009867690 [0,1,0,0,0,0|3,0,0]=4 1414 B11R1.167 Cc1ccc(c(c1)B(O)O)O 271570a_203496583355_200010883979 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,1,0,0,0,0|1,0,0]=2 1416 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,1,0,0,0,0|0,0,0]=1 1417 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,1,0,0,0,0|0,0,0]=1 1418 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,1,0,0,0,0|0,0,0]=1 1419 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,1,0,0,0,0|0,0,0]=1 1420 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,1,0,0,0,0|0,0,0]=1 1421 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,1,0,0,0,0|0,0,0]=1 1422 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [0,1,0,0,0,0|2,0,0]=3 1423 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,1,0,0,0,0|1,0,0]=2 1424 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,1,0,0,0,0|1,0,0]=2 1425 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,1,0,0,0,0|1,0,0]=2 1426 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,1,0,0,0,0|1,0,0]=2 1427 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,1,0,0,0,0|1,0,0]=2 1428 B11R1.167 Cc1ccc(cc1N(C)C)Br 2230a_100020629602_200000210301 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.167 Cc1ccc(cc1N(C)C)Br 269982a_100020629602_200000210301 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.167 Cc1ccc(cc1N(C)C)Br 34a_100020629602_200000210301 [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.167 Cc1ccc(cc1N(C)C)Br 38a_100020629602_200000210301 [0,1,0,0,0,0|3,0,0]=4 1432 B11R1.167 Cc1ccc(cc1N(C)C)Cl 2230a_100000221440_200000210301 [0,1,0,0,0,0|3,0,0]=4 1433 B11R1.167 Cc1ccc(cc1N(C)C)Cl 269982a_100000221440_200000210301 [0,1,0,0,0,0|3,0,0]=4 1434 B11R1.167 Cc1ccc(cc1N(C)C)Cl 34a_100000221440_200000210301 [0,1,0,0,0,0|3,0,0]=4 1435 B11R1.167 Cc1ccc(cc1N(C)C)Cl 38a_100000221440_200000210301 [0,1,0,0,0,0|3,0,0]=4 1436 B11R1.167 Cc1ccc(cc1N(C)C)F 2230a_114849113390_200000210301 [0,1,0,0,0,0|3,0,0]=4 1437 B11R1.167 Cc1ccc(cc1N(C)C)F 269982a_114849113390_200000210301 [0,1,0,0,0,0|3,0,0]=4 1438 B11R1.167 Cc1ccc(cc1N(C)C)F 34a_114849113390_200000210301 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.167 Cc1ccc(cc1N(C)C)F 38a_114849113390_200000210301 [0,1,0,0,0,0|3,0,0]=4 1440 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 2230a_100020629602_200025704644 [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 269982a_100020629602_200025704644 [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 34a_100020629602_200025704644 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 38a_100020629602_200025704644 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 2230a_100000221440_200025704644 [0,1,0,0,0,0|3,0,0]=4 1445 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 269982a_100000221440_200025704644 [0,1,0,0,0,0|3,0,0]=4 1446 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 34a_100000221440_200025704644 [0,1,0,0,0,0|3,0,0]=4 1447 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 38a_100000221440_200025704644 [0,1,0,0,0,0|3,0,0]=4 1448 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 2230a_114849113390_200025704644 [0,1,0,0,0,0|3,0,0]=4 1449 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 269982a_114849113390_200025704644 [0,1,0,0,0,0|3,0,0]=4 1450 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 34a_114849113390_200025704644 [0,1,0,0,0,0|3,0,0]=4 1451 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 38a_114849113390_200025704644 [0,1,0,0,0,0|3,0,0]=4 1452 B11R1.167 Cc1cnc(c(c1)N(C)C)F 27a_100102631434_100009820679 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [0,1,0,0,0,0|2,0,0]=3 1454 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [0,1,0,0,0,0|2,0,0]=3 1455 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [0,1,0,0,0,0|2,0,0]=3 1456 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.167 NC(=O)c1cc(cnc1N)O 271570a_203496583355_100000701294 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.167 NC(=O)c1cc(cnc1O)F 271570a_203496583355_100012183597 [0,1,0,0,0,0|3,0,0]=4 1461 B11R1.167 NC(=O)c1cc(ncc1F)O 271570a_203496583355_100015943597 [0,1,0,0,0,0|3,0,0]=4 1462 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [0,1,0,0,0,0|3,0,0]=4 1463 B11R1.167 NC(=O)c1nc(ccc1N)O 271570a_203496583355_100000093116 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.167 [13CH3]C(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200025704644 [0,1,0,0,0,0|2,0,1]=4 1465 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,1,0,0,0,0|1,0,0]=2 1466 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,1,0,0,0,0|1,0,0]=2 1467 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,1,0,0,0,0|1,0,0]=2 1468 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,1,0,0,0,0|1,0,0]=2 1469 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,1,0,0,0,0|1,0,0]=2 1470 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,1,0,0,0,0|1,0,0]=2 1471 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,1,0,0,0,0|1,0,0]=2 1472 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,1,0,0,0,0|1,0,0]=2 1473 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,1,0,0,0,0|1,0,0]=2 1474 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,1,0,0,0,0|1,0,0]=2 1475 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,1,0,0,0,0|1,0,0]=2 1476 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,1,0,0,0,0|1,0,0]=2 1477 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,1,0,0,0,0|1,0,0]=2 1478 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,1,0,0,0,0|1,0,0]=2 1479 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,1,0,0,0,0|1,0,0]=2 1480 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,1,0,0,0,0|1,0,0]=2 1481 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,1,0,0,0,0|1,0,0]=2 1482 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,1,0,0,0,0|1,0,0]=2 1483 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,1,0,0,0,0|1,0,0]=2 1484 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,1,0,0,0,0|1,0,0]=2 1485 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,1,0,0,0,0|1,0,0]=2 1486 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,1,0,0,0,0|1,0,0]=2 1487 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,1,0,0,0,0|1,0,0]=2 1488 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,1,0,0,0,0|1,0,0]=2 1489 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,1,0,0,0,0|1,0,0]=2 1490 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [0,1,0,0,0,0|0,0,1]=2 1491 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [0,1,0,0,0,0|0,0,1]=2 1492 B11R1.266 C=C(C)c1cc(ccn1)C#N 271570a_100000694244_100011291639 [0,1,0,0,0,0|2,0,1]=4 1493 B11R1.266 C=C(C)c1cc(ccn1)C=O 271570a_100000694244_100011290808 [0,1,0,0,0,0|2,0,1]=4 1494 B11R1.266 C=C(C)c1cc(ccn1)CC 271570a_100000694244_100009817561 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.266 C=C(C)c1cc(ccn1)CO 271570a_100000694244_100009814636 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.266 C=C(C)c1cc(ccn1)NC 271570a_100000694244_100009869472 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [0,1,0,0,0,0|2,0,0]=3 1498 B11R1.266 C=C(C)c1cc(ccn1)SC 271570a_100000694244_100010883326 [0,1,0,0,0,0|2,0,0]=3 1499 B11R1.266 C=C(C)c1cc(cnn1)OC 271570a_100000694244_100000087634 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.266 C=C(C)c1cc(ncn1)CC 271570a_100000694244_100000744278 [0,1,0,0,0,0|3,0,0]=4 1501 B11R1.266 C=C(C)c1cc(ncn1)CO 271570a_100000694244_100000731546 [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.266 C=C(C)c1cc(ncn1)NC 271570a_100000694244_100000756605 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.266 C=C(C)c1cc(ncn1)OC 271570a_100000694244_100012187182 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.266 C=C(C)c1cc(ncn1)SC 271570a_100000694244_100011443430 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.266 C=C(C)c1cccc(c1)C#N 271570a_100000694244_100000189340 [0,1,0,0,0,0|1,0,1]=3 1506 B11R1.266 C=C(C)c1cccc(c1)C=O 271570a_100000694244_100000014684 [0,1,0,0,0,0|1,0,1]=3 1507 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [0,1,0,0,0,0|1,0,0]=2 1508 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [0,1,0,0,0,0|1,0,0]=2 1509 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [0,1,0,0,0,0|1,0,0]=2 1510 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [0,1,0,0,0,0|1,0,0]=2 1511 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [0,1,0,0,0,0|1,0,0]=2 1512 B11R1.266 C=C(C)c1cccc(c1)NN 271570a_100000694244_100000217339 [0,1,0,0,0,0|2,0,0]=3 1513 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [0,1,0,0,0,0|1,0,0]=2 1514 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [0,1,0,0,0,0|1,0,0]=2 1515 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [0,1,0,0,0,0|1,0,0]=2 1516 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [0,1,0,0,0,0|1,0,0]=2 1517 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [0,1,0,0,0,0|1,0,0]=2 1518 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [0,1,0,0,0,0|1,0,0]=2 1519 B11R1.266 C=C(C)c1cccc(n1)C#N 271570a_100000694244_100011934037 [0,1,0,0,0,0|2,0,1]=4 1520 B11R1.266 C=C(C)c1cccc(n1)C=O 271570a_100000694244_100000688028 [0,1,0,0,0,0|2,0,1]=4 1521 B11R1.266 C=C(C)c1cccc(n1)CC 271570a_100000694244_100009856026 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.266 C=C(C)c1cccc(n1)CN 271570a_100000694244_100016990191 [0,1,0,0,0,0|2,0,0]=3 1523 B11R1.266 C=C(C)c1cccc(n1)CO 271570a_100000694244_100000694195 [0,1,0,0,0,0|2,0,0]=3 1524 B11R1.266 C=C(C)c1cccc(n1)NC 271570a_100000694244_100000703281 [0,1,0,0,0,0|2,0,0]=3 1525 B11R1.266 C=C(C)c1cccc(n1)NN 271570a_100000694244_100009817029 [0,1,0,0,0,0|3,0,0]=4 1526 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [0,1,0,0,0,0|2,0,0]=3 1527 B11R1.266 C=C(C)c1cccc(n1)SC 271570a_100000694244_100011960944 [0,1,0,0,0,0|2,0,0]=3 1528 B11R1.266 C=C(C)c1ccnc(c1)C#N 271570a_100000694244_100000685610 [0,1,0,0,0,0|2,0,1]=4 1529 B11R1.266 C=C(C)c1ccnc(c1)C=O 271570a_100000694244_100011998288 [0,1,0,0,0,0|2,0,1]=4 1530 B11R1.266 C=C(C)c1ccnc(c1)CC 271570a_100000694244_100009820011 [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.266 C=C(C)c1ccnc(c1)CN 271570a_100000694244_100000085674 [0,1,0,0,0,0|2,0,0]=3 1532 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.266 C=C(C)c1ccnc(c1)NC 271570a_100000694244_100009819592 [0,1,0,0,0,0|2,0,0]=3 1534 B11R1.266 C=C(C)c1ccnc(c1)NN 271570a_100000694244_100000764631 [0,1,0,0,0,0|3,0,0]=4 1535 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [0,1,0,0,0,0|2,0,0]=3 1536 B11R1.266 C=C(C)c1ccnc(n1)NC 271570a_100000694244_100012000420 [0,1,0,0,0,0|3,0,0]=4 1537 B11R1.266 C=C(C)c1ccnc(n1)OC 271570a_100000694244_100000069072 [0,1,0,0,0,0|3,0,0]=4 1538 B11R1.266 C=C(C)c1ccnc(n1)SC 271570a_100000694244_100000032126 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.266 C=C(C)c1cncc(c1)C#N 271570a_100000694244_100000686085 [0,1,0,0,0,0|2,0,1]=4 1540 B11R1.266 C=C(C)c1cncc(c1)C=O 271570a_100000694244_100000687066 [0,1,0,0,0,0|2,0,1]=4 1541 B11R1.266 C=C(C)c1cncc(c1)CC 271570a_100000694244_200009819073 [0,1,0,0,0,0|2,0,0]=3 1542 B11R1.266 C=C(C)c1cncc(c1)CN 271570a_100000694244_100011249555 [0,1,0,0,0,0|2,0,0]=3 1543 B11R1.266 C=C(C)c1cncc(c1)CO 271570a_100000694244_100011259137 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.266 C=C(C)c1cncc(c1)NC 271570a_100000694244_100012184536 [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.266 C=C(C)c1cncc(c1)NN 271570a_100000694244_100000727789 [0,1,0,0,0,0|3,0,0]=4 1546 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [0,1,0,0,0,0|2,0,0]=3 1547 B11R1.266 C=C(C)c1cncc(c1)SC 271570a_100000694244_100009816972 [0,1,0,0,0,0|2,0,0]=3 1548 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200000210301_200009889500 [0,1,0,0,0,0|2,0,0]=3 1549 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200009889500_200000210301 [0,1,0,0,0,0|2,0,0]=3 1550 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200009889500_200025704644 [0,1,0,0,0,0|2,0,0]=3 1551 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200025704644_200009889500 [0,1,0,0,0,0|2,0,0]=3 1552 B11R1.266 C=C(C)c1cncc(n1)CO 271570a_100000694244_100009853123 [0,1,0,0,0,0|3,0,0]=4 1553 B11R1.266 C=C(C)c1cncc(n1)NC 271570a_100000694244_100011529438 [0,1,0,0,0,0|3,0,0]=4 1554 B11R1.266 C=C(C)c1cncc(n1)OC 271570a_100000694244_100000756030 [0,1,0,0,0,0|3,0,0]=4 1555 B11R1.266 C=C(C)c1nccc(n1)CC 271570a_100000694244_100000100215 [0,1,0,0,0,0|3,0,0]=4 1556 B11R1.266 C=C(C)c1nccc(n1)NC 271570a_100000694244_100011649947 [0,1,0,0,0,0|3,0,0]=4 1557 B11R1.266 C=C(C)c1nccc(n1)OC 271570a_100000694244_100000182009 [0,1,0,0,0,0|3,0,0]=4 1558 B11R1.266 C=C(C)c1nccc(n1)SC 271570a_100000694244_100011650323 [0,1,0,0,0,0|3,0,0]=4 1559 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [0,1,0,0,0,0|1,0,1]=3 1560 B11R1.266 C=Cc1cc(ccn1)C(=O)N 271570a_100011290941_100000229836 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.266 C=Cc1cccc(c1)C(=C)C 271570a_100011290941_100012123953 [0,1,0,0,0,0|1,0,1]=3 1562 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [0,1,0,0,0,0|0,0,1]=2 1563 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [0,1,0,0,0,0|0,0,1]=2 1564 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [0,1,0,0,0,0|1,0,1]=3 1565 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [0,1,0,0,0,0|0,0,1]=2 1566 B11R1.266 C=Cc1cccc(c1)C(C)C 271570a_100011290941_100011214899 [0,1,0,0,0,0|1,0,2]=4 1567 B11R1.266 C=Cc1cccc(c1)C(C)N 271570a_100011290941_100020642005 [0,1,0,0,0,0|1,0,2]=4 1568 B11R1.266 C=Cc1cccc(c1)C(C)O 271570a_100011290941_100000246457 [0,1,0,0,0,0|0,0,3]=4 1569 B11R1.266 C=Cc1cccc(c1)N(C)C 271570a_100011290941_100011215952 [0,1,0,0,0,0|2,0,1]=4 1570 B11R1.266 C=Cc1cccc(c1)S(=O)C 271570a_100011290941_100009816267 [0,1,0,0,0,0|1,0,1]=3 1571 B11R1.266 C=Cc1cccc(n1)C(=O)C 271570a_100011290941_100009816502 [0,1,0,0,0,0|1,0,1]=3 1572 B11R1.266 C=Cc1cccc(n1)C(=O)N 271570a_100011290941_100011834053 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.266 C=Cc1ccnc(c1)C(=O)C 271570a_100011290941_100000709912 [0,1,0,0,0,0|1,0,1]=3 1574 B11R1.266 C=Cc1ccnc(c1)C(=O)N 271570a_100011290941_100000229564 [0,1,0,0,0,0|2,0,1]=4 1575 B11R1.266 C=Cc1cncc(c1)C(=C)C 271570a_100011290941_200009889500 [0,1,0,0,0,0|2,0,1]=4 1576 B11R1.266 C=Cc1cncc(c1)C(=O)C 271570a_100011290941_100011216243 [0,1,0,0,0,0|1,0,1]=3 1577 B11R1.266 C=Cc1cncc(c1)C(=O)N 271570a_100011290941_100000162242 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.266 C=Cc1nccc(n1)C(=O)C 271570a_100011290941_100010643186 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_100000709912_200025704644 [0,1,0,0,0,0|1,0,0]=2 1580 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000709912 [0,1,0,0,0,0|1,0,0]=2 1581 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [0,1,0,0,0,0|0,0,1]=2 1582 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [0,1,0,0,0,0|0,0,0]=1 1583 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [0,1,0,0,0,0|0,0,0]=1 1584 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [0,1,0,0,0,0|0,0,0]=1 1585 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [0,1,0,0,0,0|0,0,0]=1 1586 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [0,1,0,0,0,0|0,0,0]=1 1587 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_100009816502_200025704644 [0,1,0,0,0,0|1,0,0]=2 1588 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100009816502 [0,1,0,0,0,0|1,0,0]=2 1589 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [0,1,0,0,0,0|1,0,0]=2 1590 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [0,1,0,0,0,0|1,0,0]=2 1591 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_100010643186_200025704644 [0,1,0,0,0,0|2,0,0]=3 1592 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_200025704644_100010643186 [0,1,0,0,0,0|2,0,0]=3 1593 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_100011216243_200025704644 [0,1,0,0,0,0|1,0,0]=2 1594 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100011216243 [0,1,0,0,0,0|1,0,0]=2 1595 B11R1.266 CC(C)c1cc(ccn1)S[13CH3] 62a_100010237922_200025704644 [0,1,0,0,0,0|2,0,1]=4 1596 B11R1.266 CC(C)c1cc(ccn1)S[13CH3] 62a_200025704644_100010237922 [0,1,0,0,0,0|2,0,1]=4 1597 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 2230a_100000211879_200025704644 [0,1,0,0,0,0|1,0,1]=3 1598 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 34a_100000211879_200025704644 [0,1,0,0,0,0|1,0,1]=3 1599 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 7a_100000211879_200025704644 [0,1,0,0,0,0|1,0,1]=3 1600 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [0,1,0,0,0,0|1,0,1]=3 1601 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [0,1,0,0,0,0|1,0,1]=3 1602 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_100011214899_200025704644 [0,1,0,0,0,0|1,0,1]=3 1603 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011214899 [0,1,0,0,0,0|1,0,1]=3 1604 B11R1.266 CC(C)c1cccc(n1)S[13CH3] 62a_100012318657_200025704644 [0,1,0,0,0,0|2,0,1]=4 1605 B11R1.266 CC(C)c1cccc(n1)S[13CH3] 62a_200025704644_100012318657 [0,1,0,0,0,0|2,0,1]=4 1606 B11R1.266 CC(C)c1ccnc(c1)S[13CH3] 62a_100010237925_200025704644 [0,1,0,0,0,0|2,0,1]=4 1607 B11R1.266 CC(C)c1ccnc(c1)S[13CH3] 62a_200025704644_100010237925 [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.266 CC(C)c1cncc(c1)S[13CH3] 62a_200010191214_200025704644 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.266 CC(C)c1cncc(c1)S[13CH3] 62a_200025704644_200010191214 [0,1,0,0,0,0|2,0,1]=4 1610 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [0,1,0,0,0,0|1,0,1]=3 1611 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [0,1,0,0,0,0|1,0,1]=3 1612 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [0,1,0,0,0,0|1,0,1]=3 1613 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [0,1,0,0,0,0|1,0,1]=3 1614 B11R1.266 CC(N)c1cccc(n1)S[13CH3] 62a_200010173468_200025704644 [0,1,0,0,0,0|2,0,1]=4 1615 B11R1.266 CC(N)c1cccc(n1)S[13CH3] 62a_200025704644_200010173468 [0,1,0,0,0,0|2,0,1]=4 1616 B11R1.266 CC(O)c1cc(ccn1)S[13CH3] 62a_100000144657_200025704644 [0,1,0,0,0,0|1,0,2]=4 1617 B11R1.266 CC(O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000144657 [0,1,0,0,0,0|1,0,2]=4 1618 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 2230a_100011217120_200025704644 [0,1,0,0,0,0|0,0,2]=3 1619 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 34a_100011217120_200025704644 [0,1,0,0,0,0|0,0,2]=3 1620 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [0,1,0,0,0,0|0,0,2]=3 1621 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [0,1,0,0,0,0|0,0,2]=3 1622 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_100000246457_200025704644 [0,1,0,0,0,0|0,0,2]=3 1623 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_200025704644_100000246457 [0,1,0,0,0,0|0,0,2]=3 1624 B11R1.266 CC(O)c1cccc(n1)S[13CH3] 62a_100009820884_200025704644 [0,1,0,0,0,0|1,0,2]=4 1625 B11R1.266 CC(O)c1cccc(n1)S[13CH3] 62a_200025704644_100009820884 [0,1,0,0,0,0|1,0,2]=4 1626 B11R1.266 CC(O)c1cncc(c1)S[13CH3] 62a_100012351597_200025704644 [0,1,0,0,0,0|1,0,2]=4 1627 B11R1.266 CC(O)c1cncc(c1)S[13CH3] 62a_200025704644_100012351597 [0,1,0,0,0,0|1,0,2]=4 1628 B11R1.266 CCc1cc(ccn1)N(C)C 27a_100102631434_100009820011 [0,1,0,0,0,0|3,0,0]=4 1629 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [0,1,0,0,0,0|0,0,0]=1 1630 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [0,1,0,0,0,0|0,0,0]=1 1631 B11R1.266 CCc1ccnc(c1)N(C)C 27a_100102631434_100009817561 [0,1,0,0,0,0|3,0,0]=4 1632 B11R1.266 CN(C)c1cc(ccn1)S[13CH3] 62a_100012361627_200025704644 [0,1,0,0,0,0|3,0,0]=4 1633 B11R1.266 CN(C)c1cc(ccn1)S[13CH3] 62a_200025704644_100012361627 [0,1,0,0,0,0|3,0,0]=4 1634 B11R1.266 CN(C)c1cccc(c1)C#N 2230a_100000221292_200000210301 [0,1,0,0,0,0|2,0,1]=4 1635 B11R1.266 CN(C)c1cccc(c1)C#N 269982a_100000221292_200000210301 [0,1,0,0,0,0|2,0,1]=4 1636 B11R1.266 CN(C)c1cccc(c1)C#N 34a_100000221292_200000210301 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.266 CN(C)c1cccc(c1)C#N 7a_100000221292_200000210301 [0,1,0,0,0,0|2,0,1]=4 1638 B11R1.266 CN(C)c1cccc(c1)N[13CH3] 34a_100000209982_200025704644 [0,1,0,0,0,0|2,0,0]=3 1639 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [0,1,0,0,0,0|2,0,0]=3 1640 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_100011215952_200025704644 [0,1,0,0,0,0|2,0,0]=3 1641 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011215952 [0,1,0,0,0,0|2,0,0]=3 1642 B11R1.266 CN(C)c1cccc(n1)S[13CH3] 62a_100011960435_200025704644 [0,1,0,0,0,0|3,0,0]=4 1643 B11R1.266 CN(C)c1cccc(n1)S[13CH3] 62a_200025704644_100011960435 [0,1,0,0,0,0|3,0,0]=4 1644 B11R1.266 CN(C)c1ccnc(c1)CO 27a_100102631434_100000748867 [0,1,0,0,0,0|3,0,0]=4 1645 B11R1.266 CN(C)c1ccnc(c1)S[13CH3] 62a_100000766659_200025704644 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.266 CN(C)c1ccnc(c1)S[13CH3] 62a_200025704644_100000766659 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.266 CN(C)c1cncc(c1)S[13CH3] 62a_100012350714_200025704644 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.266 CN(C)c1cncc(c1)S[13CH3] 62a_200025704644_100012350714 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.266 CN([13CH3])c1cccc(c1)C#N 2230a_100000221292_200025704644 [0,1,0,0,0,0|2,0,1]=4 1650 B11R1.266 CN([13CH3])c1cccc(c1)C#N 269982a_100000221292_200025704644 [0,1,0,0,0,0|2,0,1]=4 1651 B11R1.266 CN([13CH3])c1cccc(c1)C#N 34a_100000221292_200025704644 [0,1,0,0,0,0|2,0,1]=4 1652 B11R1.266 CN([13CH3])c1cccc(c1)C#N 7a_100000221292_200025704644 [0,1,0,0,0,0|2,0,1]=4 1653 B11R1.266 CNc1cc(ccn1)C(C)C 27a_100102657272_100010237925 [0,1,0,0,0,0|2,0,1]=4 1654 B11R1.266 CNc1cc(cnn1)C(=O)N 27a_100102657272_100015785749 [0,1,0,0,0,0|3,0,0]=4 1655 B11R1.266 CNc1cc(ncn1)C(=O)N 27a_100102657272_100000725265 [0,1,0,0,0,0|3,0,0]=4 1656 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [0,1,0,0,0,0|1,0,0]=2 1657 B11R1.266 CNc1cccc(c1)C(C)C 2230a_100000211879_200000210301 [0,1,0,0,0,0|1,0,1]=3 1658 B11R1.266 CNc1cccc(c1)C(C)C 34a_100000211879_200000210301 [0,1,0,0,0,0|1,0,1]=3 1659 B11R1.266 CNc1cccc(c1)C(C)C 7a_100000211879_200000210301 [0,1,0,0,0,0|1,0,1]=3 1660 B11R1.266 CNc1cccc(c1)C(C)O 2230a_100011217120_200000210301 [0,1,0,0,0,0|0,0,2]=3 1661 B11R1.266 CNc1cccc(c1)C(C)O 34a_100011217120_200000210301 [0,1,0,0,0,0|0,0,2]=3 1662 B11R1.266 CNc1cccc(c1)C(F)F 2230a_100000058342_200000210301 [0,1,0,0,0,0|2,0,1]=4 1663 B11R1.266 CNc1cccc(c1)C(F)F 34a_100000058342_200000210301 [0,1,0,0,0,0|2,0,1]=4 1664 B11R1.266 CNc1cccc(c1)C(F)F 7a_100000058342_200000210301 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.266 CNc1cccc(c1)N(C)C 34a_100000209982_200000210301 [0,1,0,0,0,0|2,0,0]=3 1666 B11R1.266 CNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200000210301 [0,1,0,0,0,0|2,0,0]=3 1667 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [0,1,0,0,0,0|1,0,0]=2 1668 B11R1.266 CNc1cccc(n1)C(=O)N 27a_100102657272_100011834053 [0,1,0,0,0,0|2,0,0]=3 1669 B11R1.266 CNc1cccc(n1)C(C)C 27a_100102657272_100012318657 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.266 CNc1cccc(n1)C(C)O 27a_100102657272_100009820884 [0,1,0,0,0,0|1,0,2]=4 1671 B11R1.266 CNc1ccnc(c1)C(=O)N 27a_100102657272_100000229564 [0,1,0,0,0,0|2,0,0]=3 1672 B11R1.266 CNc1ccnc(c1)C(C)C 27a_100102657272_100010237922 [0,1,0,0,0,0|2,0,1]=4 1673 B11R1.266 CNc1ccnc(c1)C(C)O 27a_100102657272_100000144657 [0,1,0,0,0,0|1,0,2]=4 1674 B11R1.266 CNc1cncc(n1)C(=O)N 27a_100102657272_100000764846 [0,1,0,0,0,0|3,0,0]=4 1675 B11R1.266 CNc1nccc(n1)C(=O)C 27a_100102657272_100010643186 [0,1,0,0,0,0|2,0,0]=3 1676 B11R1.266 CNc1nccc(n1)C(=O)N 27a_100102657272_100000066158 [0,1,0,0,0,0|3,0,0]=4 1677 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [0,1,0,0,0,0|0,0,0]=1 1678 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [0,1,0,0,0,0|0,0,0]=1 1679 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [0,1,0,0,0,0|0,0,0]=1 1680 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [0,1,0,0,0,0|1,0,0]=2 1681 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [0,1,0,0,0,0|1,0,0]=2 1682 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [0,1,0,0,0,0|0,0,0]=1 1683 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [0,1,0,0,0,0|1,1,0]=3 1684 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [0,1,0,0,0,0|1,0,1]=3 1685 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [0,1,0,0,0,0|1,0,1]=3 1686 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [0,1,0,0,0,0|1,0,1]=3 1687 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [0,1,0,0,0,0|1,0,1]=3 1688 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [0,1,0,0,0,0|0,0,2]=3 1689 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [0,1,0,0,0,0|0,0,2]=3 1690 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [0,1,0,0,0,0|2,0,0]=3 1691 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [0,1,0,0,0,0|2,0,0]=3 1692 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [0,1,0,0,0,0|2,0,0]=3 1693 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [0,1,0,0,0,0|2,0,0]=3 1694 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [0,1,0,0,0,0|2,0,0]=3 1695 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [0,1,0,0,0,0|2,0,0]=3 1696 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [0,1,0,0,0,0|2,0,0]=3 1697 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [0,1,0,0,0,0|2,0,0]=3 1698 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [0,1,0,0,0,0|2,0,0]=3 1699 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [0,1,0,0,0,0|2,0,0]=3 1700 B11R1.266 COc1cncc(c1)[N+](=O)[O-] 34a_100009862860_200000210301 [0,1,0,0,0,0|3,0,0]=4 1701 B11R1.266 COc1cncc(c1)[N+](=O)[O-] 7a_100009862860_200000210301 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [0,1,0,0,0,0|1,0,0]=2 1703 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [0,1,0,0,0,0|1,0,0]=2 1704 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [0,1,0,0,0,0|1,0,0]=2 1705 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [0,1,0,0,0,0|1,0,0]=2 1706 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_100000229836_200000210301 [0,1,0,0,0,0|2,0,0]=3 1707 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_200000210301_100000229836 [0,1,0,0,0,0|2,0,0]=3 1708 B11R1.266 CSc1cc(ccn1)C(C)C 62a_100010237925_200000210301 [0,1,0,0,0,0|2,0,1]=4 1709 B11R1.266 CSc1cc(ccn1)C(C)C 62a_200000210301_100010237925 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.266 CSc1cc(ccn1)N(C)C 62a_100000766659_200000210301 [0,1,0,0,0,0|3,0,0]=4 1711 B11R1.266 CSc1cc(ccn1)N(C)C 62a_200000210301_100000766659 [0,1,0,0,0,0|3,0,0]=4 1712 B11R1.266 CSc1cc(cnn1)C(=O)N 62a_100015785749_200000210301 [0,1,0,0,0,0|3,0,0]=4 1713 B11R1.266 CSc1cc(cnn1)C(=O)N 62a_200000210301_100015785749 [0,1,0,0,0,0|3,0,0]=4 1714 B11R1.266 CSc1cc(ncn1)C(=O)N 62a_100000725265_200000210301 [0,1,0,0,0,0|3,0,0]=4 1715 B11R1.266 CSc1cc(ncn1)C(=O)N 62a_200000210301_100000725265 [0,1,0,0,0,0|3,0,0]=4 1716 B11R1.266 CSc1cccc(c1)B(O)O 62a_100000687717_200000210301 [0,1,0,0,0,0|2,0,1]=4 1717 B11R1.266 CSc1cccc(c1)B(O)O 62a_200000210301_100000687717 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [0,1,0,0,0,0|0,0,0]=1 1719 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [0,1,0,0,0,0|0,0,0]=1 1720 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [0,1,0,0,0,0|0,0,0]=1 1721 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [0,1,0,0,0,0|1,0,0]=2 1722 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [0,1,0,0,0,0|1,0,0]=2 1723 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [0,1,0,0,0,0|0,0,0]=1 1724 B11R1.266 CSc1cccc(c1)C(C)C 62a_100011214899_200000210301 [0,1,0,0,0,0|1,0,1]=3 1725 B11R1.266 CSc1cccc(c1)C(C)C 62a_200000210301_100011214899 [0,1,0,0,0,0|1,0,1]=3 1726 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [0,1,0,0,0,0|1,0,1]=3 1727 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [0,1,0,0,0,0|1,0,1]=3 1728 B11R1.266 CSc1cccc(c1)C(C)O 62a_100000246457_200000210301 [0,1,0,0,0,0|0,0,2]=3 1729 B11R1.266 CSc1cccc(c1)C(C)O 62a_200000210301_100000246457 [0,1,0,0,0,0|0,0,2]=3 1730 B11R1.266 CSc1cccc(c1)C(F)F 62a_100009892619_200000210301 [0,1,0,0,0,0|2,0,1]=4 1731 B11R1.266 CSc1cccc(c1)C(F)F 62a_200000210301_100009892619 [0,1,0,0,0,0|2,0,1]=4 1732 B11R1.266 CSc1cccc(c1)N(C)C 2230a_100020672454_200000210301 [0,1,0,0,0,0|2,0,0]=3 1733 B11R1.266 CSc1cccc(c1)N(C)C 269982a_100020672454_200000210301 [0,1,0,0,0,0|2,0,0]=3 1734 B11R1.266 CSc1cccc(c1)N(C)C 34a_100020672454_200000210301 [0,1,0,0,0,0|2,0,0]=3 1735 B11R1.266 CSc1cccc(c1)N(C)C 62a_100011215952_200000210301 [0,1,0,0,0,0|2,0,0]=3 1736 B11R1.266 CSc1cccc(c1)N(C)C 62a_200000210301_100011215952 [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 2230a_100020672454_200025704644 [0,1,0,0,0,0|2,0,0]=3 1738 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 269982a_100020672454_200025704644 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 34a_100020672454_200025704644 [0,1,0,0,0,0|2,0,0]=3 1740 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [0,1,0,0,0,0|1,0,0]=2 1741 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [0,1,0,0,0,0|1,0,0]=2 1742 B11R1.266 CSc1cccc(n1)C(=O)C 62a_100009816502_200000210301 [0,1,0,0,0,0|1,0,0]=2 1743 B11R1.266 CSc1cccc(n1)C(=O)C 62a_200000210301_100009816502 [0,1,0,0,0,0|1,0,0]=2 1744 B11R1.266 CSc1cccc(n1)C(=O)N 62a_100011834053_200000210301 [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.266 CSc1cccc(n1)C(=O)N 62a_200000210301_100011834053 [0,1,0,0,0,0|2,0,0]=3 1746 B11R1.266 CSc1cccc(n1)C(C)C 62a_100012318657_200000210301 [0,1,0,0,0,0|2,0,1]=4 1747 B11R1.266 CSc1cccc(n1)C(C)C 62a_200000210301_100012318657 [0,1,0,0,0,0|2,0,1]=4 1748 B11R1.266 CSc1cccc(n1)C(C)N 62a_200000210301_200010173468 [0,1,0,0,0,0|2,0,1]=4 1749 B11R1.266 CSc1cccc(n1)C(C)N 62a_200010173468_200000210301 [0,1,0,0,0,0|2,0,1]=4 1750 B11R1.266 CSc1cccc(n1)C(C)O 62a_100009820884_200000210301 [0,1,0,0,0,0|1,0,2]=4 1751 B11R1.266 CSc1cccc(n1)C(C)O 62a_200000210301_100009820884 [0,1,0,0,0,0|1,0,2]=4 1752 B11R1.266 CSc1cccc(n1)N(C)C 62a_100011960435_200000210301 [0,1,0,0,0,0|3,0,0]=4 1753 B11R1.266 CSc1cccc(n1)N(C)C 62a_200000210301_100011960435 [0,1,0,0,0,0|3,0,0]=4 1754 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_100000709912_200000210301 [0,1,0,0,0,0|1,0,0]=2 1755 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_200000210301_100000709912 [0,1,0,0,0,0|1,0,0]=2 1756 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_100000229564_200000210301 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_200000210301_100000229564 [0,1,0,0,0,0|2,0,0]=3 1758 B11R1.266 CSc1ccnc(c1)C(C)C 62a_100010237922_200000210301 [0,1,0,0,0,0|2,0,1]=4 1759 B11R1.266 CSc1ccnc(c1)C(C)C 62a_200000210301_100010237922 [0,1,0,0,0,0|2,0,1]=4 1760 B11R1.266 CSc1ccnc(c1)C(C)O 62a_100000144657_200000210301 [0,1,0,0,0,0|1,0,2]=4 1761 B11R1.266 CSc1ccnc(c1)C(C)O 62a_200000210301_100000144657 [0,1,0,0,0,0|1,0,2]=4 1762 B11R1.266 CSc1ccnc(c1)N(C)C 62a_100012361627_200000210301 [0,1,0,0,0,0|3,0,0]=4 1763 B11R1.266 CSc1ccnc(c1)N(C)C 62a_200000210301_100012361627 [0,1,0,0,0,0|3,0,0]=4 1764 B11R1.266 CSc1cncc(c1)C(=O)C 62a_100011216243_200000210301 [0,1,0,0,0,0|1,0,0]=2 1765 B11R1.266 CSc1cncc(c1)C(=O)C 62a_200000210301_100011216243 [0,1,0,0,0,0|1,0,0]=2 1766 B11R1.266 CSc1cncc(c1)C(=O)N 62a_100000162242_200000210301 [0,1,0,0,0,0|2,0,0]=3 1767 B11R1.266 CSc1cncc(c1)C(=O)N 62a_200000210301_100000162242 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.266 CSc1cncc(c1)C(C)C 62a_200000210301_200010191214 [0,1,0,0,0,0|2,0,1]=4 1769 B11R1.266 CSc1cncc(c1)C(C)C 62a_200010191214_200000210301 [0,1,0,0,0,0|2,0,1]=4 1770 B11R1.266 CSc1cncc(c1)C(C)O 62a_100012351597_200000210301 [0,1,0,0,0,0|1,0,2]=4 1771 B11R1.266 CSc1cncc(c1)C(C)O 62a_200000210301_100012351597 [0,1,0,0,0,0|1,0,2]=4 1772 B11R1.266 CSc1cncc(c1)N(C)C 62a_100012350714_200000210301 [0,1,0,0,0,0|3,0,0]=4 1773 B11R1.266 CSc1cncc(c1)N(C)C 62a_200000210301_100012350714 [0,1,0,0,0,0|3,0,0]=4 1774 B11R1.266 CSc1cncc(c1)[C@@H](C)N 62a_100012350620_200000210301 [0,1,0,0,0,0|2,0,1]=4 1775 B11R1.266 CSc1cncc(c1)[C@@H](C)N 62a_200000210301_100012350620 [0,1,0,0,0,0|2,0,1]=4 1776 B11R1.266 CSc1cncc(n1)C(=O)N 62a_100000764846_200000210301 [0,1,0,0,0,0|3,0,0]=4 1777 B11R1.266 CSc1cncc(n1)C(=O)N 62a_200000210301_100000764846 [0,1,0,0,0,0|3,0,0]=4 1778 B11R1.266 CSc1nccc(n1)C(=O)C 62a_100010643186_200000210301 [0,1,0,0,0,0|2,0,0]=3 1779 B11R1.266 CSc1nccc(n1)C(=O)C 62a_200000210301_100010643186 [0,1,0,0,0,0|2,0,0]=3 1780 B11R1.266 CSc1nccc(n1)C(=O)N 62a_100000066158_200000210301 [0,1,0,0,0,0|3,0,0]=4 1781 B11R1.266 CSc1nccc(n1)C(=O)N 62a_200000210301_100000066158 [0,1,0,0,0,0|3,0,0]=4 1782 B11R1.266 C[C@@H](N)c1cncc(c1)S[13CH3] 62a_100012350620_200025704644 [0,1,0,0,0,0|2,0,1]=4 1783 B11R1.266 C[C@@H](N)c1cncc(c1)S[13CH3] 62a_200025704644_100012350620 [0,1,0,0,0,0|2,0,1]=4 1784 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [0,1,0,0,0,0|0,0,1]=2 1785 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [0,1,0,0,0,0|0,0,0]=1 1786 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [0,1,0,0,0,0|1,0,0]=2 1787 B11R1.266 [13CH3]Nc1cccc(c1)C(F)F 2230a_100000058342_200025704644 [0,1,0,0,0,0|2,0,1]=4 1788 B11R1.266 [13CH3]Nc1cccc(c1)C(F)F 34a_100000058342_200025704644 [0,1,0,0,0,0|2,0,1]=4 1789 B11R1.266 [13CH3]Nc1cccc(c1)C(F)F 7a_100000058342_200025704644 [0,1,0,0,0,0|2,0,1]=4 1790 B11R1.266 [13CH3]Nc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200025704644 [0,1,0,0,0,0|2,0,0]=3 1791 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [0,1,0,0,0,0|1,0,0]=2 1792 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [0,1,0,0,0,0|1,0,0]=2 1793 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [0,1,0,0,0,0|1,1,0]=3 1794 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [0,1,0,0,0,0|2,0,0]=3 1795 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [0,1,0,0,0,0|2,0,0]=3 1796 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [0,1,0,0,0,0|2,0,0]=3 1797 B11R1.266 [13CH3]Oc1cncc(c1)[N+](=O)[O-] 34a_100009862860_200025704644 [0,1,0,0,0,0|3,0,0]=4 1798 B11R1.266 [13CH3]Oc1cncc(c1)[N+](=O)[O-] 7a_100009862860_200025704644 [0,1,0,0,0,0|3,0,0]=4 1799 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_100000229836_200025704644 [0,1,0,0,0,0|2,0,0]=3 1800 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_200025704644_100000229836 [0,1,0,0,0,0|2,0,0]=3 1801 B11R1.266 [13CH3]Sc1cc(cnn1)C(=O)N 62a_100015785749_200025704644 [0,1,0,0,0,0|3,0,0]=4 1802 B11R1.266 [13CH3]Sc1cc(cnn1)C(=O)N 62a_200025704644_100015785749 [0,1,0,0,0,0|3,0,0]=4 1803 B11R1.266 [13CH3]Sc1cc(ncn1)C(=O)N 62a_100000725265_200025704644 [0,1,0,0,0,0|3,0,0]=4 1804 B11R1.266 [13CH3]Sc1cc(ncn1)C(=O)N 62a_200025704644_100000725265 [0,1,0,0,0,0|3,0,0]=4 1805 B11R1.266 [13CH3]Sc1cccc(c1)B(O)O 62a_100000687717_200025704644 [0,1,0,0,0,0|2,0,1]=4 1806 B11R1.266 [13CH3]Sc1cccc(c1)B(O)O 62a_200025704644_100000687717 [0,1,0,0,0,0|2,0,1]=4 1807 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [0,1,0,0,0,0|1,0,0]=2 1808 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [0,1,0,0,0,0|1,0,0]=2 1809 B11R1.266 [13CH3]Sc1cccc(c1)C(F)F 62a_100009892619_200025704644 [0,1,0,0,0,0|2,0,1]=4 1810 B11R1.266 [13CH3]Sc1cccc(c1)C(F)F 62a_200025704644_100009892619 [0,1,0,0,0,0|2,0,1]=4 1811 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_100011834053_200025704644 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_200025704644_100011834053 [0,1,0,0,0,0|2,0,0]=3 1813 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_100000229564_200025704644 [0,1,0,0,0,0|2,0,0]=3 1814 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_200025704644_100000229564 [0,1,0,0,0,0|2,0,0]=3 1815 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_100000162242_200025704644 [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_200025704644_100000162242 [0,1,0,0,0,0|2,0,0]=3 1817 B11R1.266 [13CH3]Sc1cncc(n1)C(=O)N 62a_100000764846_200025704644 [0,1,0,0,0,0|3,0,0]=4 1818 B11R1.266 [13CH3]Sc1cncc(n1)C(=O)N 62a_200025704644_100000764846 [0,1,0,0,0,0|3,0,0]=4 1819 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_100000066158_200025704644 [0,1,0,0,0,0|3,0,0]=4 1820 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_200025704644_100000066158 [0,1,0,0,0,0|3,0,0]=4 1821 B9R0.42 C=CC(=O)CC(=O)C(=O)C 1458a_100000185746_100011261029 [0,0,1,0,0,0|2,0,1]=4 1822 B9R0.47 C/C=C/C=CC(=O)C(C)C 1458a_100000185730_100000210206 [0,0,1,0,0,0|2,0,1]=4 1823 B9R0.47 C/C=C/C=CC(=O)N(C)C 11a_100102631434_100000185730 [0,0,1,0,0,0|3,0,0]=4 1824 B9R0.47 C/C=C/C=CC(=O)N(C)C 1626a_100102631434_100000185730 [0,0,1,0,0,0|3,0,0]=4 1825 B9R0.47 C/C=C/C=CC(=O)N(C)C 240690a_100102631434_100000185730 [0,0,1,0,0,0|3,0,0]=4 1826 B9R0.48 CC=CC(=NNC(=O)C)C 4a_100000189765_100011218416 [0,0,1,0,0,0|2,0,1]=4 1827 B9R0.55 CC(=O)NN=CC=C(C)C 4a_100000189765_100011215525 [0,0,1,0,0,0|2,0,1]=4 1828 B11R2.35 Brc1cccc(c1)C2CC2 271570a_100011220607_100000691529 [0,0,0,1,0,0|2,0,1]=4 1829 B11R2.35 C[n+]1cccc(c1)C2CC2 271570a_100011220607_100009996589 [0,0,0,1,0,0|2,0,1]=4 1830 B11R2.35 Cc1cc(ccn1)C2CC2 271570a_100011220607_100000758586 [0,0,0,1,0,0|2,0,1]=4 1831 B11R2.35 Cc1cccc(c1)C2CC2 271570a_100011220607_100011215228 [0,0,0,1,0,0|1,0,1]=3 1832 B11R2.35 Cc1cccc(n1)C2CC2 271570a_100011220607_100000742759 [0,0,0,1,0,0|2,0,1]=4 1833 B11R2.35 Cc1ccnc(c1)C2CC2 271570a_100011220607_100000750283 [0,0,0,1,0,0|2,0,1]=4 1834 B11R2.35 Cc1cncc(c1)C2CC2 271570a_100011220607_100000760492 [0,0,0,1,0,0|2,0,1]=4 1835 B11R2.35 Clc1cccc(c1)C2CC2 271570a_100011220607_100000699651 [0,0,0,1,0,0|2,0,1]=4 1836 B11R2.35 Fc1cccc(c1)C2CC2 271570a_100011220607_100000685547 [0,0,0,1,0,0|2,0,1]=4 1837 B11R2.35 Nc1cccc(c1)C2CC2 271570a_100011220607_100000210019 [0,0,0,1,0,0|2,0,1]=4 1838 B11R2.35 Oc1cccc(c1)C2CC2 271570a_100011220607_100000211634 [0,0,0,1,0,0|2,0,1]=4 1839 B11R2.35 Oc1cccc(c1)C2CC2 271570a_203496583355_100009816567 [0,0,0,1,0,0|2,0,1]=4 1840 B11R2.35 [S]c1cccc(c1)C2CC2 271570a_100011220607_114929384022 [0,0,0,1,0,0|2,0,1]=4 1841 B9R1.35 C=C(C)c1c[nH]c(n1)C 271570a_100000694244_100009814057 [0,0,0,0,1,0|3,0,0]=4 1842 B9R1.35 C=C(C)c1cc([nH]n1)C 271570a_100000694244_100015199547 [0,0,0,0,1,0|3,0,0]=4 1843 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [0,0,0,0,1,0|2,0,0]=3 1844 B9R1.35 C=C(C)c1cc(ns1)C 271570a_100000694244_100009815735 [0,0,0,0,1,0|3,0,0]=4 1845 B9R1.35 C=C(C)c1ccc(s1)Br 271570a_100000694244_100010197418 [0,0,0,0,1,0|3,0,0]=4 1846 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [0,0,0,0,1,0|2,0,0]=3 1847 B9R1.35 C=C(C)c1ccn(n1)C 271570a_100000694244_100000752436 [0,0,0,0,1,0|3,0,0]=4 1848 B9R1.35 C=C(C)c1cn(cn1)C 271570a_100000694244_100000040308 [0,0,0,0,1,0|3,0,0]=4 1849 B9R1.35 C=C(C)c1cnc(s1)C 271570a_100000694244_100000764884 [0,0,0,0,1,0|3,0,0]=4 1850 B9R1.35 C=C(C)c1cnn(c1)C 271570a_100000694244_100000748075 [0,0,0,0,1,0|3,0,0]=4 1851 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [0,0,0,0,1,0|2,0,0]=3 1852 B9R1.35 C=C(C)c1csc(n1)C 271570a_100000694244_100011934587 [0,0,0,0,1,0|3,0,0]=4 1853 B9R1.35 C=C(C)c1nc(c[nH]1)C 271570a_100000694244_100161115468 [0,0,0,0,1,0|3,0,0]=4 1854 B9R1.35 C=C(C)c1nc(cs1)C 271570a_100000694244_100011291629 [0,0,0,0,1,0|3,0,0]=4 1855 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [0,0,0,0,1,0|3,0,0]=4 1856 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [0,0,0,0,1,0|2,0,0]=3 1857 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [0,0,0,0,1,0|2,0,0]=3 1858 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [0,0,0,0,1,0|2,0,0]=3 1859 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [0,0,0,0,1,0|2,0,0]=3 1860 B9R1.35 CC(=O)c1cn(nn1)C 274090a_200000210301_100000690481 [0,0,0,0,1,0|3,0,0]=4 1861 B9R1.35 CC(=O)c1cn(nn1)[13CH3] 274090a_200025704644_100000690481 [0,0,0,0,1,0|3,0,0]=4 1862 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [0,0,0,0,1,0|3,0,0]=4 1863 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [0,0,0,0,1,0|2,0,0]=3 1864 B9R1.35 CC(=O)c1nc(cs1)O 271570a_203496583355_100010231720 [0,0,0,0,1,0|3,0,0]=4 1865 B9R1.35 CC(=O)c1ncc(s1)O 271570a_203496583355_100000693680 [0,0,0,0,1,0|3,0,0]=4 1866 B9R1.35 CC(=O)n1cc(cn1)O 271570a_203496583355_100010205889 [0,0,0,0,1,0|3,0,0]=4 1867 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [0,0,0,0,1,0|3,0,0]=4 1868 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [0,0,0,0,1,0|3,0,0]=4 1869 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [0,0,0,0,1,0|3,0,0]=4 1870 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [0,0,0,0,1,0|3,0,0]=4 1871 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [0,0,0,0,1,0|3,0,0]=4 1872 B9R1.41 C=C(C)c1c[nH]nc1C 271570a_100000694244_100011912673 [0,0,0,0,1,0|3,0,0]=4 1873 B9R1.41 C=C(C)c1ccnn1C 271570a_100000694244_100000688441 [0,0,0,0,1,0|3,0,0]=4 1874 B9R1.41 C=C(C)c1ccsc1C 271570a_100000694244_100000684487 [0,0,0,0,1,0|2,0,0]=3 1875 B9R1.41 C=C(C)c1cncn1C 271570a_100000694244_100009814087 [0,0,0,0,1,0|3,0,0]=4 1876 B9R1.41 C=C(C)c1cnoc1C 271570a_100000694244_100009872056 [0,0,0,0,1,0|3,0,0]=4 1877 B9R1.41 C=C(C)c1cscc1Br 271570a_100000694244_100010143727 [0,0,0,0,1,0|3,0,0]=4 1878 B9R1.41 C=C(C)c1cscc1C 271570a_100000694244_100000759966 [0,0,0,0,1,0|2,0,0]=3 1879 B9R1.41 C=C(C)c1n[nH]cc1C 271570a_100000694244_100009871783 [0,0,0,0,1,0|3,0,0]=4 1880 B9R1.41 C=C(C)c1nc[nH]c1C 271570a_100000694244_100009816806 [0,0,0,0,1,0|3,0,0]=4 1881 B9R1.41 C=C(C)c1nccn1C 271570a_100000694244_100000707724 [0,0,0,0,1,0|3,0,0]=4 1882 B9R1.41 C=C(C)c1ncsc1C 271570a_100000694244_100000732656 [0,0,0,0,1,0|3,0,0]=4 1883 B9R1.41 C=C(C)c1sccc1Br 271570a_100000694244_100012361411 [0,0,0,0,1,0|3,0,0]=4 1884 B9R1.41 C=C(C)c1sccc1C 271570a_100000694244_100000742657 [0,0,0,0,1,0|2,0,0]=3 1885 B9R1.41 C=C(C)c1scnc1C 271570a_100000694244_100009817116 [0,0,0,0,1,0|3,0,0]=4 1886 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [0,0,0,0,1,0|2,0,0]=3 1887 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [0,0,0,0,1,0|3,0,0]=4 1888 B9R1.41 NC(=O)c1cscc1O 271570a_203496583355_100009817205 [0,0,0,0,1,0|3,0,0]=4 1889 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [0,0,0,0,0,1|2,0,0]=3 1890 B11R1.157 CC(=Cc1cc(ccn1)Cl)C 271570a_100102525489_100010167805 [0,0,0,0,0,1|3,0,0]=4 1891 B11R1.157 CC(=Cc1cc(ccn1)F)C 271570a_100102525489_100009817058 [0,0,0,0,0,1|3,0,0]=4 1892 B11R1.157 CC(=Cc1cc(ccn1)N)C 271570a_100102525489_100009814236 [0,0,0,0,0,1|3,0,0]=4 1893 B11R1.157 CC(=Cc1cc(ccn1)O)C 271570a_100102525489_100000762945 [0,0,0,0,0,1|3,0,0]=4 1894 B11R1.157 CC(=Cc1cc(cnn1)C)C 271570a_100102525489_100000070100 [0,0,0,0,0,1|3,0,0]=4 1895 B11R1.157 CC(=Cc1cc(ncn1)C)C 271570a_100102525489_100000744208 [0,0,0,0,0,1|3,0,0]=4 1896 B11R1.157 CC(=Cc1cc[nH]c(=O)c1)C 271570a_100102525489_100009816521 [0,0,0,0,0,1|3,0,0]=4 1897 B11R1.157 CC(=Cc1ccc[n+](c1)C)C 271570a_100102525489_100009996589 [0,0,0,0,0,1|2,0,0]=3 1898 B11R1.157 CC(=Cc1ccc[n+](c1)[O-])C 271570a_100102525489_100009815978 [0,0,0,0,0,1|3,0,0]=4 1899 B11R1.157 CC(=Cc1cccc(=O)[nH]1)C 271570a_100102525489_100000761760 [0,0,0,0,0,1|3,0,0]=4 1900 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [0,0,0,0,0,1|2,0,0]=3 1901 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [0,0,0,0,0,1|1,0,0]=2 1902 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [0,0,0,0,0,1|2,0,0]=3 1903 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [0,0,0,0,0,1|2,0,0]=3 1904 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [0,0,0,0,0,1|2,0,0]=3 1905 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [0,0,0,0,0,1|2,0,0]=3 1906 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [0,0,0,0,0,1|2,0,0]=3 1907 B11R1.157 CC(=Cc1cccc(n1)Br)C 271570a_100102525489_100000684672 [0,0,0,0,0,1|3,0,0]=4 1908 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [0,0,0,0,0,1|2,0,0]=3 1909 B11R1.157 CC(=Cc1cccc(n1)F)C 271570a_100102525489_100009815982 [0,0,0,0,0,1|3,0,0]=4 1910 B11R1.157 CC(=Cc1cccc(n1)N)C 271570a_100102525489_100000740741 [0,0,0,0,0,1|3,0,0]=4 1911 B11R1.157 CC(=Cc1ccnc(c1)Br)C 271570a_100102525489_100009814637 [0,0,0,0,0,1|3,0,0]=4 1912 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [0,0,0,0,0,1|2,0,0]=3 1913 B11R1.157 CC(=Cc1ccnc(c1)Cl)C 271570a_100102525489_100000035001 [0,0,0,0,0,1|3,0,0]=4 1914 B11R1.157 CC(=Cc1ccnc(c1)F)C 271570a_100102525489_100009816116 [0,0,0,0,0,1|3,0,0]=4 1915 B11R1.157 CC(=Cc1ccnc(c1)N)C 271570a_100102525489_100000744379 [0,0,0,0,0,1|3,0,0]=4 1916 B11R1.157 CC(=Cc1ccnc(n1)C)C 271570a_100102525489_100000749937 [0,0,0,0,0,1|3,0,0]=4 1917 B11R1.157 CC(=Cc1cncc(c1)Br)C 271570a_100102525489_100000728054 [0,0,0,0,0,1|3,0,0]=4 1918 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [0,0,0,0,0,1|2,0,0]=3 1919 B11R1.157 CC(=Cc1cncc(c1)Cl)C 271570a_100102525489_100000049639 [0,0,0,0,0,1|3,0,0]=4 1920 B11R1.157 CC(=Cc1cncc(c1)F)C 271570a_100102525489_100000744099 [0,0,0,0,0,1|3,0,0]=4 1921 B11R1.157 CC(=Cc1cncc(c1)N)C 271570a_100102525489_100000687067 [0,0,0,0,0,1|3,0,0]=4 1922 B11R1.157 CC(=Cc1cncc(c1)O)C 271570a_100102525489_100000754920 [0,0,0,0,0,1|3,0,0]=4 1923 B11R1.157 CC(=Cc1cncc(n1)C)C 271570a_100102525489_100009842155 [0,0,0,0,0,1|3,0,0]=4 1924 B11R1.157 CC(=Cc1nccc(n1)C)C 271570a_100102525489_100011243806 [0,0,0,0,0,1|3,0,0]=4 1925 B11R1.157 CC(=O)Cc1cc(ccn1)Br 1458a_100000070787_100010173614 [0,0,0,0,0,1|2,0,0]=3 1926 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [0,0,0,0,0,1|1,0,0]=2 1927 B11R1.157 CC(=O)Cc1cc(ccn1)Cl 1458a_100000070787_100016988179 [0,0,0,0,0,1|2,0,0]=3 1928 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [0,0,0,0,0,1|1,0,0]=2 1929 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [0,0,0,0,0,1|1,0,0]=2 1930 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [0,0,0,0,0,1|0,0,0]=1 1931 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [0,0,0,0,0,1|0,0,0]=1 1932 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [0,0,0,0,0,1|1,0,0]=2 1933 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [0,0,0,0,0,1|1,0,0]=2 1934 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [0,0,0,0,0,1|1,0,0]=2 1935 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [0,0,0,0,0,1|1,0,0]=2 1936 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [0,0,0,0,0,1|1,0,0]=2 1937 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [0,0,0,0,0,1|1,0,0]=2 1938 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [0,0,0,0,0,1|1,0,0]=2 1939 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [0,0,0,0,0,1|1,0,0]=2 1940 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [0,0,0,0,0,1|1,0,0]=2 1941 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100000070787_100009889011 [0,0,0,0,0,1|2,0,0]=3 1942 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000210301 [0,0,0,0,0,1|2,0,0]=3 1943 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [0,0,0,0,0,1|1,0,0]=2 1944 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [0,0,0,0,0,1|1,0,0]=2 1945 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000070787_100000086093 [0,0,0,0,0,1|2,0,0]=3 1946 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000210301 [0,0,0,0,0,1|2,0,0]=3 1947 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000070787_100009819644 [0,0,0,0,0,1|2,0,0]=3 1948 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000096803_200000210301 [0,0,0,0,0,1|2,0,0]=3 1949 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100000070787_100010243470 [0,0,0,0,0,1|2,0,0]=3 1950 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000210301 [0,0,0,0,0,1|2,0,0]=3 1951 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [0,0,0,0,0,1|1,0,0]=2 1952 B11R1.157 CC(=O)Cc1ccnc(c1)Cl 1458a_100000070787_100000764220 [0,0,0,0,0,1|2,0,0]=3 1953 B11R1.157 CC(=O)Cc1ccnc(n1)Cl 1458a_100000070787_100000099655 [0,0,0,0,0,1|3,0,0]=4 1954 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000070787_100011740620 [0,0,0,0,0,1|2,0,0]=3 1955 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000210301 [0,0,0,0,0,1|2,0,0]=3 1956 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [0,0,0,0,0,1|1,0,0]=2 1957 B11R1.157 CC(=O)Cc1cncc(c1)Cl 1458a_100000070787_100016992070 [0,0,0,0,0,1|2,0,0]=3 1958 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100000070787_100000725299 [0,0,0,0,0,1|2,0,0]=3 1959 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100011667516_200000210301 [0,0,0,0,0,1|2,0,0]=3 1960 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [0,0,0,0,0,1|2,0,0]=3 1961 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,0,0,0,0,1|1,0,0]=2 1962 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,0,0,0,0,1|1,0,0]=2 1963 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,0,0,0,0,1|1,0,0]=2 1964 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,0,0,0,0,1|1,0,0]=2 1965 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,0,0,0,0,1|0,0,0]=1 1966 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,0,0,0,0,1|0,0,0]=1 1967 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,0,0,0,0,1|0,0,0]=1 1968 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,0,0,0,0,1|0,0,0]=1 1969 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,0,0,0,0,1|1,0,0]=2 1970 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,0,0,0,0,1|1,0,0]=2 1971 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,0,0,0,0,1|1,0,0]=2 1972 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,0,0,0,0,1|1,0,0]=2 1973 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,0,0,0,0,1|1,0,0]=2 1974 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,0,0,0,0,1|1,0,0]=2 1975 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,0,0,0,0,1|1,0,0]=2 1976 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,0,0,0,0,1|1,0,0]=2 1977 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,0,0,0,0,1|1,0,0]=2 1978 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,0,0,0,0,1|1,0,0]=2 1979 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,0,0,0,0,1|1,0,0]=2 1980 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,0,0,0,0,1|1,0,0]=2 1981 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,0,0,0,0,1|1,0,0]=2 1982 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,0,0,0,0,1|1,0,0]=2 1983 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,0,0,0,0,1|1,0,0]=2 1984 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [0,0,0,0,0,1|2,0,0]=3 1985 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [0,0,0,0,0,1|2,0,0]=3 1986 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [0,0,0,0,0,1|2,0,0]=3 1987 B11R1.157 CC(=O)Nc1cncc(n1)O 271570a_203496583355_100000703374 [0,0,0,0,0,1|3,0,0]=4 1988 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [0,0,0,0,0,1|1,0,0]=2 1989 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [0,0,0,0,0,1|2,0,1]=4 1990 B11R1.157 CC(C)Nc1cccc(c1)Br 34a_100000210019_100000210206 [0,0,0,0,0,1|2,0,1]=4 1991 B11R1.157 CC(C)Nc1cccc(c1)Cl 34a_100000185859_100000210206 [0,0,0,0,0,1|2,0,1]=4 1992 B11R1.157 CC(C)Nc1cccc(c1)F 34a_100000210047_100000210206 [0,0,0,0,0,1|2,0,1]=4 1993 B11R1.157 CC(C)Nc1cccc(c1)I 34a_100000211102_100000210206 [0,0,0,0,0,1|2,0,1]=4 1994 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [0,0,0,0,0,1|2,0,1]=4 1995 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [0,0,0,0,0,1|2,0,1]=4 1996 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [0,0,0,0,0,1|2,0,1]=4 1997 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [0,0,0,0,0,1|2,0,1]=4 1998 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [0,0,0,0,0,1|2,0,1]=4 1999 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [0,0,0,0,0,1|2,0,1]=4 2000 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [0,0,0,0,0,1|2,0,1]=4 2001 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [0,0,0,0,0,1|2,0,1]=4 2002 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [0,0,0,0,0,1|2,0,1]=4 2003 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [0,0,0,0,0,1|2,0,1]=4 2004 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [0,0,0,0,0,1|2,0,1]=4 2005 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [0,0,0,0,0,1|2,0,1]=4 2006 B11R1.157 CC(C)Sc1ccc[n+](c1)C 62a_100000210206_100009996589 [0,0,0,0,0,1|2,0,1]=4 2007 B11R1.157 CC(C)Sc1ccc[n+](c1)C 62a_100009996589_100000210206 [0,0,0,0,0,1|2,0,1]=4 2008 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000210206_100000691529 [0,0,0,0,0,1|2,0,1]=4 2009 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000691529_100000210206 [0,0,0,0,0,1|2,0,1]=4 2010 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000210206_100000699651 [0,0,0,0,0,1|2,0,1]=4 2011 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000699651_100000210206 [0,0,0,0,0,1|2,0,1]=4 2012 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000210206_100000685547 [0,0,0,0,0,1|2,0,1]=4 2013 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000685547_100000210206 [0,0,0,0,0,1|2,0,1]=4 2014 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210019_100000210206 [0,0,0,0,0,1|2,0,1]=4 2015 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210206_100000210019 [0,0,0,0,0,1|2,0,1]=4 2016 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [0,0,0,0,0,1|2,0,1]=4 2017 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [0,0,0,0,0,1|2,0,1]=4 2018 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_100000210206_114929384022 [0,0,0,0,0,1|2,0,1]=4 2019 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_114929384022_100000210206 [0,0,0,0,0,1|2,0,1]=4 2020 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [0,0,0,0,0,1|3,0,0]=4 2021 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [0,0,0,0,0,1|3,0,0]=4 2022 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [0,0,0,0,0,1|3,0,0]=4 2023 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [0,0,0,0,0,1|3,0,0]=4 2024 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [0,0,0,0,0,1|3,0,0]=4 2025 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [0,0,0,0,0,1|3,0,0]=4 2026 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [0,0,0,0,0,1|3,0,0]=4 2027 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [0,0,0,0,0,1|3,0,0]=4 2028 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [0,0,0,0,0,1|3,0,0]=4 2029 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [0,0,0,0,0,1|3,0,0]=4 2030 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [0,0,0,0,0,1|3,0,0]=4 2031 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [0,0,0,0,0,1|3,0,0]=4 2032 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [0,0,0,0,0,1|3,0,0]=4 2033 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [0,0,0,0,0,1|3,0,0]=4 2034 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [0,0,0,0,0,1|3,0,0]=4 2035 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [0,0,0,0,0,1|3,0,0]=4 2036 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [0,0,0,0,0,1|3,0,0]=4 2037 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [0,0,0,0,0,1|3,0,0]=4 2038 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [0,0,0,0,0,1|3,0,0]=4 2039 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [0,0,0,0,0,1|3,0,0]=4 2040 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [0,0,0,0,0,1|3,0,0]=4 2041 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [0,0,0,0,0,1|3,0,0]=4 2042 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [0,0,0,0,0,1|3,0,0]=4 2043 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [0,0,0,0,0,1|3,0,0]=4 2044 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [0,0,0,0,0,1|3,0,0]=4 2045 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [0,0,0,0,0,1|3,0,0]=4 2046 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [0,0,0,0,0,1|3,0,0]=4 2047 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [0,0,0,0,0,1|3,0,0]=4 2048 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [0,0,0,0,0,1|3,0,0]=4 2049 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [0,0,0,0,0,1|3,0,0]=4 2050 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [0,0,0,0,0,1|3,0,0]=4 2051 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [0,0,0,0,0,1|3,0,0]=4 2052 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [0,0,0,0,0,1|3,0,0]=4 2053 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [0,0,0,0,0,1|3,0,0]=4 2054 B11R1.157 Cc1cc(ccn1)CN(C)C 2230a_100102631434_200020672517 [0,0,0,0,0,1|3,0,0]=4 2055 B11R1.157 Cc1cc(ccn1)CN(C)C 269982a_100102631434_200020672517 [0,0,0,0,0,1|3,0,0]=4 2056 B11R1.157 Cc1cc(ccn1)CN(C)C 270004a_100102631434_100011361630 [0,0,0,0,0,1|3,0,0]=4 2057 B11R1.157 Cc1cc(ccn1)NC(C)C 27a_100138425928_100000758586 [0,0,0,0,0,1|2,0,1]=4 2058 B11R1.157 Cc1cc(ccn1)OC(C)C 34a_100000688365_100000210206 [0,0,0,0,0,1|2,0,1]=4 2059 B11R1.157 Cc1cc(ccn1)SC(C)C 62a_100000210206_100000758586 [0,0,0,0,0,1|2,0,1]=4 2060 B11R1.157 Cc1cc(ccn1)SC(C)C 62a_100000758586_100000210206 [0,0,0,0,0,1|2,0,1]=4 2061 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [0,0,0,0,0,1|0,0,0]=1 2062 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [0,0,0,0,0,1|2,0,0]=3 2063 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [0,0,0,0,0,1|2,0,0]=3 2064 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [0,0,0,0,0,1|2,0,0]=3 2065 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [0,0,0,0,0,1|2,0,0]=3 2066 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [0,0,0,0,0,1|2,0,0]=3 2067 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [0,0,0,0,0,1|2,0,0]=3 2068 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [0,0,0,0,0,1|2,0,0]=3 2069 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [0,0,0,0,0,1|2,0,0]=3 2070 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [0,0,0,0,0,1|2,0,0]=3 2071 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [0,0,0,0,0,1|1,0,1]=3 2072 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [0,0,0,0,0,1|1,0,1]=3 2073 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [0,0,0,0,0,1|1,0,1]=3 2074 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [0,0,0,0,0,1|1,0,1]=3 2075 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [0,0,0,0,0,1|1,0,1]=3 2076 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [0,0,0,0,0,1|1,0,1]=3 2077 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [0,0,0,0,0,1|1,0,0]=2 2078 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100000687132_200000210301 [0,0,0,0,0,1|3,0,0]=4 2079 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100102631434_100000757606 [0,0,0,0,0,1|3,0,0]=4 2080 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100000687132_200000210301 [0,0,0,0,0,1|3,0,0]=4 2081 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100102631434_100000757606 [0,0,0,0,0,1|3,0,0]=4 2082 B11R1.157 Cc1cccc(n1)CN(C)C 270004a_100102631434_100011215050 [0,0,0,0,0,1|3,0,0]=4 2083 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 2230a_100000687132_200025704644 [0,0,0,0,0,1|3,0,0]=4 2084 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 269982a_100000687132_200025704644 [0,0,0,0,0,1|3,0,0]=4 2085 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000210206_100000742759 [0,0,0,0,0,1|2,0,1]=4 2086 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000742759_100000210206 [0,0,0,0,0,1|2,0,1]=4 2087 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_100102631434_100000718516 [0,0,0,0,0,1|3,0,0]=4 2088 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_106354213154_200000210301 [0,0,0,0,0,1|3,0,0]=4 2089 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_100102631434_100000718516 [0,0,0,0,0,1|3,0,0]=4 2090 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_106354213154_200000210301 [0,0,0,0,0,1|3,0,0]=4 2091 B11R1.157 Cc1ccnc(c1)CN(C)C 270004a_100102631434_100011361488 [0,0,0,0,0,1|3,0,0]=4 2092 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 2230a_106354213154_200025704644 [0,0,0,0,0,1|3,0,0]=4 2093 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 269982a_106354213154_200025704644 [0,0,0,0,0,1|3,0,0]=4 2094 B11R1.157 Cc1ccnc(c1)SC(C)C 62a_100000210206_100000750283 [0,0,0,0,0,1|2,0,1]=4 2095 B11R1.157 Cc1ccnc(c1)SC(C)C 62a_100000750283_100000210206 [0,0,0,0,0,1|2,0,1]=4 2096 B11R1.157 Cc1cncc(c1)CN(C)C 2230a_100102631434_100000716715 [0,0,0,0,0,1|3,0,0]=4 2097 B11R1.157 Cc1cncc(c1)CN(C)C 269982a_100102631434_100000716715 [0,0,0,0,0,1|3,0,0]=4 2098 B11R1.157 Cc1cncc(c1)CN(C)C 270004a_100102631434_100011998712 [0,0,0,0,0,1|3,0,0]=4 2099 B11R1.157 Cc1cncc(c1)OC(C)C 34a_100011830280_100000210206 [0,0,0,0,0,1|2,0,1]=4 2100 B11R1.157 Cc1cncc(c1)OC(C)C 7a_100011830280_100000210206 [0,0,0,0,0,1|2,0,1]=4 2101 B11R1.157 Cc1cncc(c1)SC(C)C 62a_100000210206_100000760492 [0,0,0,0,0,1|2,0,1]=4 2102 B11R1.157 Cc1cncc(c1)SC(C)C 62a_100000760492_100000210206 [0,0,0,0,0,1|2,0,1]=4 2103 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [0,0,0,0,0,1|2,0,0]=3 2104 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [0,0,0,0,0,1|2,0,0]=3 2105 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [0,0,0,0,0,1|1,0,0]=2 2106 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [0,0,0,0,0,1|1,0,0]=2 2107 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [0,0,0,0,0,1|1,0,0]=2 2108 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [0,0,0,0,0,1|1,0,0]=2 2109 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [0,0,0,0,0,1|1,0,0]=2 2110 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Br 1458a_100010201708_200025704644 [0,0,0,0,0,1|2,0,0]=3 2111 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200025704644 [0,0,0,0,0,1|2,0,0]=3 2112 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)F 1458a_100000096803_200025704644 [0,0,0,0,0,1|2,0,0]=3 2113 B11R1.157 [13CH3]C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200025704644 [0,0,0,0,0,1|2,0,0]=3 2114 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)Br 1458a_100000239331_200025704644 [0,0,0,0,0,1|2,0,0]=3 2115 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)F 1458a_100011667516_200025704644 [0,0,0,0,0,1|2,0,0]=3 2116 B8R0.9 C=CC(=NNC(=O)C)C 4a_100000189765_200015361842 [1,0,1,0,0,0|2,0,0]=4 2117 B8R0.9 CC=C(C)C=CC(=O)C 1458a_100000692105_200000210301 [1,0,1,0,0,0|0,0,1]=3 2118 B8R0.9 CC=C(C)C=CC(=O)[13CH3] 1458a_100000692105_200025704644 [1,0,1,0,0,0|0,0,1]=3 2119 B8R0.6 C/C=C/C=CC(=O)CC 1458a_100000185730_100000210202 [1,0,1,0,0,0|1,0,1]=4 2120 B8R0.6 C/C=C/C=CC(=O)NC 11a_106832991635_100000185730 [1,0,1,0,0,0|2,0,0]=4 2121 B8R0.6 C/C=C/C=CC(=O)NC 1626a_100102657272_100000185730 [1,0,1,0,0,0|2,0,0]=4 2122 B8R0.6 C/C=C/C=CC(=O)NC 240690a_100102657272_100000185730 [1,0,1,0,0,0|2,0,0]=4 2123 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,1]=3 2124 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|1,0,1]=4 2125 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|1,0,1]=4 2126 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|1,0,1]=4 2127 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,0]=3 2128 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 2129 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 2130 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 2131 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 2132 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 2133 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 2134 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 2135 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 2136 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 2137 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 2138 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 2139 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 2140 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 2141 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,0]=3 2142 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 2143 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 2144 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 2145 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 2146 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 2147 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 2148 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 2149 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 2150 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 2151 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 2152 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 2153 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 2154 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 2155 B8R1.4 C[n+]1cccc(c1)O 271570a_203496583355_100009996589 [2,0,0,0,0,0|1,0,1]=4 2156 B8R1.4 Cc1cc(ccn1)O 271570a_203496583355_100000758586 [2,0,0,0,0,0|1,0,1]=4 2157 B8R1.4 Cc1cccc(c1)O 271570a_203496583355_100011215228 [2,0,0,0,0,0|0,0,1]=3 2158 B8R1.4 Cc1cccc(n1)O 271570a_203496583355_100000742759 [2,0,0,0,0,0|1,0,1]=4 2159 B8R1.4 Cc1ccnc(c1)O 271570a_203496583355_100000750283 [2,0,0,0,0,0|1,0,1]=4 2160 B8R1.4 Cc1cncc(c1)O 271570a_203496583355_100000760492 [2,0,0,0,0,0|1,0,1]=4 2161 B8R1.4 Nc1cccc(c1)O 271570a_203496583355_100000210019 [2,0,0,0,0,0|1,0,1]=4 2162 B8R1.4 O=c1cc(cc[nH]1)O 271570a_203496583355_100009816521 [2,0,0,0,0,0|2,0,0]=4 2163 B8R1.4 O=c1cccc([nH]1)O 271570a_203496583355_100000761760 [2,0,0,0,0,0|2,0,0]=4 2164 B8R1.4 Oc1cccc(c1)Br 271570a_203496583355_100000691529 [2,0,0,0,0,0|1,0,1]=4 2165 B8R1.4 Oc1cccc(c1)Cl 271570a_203496583355_100000699651 [2,0,0,0,0,0|1,0,1]=4 2166 B8R1.4 Oc1cccc(c1)F 271570a_203496583355_100000685547 [2,0,0,0,0,0|1,0,1]=4 2167 B8R1.4 Oc1cccc(c1)O 271570a_203496583355_100000211634 [2,0,0,0,0,0|1,0,1]=4 2168 B8R1.4 Oc1cccc(c1)[S] 271570a_203496583355_114929384022 [2,0,0,0,0,0|1,0,1]=4 2169 B10R0.108 C=CCC(=O)C=CC(=O)NC 1458a_100016259477_100000210623 [0,1,1,0,0,0|1,0,1]=4 2170 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,1,0,0,0,0|1,0,1]=4 2171 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,1,0,0,0,0|1,0,1]=4 2172 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,1,0,0,0,0|0,0,1]=3 2173 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,1,0,0,0,0|1,0,1]=4 2174 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,1,0,0,0,0|1,0,1]=4 2175 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,1,0,0,0,0|1,0,1]=4 2176 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,1,0,0,0,0|1,0,1]=4 2177 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,1,0,0,0,0|1,0,1]=4 2178 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,1,0,0,0,0|0,0,1]=3 2179 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,1,0,0,0,0|1,0,1]=4 2180 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,1,0,0,0,0|1,0,1]=4 2181 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,1,0,0,0,0|1,0,1]=4 2182 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,1,0,0,0,0|1,0,1]=4 2183 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,1,0,0,0,0|0,0,1]=3 2184 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,1,0,0,0,0|1,0,1]=4 2185 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,1,0,0,0,0|1,0,1]=4 2186 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,1,0,0,0,0|1,0,1]=4 2187 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,1,0,0,0,0|1,0,1]=4 2188 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,1,0,0,0,0|1,0,1]=4 2189 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,1,0,0,0,0|0,0,1]=3 2190 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,1,0,0,0,0|1,0,1]=4 2191 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,1,0,0,0,0|1,0,1]=4 2192 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,1,0,0,0,0|1,0,1]=4 2193 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,1,0,0,0,0|1,0,1]=4 2194 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,1,0,0,0,0|1,0,1]=4 2195 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,1,0,0,0,0|0,0,1]=3 2196 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,1,0,0,0,0|1,0,1]=4 2197 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,1,0,0,0,0|1,0,1]=4 2198 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,1,0,0,0,0|1,0,1]=4 2199 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,1,0,0,0,0|1,0,1]=4 2200 B10R1.2 C=Cc1cccn(c1=O)C 271570a_100011290941_100000687173 [1,1,0,0,0,0|1,0,1]=4 2201 B10R1.2 C=Cc1ccnc(c1C)C 271570a_100011290941_100009846815 [1,1,0,0,0,0|1,0,1]=4 2202 B10R1.2 C=Cc1ccnc(c1Cl)C 271570a_100011290941_100000698670 [1,1,0,0,0,0|1,0,1]=4 2203 B10R1.2 C=Cc1ccnc(c1F)C 271570a_100011290941_100009849794 [1,1,0,0,0,0|1,0,1]=4 2204 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [1,1,0,0,0,0|1,0,1]=4 2205 B10R1.2 C=Cc1cncc(c1C)C 271570a_100011290941_100009864703 [1,1,0,0,0,0|1,0,1]=4 2206 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,1,0,0,0,0|1,0,1]=4 2207 B10R1.2 C=Cc1nccc(c1C)C 271570a_100011290941_100009847204 [1,1,0,0,0,0|1,0,1]=4 2208 B10R1.2 C=Cc1nccc(c1F)C 271570a_100011290941_100009817629 [1,1,0,0,0,0|1,0,1]=4 2209 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [1,1,0,0,0,0|1,0,1]=4 2210 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,1,0,0,0,0|1,0,1]=4 2211 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,1,0,0,0,0|0,0,1]=3 2212 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,1,0,0,0,0|1,0,1]=4 2213 B10R1.2 CNc1cccc(c1Br)C 34a_100000684715_200000210301 [1,1,0,0,0,0|1,0,0]=3 2214 B10R1.2 CNc1cccc(c1Br)Cl 34a_100000687072_200000210301 [1,1,0,0,0,0|2,0,0]=4 2215 B10R1.2 CNc1cccc(c1Br)F 34a_100011934729_200000210301 [1,1,0,0,0,0|2,0,0]=4 2216 B10R1.2 CNc1cccc(c1Br)O 34a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 2217 B10R1.2 CNc1cccc(c1Br)O 7a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 2218 B10R1.2 CNc1cccc(c1C)Br 34a_100000750434_200000210301 [1,1,0,0,0,0|2,0,0]=4 2219 B10R1.2 CNc1cccc(c1C)C 2230a_100000210026_200000210301 [1,1,0,0,0,0|1,0,0]=3 2220 B10R1.2 CNc1cccc(c1C)C 34a_100000210026_200000210301 [1,1,0,0,0,0|1,0,0]=3 2221 B10R1.2 CNc1cccc(c1C)C 7a_100000210026_200000210301 [1,1,0,0,0,0|1,0,0]=3 2222 B10R1.2 CNc1cccc(c1C)Cl 2230a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 2223 B10R1.2 CNc1cccc(c1C)Cl 34a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.2 CNc1cccc(c1C)Cl 7a_100000210441_200000210301 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.2 CNc1cccc(c1C)F 34a_100000745574_200000210301 [1,1,0,0,0,0|2,0,0]=4 2226 B10R1.2 CNc1cccc(c1C)F 7a_100000745574_200000210301 [1,1,0,0,0,0|2,0,0]=4 2227 B10R1.2 CNc1cccc(c1C)I 34a_100000761887_200000210301 [1,1,0,0,0,0|2,0,0]=4 2228 B10R1.2 CNc1cccc(c1C)O 34a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2229 B10R1.2 CNc1cccc(c1C)O 7a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2230 B10R1.2 CNc1cccc(c1Cl)Br 34a_100000687075_200000210301 [1,1,0,0,0,0|2,0,0]=4 2231 B10R1.2 CNc1cccc(c1Cl)C 34a_100000765562_200000210301 [1,1,0,0,0,0|1,0,0]=3 2232 B10R1.2 CNc1cccc(c1Cl)C 7a_100000765562_200000210301 [1,1,0,0,0,0|1,0,0]=3 2233 B10R1.2 CNc1cccc(c1Cl)Cl 34a_100000185733_200000210301 [1,1,0,0,0,0|2,0,0]=4 2234 B10R1.2 CNc1cccc(c1Cl)F 34a_100000692321_200000210301 [1,1,0,0,0,0|2,0,0]=4 2235 B10R1.2 CNc1cccc(c1Cl)O 34a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 2236 B10R1.2 CNc1cccc(c1Cl)O 7a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 2237 B10R1.2 CNc1cccc(c1F)Br 2230a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 2238 B10R1.2 CNc1cccc(c1F)Br 34a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 2239 B10R1.2 CNc1cccc(c1F)C 2230a_100000697159_200000210301 [1,1,0,0,0,0|1,0,0]=3 2240 B10R1.2 CNc1cccc(c1F)C 34a_100000697159_200000210301 [1,1,0,0,0,0|1,0,0]=3 2241 B10R1.2 CNc1cccc(c1F)C 7a_100000697159_200000210301 [1,1,0,0,0,0|1,0,0]=3 2242 B10R1.2 CNc1cccc(c1F)Cl 2230a_100000199060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2243 B10R1.2 CNc1cccc(c1F)Cl 34a_100000199060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2244 B10R1.2 CNc1cccc(c1F)F 34a_100000743855_200000210301 [1,1,0,0,0,0|2,0,0]=4 2245 B10R1.2 CNc1cccc(c1I)Br 34a_100020590159_200000210301 [1,1,0,0,0,0|2,0,0]=4 2246 B10R1.2 CNc1cccc(c1I)C 34a_100000761888_200000210301 [1,1,0,0,0,0|1,0,0]=3 2247 B10R1.2 CNc1cccc(c1I)Cl 34a_100000049713_200000210301 [1,1,0,0,0,0|2,0,0]=4 2248 B10R1.2 CNc1cccc(c1I)F 34a_100000690935_200000210301 [1,1,0,0,0,0|2,0,0]=4 2249 B10R1.2 CNc1cccc(c1N)O 271570a_203496583355_100000695761 [1,1,0,0,0,0|2,0,0]=4 2250 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,1,0,0,0,0|2,0,0]=4 2251 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,1,0,0,0,0|1,0,0]=3 2252 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,1,0,0,0,0|2,0,0]=4 2253 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,1,0,0,0,0|2,0,0]=4 2254 B10R1.2 CNc1ccnc(c1Cl)C 27a_100102657272_100000698670 [1,1,0,0,0,0|2,0,0]=4 2255 B10R1.2 CNc1ccnc(c1F)C 27a_100102657272_100009849794 [1,1,0,0,0,0|2,0,0]=4 2256 B10R1.2 COc1cccc(c1Br)Br 34a_100010187966_200000210301 [1,1,0,0,0,0|2,0,0]=4 2257 B10R1.2 COc1cccc(c1Br)Br 7a_100010187966_200000210301 [1,1,0,0,0,0|2,0,0]=4 2258 B10R1.2 COc1cccc(c1Br)C 34a_100000686692_200000210301 [1,1,0,0,0,0|1,0,0]=3 2259 B10R1.2 COc1cccc(c1Br)C 7a_100000686692_200000210301 [1,1,0,0,0,0|1,0,0]=3 2260 B10R1.2 COc1cccc(c1Br)Cl 34a_100012348804_200000210301 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.2 COc1cccc(c1Br)Cl 7a_100012348804_200000210301 [1,1,0,0,0,0|2,0,0]=4 2262 B10R1.2 COc1cccc(c1Br)F 34a_100009820682_200000210301 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.2 COc1cccc(c1Br)F 7a_100009820682_200000210301 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.2 COc1cccc(c1Br)I 34a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.2 COc1cccc(c1Br)I 7a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2266 B10R1.2 COc1cccc(c1Br)N 34a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 2267 B10R1.2 COc1cccc(c1Br)N 7a_100012183704_200000210301 [1,1,0,0,0,0|2,0,0]=4 2268 B10R1.2 COc1cccc(c1C)Br 34a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 2269 B10R1.2 COc1cccc(c1C)Br 7a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 2270 B10R1.2 COc1cccc(c1C)C 34a_100000185855_200000210301 [1,1,0,0,0,0|1,0,0]=3 2271 B10R1.2 COc1cccc(c1C)C 7a_100000185855_200000210301 [1,1,0,0,0,0|1,0,0]=3 2272 B10R1.2 COc1cccc(c1C)Cl 34a_100011265684_200000210301 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.2 COc1cccc(c1C)Cl 7a_100011265684_200000210301 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.2 COc1cccc(c1C)F 34a_100011217231_200000210301 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.2 COc1cccc(c1C)F 7a_100011217231_200000210301 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.2 COc1cccc(c1C)N 34a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2277 B10R1.2 COc1cccc(c1C)N 7a_100011216573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.2 COc1cccc(c1C)O 271570a_203496583355_100010002647 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.2 COc1cccc(c1Cl)Br 34a_100010187913_200000210301 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.2 COc1cccc(c1Cl)Br 7a_100010187913_200000210301 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.2 COc1cccc(c1Cl)C 34a_100000695629_200000210301 [1,1,0,0,0,0|1,0,0]=3 2282 B10R1.2 COc1cccc(c1Cl)C 7a_100000695629_200000210301 [1,1,0,0,0,0|1,0,0]=3 2283 B10R1.2 COc1cccc(c1Cl)Cl 34a_100000211076_200000210301 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.2 COc1cccc(c1Cl)Cl 7a_100000211076_200000210301 [1,1,0,0,0,0|2,0,0]=4 2285 B10R1.2 COc1cccc(c1Cl)F 34a_100000087408_200000210301 [1,1,0,0,0,0|2,0,0]=4 2286 B10R1.2 COc1cccc(c1Cl)F 7a_100000087408_200000210301 [1,1,0,0,0,0|2,0,0]=4 2287 B10R1.2 COc1cccc(c1Cl)I 34a_100000049636_200000210301 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.2 COc1cccc(c1Cl)I 7a_100000049636_200000210301 [1,1,0,0,0,0|2,0,0]=4 2289 B10R1.2 COc1cccc(c1Cl)N 34a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.2 COc1cccc(c1Cl)N 7a_100012002038_200000210301 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.2 COc1cccc(c1Cl)O 271570a_203496583355_100010147677 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.2 COc1cccc(c1F)Br 34a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 2293 B10R1.2 COc1cccc(c1F)Br 7a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 2294 B10R1.2 COc1cccc(c1F)C 34a_100000751311_200000210301 [1,1,0,0,0,0|1,0,0]=3 2295 B10R1.2 COc1cccc(c1F)C 7a_100000751311_200000210301 [1,1,0,0,0,0|1,0,0]=3 2296 B10R1.2 COc1cccc(c1F)Cl 34a_100000687438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2297 B10R1.2 COc1cccc(c1F)Cl 7a_100000687438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2298 B10R1.2 COc1cccc(c1F)F 34a_100000751161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2299 B10R1.2 COc1cccc(c1F)F 7a_100000751161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2300 B10R1.2 COc1cccc(c1F)O 271570a_203496583355_100010185846 [1,1,0,0,0,0|2,0,0]=4 2301 B10R1.2 COc1cccc(c1I)Br 34a_100010187912_200000210301 [1,1,0,0,0,0|2,0,0]=4 2302 B10R1.2 COc1cccc(c1I)Br 7a_100010187912_200000210301 [1,1,0,0,0,0|2,0,0]=4 2303 B10R1.2 COc1cccc(c1I)C 34a_100010083724_200000210301 [1,1,0,0,0,0|1,0,0]=3 2304 B10R1.2 COc1cccc(c1I)C 7a_100010083724_200000210301 [1,1,0,0,0,0|1,0,0]=3 2305 B10R1.2 COc1cccc(c1I)Cl 34a_100000050174_200000210301 [1,1,0,0,0,0|2,0,0]=4 2306 B10R1.2 COc1cccc(c1I)Cl 7a_100000050174_200000210301 [1,1,0,0,0,0|2,0,0]=4 2307 B10R1.2 COc1cccc(c1I)F 34a_100000690913_200000210301 [1,1,0,0,0,0|2,0,0]=4 2308 B10R1.2 COc1cccc(c1I)F 7a_100000690913_200000210301 [1,1,0,0,0,0|2,0,0]=4 2309 B10R1.2 COc1cccc(c1N)Br 34a_100011934926_200000210301 [1,1,0,0,0,0|2,0,0]=4 2310 B10R1.2 COc1cccc(c1N)Br 7a_100011934926_200000210301 [1,1,0,0,0,0|2,0,0]=4 2311 B10R1.2 COc1cccc(c1N)C 34a_100000743429_200000210301 [1,1,0,0,0,0|1,0,0]=3 2312 B10R1.2 COc1cccc(c1N)C 7a_100000743429_200000210301 [1,1,0,0,0,0|1,0,0]=3 2313 B10R1.2 COc1cccc(c1N)Cl 34a_100012022510_200000210301 [1,1,0,0,0,0|2,0,0]=4 2314 B10R1.2 COc1cccc(c1N)Cl 7a_100012022510_200000210301 [1,1,0,0,0,0|2,0,0]=4 2315 B10R1.2 COc1cccc(c1N)F 34a_100020591140_200000210301 [1,1,0,0,0,0|2,0,0]=4 2316 B10R1.2 COc1cccc(c1N)F 7a_100020591140_200000210301 [1,1,0,0,0,0|2,0,0]=4 2317 B10R1.2 COc1cccc(c1N)I 34a_200000049512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2318 B10R1.2 COc1cccc(c1N)I 7a_200000049512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.2 COc1cccc(c1N)N 34a_100000033209_200000210301 [1,1,0,0,0,0|2,0,0]=4 2320 B10R1.2 COc1cccc(c1N)O 271570a_203496583355_100000708083 [1,1,0,0,0,0|2,0,0]=4 2321 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,1,0,0,0,0|2,0,0]=4 2322 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,1,0,0,0,0|2,0,0]=4 2323 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,1,0,0,0,0|2,0,0]=4 2324 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,1,0,0,0,0|2,0,0]=4 2325 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,1,0,0,0,0|2,0,0]=4 2326 B10R1.2 COc1cccn(c1=O)C 34a_100000117616_200000210301 [1,1,0,0,0,0|2,0,0]=4 2327 B10R1.2 COc1cccn(c1=O)C 7a_100000117616_200000210301 [1,1,0,0,0,0|2,0,0]=4 2328 B10R1.2 COc1nccc(c1Br)C 34a_100012000493_200000210301 [1,1,0,0,0,0|2,0,0]=4 2329 B10R1.2 COc1nccc(c1O)C 271570a_203496583355_100012353928 [1,1,0,0,0,0|2,0,0]=4 2330 B10R1.2 CSc1cccc(c1Br)Br 62a_100010175083_200000210301 [1,1,0,0,0,0|2,0,0]=4 2331 B10R1.2 CSc1cccc(c1Br)Br 62a_200000210301_100010175083 [1,1,0,0,0,0|2,0,0]=4 2332 B10R1.2 CSc1cccc(c1Br)C 62a_100012362457_200000210301 [1,1,0,0,0,0|1,0,0]=3 2333 B10R1.2 CSc1cccc(c1Br)C 62a_200000210301_100012362457 [1,1,0,0,0,0|1,0,0]=3 2334 B10R1.2 CSc1cccc(c1Br)Cl 62a_100014021842_200000210301 [1,1,0,0,0,0|2,0,0]=4 2335 B10R1.2 CSc1cccc(c1Br)Cl 62a_200000210301_100014021842 [1,1,0,0,0,0|2,0,0]=4 2336 B10R1.2 CSc1cccc(c1Br)F 62a_100010202630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2337 B10R1.2 CSc1cccc(c1Br)F 62a_200000210301_100010202630 [1,1,0,0,0,0|2,0,0]=4 2338 B10R1.2 CSc1cccc(c1Br)O 62a_100010187914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2339 B10R1.2 CSc1cccc(c1Br)O 62a_200000210301_100010187914 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.2 CSc1cccc(c1C)Br 62a_100012353703_200000210301 [1,1,0,0,0,0|2,0,0]=4 2341 B10R1.2 CSc1cccc(c1C)Br 62a_200000210301_100012353703 [1,1,0,0,0,0|2,0,0]=4 2342 B10R1.2 CSc1cccc(c1C)C 62a_100011214922_200000210301 [1,1,0,0,0,0|1,0,0]=3 2343 B10R1.2 CSc1cccc(c1C)C 62a_200000210301_100011214922 [1,1,0,0,0,0|1,0,0]=3 2344 B10R1.2 CSc1cccc(c1C)Cl 62a_100000726075_200000210301 [1,1,0,0,0,0|2,0,0]=4 2345 B10R1.2 CSc1cccc(c1C)Cl 62a_200000210301_100000726075 [1,1,0,0,0,0|2,0,0]=4 2346 B10R1.2 CSc1cccc(c1C)F 62a_100011216893_200000210301 [1,1,0,0,0,0|2,0,0]=4 2347 B10R1.2 CSc1cccc(c1C)F 62a_200000210301_100011216893 [1,1,0,0,0,0|2,0,0]=4 2348 B10R1.2 CSc1cccc(c1C)N 62a_100000761887_200000210301 [1,1,0,0,0,0|2,0,0]=4 2349 B10R1.2 CSc1cccc(c1C)N 62a_200000210301_100000761887 [1,1,0,0,0,0|2,0,0]=4 2350 B10R1.2 CSc1cccc(c1C)O 62a_100012002258_200000210301 [1,1,0,0,0,0|2,0,0]=4 2351 B10R1.2 CSc1cccc(c1C)O 62a_200000210301_100012002258 [1,1,0,0,0,0|2,0,0]=4 2352 B10R1.2 CSc1cccc(c1Cl)Br 62a_100010142854_200000210301 [1,1,0,0,0,0|2,0,0]=4 2353 B10R1.2 CSc1cccc(c1Cl)Br 62a_200000210301_100010142854 [1,1,0,0,0,0|2,0,0]=4 2354 B10R1.2 CSc1cccc(c1Cl)C 62a_200000210301_200012352035 [1,1,0,0,0,0|1,0,0]=3 2355 B10R1.2 CSc1cccc(c1Cl)C 62a_200012352035_200000210301 [1,1,0,0,0,0|1,0,0]=3 2356 B10R1.2 CSc1cccc(c1Cl)Cl 62a_100011215384_200000210301 [1,1,0,0,0,0|2,0,0]=4 2357 B10R1.2 CSc1cccc(c1Cl)Cl 62a_200000210301_100011215384 [1,1,0,0,0,0|2,0,0]=4 2358 B10R1.2 CSc1cccc(c1Cl)F 62a_200000210301_200010234923 [1,1,0,0,0,0|2,0,0]=4 2359 B10R1.2 CSc1cccc(c1Cl)F 62a_200010234923_200000210301 [1,1,0,0,0,0|2,0,0]=4 2360 B10R1.2 CSc1cccc(c1Cl)O 62a_200000210301_100000049636 [1,1,0,0,0,0|2,0,0]=4 2361 B10R1.2 CSc1cccc(c1F)Br 62a_100000702267_200000210301 [1,1,0,0,0,0|2,0,0]=4 2362 B10R1.2 CSc1cccc(c1F)Br 62a_200000210301_100000702267 [1,1,0,0,0,0|2,0,0]=4 2363 B10R1.2 CSc1cccc(c1F)C 62a_100000717567_200000210301 [1,1,0,0,0,0|1,0,0]=3 2364 B10R1.2 CSc1cccc(c1F)C 62a_200000210301_100000717567 [1,1,0,0,0,0|1,0,0]=3 2365 B10R1.2 CSc1cccc(c1F)Cl 62a_100011217346_200000210301 [1,1,0,0,0,0|2,0,0]=4 2366 B10R1.2 CSc1cccc(c1F)Cl 62a_200000210301_100011217346 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.2 CSc1cccc(c1F)F 62a_100000694657_200000210301 [1,1,0,0,0,0|2,0,0]=4 2368 B10R1.2 CSc1cccc(c1F)F 62a_200000210301_100000694657 [1,1,0,0,0,0|2,0,0]=4 2369 B10R1.2 CSc1cccc(c1F)N 62a_100011935091_200000210301 [1,1,0,0,0,0|2,0,0]=4 2370 B10R1.2 CSc1cccc(c1F)N 62a_200000210301_100011935091 [1,1,0,0,0,0|2,0,0]=4 2371 B10R1.2 CSc1cccc(c1F)O 62a_100009817021_200000210301 [1,1,0,0,0,0|2,0,0]=4 2372 B10R1.2 CSc1cccc(c1F)O 62a_200000210301_100009817021 [1,1,0,0,0,0|2,0,0]=4 2373 B10R1.2 CSc1cccc(c1N)Br 62a_100010146558_200000210301 [1,1,0,0,0,0|2,0,0]=4 2374 B10R1.2 CSc1cccc(c1N)Br 62a_200000210301_100010146558 [1,1,0,0,0,0|2,0,0]=4 2375 B10R1.2 CSc1cccc(c1N)C 62a_100011834072_200000210301 [1,1,0,0,0,0|1,0,0]=3 2376 B10R1.2 CSc1cccc(c1N)C 62a_200000210301_100011834072 [1,1,0,0,0,0|1,0,0]=3 2377 B10R1.2 CSc1cccc(c1N)Cl 62a_100010190421_200000210301 [1,1,0,0,0,0|2,0,0]=4 2378 B10R1.2 CSc1cccc(c1N)Cl 62a_200000210301_100010190421 [1,1,0,0,0,0|2,0,0]=4 2379 B10R1.2 CSc1cccc(c1N)F 62a_100000042321_200000210301 [1,1,0,0,0,0|2,0,0]=4 2380 B10R1.2 CSc1cccc(c1N)F 62a_200000210301_100000042321 [1,1,0,0,0,0|2,0,0]=4 2381 B10R1.2 CSc1cccc(c1N)N 62a_100015191791_200000210301 [1,1,0,0,0,0|2,0,0]=4 2382 B10R1.2 CSc1cccc(c1N)O 62a_200000210301_100011934926 [1,1,0,0,0,0|2,0,0]=4 2383 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,1,0,0,0,0|2,0,0]=4 2384 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,1,0,0,0,0|2,0,0]=4 2385 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,1,0,0,0,0|1,0,0]=3 2386 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,1,0,0,0,0|1,0,0]=3 2387 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,1,0,0,0,0|2,0,0]=4 2388 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,1,0,0,0,0|2,0,0]=4 2389 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,1,0,0,0,0|2,0,0]=4 2390 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,1,0,0,0,0|2,0,0]=4 2391 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,1,0,0,0,0|2,0,0]=4 2392 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,1,0,0,0,0|2,0,0]=4 2393 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,1,0,0,0,0|2,0,0]=4 2394 B10R1.2 CSc1cccn(c1=O)C 62a_100000687173_200000210301 [1,1,0,0,0,0|2,0,0]=4 2395 B10R1.2 CSc1cccn(c1=O)C 62a_200000210301_100000687173 [1,1,0,0,0,0|2,0,0]=4 2396 B10R1.2 CSc1ccnc(c1C)C 62a_100009846815_200000210301 [1,1,0,0,0,0|2,0,0]=4 2397 B10R1.2 CSc1ccnc(c1C)C 62a_200000210301_100009846815 [1,1,0,0,0,0|2,0,0]=4 2398 B10R1.2 CSc1ccnc(c1Cl)C 62a_100000698670_200000210301 [1,1,0,0,0,0|2,0,0]=4 2399 B10R1.2 CSc1ccnc(c1Cl)C 62a_200000210301_100000698670 [1,1,0,0,0,0|2,0,0]=4 2400 B10R1.2 CSc1ccnc(c1F)C 62a_100009849794_200000210301 [1,1,0,0,0,0|2,0,0]=4 2401 B10R1.2 CSc1ccnc(c1F)C 62a_200000210301_100009849794 [1,1,0,0,0,0|2,0,0]=4 2402 B10R1.2 CSc1ccnc(c1N)C 62a_100009885578_200000210301 [1,1,0,0,0,0|2,0,0]=4 2403 B10R1.2 CSc1ccnc(c1N)C 62a_200000210301_100009885578 [1,1,0,0,0,0|2,0,0]=4 2404 B10R1.2 CSc1cncc(c1C)C 62a_100009864703_200000210301 [1,1,0,0,0,0|2,0,0]=4 2405 B10R1.2 CSc1cncc(c1C)C 62a_200000210301_100009864703 [1,1,0,0,0,0|2,0,0]=4 2406 B10R1.2 CSc1cncc(c1N)C 62a_100009818025_200000210301 [1,1,0,0,0,0|2,0,0]=4 2407 B10R1.2 CSc1cncc(c1N)C 62a_200000210301_100009818025 [1,1,0,0,0,0|2,0,0]=4 2408 B10R1.2 CSc1nccc(c1C)C 62a_100009847204_200000210301 [1,1,0,0,0,0|2,0,0]=4 2409 B10R1.2 CSc1nccc(c1C)C 62a_200000210301_100009847204 [1,1,0,0,0,0|2,0,0]=4 2410 B10R1.2 CSc1nccc(c1F)C 62a_100009817629_200000210301 [1,1,0,0,0,0|2,0,0]=4 2411 B10R1.2 CSc1nccc(c1F)C 62a_200000210301_100009817629 [1,1,0,0,0,0|2,0,0]=4 2412 B10R1.2 CSc1nccc(c1N)C 62a_100000763560_200000210301 [1,1,0,0,0,0|2,0,0]=4 2413 B10R1.2 CSc1nccc(c1N)C 62a_200000210301_100000763560 [1,1,0,0,0,0|2,0,0]=4 2414 B10R1.2 CSc1nccc(c1O)C 62a_200000210301_100000696282 [1,1,0,0,0,0|2,0,0]=4 2415 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,1,0,0,0,0|1,0,0]=3 2416 B10R1.2 Cc1c(cccc1N[13CH3])Br 34a_100000750434_200025704644 [1,1,0,0,0,0|2,0,0]=4 2417 B10R1.2 Cc1c(cccc1N[13CH3])Cl 2230a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 2418 B10R1.2 Cc1c(cccc1N[13CH3])Cl 34a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 2419 B10R1.2 Cc1c(cccc1N[13CH3])Cl 7a_100000210441_200025704644 [1,1,0,0,0,0|2,0,0]=4 2420 B10R1.2 Cc1c(cccc1N[13CH3])F 34a_100000745574_200025704644 [1,1,0,0,0,0|2,0,0]=4 2421 B10R1.2 Cc1c(cccc1N[13CH3])F 7a_100000745574_200025704644 [1,1,0,0,0,0|2,0,0]=4 2422 B10R1.2 Cc1c(cccc1N[13CH3])I 34a_100000761887_200025704644 [1,1,0,0,0,0|2,0,0]=4 2423 B10R1.2 Cc1c(cccc1N[13CH3])O 34a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2424 B10R1.2 Cc1c(cccc1N[13CH3])O 7a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2425 B10R1.2 Cc1c(cccc1O[13CH3])Br 34a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 2426 B10R1.2 Cc1c(cccc1O[13CH3])Br 7a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 2427 B10R1.2 Cc1c(cccc1O[13CH3])Cl 34a_100011265684_200025704644 [1,1,0,0,0,0|2,0,0]=4 2428 B10R1.2 Cc1c(cccc1O[13CH3])Cl 7a_100011265684_200025704644 [1,1,0,0,0,0|2,0,0]=4 2429 B10R1.2 Cc1c(cccc1O[13CH3])F 34a_100011217231_200025704644 [1,1,0,0,0,0|2,0,0]=4 2430 B10R1.2 Cc1c(cccc1O[13CH3])F 7a_100011217231_200025704644 [1,1,0,0,0,0|2,0,0]=4 2431 B10R1.2 Cc1c(cccc1O[13CH3])N 34a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2432 B10R1.2 Cc1c(cccc1O[13CH3])N 7a_100011216573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2433 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_100012353703_200025704644 [1,1,0,0,0,0|2,0,0]=4 2434 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_200025704644_100012353703 [1,1,0,0,0,0|2,0,0]=4 2435 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_100000726075_200025704644 [1,1,0,0,0,0|2,0,0]=4 2436 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_200025704644_100000726075 [1,1,0,0,0,0|2,0,0]=4 2437 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_100011216893_200025704644 [1,1,0,0,0,0|2,0,0]=4 2438 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_200025704644_100011216893 [1,1,0,0,0,0|2,0,0]=4 2439 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_100000761887_200025704644 [1,1,0,0,0,0|2,0,0]=4 2440 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_200025704644_100000761887 [1,1,0,0,0,0|2,0,0]=4 2441 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_100012002258_200025704644 [1,1,0,0,0,0|2,0,0]=4 2442 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_200025704644_100012002258 [1,1,0,0,0,0|2,0,0]=4 2443 B10R1.2 Cc1c(ccnc1O)C=O 271570a_203496583355_100000096011 [1,1,0,0,0,0|2,0,0]=4 2444 B10R1.2 Cc1c(cncc1C=O)O 271570a_203496583355_100010214934 [1,1,0,0,0,0|2,0,0]=4 2445 B10R1.2 Cc1cccc(c1Br)N[13CH3] 34a_100000684715_200025704644 [1,1,0,0,0,0|1,0,0]=3 2446 B10R1.2 Cc1cccc(c1Br)O[13CH3] 34a_100000686692_200025704644 [1,1,0,0,0,0|1,0,0]=3 2447 B10R1.2 Cc1cccc(c1Br)O[13CH3] 7a_100000686692_200025704644 [1,1,0,0,0,0|1,0,0]=3 2448 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_100012362457_200025704644 [1,1,0,0,0,0|1,0,0]=3 2449 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_200025704644_100012362457 [1,1,0,0,0,0|1,0,0]=3 2450 B10R1.2 Cc1cccc(c1C)N[13CH3] 2230a_100000210026_200025704644 [1,1,0,0,0,0|1,0,0]=3 2451 B10R1.2 Cc1cccc(c1C)N[13CH3] 34a_100000210026_200025704644 [1,1,0,0,0,0|1,0,0]=3 2452 B10R1.2 Cc1cccc(c1C)N[13CH3] 7a_100000210026_200025704644 [1,1,0,0,0,0|1,0,0]=3 2453 B10R1.2 Cc1cccc(c1C)O[13CH3] 34a_100000185855_200025704644 [1,1,0,0,0,0|1,0,0]=3 2454 B10R1.2 Cc1cccc(c1C)O[13CH3] 7a_100000185855_200025704644 [1,1,0,0,0,0|1,0,0]=3 2455 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_100011214922_200025704644 [1,1,0,0,0,0|1,0,0]=3 2456 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_200025704644_100011214922 [1,1,0,0,0,0|1,0,0]=3 2457 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 34a_100000765562_200025704644 [1,1,0,0,0,0|1,0,0]=3 2458 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 7a_100000765562_200025704644 [1,1,0,0,0,0|1,0,0]=3 2459 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 34a_100000695629_200025704644 [1,1,0,0,0,0|1,0,0]=3 2460 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 7a_100000695629_200025704644 [1,1,0,0,0,0|1,0,0]=3 2461 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200012352035_200025704644 [1,1,0,0,0,0|1,0,0]=3 2462 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200025704644_200012352035 [1,1,0,0,0,0|1,0,0]=3 2463 B10R1.2 Cc1cccc(c1F)N[13CH3] 2230a_100000697159_200025704644 [1,1,0,0,0,0|1,0,0]=3 2464 B10R1.2 Cc1cccc(c1F)N[13CH3] 34a_100000697159_200025704644 [1,1,0,0,0,0|1,0,0]=3 2465 B10R1.2 Cc1cccc(c1F)N[13CH3] 7a_100000697159_200025704644 [1,1,0,0,0,0|1,0,0]=3 2466 B10R1.2 Cc1cccc(c1F)O[13CH3] 34a_100000751311_200025704644 [1,1,0,0,0,0|1,0,0]=3 2467 B10R1.2 Cc1cccc(c1F)O[13CH3] 7a_100000751311_200025704644 [1,1,0,0,0,0|1,0,0]=3 2468 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_100000717567_200025704644 [1,1,0,0,0,0|1,0,0]=3 2469 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_200025704644_100000717567 [1,1,0,0,0,0|1,0,0]=3 2470 B10R1.2 Cc1cccc(c1I)N[13CH3] 34a_100000761888_200025704644 [1,1,0,0,0,0|1,0,0]=3 2471 B10R1.2 Cc1cccc(c1I)O[13CH3] 34a_100010083724_200025704644 [1,1,0,0,0,0|1,0,0]=3 2472 B10R1.2 Cc1cccc(c1I)O[13CH3] 7a_100010083724_200025704644 [1,1,0,0,0,0|1,0,0]=3 2473 B10R1.2 Cc1cccc(c1N)O[13CH3] 34a_100000743429_200025704644 [1,1,0,0,0,0|1,0,0]=3 2474 B10R1.2 Cc1cccc(c1N)O[13CH3] 7a_100000743429_200025704644 [1,1,0,0,0,0|1,0,0]=3 2475 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_100011834072_200025704644 [1,1,0,0,0,0|1,0,0]=3 2476 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_200025704644_100011834072 [1,1,0,0,0,0|1,0,0]=3 2477 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,1,0,0,0,0|1,0,1]=4 2478 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,1,0,0,0,0|0,0,2]=4 2479 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,1,0,0,0,0|1,0,0]=3 2480 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,1,0,0,0,0|1,0,0]=3 2481 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,1,0,0,0,0|1,0,0]=3 2482 B10R1.2 Cc1ccnc(c1Br)O[13CH3] 34a_100012000493_200025704644 [1,1,0,0,0,0|2,0,0]=4 2483 B10R1.2 Cc1ccnc(c1C)S[13CH3] 62a_100009847204_200025704644 [1,1,0,0,0,0|2,0,0]=4 2484 B10R1.2 Cc1ccnc(c1C)S[13CH3] 62a_200025704644_100009847204 [1,1,0,0,0,0|2,0,0]=4 2485 B10R1.2 Cc1ccnc(c1F)S[13CH3] 62a_100009817629_200025704644 [1,1,0,0,0,0|2,0,0]=4 2486 B10R1.2 Cc1ccnc(c1F)S[13CH3] 62a_200025704644_100009817629 [1,1,0,0,0,0|2,0,0]=4 2487 B10R1.2 Cc1ccnc(c1N)S[13CH3] 62a_100000763560_200025704644 [1,1,0,0,0,0|2,0,0]=4 2488 B10R1.2 Cc1ccnc(c1N)S[13CH3] 62a_200025704644_100000763560 [1,1,0,0,0,0|2,0,0]=4 2489 B10R1.2 Cc1ccnc(c1O)S[13CH3] 62a_200025704644_100000696282 [1,1,0,0,0,0|2,0,0]=4 2490 B10R1.2 Cc1cncc(c1C)S[13CH3] 62a_100009864703_200025704644 [1,1,0,0,0,0|2,0,0]=4 2491 B10R1.2 Cc1cncc(c1C)S[13CH3] 62a_200025704644_100009864703 [1,1,0,0,0,0|2,0,0]=4 2492 B10R1.2 Cc1cncc(c1N)S[13CH3] 62a_100009818025_200025704644 [1,1,0,0,0,0|2,0,0]=4 2493 B10R1.2 Cc1cncc(c1N)S[13CH3] 62a_200025704644_100009818025 [1,1,0,0,0,0|2,0,0]=4 2494 B10R1.2 Cc1nccc(c1C)S[13CH3] 62a_100009846815_200025704644 [1,1,0,0,0,0|2,0,0]=4 2495 B10R1.2 Cc1nccc(c1C)S[13CH3] 62a_200025704644_100009846815 [1,1,0,0,0,0|2,0,0]=4 2496 B10R1.2 Cc1nccc(c1Cl)S[13CH3] 62a_100000698670_200025704644 [1,1,0,0,0,0|2,0,0]=4 2497 B10R1.2 Cc1nccc(c1Cl)S[13CH3] 62a_200025704644_100000698670 [1,1,0,0,0,0|2,0,0]=4 2498 B10R1.2 Cc1nccc(c1F)S[13CH3] 62a_100009849794_200025704644 [1,1,0,0,0,0|2,0,0]=4 2499 B10R1.2 Cc1nccc(c1F)S[13CH3] 62a_200025704644_100009849794 [1,1,0,0,0,0|2,0,0]=4 2500 B10R1.2 Cc1nccc(c1N)S[13CH3] 62a_100009885578_200025704644 [1,1,0,0,0,0|2,0,0]=4 2501 B10R1.2 Cc1nccc(c1N)S[13CH3] 62a_200025704644_100009885578 [1,1,0,0,0,0|2,0,0]=4 2502 B10R1.2 Cn1cccc(c1=O)O[13CH3] 34a_100000117616_200025704644 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.2 Cn1cccc(c1=O)O[13CH3] 7a_100000117616_200025704644 [1,1,0,0,0,0|2,0,0]=4 2504 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_100000687173_200025704644 [1,1,0,0,0,0|2,0,0]=4 2505 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_200025704644_100000687173 [1,1,0,0,0,0|2,0,0]=4 2506 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,1,0,0,0,0|1,0,0]=3 2507 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,1,0,0,0,0|1,0,0]=3 2508 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,1,0,0,0,0|1,0,0]=3 2509 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,1,0,0,0,0|1,0,0]=3 2510 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,1,0,0,0,0|1,0,0]=3 2511 B10R1.2 O=Cc1ccnc(c1F)O 271570a_203496583355_100010064874 [1,1,0,0,0,0|2,0,0]=4 2512 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [1,1,0,0,0,0|2,0,0]=4 2513 B10R1.2 O=Cc1nccc(c1F)O 271570a_203496583355_100015713984 [1,1,0,0,0,0|2,0,0]=4 2514 B10R1.2 [13CH3]Nc1cccc(c1Br)Cl 34a_100000687072_200025704644 [1,1,0,0,0,0|2,0,0]=4 2515 B10R1.2 [13CH3]Nc1cccc(c1Br)F 34a_100011934729_200025704644 [1,1,0,0,0,0|2,0,0]=4 2516 B10R1.2 [13CH3]Nc1cccc(c1Br)O 34a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 2517 B10R1.2 [13CH3]Nc1cccc(c1Br)O 7a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 2518 B10R1.2 [13CH3]Nc1cccc(c1Cl)Br 34a_100000687075_200025704644 [1,1,0,0,0,0|2,0,0]=4 2519 B10R1.2 [13CH3]Nc1cccc(c1Cl)Cl 34a_100000185733_200025704644 [1,1,0,0,0,0|2,0,0]=4 2520 B10R1.2 [13CH3]Nc1cccc(c1Cl)F 34a_100000692321_200025704644 [1,1,0,0,0,0|2,0,0]=4 2521 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 34a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 2522 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 7a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 2523 B10R1.2 [13CH3]Nc1cccc(c1F)Br 2230a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2524 B10R1.2 [13CH3]Nc1cccc(c1F)Br 34a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2525 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 2230a_100000199060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2526 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 34a_100000199060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2527 B10R1.2 [13CH3]Nc1cccc(c1F)F 34a_100000743855_200025704644 [1,1,0,0,0,0|2,0,0]=4 2528 B10R1.2 [13CH3]Nc1cccc(c1I)Br 34a_100020590159_200025704644 [1,1,0,0,0,0|2,0,0]=4 2529 B10R1.2 [13CH3]Nc1cccc(c1I)Cl 34a_100000049713_200025704644 [1,1,0,0,0,0|2,0,0]=4 2530 B10R1.2 [13CH3]Nc1cccc(c1I)F 34a_100000690935_200025704644 [1,1,0,0,0,0|2,0,0]=4 2531 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,1,0,0,0,0|2,0,0]=4 2532 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,1,0,0,0,0|2,0,0]=4 2533 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,1,0,0,0,0|2,0,0]=4 2534 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 34a_100010187966_200025704644 [1,1,0,0,0,0|2,0,0]=4 2535 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 7a_100010187966_200025704644 [1,1,0,0,0,0|2,0,0]=4 2536 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 34a_100012348804_200025704644 [1,1,0,0,0,0|2,0,0]=4 2537 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 7a_100012348804_200025704644 [1,1,0,0,0,0|2,0,0]=4 2538 B10R1.2 [13CH3]Oc1cccc(c1Br)F 34a_100009820682_200025704644 [1,1,0,0,0,0|2,0,0]=4 2539 B10R1.2 [13CH3]Oc1cccc(c1Br)F 7a_100009820682_200025704644 [1,1,0,0,0,0|2,0,0]=4 2540 B10R1.2 [13CH3]Oc1cccc(c1Br)I 34a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 2541 B10R1.2 [13CH3]Oc1cccc(c1Br)I 7a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 2542 B10R1.2 [13CH3]Oc1cccc(c1Br)N 34a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 2543 B10R1.2 [13CH3]Oc1cccc(c1Br)N 7a_100012183704_200025704644 [1,1,0,0,0,0|2,0,0]=4 2544 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 34a_100010187913_200025704644 [1,1,0,0,0,0|2,0,0]=4 2545 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 7a_100010187913_200025704644 [1,1,0,0,0,0|2,0,0]=4 2546 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 34a_100000211076_200025704644 [1,1,0,0,0,0|2,0,0]=4 2547 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 7a_100000211076_200025704644 [1,1,0,0,0,0|2,0,0]=4 2548 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 34a_100000087408_200025704644 [1,1,0,0,0,0|2,0,0]=4 2549 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 7a_100000087408_200025704644 [1,1,0,0,0,0|2,0,0]=4 2550 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 34a_100000049636_200025704644 [1,1,0,0,0,0|2,0,0]=4 2551 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 7a_100000049636_200025704644 [1,1,0,0,0,0|2,0,0]=4 2552 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 34a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 2553 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 7a_100012002038_200025704644 [1,1,0,0,0,0|2,0,0]=4 2554 B10R1.2 [13CH3]Oc1cccc(c1F)Br 34a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 2555 B10R1.2 [13CH3]Oc1cccc(c1F)Br 7a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 2556 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 34a_100000687438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2557 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 7a_100000687438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2558 B10R1.2 [13CH3]Oc1cccc(c1F)F 34a_100000751161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2559 B10R1.2 [13CH3]Oc1cccc(c1F)F 7a_100000751161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2560 B10R1.2 [13CH3]Oc1cccc(c1I)Br 34a_100010187912_200025704644 [1,1,0,0,0,0|2,0,0]=4 2561 B10R1.2 [13CH3]Oc1cccc(c1I)Br 7a_100010187912_200025704644 [1,1,0,0,0,0|2,0,0]=4 2562 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 34a_100000050174_200025704644 [1,1,0,0,0,0|2,0,0]=4 2563 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 7a_100000050174_200025704644 [1,1,0,0,0,0|2,0,0]=4 2564 B10R1.2 [13CH3]Oc1cccc(c1I)F 34a_100000690913_200025704644 [1,1,0,0,0,0|2,0,0]=4 2565 B10R1.2 [13CH3]Oc1cccc(c1I)F 7a_100000690913_200025704644 [1,1,0,0,0,0|2,0,0]=4 2566 B10R1.2 [13CH3]Oc1cccc(c1N)Br 34a_100011934926_200025704644 [1,1,0,0,0,0|2,0,0]=4 2567 B10R1.2 [13CH3]Oc1cccc(c1N)Br 7a_100011934926_200025704644 [1,1,0,0,0,0|2,0,0]=4 2568 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 34a_100012022510_200025704644 [1,1,0,0,0,0|2,0,0]=4 2569 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 7a_100012022510_200025704644 [1,1,0,0,0,0|2,0,0]=4 2570 B10R1.2 [13CH3]Oc1cccc(c1N)F 34a_100020591140_200025704644 [1,1,0,0,0,0|2,0,0]=4 2571 B10R1.2 [13CH3]Oc1cccc(c1N)F 7a_100020591140_200025704644 [1,1,0,0,0,0|2,0,0]=4 2572 B10R1.2 [13CH3]Oc1cccc(c1N)I 34a_200000049512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2573 B10R1.2 [13CH3]Oc1cccc(c1N)I 7a_200000049512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2574 B10R1.2 [13CH3]Oc1cccc(c1N)N 34a_100000033209_200025704644 [1,1,0,0,0,0|2,0,0]=4 2575 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_100010175083_200025704644 [1,1,0,0,0,0|2,0,0]=4 2576 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_200025704644_100010175083 [1,1,0,0,0,0|2,0,0]=4 2577 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_100014021842_200025704644 [1,1,0,0,0,0|2,0,0]=4 2578 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_200025704644_100014021842 [1,1,0,0,0,0|2,0,0]=4 2579 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_100010202630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2580 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_200025704644_100010202630 [1,1,0,0,0,0|2,0,0]=4 2581 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_100010187914_200025704644 [1,1,0,0,0,0|2,0,0]=4 2582 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_200025704644_100010187914 [1,1,0,0,0,0|2,0,0]=4 2583 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_100010142854_200025704644 [1,1,0,0,0,0|2,0,0]=4 2584 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_200025704644_100010142854 [1,1,0,0,0,0|2,0,0]=4 2585 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_100011215384_200025704644 [1,1,0,0,0,0|2,0,0]=4 2586 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_200025704644_100011215384 [1,1,0,0,0,0|2,0,0]=4 2587 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200010234923_200025704644 [1,1,0,0,0,0|2,0,0]=4 2588 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200025704644_200010234923 [1,1,0,0,0,0|2,0,0]=4 2589 B10R1.2 [13CH3]Sc1cccc(c1Cl)O 62a_200025704644_100000049636 [1,1,0,0,0,0|2,0,0]=4 2590 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_100000702267_200025704644 [1,1,0,0,0,0|2,0,0]=4 2591 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_200025704644_100000702267 [1,1,0,0,0,0|2,0,0]=4 2592 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_100011217346_200025704644 [1,1,0,0,0,0|2,0,0]=4 2593 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_200025704644_100011217346 [1,1,0,0,0,0|2,0,0]=4 2594 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_100000694657_200025704644 [1,1,0,0,0,0|2,0,0]=4 2595 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_200025704644_100000694657 [1,1,0,0,0,0|2,0,0]=4 2596 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_100011935091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2597 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_200025704644_100011935091 [1,1,0,0,0,0|2,0,0]=4 2598 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_100009817021_200025704644 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_200025704644_100009817021 [1,1,0,0,0,0|2,0,0]=4 2600 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_100010146558_200025704644 [1,1,0,0,0,0|2,0,0]=4 2601 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_200025704644_100010146558 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_100010190421_200025704644 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_200025704644_100010190421 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_100000042321_200025704644 [1,1,0,0,0,0|2,0,0]=4 2605 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_200025704644_100000042321 [1,1,0,0,0,0|2,0,0]=4 2606 B10R1.2 [13CH3]Sc1cccc(c1N)N 62a_100015191791_200025704644 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.2 [13CH3]Sc1cccc(c1N)O 62a_200025704644_100011934926 [1,1,0,0,0,0|2,0,0]=4 2608 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,1,0,0,0,0|2,0,0]=4 2609 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,1,0,0,0,0|2,0,0]=4 2610 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,1,0,0,0,0|2,0,0]=4 2611 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,1,0,0,0,0|2,0,0]=4 2612 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,1,0,0,0,0|2,0,0]=4 2613 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,1,0,0,0,0|2,0,0]=4 2614 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,1,0,0,0,0|2,0,0]=4 2615 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,1,0,0,0,0|2,0,0]=4 2616 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,1,0,0,0,0|2,0,0]=4 2617 B10R1.8 C=Cc1cc([nH]c(=O)c1)C 271570a_100011290941_100009861981 [1,1,0,0,0,0|1,0,1]=4 2618 B10R1.8 C=Cc1cc(cc(c1)Br)Br 271570a_100011290941_100009814770 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.8 C=Cc1cc(cc(c1)Br)Cl 271570a_100011290941_100009814755 [1,1,0,0,0,0|1,0,1]=4 2620 B10R1.8 C=Cc1cc(cc(c1)Br)F 271570a_100011290941_100009814764 [1,1,0,0,0,0|1,0,1]=4 2621 B10R1.8 C=Cc1cc(cc(c1)Br)N 271570a_100011290941_100009814763 [1,1,0,0,0,0|1,0,1]=4 2622 B10R1.8 C=Cc1cc(cc(c1)Br)O 271570a_100011290941_100010068917 [1,1,0,0,0,0|1,0,1]=4 2623 B10R1.8 C=Cc1cc(cc(c1)C)C 271570a_100011290941_100011215608 [1,1,0,0,0,0|0,0,1]=3 2624 B10R1.8 C=Cc1cc(cc(c1)Cl)C 271570a_100011290941_100010172791 [1,1,0,0,0,0|0,0,1]=3 2625 B10R1.8 C=Cc1cc(cc(c1)Cl)Cl 271570a_100011290941_100000747138 [1,1,0,0,0,0|1,0,1]=4 2626 B10R1.8 C=Cc1cc(cc(c1)Cl)F 271570a_100011290941_100013859453 [1,1,0,0,0,0|1,0,1]=4 2627 B10R1.8 C=Cc1cc(cc(c1)Cl)N 271570a_100011290941_100010147676 [1,1,0,0,0,0|1,0,1]=4 2628 B10R1.8 C=Cc1cc(cc(c1)Cl)O 271570a_100011290941_100010068924 [1,1,0,0,0,0|1,0,1]=4 2629 B10R1.8 C=Cc1cc(cc(c1)F)C 271570a_100011290941_100011356977 [1,1,0,0,0,0|0,0,1]=3 2630 B10R1.8 C=Cc1cc(cc(c1)F)F 271570a_100011290941_100011218498 [1,1,0,0,0,0|1,0,1]=4 2631 B10R1.8 C=Cc1cc(cc(c1)F)N 271570a_100011290941_100011356972 [1,1,0,0,0,0|1,0,1]=4 2632 B10R1.8 C=Cc1cc(cc(c1)F)O 271570a_100011290941_100000717995 [1,1,0,0,0,0|1,0,1]=4 2633 B10R1.8 C=Cc1cc(cc(c1)N)C 271570a_100011290941_100000695972 [1,1,0,0,0,0|0,0,1]=3 2634 B10R1.8 C=Cc1cc(cc(c1)N)N 271570a_100011290941_100011999608 [1,1,0,0,0,0|1,0,1]=4 2635 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [1,1,0,0,0,0|0,0,1]=3 2636 B10R1.8 C=Cc1cc(cc(c1)O)O 271570a_100011290941_100009868816 [1,1,0,0,0,0|1,0,1]=4 2637 B10R1.8 C=Cc1cc(cc(n1)C)C 271570a_100011290941_100000069240 [1,1,0,0,0,0|1,0,1]=4 2638 B10R1.8 C=Cc1cc(cc(n1)F)C 271570a_100011290941_100009819601 [1,1,0,0,0,0|1,0,1]=4 2639 B10R1.8 C=Cc1cc(cc(n1)N)C 271570a_100011290941_100009819863 [1,1,0,0,0,0|1,0,1]=4 2640 B10R1.8 C=Cc1cc(nc(c1)C)C 271570a_100011290941_100009816552 [1,1,0,0,0,0|1,0,1]=4 2641 B10R1.8 C=Cc1cc(nc(c1)F)C 271570a_100011290941_100010006595 [1,1,0,0,0,0|1,0,1]=4 2642 B10R1.8 C=Cc1cc(nc(c1)N)C 271570a_100011290941_100000076705 [1,1,0,0,0,0|1,0,1]=4 2643 B10R1.8 CCc1cc(cc(c1)O)N 271570a_203496583355_100010074814 [1,1,0,0,0,0|1,0,1]=4 2644 B10R1.8 CNc1cc([nH]c(=O)c1)C 27a_100102657272_100009861981 [1,1,0,0,0,0|2,0,0]=4 2645 B10R1.8 CNc1cc(cc(c1)Br)Br 27a_100102657272_100009814770 [1,1,0,0,0,0|2,0,0]=4 2646 B10R1.8 CNc1cc(cc(c1)Br)Br 34a_100012047176_200000210301 [1,1,0,0,0,0|2,0,0]=4 2647 B10R1.8 CNc1cc(cc(c1)Br)Br 7a_100012047176_200000210301 [1,1,0,0,0,0|2,0,0]=4 2648 B10R1.8 CNc1cc(cc(c1)Br)C 34a_100000695972_200000210301 [1,1,0,0,0,0|1,0,0]=3 2649 B10R1.8 CNc1cc(cc(c1)Br)C 7a_100000695972_200000210301 [1,1,0,0,0,0|1,0,0]=3 2650 B10R1.8 CNc1cc(cc(c1)Br)Cl 34a_100011934539_200000210301 [1,1,0,0,0,0|2,0,0]=4 2651 B10R1.8 CNc1cc(cc(c1)Br)Cl 7a_100011934539_200000210301 [1,1,0,0,0,0|2,0,0]=4 2652 B10R1.8 CNc1cc(cc(c1)Br)F 34a_100000705686_200000210301 [1,1,0,0,0,0|2,0,0]=4 2653 B10R1.8 CNc1cc(cc(c1)Br)F 7a_100000705686_200000210301 [1,1,0,0,0,0|2,0,0]=4 2654 B10R1.8 CNc1cc(cc(c1)C)C 2230a_100000210930_200000210301 [1,1,0,0,0,0|1,0,0]=3 2655 B10R1.8 CNc1cc(cc(c1)C)C 34a_100000210930_200000210301 [1,1,0,0,0,0|1,0,0]=3 2656 B10R1.8 CNc1cc(cc(c1)C)C 7a_100000210930_200000210301 [1,1,0,0,0,0|1,0,0]=3 2657 B10R1.8 CNc1cc(cc(c1)Cl)C 2230a_100012022512_200000210301 [1,1,0,0,0,0|1,0,0]=3 2658 B10R1.8 CNc1cc(cc(c1)Cl)C 34a_100012022512_200000210301 [1,1,0,0,0,0|1,0,0]=3 2659 B10R1.8 CNc1cc(cc(c1)Cl)C 7a_100012022512_200000210301 [1,1,0,0,0,0|1,0,0]=3 2660 B10R1.8 CNc1cc(cc(c1)Cl)Cl 34a_100000210456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2661 B10R1.8 CNc1cc(cc(c1)Cl)Cl 7a_100000210456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2662 B10R1.8 CNc1cc(cc(c1)Cl)F 34a_100000686136_200000210301 [1,1,0,0,0,0|2,0,0]=4 2663 B10R1.8 CNc1cc(cc(c1)Cl)F 7a_100000686136_200000210301 [1,1,0,0,0,0|2,0,0]=4 2664 B10R1.8 CNc1cc(cc(c1)Cl)O 34a_100000123917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2665 B10R1.8 CNc1cc(cc(c1)Cl)O 7a_100000123917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2666 B10R1.8 CNc1cc(cc(c1)F)C 2230a_100000742734_200000210301 [1,1,0,0,0,0|1,0,0]=3 2667 B10R1.8 CNc1cc(cc(c1)F)C 34a_100000742734_200000210301 [1,1,0,0,0,0|1,0,0]=3 2668 B10R1.8 CNc1cc(cc(c1)F)C 7a_100000742734_200000210301 [1,1,0,0,0,0|1,0,0]=3 2669 B10R1.8 CNc1cc(cc(c1)F)F 34a_100000233717_200000210301 [1,1,0,0,0,0|2,0,0]=4 2670 B10R1.8 CNc1cc(cc(c1)F)F 7a_100000233717_200000210301 [1,1,0,0,0,0|2,0,0]=4 2671 B10R1.8 CNc1cc(cc(c1)F)O 271570a_203496583355_106741647397 [1,1,0,0,0,0|2,0,0]=4 2672 B10R1.8 CNc1cc(cc(c1)I)Br 7a_100009814763_200000210301 [1,1,0,0,0,0|2,0,0]=4 2673 B10R1.8 CNc1cc(cc(c1)I)Cl 7a_100010147676_200000210301 [1,1,0,0,0,0|2,0,0]=4 2674 B10R1.8 CNc1cc(cc(c1)I)F 34a_100011356972_200000210301 [1,1,0,0,0,0|2,0,0]=4 2675 B10R1.8 CNc1cc(cc(c1)I)F 7a_100011356972_200000210301 [1,1,0,0,0,0|2,0,0]=4 2676 B10R1.8 CNc1cc(cc(c1)I)I 7a_200000696836_200000210301 [1,1,0,0,0,0|2,0,0]=4 2677 B10R1.8 CNc1cc(cc(c1)O)C 34a_100011995906_200000210301 [1,1,0,0,0,0|1,0,0]=3 2678 B10R1.8 CNc1cc(cc(c1)O)C 7a_100011995906_200000210301 [1,1,0,0,0,0|1,0,0]=3 2679 B10R1.8 CNc1cc(cc(c1)O)O 34a_100000043371_200000210301 [1,1,0,0,0,0|2,0,0]=4 2680 B10R1.8 CNc1cc(cc(n1)C)C 27a_100102657272_100000069240 [1,1,0,0,0,0|2,0,0]=4 2681 B10R1.8 CNc1cc(cc(n1)F)C 27a_100102657272_100009819601 [1,1,0,0,0,0|2,0,0]=4 2682 B10R1.8 CNc1cc(nc(c1)C)C 27a_100102657272_100000066820 [1,1,0,0,0,0|2,0,0]=4 2683 B10R1.8 CNc1cc(nc(c1)Cl)C 27a_100102657272_100010068023 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.8 CNc1cc(nc(c1)F)C 27a_100102657272_100010006595 [1,1,0,0,0,0|2,0,0]=4 2685 B10R1.8 COc1cc(=O)cc(o1)C 34a_100016989201_200000210301 [1,1,0,0,0,0|2,0,0]=4 2686 B10R1.8 COc1cc([nH]c(=O)c1)C 34a_100000039070_200000210301 [1,1,0,0,0,0|2,0,0]=4 2687 B10R1.8 COc1cc(cc(c1)Br)Br 34a_100010167048_200000210301 [1,1,0,0,0,0|2,0,0]=4 2688 B10R1.8 COc1cc(cc(c1)Br)Br 7a_100010167048_200000210301 [1,1,0,0,0,0|2,0,0]=4 2689 B10R1.8 COc1cc(cc(c1)Br)C 34a_100011999630_200000210301 [1,1,0,0,0,0|1,0,0]=3 2690 B10R1.8 COc1cc(cc(c1)Br)C 7a_100011999630_200000210301 [1,1,0,0,0,0|1,0,0]=3 2691 B10R1.8 COc1cc(cc(c1)Br)Cl 34a_100010185897_200000210301 [1,1,0,0,0,0|2,0,0]=4 2692 B10R1.8 COc1cc(cc(c1)Br)Cl 7a_100010185897_200000210301 [1,1,0,0,0,0|2,0,0]=4 2693 B10R1.8 COc1cc(cc(c1)Br)F 34a_100000688818_200000210301 [1,1,0,0,0,0|2,0,0]=4 2694 B10R1.8 COc1cc(cc(c1)Br)F 7a_100000688818_200000210301 [1,1,0,0,0,0|2,0,0]=4 2695 B10R1.8 COc1cc(cc(c1)Br)O 271570a_203496583355_100010141301 [1,1,0,0,0,0|2,0,0]=4 2696 B10R1.8 COc1cc(cc(c1)C)C 34a_100000210933_200000210301 [1,1,0,0,0,0|1,0,0]=3 2697 B10R1.8 COc1cc(cc(c1)C)C 7a_100000210933_200000210301 [1,1,0,0,0,0|1,0,0]=3 2698 B10R1.8 COc1cc(cc(c1)Cl)C 34a_100000087485_200000210301 [1,1,0,0,0,0|1,0,0]=3 2699 B10R1.8 COc1cc(cc(c1)Cl)C 7a_100000087485_200000210301 [1,1,0,0,0,0|1,0,0]=3 2700 B10R1.8 COc1cc(cc(c1)Cl)Cl 34a_100000181315_200000210301 [1,1,0,0,0,0|2,0,0]=4 2701 B10R1.8 COc1cc(cc(c1)Cl)Cl 7a_100000181315_200000210301 [1,1,0,0,0,0|2,0,0]=4 2702 B10R1.8 COc1cc(cc(c1)Cl)F 34a_100011219751_200000210301 [1,1,0,0,0,0|2,0,0]=4 2703 B10R1.8 COc1cc(cc(c1)Cl)F 7a_100011219751_200000210301 [1,1,0,0,0,0|2,0,0]=4 2704 B10R1.8 COc1cc(cc(c1)Cl)N 34a_100000123917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2705 B10R1.8 COc1cc(cc(c1)Cl)N 7a_100000123917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2706 B10R1.8 COc1cc(cc(c1)Cl)O 271570a_203496583355_100010147680 [1,1,0,0,0,0|2,0,0]=4 2707 B10R1.8 COc1cc(cc(c1)F)C 34a_100011830401_200000210301 [1,1,0,0,0,0|1,0,0]=3 2708 B10R1.8 COc1cc(cc(c1)F)C 7a_100011830401_200000210301 [1,1,0,0,0,0|1,0,0]=3 2709 B10R1.8 COc1cc(cc(c1)F)F 34a_100000747503_200000210301 [1,1,0,0,0,0|2,0,0]=4 2710 B10R1.8 COc1cc(cc(c1)F)F 7a_100000747503_200000210301 [1,1,0,0,0,0|2,0,0]=4 2711 B10R1.8 COc1cc(cc(c1)F)O 271570a_203496583355_100011934182 [1,1,0,0,0,0|2,0,0]=4 2712 B10R1.8 COc1cc(cc(c1)I)Br 34a_100010068917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2713 B10R1.8 COc1cc(cc(c1)I)Br 7a_100010068917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2714 B10R1.8 COc1cc(cc(c1)I)Cl 34a_100010068924_200000210301 [1,1,0,0,0,0|2,0,0]=4 2715 B10R1.8 COc1cc(cc(c1)I)Cl 7a_100010068924_200000210301 [1,1,0,0,0,0|2,0,0]=4 2716 B10R1.8 COc1cc(cc(c1)I)F 34a_100000717995_200000210301 [1,1,0,0,0,0|2,0,0]=4 2717 B10R1.8 COc1cc(cc(c1)I)F 7a_100000717995_200000210301 [1,1,0,0,0,0|2,0,0]=4 2718 B10R1.8 COc1cc(cc(c1)N)C 34a_100011995906_200000210301 [1,1,0,0,0,0|1,0,0]=3 2719 B10R1.8 COc1cc(cc(c1)N)C 7a_100011995906_200000210301 [1,1,0,0,0,0|1,0,0]=3 2720 B10R1.8 COc1cc(cc(c1)O)C 271570a_203496583355_100010187550 [1,1,0,0,0,0|1,0,0]=3 2721 B10R1.8 COc1cc(cc(c1)O)N 271570a_203496583355_100000750983 [1,1,0,0,0,0|2,0,0]=4 2722 B10R1.8 COc1cc(cc(c1)O)O 271570a_203496583355_100010068927 [1,1,0,0,0,0|2,0,0]=4 2723 B10R1.8 COc1cc(cc(n1)C)O 271570a_203496583355_100010067692 [1,1,0,0,0,0|2,0,0]=4 2724 B10R1.8 COc1cc(cc(n1)O)C 271570a_203496583355_100009856763 [1,1,0,0,0,0|2,0,0]=4 2725 B10R1.8 COc1cc(nc(c1)O)C 271570a_203496583355_200009849800 [1,1,0,0,0,0|2,0,0]=4 2726 B10R1.8 COc1cc(oc(=O)c1)C 34a_100000210952_200000210301 [1,1,0,0,0,0|2,0,0]=4 2727 B10R1.8 COc1cc(oc(=O)c1)C 7a_100000210952_200000210301 [1,1,0,0,0,0|2,0,0]=4 2728 B10R1.8 CSc1cc([nH]c(=O)c1)C 62a_100009861981_200000210301 [1,1,0,0,0,0|2,0,0]=4 2729 B10R1.8 CSc1cc([nH]c(=O)c1)C 62a_200000210301_100009861981 [1,1,0,0,0,0|2,0,0]=4 2730 B10R1.8 CSc1cc(cc(c1)Br)Br 62a_100009814770_200000210301 [1,1,0,0,0,0|2,0,0]=4 2731 B10R1.8 CSc1cc(cc(c1)Br)Br 62a_200000210301_100009814770 [1,1,0,0,0,0|2,0,0]=4 2732 B10R1.8 CSc1cc(cc(c1)Br)Cl 62a_100009814755_200000210301 [1,1,0,0,0,0|2,0,0]=4 2733 B10R1.8 CSc1cc(cc(c1)Br)Cl 62a_200000210301_100009814755 [1,1,0,0,0,0|2,0,0]=4 2734 B10R1.8 CSc1cc(cc(c1)Br)F 62a_100009814764_200000210301 [1,1,0,0,0,0|2,0,0]=4 2735 B10R1.8 CSc1cc(cc(c1)Br)F 62a_200000210301_100009814764 [1,1,0,0,0,0|2,0,0]=4 2736 B10R1.8 CSc1cc(cc(c1)Br)N 62a_100009814763_200000210301 [1,1,0,0,0,0|2,0,0]=4 2737 B10R1.8 CSc1cc(cc(c1)Br)N 62a_200000210301_100009814763 [1,1,0,0,0,0|2,0,0]=4 2738 B10R1.8 CSc1cc(cc(c1)Br)O 62a_100010068917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2739 B10R1.8 CSc1cc(cc(c1)Br)O 62a_200000210301_100010068917 [1,1,0,0,0,0|2,0,0]=4 2740 B10R1.8 CSc1cc(cc(c1)C)C 62a_100011215608_200000210301 [1,1,0,0,0,0|1,0,0]=3 2741 B10R1.8 CSc1cc(cc(c1)C)C 62a_200000210301_100011215608 [1,1,0,0,0,0|1,0,0]=3 2742 B10R1.8 CSc1cc(cc(c1)Cl)C 62a_100010172791_200000210301 [1,1,0,0,0,0|1,0,0]=3 2743 B10R1.8 CSc1cc(cc(c1)Cl)C 62a_200000210301_100010172791 [1,1,0,0,0,0|1,0,0]=3 2744 B10R1.8 CSc1cc(cc(c1)Cl)Cl 62a_100000747138_200000210301 [1,1,0,0,0,0|2,0,0]=4 2745 B10R1.8 CSc1cc(cc(c1)Cl)Cl 62a_200000210301_100000747138 [1,1,0,0,0,0|2,0,0]=4 2746 B10R1.8 CSc1cc(cc(c1)Cl)F 62a_100013859453_200000210301 [1,1,0,0,0,0|2,0,0]=4 2747 B10R1.8 CSc1cc(cc(c1)Cl)F 62a_200000210301_100013859453 [1,1,0,0,0,0|2,0,0]=4 2748 B10R1.8 CSc1cc(cc(c1)Cl)N 62a_100010147676_200000210301 [1,1,0,0,0,0|2,0,0]=4 2749 B10R1.8 CSc1cc(cc(c1)Cl)N 62a_200000210301_100010147676 [1,1,0,0,0,0|2,0,0]=4 2750 B10R1.8 CSc1cc(cc(c1)Cl)O 62a_100010068924_200000210301 [1,1,0,0,0,0|2,0,0]=4 2751 B10R1.8 CSc1cc(cc(c1)Cl)O 62a_200000210301_100010068924 [1,1,0,0,0,0|2,0,0]=4 2752 B10R1.8 CSc1cc(cc(c1)F)C 62a_100011356977_200000210301 [1,1,0,0,0,0|1,0,0]=3 2753 B10R1.8 CSc1cc(cc(c1)F)C 62a_200000210301_100011356977 [1,1,0,0,0,0|1,0,0]=3 2754 B10R1.8 CSc1cc(cc(c1)F)F 62a_100000233788_200000210301 [1,1,0,0,0,0|2,0,0]=4 2755 B10R1.8 CSc1cc(cc(c1)F)F 62a_200000210301_100000233788 [1,1,0,0,0,0|2,0,0]=4 2756 B10R1.8 CSc1cc(cc(c1)F)N 62a_100011356972_200000210301 [1,1,0,0,0,0|2,0,0]=4 2757 B10R1.8 CSc1cc(cc(c1)F)N 62a_200000210301_100011356972 [1,1,0,0,0,0|2,0,0]=4 2758 B10R1.8 CSc1cc(cc(c1)F)O 271570a_203496583355_200010245467 [1,1,0,0,0,0|2,0,0]=4 2759 B10R1.8 CSc1cc(cc(c1)F)O 62a_100000688818_200000210301 [1,1,0,0,0,0|2,0,0]=4 2760 B10R1.8 CSc1cc(cc(c1)F)O 62a_200000210301_100000688818 [1,1,0,0,0,0|2,0,0]=4 2761 B10R1.8 CSc1cc(cc(c1)N)C 62a_100000695972_200000210301 [1,1,0,0,0,0|1,0,0]=3 2762 B10R1.8 CSc1cc(cc(c1)N)C 62a_200000210301_100000695972 [1,1,0,0,0,0|1,0,0]=3 2763 B10R1.8 CSc1cc(cc(c1)N)N 62a_100011999608_200000210301 [1,1,0,0,0,0|2,0,0]=4 2764 B10R1.8 CSc1cc(cc(c1)N)N 62a_200000210301_100011999608 [1,1,0,0,0,0|2,0,0]=4 2765 B10R1.8 CSc1cc(cc(c1)O)C 271570a_203496583355_200010709730 [1,1,0,0,0,0|1,0,0]=3 2766 B10R1.8 CSc1cc(cc(c1)O)C 62a_200000210301_100011999630 [1,1,0,0,0,0|1,0,0]=3 2767 B10R1.8 CSc1cc(cc(c1)O)O 62a_200000210301_100009868816 [1,1,0,0,0,0|2,0,0]=4 2768 B10R1.8 CSc1cc(cc(n1)C)C 62a_100000069240_200000210301 [1,1,0,0,0,0|2,0,0]=4 2769 B10R1.8 CSc1cc(cc(n1)C)C 62a_200000210301_100000069240 [1,1,0,0,0,0|2,0,0]=4 2770 B10R1.8 CSc1cc(cc(n1)C)N 62a_100000071261_200000210301 [1,1,0,0,0,0|2,0,0]=4 2771 B10R1.8 CSc1cc(cc(n1)C)N 62a_200000210301_100000071261 [1,1,0,0,0,0|2,0,0]=4 2772 B10R1.8 CSc1cc(cc(n1)F)C 62a_100009819601_200000210301 [1,1,0,0,0,0|2,0,0]=4 2773 B10R1.8 CSc1cc(cc(n1)F)C 62a_200000210301_100009819601 [1,1,0,0,0,0|2,0,0]=4 2774 B10R1.8 CSc1cc(cc(n1)N)C 62a_100009819863_200000210301 [1,1,0,0,0,0|2,0,0]=4 2775 B10R1.8 CSc1cc(cc(n1)N)C 62a_200000210301_100009819863 [1,1,0,0,0,0|2,0,0]=4 2776 B10R1.8 CSc1cc(nc(c1)C)C 62a_100000066820_200000210301 [1,1,0,0,0,0|2,0,0]=4 2777 B10R1.8 CSc1cc(nc(c1)C)C 62a_200000210301_100000066820 [1,1,0,0,0,0|2,0,0]=4 2778 B10R1.8 CSc1cc(nc(c1)Cl)C 62a_100010068023_200000210301 [1,1,0,0,0,0|2,0,0]=4 2779 B10R1.8 CSc1cc(nc(c1)Cl)C 62a_200000210301_100010068023 [1,1,0,0,0,0|2,0,0]=4 2780 B10R1.8 CSc1cc(nc(c1)F)C 62a_100010006595_200000210301 [1,1,0,0,0,0|2,0,0]=4 2781 B10R1.8 CSc1cc(nc(c1)F)C 62a_200000210301_100010006595 [1,1,0,0,0,0|2,0,0]=4 2782 B10R1.8 CSc1cc(nc(c1)N)C 62a_100000076705_200000210301 [1,1,0,0,0,0|2,0,0]=4 2783 B10R1.8 CSc1cc(nc(c1)N)C 62a_200000210301_100000076705 [1,1,0,0,0,0|2,0,0]=4 2784 B10R1.8 Cc1cc(=O)cc(o1)O[13CH3] 34a_100016989201_200025704644 [1,1,0,0,0,0|2,0,0]=4 2785 B10R1.8 Cc1cc(cc(=O)[nH]1)O[13CH3] 34a_100000039070_200025704644 [1,1,0,0,0,0|2,0,0]=4 2786 B10R1.8 Cc1cc(cc(=O)[nH]1)S[13CH3] 62a_100009861981_200025704644 [1,1,0,0,0,0|2,0,0]=4 2787 B10R1.8 Cc1cc(cc(=O)[nH]1)S[13CH3] 62a_200025704644_100009861981 [1,1,0,0,0,0|2,0,0]=4 2788 B10R1.8 Cc1cc(cc(=O)o1)O[13CH3] 34a_100000210952_200025704644 [1,1,0,0,0,0|2,0,0]=4 2789 B10R1.8 Cc1cc(cc(=O)o1)O[13CH3] 7a_100000210952_200025704644 [1,1,0,0,0,0|2,0,0]=4 2790 B10R1.8 Cc1cc(cc(c1)C#N)O 271570a_203496583355_100011998626 [1,1,0,0,0,0|1,0,1]=4 2791 B10R1.8 Cc1cc(cc(c1)C=O)O 271570a_203496583355_100000686105 [1,1,0,0,0,0|0,0,0]=2 2792 B10R1.8 Cc1cc(cc(c1)CO)O 271570a_203496583355_100000720511 [1,1,0,0,0,0|0,0,2]=4 2793 B10R1.8 Cc1cc(cc(c1)N[13CH3])Br 34a_100000695972_200025704644 [1,1,0,0,0,0|1,0,0]=3 2794 B10R1.8 Cc1cc(cc(c1)N[13CH3])Br 7a_100000695972_200025704644 [1,1,0,0,0,0|1,0,0]=3 2795 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 2230a_100000210930_200025704644 [1,1,0,0,0,0|1,0,0]=3 2796 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 34a_100000210930_200025704644 [1,1,0,0,0,0|1,0,0]=3 2797 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 7a_100000210930_200025704644 [1,1,0,0,0,0|1,0,0]=3 2798 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 2230a_100012022512_200025704644 [1,1,0,0,0,0|1,0,0]=3 2799 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 34a_100012022512_200025704644 [1,1,0,0,0,0|1,0,0]=3 2800 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 7a_100012022512_200025704644 [1,1,0,0,0,0|1,0,0]=3 2801 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 2230a_100000742734_200025704644 [1,1,0,0,0,0|1,0,0]=3 2802 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 34a_100000742734_200025704644 [1,1,0,0,0,0|1,0,0]=3 2803 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 7a_100000742734_200025704644 [1,1,0,0,0,0|1,0,0]=3 2804 B10R1.8 Cc1cc(cc(c1)N[13CH3])O 34a_100011995906_200025704644 [1,1,0,0,0,0|1,0,0]=3 2805 B10R1.8 Cc1cc(cc(c1)N[13CH3])O 7a_100011995906_200025704644 [1,1,0,0,0,0|1,0,0]=3 2806 B10R1.8 Cc1cc(cc(c1)O[13CH3])Br 34a_100011999630_200025704644 [1,1,0,0,0,0|1,0,0]=3 2807 B10R1.8 Cc1cc(cc(c1)O[13CH3])Br 7a_100011999630_200025704644 [1,1,0,0,0,0|1,0,0]=3 2808 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 34a_100000210933_200025704644 [1,1,0,0,0,0|1,0,0]=3 2809 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 7a_100000210933_200025704644 [1,1,0,0,0,0|1,0,0]=3 2810 B10R1.8 Cc1cc(cc(c1)O[13CH3])Cl 34a_100000087485_200025704644 [1,1,0,0,0,0|1,0,0]=3 2811 B10R1.8 Cc1cc(cc(c1)O[13CH3])Cl 7a_100000087485_200025704644 [1,1,0,0,0,0|1,0,0]=3 2812 B10R1.8 Cc1cc(cc(c1)O[13CH3])F 34a_100011830401_200025704644 [1,1,0,0,0,0|1,0,0]=3 2813 B10R1.8 Cc1cc(cc(c1)O[13CH3])F 7a_100011830401_200025704644 [1,1,0,0,0,0|1,0,0]=3 2814 B10R1.8 Cc1cc(cc(c1)O[13CH3])N 34a_100011995906_200025704644 [1,1,0,0,0,0|1,0,0]=3 2815 B10R1.8 Cc1cc(cc(c1)O[13CH3])N 7a_100011995906_200025704644 [1,1,0,0,0,0|1,0,0]=3 2816 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_100011215608_200025704644 [1,1,0,0,0,0|1,0,0]=3 2817 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_200025704644_100011215608 [1,1,0,0,0,0|1,0,0]=3 2818 B10R1.8 Cc1cc(cc(c1)S[13CH3])Cl 62a_100010172791_200025704644 [1,1,0,0,0,0|1,0,0]=3 2819 B10R1.8 Cc1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100010172791 [1,1,0,0,0,0|1,0,0]=3 2820 B10R1.8 Cc1cc(cc(c1)S[13CH3])F 62a_100011356977_200025704644 [1,1,0,0,0,0|1,0,0]=3 2821 B10R1.8 Cc1cc(cc(c1)S[13CH3])F 62a_200025704644_100011356977 [1,1,0,0,0,0|1,0,0]=3 2822 B10R1.8 Cc1cc(cc(c1)S[13CH3])N 62a_100000695972_200025704644 [1,1,0,0,0,0|1,0,0]=3 2823 B10R1.8 Cc1cc(cc(c1)S[13CH3])N 62a_200025704644_100000695972 [1,1,0,0,0,0|1,0,0]=3 2824 B10R1.8 Cc1cc(cc(c1)S[13CH3])O 62a_200025704644_100011999630 [1,1,0,0,0,0|1,0,0]=3 2825 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_100000066820_200025704644 [1,1,0,0,0,0|2,0,0]=4 2826 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100000066820 [1,1,0,0,0,0|2,0,0]=4 2827 B10R1.8 Cc1cc(cc(n1)C=O)O 271570a_203496583355_100009814795 [1,1,0,0,0,0|1,0,0]=3 2828 B10R1.8 Cc1cc(cc(n1)Cl)S[13CH3] 62a_100010068023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2829 B10R1.8 Cc1cc(cc(n1)Cl)S[13CH3] 62a_200025704644_100010068023 [1,1,0,0,0,0|2,0,0]=4 2830 B10R1.8 Cc1cc(cc(n1)F)S[13CH3] 62a_100010006595_200025704644 [1,1,0,0,0,0|2,0,0]=4 2831 B10R1.8 Cc1cc(cc(n1)F)S[13CH3] 62a_200025704644_100010006595 [1,1,0,0,0,0|2,0,0]=4 2832 B10R1.8 Cc1cc(cc(n1)N)S[13CH3] 62a_100000076705_200025704644 [1,1,0,0,0,0|2,0,0]=4 2833 B10R1.8 Cc1cc(cc(n1)N)S[13CH3] 62a_200025704644_100000076705 [1,1,0,0,0,0|2,0,0]=4 2834 B10R1.8 Cc1cc(cc(n1)S[13CH3])N 62a_100000071261_200025704644 [1,1,0,0,0,0|2,0,0]=4 2835 B10R1.8 Cc1cc(cc(n1)S[13CH3])N 62a_200025704644_100000071261 [1,1,0,0,0,0|2,0,0]=4 2836 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_100000069240_200025704644 [1,1,0,0,0,0|2,0,0]=4 2837 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_200025704644_100000069240 [1,1,0,0,0,0|2,0,0]=4 2838 B10R1.8 Cc1cc(nc(c1)S[13CH3])F 62a_100009819601_200025704644 [1,1,0,0,0,0|2,0,0]=4 2839 B10R1.8 Cc1cc(nc(c1)S[13CH3])F 62a_200025704644_100009819601 [1,1,0,0,0,0|2,0,0]=4 2840 B10R1.8 Cc1cc(nc(c1)S[13CH3])N 62a_100009819863_200025704644 [1,1,0,0,0,0|2,0,0]=4 2841 B10R1.8 Cc1cc(nc(c1)S[13CH3])N 62a_200025704644_100009819863 [1,1,0,0,0,0|2,0,0]=4 2842 B10R1.8 O=Cc1cc(cc(c1)Br)O 271570a_203496583355_100010185649 [1,1,0,0,0,0|1,0,0]=3 2843 B10R1.8 O=Cc1cc(cc(c1)F)O 271570a_203496583355_100011794424 [1,1,0,0,0,0|1,0,0]=3 2844 B10R1.8 O=Cc1cc(cc(c1)O)O 271570a_203496583355_100010176088 [1,1,0,0,0,0|1,0,0]=3 2845 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)Br 34a_100012047176_200025704644 [1,1,0,0,0,0|2,0,0]=4 2846 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)Br 7a_100012047176_200025704644 [1,1,0,0,0,0|2,0,0]=4 2847 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)Cl 34a_100011934539_200025704644 [1,1,0,0,0,0|2,0,0]=4 2848 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)Cl 7a_100011934539_200025704644 [1,1,0,0,0,0|2,0,0]=4 2849 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)F 34a_100000705686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2850 B10R1.8 [13CH3]Nc1cc(cc(c1)Br)F 7a_100000705686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2851 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)Cl 34a_100000210456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2852 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)Cl 7a_100000210456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2853 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)F 34a_100000686136_200025704644 [1,1,0,0,0,0|2,0,0]=4 2854 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)F 7a_100000686136_200025704644 [1,1,0,0,0,0|2,0,0]=4 2855 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)O 34a_100000123917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2856 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)O 7a_100000123917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2857 B10R1.8 [13CH3]Nc1cc(cc(c1)F)F 34a_100000233717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2858 B10R1.8 [13CH3]Nc1cc(cc(c1)F)F 7a_100000233717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2859 B10R1.8 [13CH3]Nc1cc(cc(c1)I)Br 7a_100009814763_200025704644 [1,1,0,0,0,0|2,0,0]=4 2860 B10R1.8 [13CH3]Nc1cc(cc(c1)I)Cl 7a_100010147676_200025704644 [1,1,0,0,0,0|2,0,0]=4 2861 B10R1.8 [13CH3]Nc1cc(cc(c1)I)F 34a_100011356972_200025704644 [1,1,0,0,0,0|2,0,0]=4 2862 B10R1.8 [13CH3]Nc1cc(cc(c1)I)F 7a_100011356972_200025704644 [1,1,0,0,0,0|2,0,0]=4 2863 B10R1.8 [13CH3]Nc1cc(cc(c1)I)I 7a_200000696836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2864 B10R1.8 [13CH3]Nc1cc(cc(c1)O)O 34a_100000043371_200025704644 [1,1,0,0,0,0|2,0,0]=4 2865 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Br 34a_100010167048_200025704644 [1,1,0,0,0,0|2,0,0]=4 2866 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Br 7a_100010167048_200025704644 [1,1,0,0,0,0|2,0,0]=4 2867 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Cl 34a_100010185897_200025704644 [1,1,0,0,0,0|2,0,0]=4 2868 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Cl 7a_100010185897_200025704644 [1,1,0,0,0,0|2,0,0]=4 2869 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)F 34a_100000688818_200025704644 [1,1,0,0,0,0|2,0,0]=4 2870 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)F 7a_100000688818_200025704644 [1,1,0,0,0,0|2,0,0]=4 2871 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)Cl 34a_100000181315_200025704644 [1,1,0,0,0,0|2,0,0]=4 2872 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)Cl 7a_100000181315_200025704644 [1,1,0,0,0,0|2,0,0]=4 2873 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)F 34a_100011219751_200025704644 [1,1,0,0,0,0|2,0,0]=4 2874 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)F 7a_100011219751_200025704644 [1,1,0,0,0,0|2,0,0]=4 2875 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)N 34a_100000123917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2876 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)N 7a_100000123917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2877 B10R1.8 [13CH3]Oc1cc(cc(c1)F)F 34a_100000747503_200025704644 [1,1,0,0,0,0|2,0,0]=4 2878 B10R1.8 [13CH3]Oc1cc(cc(c1)F)F 7a_100000747503_200025704644 [1,1,0,0,0,0|2,0,0]=4 2879 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Br 34a_100010068917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2880 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Br 7a_100010068917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2881 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Cl 34a_100010068924_200025704644 [1,1,0,0,0,0|2,0,0]=4 2882 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Cl 7a_100010068924_200025704644 [1,1,0,0,0,0|2,0,0]=4 2883 B10R1.8 [13CH3]Oc1cc(cc(c1)I)F 34a_100000717995_200025704644 [1,1,0,0,0,0|2,0,0]=4 2884 B10R1.8 [13CH3]Oc1cc(cc(c1)I)F 7a_100000717995_200025704644 [1,1,0,0,0,0|2,0,0]=4 2885 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)Br 62a_100009814770_200025704644 [1,1,0,0,0,0|2,0,0]=4 2886 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)Br 62a_200025704644_100009814770 [1,1,0,0,0,0|2,0,0]=4 2887 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)Cl 62a_100009814755_200025704644 [1,1,0,0,0,0|2,0,0]=4 2888 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)Cl 62a_200025704644_100009814755 [1,1,0,0,0,0|2,0,0]=4 2889 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)F 62a_100009814764_200025704644 [1,1,0,0,0,0|2,0,0]=4 2890 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)F 62a_200025704644_100009814764 [1,1,0,0,0,0|2,0,0]=4 2891 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)N 62a_100009814763_200025704644 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)N 62a_200025704644_100009814763 [1,1,0,0,0,0|2,0,0]=4 2893 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)O 62a_100010068917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2894 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)O 62a_200025704644_100010068917 [1,1,0,0,0,0|2,0,0]=4 2895 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)Cl 62a_100000747138_200025704644 [1,1,0,0,0,0|2,0,0]=4 2896 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)Cl 62a_200025704644_100000747138 [1,1,0,0,0,0|2,0,0]=4 2897 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)F 62a_100013859453_200025704644 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)F 62a_200025704644_100013859453 [1,1,0,0,0,0|2,0,0]=4 2899 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)N 62a_100010147676_200025704644 [1,1,0,0,0,0|2,0,0]=4 2900 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)N 62a_200025704644_100010147676 [1,1,0,0,0,0|2,0,0]=4 2901 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)O 62a_100010068924_200025704644 [1,1,0,0,0,0|2,0,0]=4 2902 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)O 62a_200025704644_100010068924 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.8 [13CH3]Sc1cc(cc(c1)F)F 62a_100000233788_200025704644 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.8 [13CH3]Sc1cc(cc(c1)F)F 62a_200025704644_100000233788 [1,1,0,0,0,0|2,0,0]=4 2905 B10R1.8 [13CH3]Sc1cc(cc(c1)F)N 62a_100011356972_200025704644 [1,1,0,0,0,0|2,0,0]=4 2906 B10R1.8 [13CH3]Sc1cc(cc(c1)F)N 62a_200025704644_100011356972 [1,1,0,0,0,0|2,0,0]=4 2907 B10R1.8 [13CH3]Sc1cc(cc(c1)F)O 62a_100000688818_200025704644 [1,1,0,0,0,0|2,0,0]=4 2908 B10R1.8 [13CH3]Sc1cc(cc(c1)F)O 62a_200025704644_100000688818 [1,1,0,0,0,0|2,0,0]=4 2909 B10R1.8 [13CH3]Sc1cc(cc(c1)N)N 62a_100011999608_200025704644 [1,1,0,0,0,0|2,0,0]=4 2910 B10R1.8 [13CH3]Sc1cc(cc(c1)N)N 62a_200025704644_100011999608 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.8 [13CH3]Sc1cc(cc(c1)O)O 62a_200025704644_100009868816 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.10 C=C=Cc1cc(ccn1)C 271570a_100015277604_100000750283 [1,1,0,0,0,0|1,0,1]=4 2913 B10R1.10 C=C=Cc1ccc[n+](c1)C 271570a_100015277604_100009996589 [1,1,0,0,0,0|1,0,1]=4 2914 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,1,0,0,0,0|1,0,1]=4 2915 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,1,0,0,0,0|0,0,1]=3 2916 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,1,0,0,0,0|1,0,1]=4 2917 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,1,0,0,0,0|1,0,1]=4 2918 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,1,0,0,0,0|1,0,1]=4 2919 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,1,0,0,0,0|1,0,1]=4 2920 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,1,0,0,0,0|1,0,1]=4 2921 B10R1.10 C=C=Cc1cccc(n1)C 271570a_100015277604_100000742759 [1,1,0,0,0,0|1,0,1]=4 2922 B10R1.10 C=C=Cc1ccnc(c1)C 271570a_100015277604_100000758586 [1,1,0,0,0,0|1,0,1]=4 2923 B10R1.10 C=C=Cc1cncc(c1)C 271570a_100015277604_100000760492 [1,1,0,0,0,0|1,0,1]=4 2924 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,1,0,0,0,0|1,0,1]=4 2925 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,1,0,0,0,0|1,0,1]=4 2926 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,1,0,0,0,0|1,0,0]=3 2927 B10R1.10 CC=Cc1cc(ccn1)Cl 271570a_100016259895_100010167805 [1,1,0,0,0,0|2,0,0]=4 2928 B10R1.10 CC=Cc1cc(ccn1)F 271570a_100016259895_100009817058 [1,1,0,0,0,0|2,0,0]=4 2929 B10R1.10 CC=Cc1cc(ccn1)N 271570a_100016259895_100009814236 [1,1,0,0,0,0|2,0,0]=4 2930 B10R1.10 CC=Cc1cc(ccn1)O 271570a_100016259895_100000762945 [1,1,0,0,0,0|2,0,0]=4 2931 B10R1.10 CC=Cc1cc(cnn1)C 271570a_100016259895_100000070100 [1,1,0,0,0,0|2,0,0]=4 2932 B10R1.10 CC=Cc1cc(ncn1)C 271570a_100016259895_100000744208 [1,1,0,0,0,0|2,0,0]=4 2933 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [1,1,0,0,0,0|2,0,0]=4 2934 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,1,0,0,0,0|1,0,0]=3 2935 B10R1.10 CC=Cc1ccc[n+](c1)[O-] 271570a_100016259895_100009815978 [1,1,0,0,0,0|2,0,0]=4 2936 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [1,1,0,0,0,0|2,0,0]=4 2937 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|1,0,0]=3 2938 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|0,0,0]=2 2939 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|1,0,0]=3 2940 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|1,0,0]=3 2941 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|1,0,0]=3 2942 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|1,0,0]=3 2943 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|1,0,0]=3 2944 B10R1.10 CC=Cc1cccc(n1)Br 271570a_100016259895_100000684672 [1,1,0,0,0,0|2,0,0]=4 2945 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,1,0,0,0,0|1,0,0]=3 2946 B10R1.10 CC=Cc1cccc(n1)F 271570a_100016259895_100009815982 [1,1,0,0,0,0|2,0,0]=4 2947 B10R1.10 CC=Cc1cccc(n1)N 271570a_100016259895_100000740741 [1,1,0,0,0,0|2,0,0]=4 2948 B10R1.10 CC=Cc1ccnc(c1)Br 271570a_100016259895_100009814637 [1,1,0,0,0,0|2,0,0]=4 2949 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,1,0,0,0,0|1,0,0]=3 2950 B10R1.10 CC=Cc1ccnc(c1)Cl 271570a_100016259895_100000035001 [1,1,0,0,0,0|2,0,0]=4 2951 B10R1.10 CC=Cc1ccnc(c1)F 271570a_100016259895_100009816116 [1,1,0,0,0,0|2,0,0]=4 2952 B10R1.10 CC=Cc1ccnc(c1)N 271570a_100016259895_100000744379 [1,1,0,0,0,0|2,0,0]=4 2953 B10R1.10 CC=Cc1ccnc(n1)C 271570a_100016259895_100000749937 [1,1,0,0,0,0|2,0,0]=4 2954 B10R1.10 CC=Cc1cncc(c1)Br 271570a_100016259895_100000728054 [1,1,0,0,0,0|2,0,0]=4 2955 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,1,0,0,0,0|1,0,0]=3 2956 B10R1.10 CC=Cc1cncc(c1)Cl 271570a_100016259895_100000049639 [1,1,0,0,0,0|2,0,0]=4 2957 B10R1.10 CC=Cc1cncc(c1)F 271570a_100016259895_100000744099 [1,1,0,0,0,0|2,0,0]=4 2958 B10R1.10 CC=Cc1cncc(c1)N 271570a_100016259895_100000687067 [1,1,0,0,0,0|2,0,0]=4 2959 B10R1.10 CC=Cc1cncc(c1)O 271570a_100016259895_100000754920 [1,1,0,0,0,0|2,0,0]=4 2960 B10R1.10 CC=Cc1cncc(n1)C 271570a_100016259895_100009842155 [1,1,0,0,0,0|2,0,0]=4 2961 B10R1.10 CC=Cc1nccc(n1)C 271570a_100016259895_100011243806 [1,1,0,0,0,0|2,0,0]=4 2962 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|1,0,1]=4 2963 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,1,0,0,0,0|1,0,1]=4 2964 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,1,0,0,0,0|0,0,1]=3 2965 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,1,0,0,0,0|0,0,1]=3 2966 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,1,0,0,0,0|1,0,1]=4 2967 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,1,0,0,0,0|1,0,1]=4 2968 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,1,0,0,0,0|1,0,1]=4 2969 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,1,0,0,0,0|1,0,1]=4 2970 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,1]=4 2971 B10R1.10 CCNc1ccnc(c1)C 27a_100015525214_100000758586 [1,1,0,0,0,0|1,0,1]=4 2972 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,1,0,0,0,0|1,0,1]=4 2973 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,1,0,0,0,0|1,0,1]=4 2974 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,1,0,0,0,0|0,0,1]=3 2975 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,1,0,0,0,0|0,0,1]=3 2976 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,1,0,0,0,0|1,0,1]=4 2977 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,1,0,0,0,0|1,0,1]=4 2978 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,1,0,0,0,0|1,0,1]=4 2979 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,1,0,0,0,0|1,0,1]=4 2980 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,1,0,0,0,0|1,0,1]=4 2981 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,1,0,0,0,0|1,0,1]=4 2982 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,1]=4 2983 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,1,0,0,0,0|1,0,1]=4 2984 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [1,1,0,0,0,0|1,0,1]=4 2985 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [1,1,0,0,0,0|1,0,1]=4 2986 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [1,1,0,0,0,0|1,0,1]=4 2987 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [1,1,0,0,0,0|1,0,1]=4 2988 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [1,1,0,0,0,0|1,0,1]=4 2989 B10R1.10 CCSc1ccc[n+](c1)C 62a_100000210202_100009996589 [1,1,0,0,0,0|1,0,1]=4 2990 B10R1.10 CCSc1ccc[n+](c1)C 62a_100009996589_100000210202 [1,1,0,0,0,0|1,0,1]=4 2991 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,1,0,0,0,0|1,0,1]=4 2992 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,1,0,0,0,0|1,0,1]=4 2993 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,1,0,0,0,0|0,0,1]=3 2994 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,1,0,0,0,0|0,0,1]=3 2995 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,1,0,0,0,0|1,0,1]=4 2996 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,1,0,0,0,0|1,0,1]=4 2997 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,1,0,0,0,0|1,0,1]=4 2998 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,1,0,0,0,0|1,0,1]=4 2999 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,1,0,0,0,0|1,0,1]=4 3000 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,1,0,0,0,0|1,0,1]=4 3001 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,1,0,0,0,0|1,0,1]=4 3002 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,1,0,0,0,0|1,0,1]=4 3003 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,1,0,0,0,0|1,0,1]=4 3004 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,1,0,0,0,0|1,0,1]=4 3005 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [1,1,0,0,0,0|1,0,1]=4 3006 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [1,1,0,0,0,0|1,0,1]=4 3007 B10R1.10 CCSc1ccnc(c1)C 62a_100000210202_100000758586 [1,1,0,0,0,0|1,0,1]=4 3008 B10R1.10 CCSc1ccnc(c1)C 62a_100000758586_100000210202 [1,1,0,0,0,0|1,0,1]=4 3009 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [1,1,0,0,0,0|1,0,1]=4 3010 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [1,1,0,0,0,0|1,0,1]=4 3011 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [1,1,0,0,0,0|1,0,1]=4 3012 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [1,1,0,0,0,0|1,0,1]=4 3013 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [1,1,0,0,0,0|1,0,1]=4 3014 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [1,1,0,0,0,0|1,0,1]=4 3015 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [1,1,0,0,0,0|1,0,1]=4 3016 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|1,0,1]=4 3017 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3018 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|1,0,1]=4 3019 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|1,0,1]=4 3020 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|1,0,1]=4 3021 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|1,0,1]=4 3022 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|1,0,1]=4 3023 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|1,0,1]=4 3024 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|0,0,1]=3 3025 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|0,0,1]=3 3026 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|0,0,1]=3 3027 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|0,0,1]=3 3028 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|0,0,1]=3 3029 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|0,0,1]=3 3030 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|0,0,1]=3 3031 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|1,0,1]=4 3032 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|1,0,1]=4 3033 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|1,0,1]=4 3034 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|1,0,1]=4 3035 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|1,0,1]=4 3036 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|1,0,1]=4 3037 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|1,0,1]=4 3038 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|1,0,1]=4 3039 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|1,0,1]=4 3040 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|1,0,1]=4 3041 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|1,0,1]=4 3042 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|1,0,1]=4 3043 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|1,0,1]=4 3044 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|1,0,1]=4 3045 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|1,0,1]=4 3046 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|1,0,1]=4 3047 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|1,0,1]=4 3048 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|1,0,1]=4 3049 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|1,0,1]=4 3050 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|1,0,1]=4 3051 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|1,0,1]=4 3052 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|1,0,1]=4 3053 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|1,0,1]=4 3054 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|1,0,1]=4 3055 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|1,0,1]=4 3056 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|1,0,1]=4 3057 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|1,0,1]=4 3058 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|1,0,1]=4 3059 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|1,0,1]=4 3060 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [1,1,0,0,0,0|1,0,1]=4 3061 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [1,1,0,0,0,0|1,0,1]=4 3062 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [1,1,0,0,0,0|1,0,1]=4 3063 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [1,1,0,0,0,0|1,0,1]=4 3064 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [1,1,0,0,0,0|1,0,1]=4 3065 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [1,1,0,0,0,0|1,0,1]=4 3066 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [1,1,0,0,0,0|1,0,1]=4 3068 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [1,1,0,0,0,0|1,0,1]=4 3069 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [1,1,0,0,0,0|1,0,1]=4 3070 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [1,1,0,0,0,0|1,0,1]=4 3071 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [1,1,0,0,0,0|1,0,1]=4 3072 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [1,1,0,0,0,0|1,0,1]=4 3073 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [1,1,0,0,0,0|1,0,1]=4 3074 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [1,1,0,0,0,0|1,0,1]=4 3075 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [1,1,0,0,0,0|1,0,1]=4 3076 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [1,1,0,0,0,0|1,0,1]=4 3077 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [1,1,0,0,0,0|1,0,1]=4 3078 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [1,1,0,0,0,0|1,0,1]=4 3079 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [1,1,0,0,0,0|1,0,1]=4 3080 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [1,1,0,0,0,0|1,0,1]=4 3081 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 3082 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|1,0,1]=4 3083 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|1,0,1]=4 3084 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|0,0,1]=3 3085 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|0,0,1]=3 3086 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|0,0,1]=3 3087 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 3088 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|1,0,1]=4 3089 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|1,0,1]=4 3090 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 3091 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|1,0,1]=4 3092 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|1,0,1]=4 3093 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 3094 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|1,0,1]=4 3095 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|1,0,1]=4 3096 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,1]=4 3097 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|1,0,1]=4 3098 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|1,0,1]=4 3099 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [1,1,0,0,0,0|1,0,1]=4 3100 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [1,1,0,0,0,0|1,0,1]=4 3101 B10R1.10 COCc1ccnc(c1)C 34a_100011998630_200000210301 [1,1,0,0,0,0|1,0,1]=4 3102 B10R1.10 COCc1ccnc(c1)C 34a_100138415774_200020672517 [1,1,0,0,0,0|1,0,1]=4 3103 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [1,1,0,0,0,0|1,0,1]=4 3104 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [1,1,0,0,0,0|1,0,1]=4 3105 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [1,1,0,0,0,0|1,0,1]=4 3106 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [1,1,0,0,0,0|1,0,1]=4 3107 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [1,1,0,0,0,0|1,0,1]=4 3108 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|1,0,1]=4 3109 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|1,0,1]=4 3110 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|0,0,1]=3 3111 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|0,0,1]=3 3112 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|1,0,1]=4 3113 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|1,0,1]=4 3114 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|1,0,1]=4 3115 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|1,0,1]=4 3116 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|1,0,1]=4 3117 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|1,0,1]=4 3118 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|1,0,1]=4 3119 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|1,0,1]=4 3120 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [1,1,0,0,0,0|1,0,1]=4 3121 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [1,1,0,0,0,0|1,0,1]=4 3122 B10R1.10 CSCc1ccnc(c1)C 62a_200000210301_200020672517 [1,1,0,0,0,0|1,0,1]=4 3123 B10R1.10 CSCc1ccnc(c1)C 62a_200020672517_200000210301 [1,1,0,0,0,0|1,0,1]=4 3124 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [1,1,0,0,0,0|1,0,1]=4 3125 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [1,1,0,0,0,0|1,0,1]=4 3126 B10R1.10 C[n+]1cccc(c1)SCF 62a_100009996589_100015361967 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.10 C[n+]1cccc(c1)SCF 62a_100015361967_100009996589 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [1,1,0,0,0,0|1,0,1]=4 3129 B10R1.10 Cc1cc(ccn1)CO[13CH3] 34a_100011998630_200025704644 [1,1,0,0,0,0|1,0,1]=4 3130 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200020672517_200025704644 [1,1,0,0,0,0|1,0,1]=4 3131 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200025704644_200020672517 [1,1,0,0,0,0|1,0,1]=4 3132 B10R1.10 Cc1cc(ccn1)OCF 34a_100000688365_100015361967 [1,1,0,0,0,0|2,0,0]=4 3133 B10R1.10 Cc1cc(ccn1)SCF 62a_100000758586_100015361967 [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.10 Cc1cc(ccn1)SCF 62a_100015361967_100000758586 [1,1,0,0,0,0|2,0,0]=4 3135 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|0,0,1]=3 3136 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|0,0,1]=3 3137 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|0,0,1]=3 3138 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|0,0,1]=3 3139 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|0,0,1]=3 3140 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|0,0,1]=3 3141 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,1,0,0,0,0|1,0,0]=3 3142 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,1,0,0,0,0|1,0,0]=3 3143 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,1,0,0,0,0|1,0,0]=3 3144 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [1,1,0,0,0,0|1,0,0]=3 3145 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [1,1,0,0,0,0|1,0,0]=3 3146 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [1,1,0,0,0,0|1,0,1]=4 3147 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [1,1,0,0,0,0|1,0,1]=4 3148 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [1,1,0,0,0,0|1,0,1]=4 3149 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [1,1,0,0,0,0|1,0,1]=4 3150 B10R1.10 Cc1cccc(n1)SCF 62a_100000742759_100015361967 [1,1,0,0,0,0|2,0,0]=4 3151 B10R1.10 Cc1cccc(n1)SCF 62a_100015361967_100000742759 [1,1,0,0,0,0|2,0,0]=4 3152 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [1,1,0,0,0,0|1,0,1]=4 3153 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [1,1,0,0,0,0|1,0,1]=4 3154 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [1,1,0,0,0,0|1,0,1]=4 3155 B10R1.10 Cc1ccnc(c1)SCF 62a_100000750283_100015361967 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.10 Cc1ccnc(c1)SCF 62a_100015361967_100000750283 [1,1,0,0,0,0|2,0,0]=4 3157 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [1,1,0,0,0,0|1,0,1]=4 3158 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [1,1,0,0,0,0|1,0,1]=4 3159 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [1,1,0,0,0,0|1,0,1]=4 3160 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [1,1,0,0,0,0|1,0,1]=4 3161 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [1,1,0,0,0,0|1,0,1]=4 3162 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [1,1,0,0,0,0|1,0,1]=4 3163 B10R1.10 Cc1cncc(c1)OCF 34a_100011830280_100015361967 [1,1,0,0,0,0|2,0,0]=4 3164 B10R1.10 Cc1cncc(c1)OCF 7a_100011830280_100015361967 [1,1,0,0,0,0|2,0,0]=4 3165 B10R1.10 Cc1cncc(c1)SCF 62a_100000760492_100015361967 [1,1,0,0,0,0|2,0,0]=4 3166 B10R1.10 Cc1cncc(c1)SCF 62a_100015361967_100000760492 [1,1,0,0,0,0|2,0,0]=4 3167 B10R1.10 FCNc1cccc(c1)Br 34a_100000210019_100015361967 [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.10 FCNc1cccc(c1)Cl 34a_100000185859_100015361967 [1,1,0,0,0,0|2,0,0]=4 3169 B10R1.10 FCNc1cccc(c1)F 34a_100000210047_100015361967 [1,1,0,0,0,0|2,0,0]=4 3170 B10R1.10 FCNc1cccc(c1)I 34a_100000211102_100015361967 [1,1,0,0,0,0|2,0,0]=4 3171 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [1,1,0,0,0,0|2,0,0]=4 3172 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [1,1,0,0,0,0|2,0,0]=4 3173 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [1,1,0,0,0,0|2,0,0]=4 3175 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [1,1,0,0,0,0|2,0,0]=4 3176 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [1,1,0,0,0,0|2,0,0]=4 3177 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [1,1,0,0,0,0|2,0,0]=4 3178 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [1,1,0,0,0,0|2,0,0]=4 3179 B10R1.10 FCSc1cccc(c1)Br 62a_100000691529_100015361967 [1,1,0,0,0,0|2,0,0]=4 3180 B10R1.10 FCSc1cccc(c1)Br 62a_100015361967_100000691529 [1,1,0,0,0,0|2,0,0]=4 3181 B10R1.10 FCSc1cccc(c1)Cl 62a_100000699651_100015361967 [1,1,0,0,0,0|2,0,0]=4 3182 B10R1.10 FCSc1cccc(c1)Cl 62a_100015361967_100000699651 [1,1,0,0,0,0|2,0,0]=4 3183 B10R1.10 FCSc1cccc(c1)F 62a_100000685547_100015361967 [1,1,0,0,0,0|2,0,0]=4 3184 B10R1.10 FCSc1cccc(c1)F 62a_100015361967_100000685547 [1,1,0,0,0,0|2,0,0]=4 3185 B10R1.10 FCSc1cccc(c1)[S] 62a_100015361967_114929384022 [1,1,0,0,0,0|2,0,0]=4 3186 B10R1.10 FCSc1cccc(c1)[S] 62a_114929384022_100015361967 [1,1,0,0,0,0|2,0,0]=4 3187 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,1,0,0,0,0|1,0,1]=4 3188 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.10 Nc1cccc(c1)SCF 62a_100000210019_100015361967 [1,1,0,0,0,0|2,0,0]=4 3190 B10R1.10 Nc1cccc(c1)SCF 62a_100015361967_100000210019 [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,1,0,0,0,0|1,0,0]=3 3192 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,1,0,0,0,0|1,0,1]=4 3193 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,1,0,0,0,0|2,0,0]=4 3194 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [1,1,0,0,0,0|2,0,0]=4 3195 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3196 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|1,0,1]=4 3203 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|1,0,1]=4 3204 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|1,0,1]=4 3205 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 3206 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|1,0,1]=4 3207 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 3208 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|1,0,1]=4 3209 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 3210 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|1,0,1]=4 3211 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 3212 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|1,0,1]=4 3213 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,1]=4 3214 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|1,0,1]=4 3215 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|1,0,1]=4 3216 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|1,0,1]=4 3217 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|1,0,1]=4 3218 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|1,0,1]=4 3219 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|1,0,1]=4 3220 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|1,0,1]=4 3221 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|1,0,1]=4 3222 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|1,0,1]=4 3223 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|1,0,1]=4 3224 B10R1.30 C=Cc1cc(ccc1Br)Br 271570a_100011290941_100011483371 [1,1,0,0,0,0|1,0,1]=4 3225 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,1,0,0,0,0|0,0,1]=3 3226 B10R1.30 C=Cc1cc(ccc1Br)Cl 271570a_100011290941_100012339723 [1,1,0,0,0,0|1,0,1]=4 3227 B10R1.30 C=Cc1cc(ccc1Br)F 271570a_100011290941_100011217576 [1,1,0,0,0,0|1,0,1]=4 3228 B10R1.30 C=Cc1cc(ccc1Br)N 271570a_100011290941_100000750459 [1,1,0,0,0,0|1,0,1]=4 3229 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,1,0,0,0,0|1,0,1]=4 3230 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [1,1,0,0,0,0|1,0,1]=4 3231 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,1,0,0,0,0|0,0,1]=3 3232 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [1,1,0,0,0,0|1,0,1]=4 3233 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [1,1,0,0,0,0|1,0,1]=4 3234 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,1,0,0,0,0|1,0,1]=4 3236 B10R1.30 C=Cc1cc(ccc1Cl)Br 271570a_100011290941_100011772130 [1,1,0,0,0,0|1,0,1]=4 3237 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,1,0,0,0,0|0,0,1]=3 3238 B10R1.30 C=Cc1cc(ccc1Cl)Cl 271570a_100011290941_100000707729 [1,1,0,0,0,0|1,0,1]=4 3239 B10R1.30 C=Cc1cc(ccc1Cl)F 271570a_100011290941_100011217299 [1,1,0,0,0,0|1,0,1]=4 3240 B10R1.30 C=Cc1cc(ccc1Cl)N 271570a_100011290941_100012360549 [1,1,0,0,0,0|1,0,1]=4 3241 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,1,0,0,0,0|1,0,1]=4 3242 B10R1.30 C=Cc1cc(ccc1F)Br 271570a_100011290941_100011217312 [1,1,0,0,0,0|1,0,1]=4 3243 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,1,0,0,0,0|0,0,1]=3 3244 B10R1.30 C=Cc1cc(ccc1F)Cl 271570a_100011290941_100011218116 [1,1,0,0,0,0|1,0,1]=4 3245 B10R1.30 C=Cc1cc(ccc1F)F 271570a_100011290941_100000750033 [1,1,0,0,0,0|1,0,1]=4 3246 B10R1.30 C=Cc1cc(ccc1F)N 271570a_100011290941_100000760356 [1,1,0,0,0,0|1,0,1]=4 3247 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,1,0,0,0,0|1,0,1]=4 3248 B10R1.30 C=Cc1cc(ccc1N)Br 271570a_100011290941_100000187925 [1,1,0,0,0,0|1,0,1]=4 3249 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,1,0,0,0,0|0,0,1]=3 3250 B10R1.30 C=Cc1cc(ccc1N)Cl 271570a_100011290941_100000761889 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.30 C=Cc1cc(ccc1N)F 271570a_100011290941_100000760547 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.30 C=Cc1cc(ccc1N)N 271570a_100011290941_100011534242 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,1,0,0,0,0|1,0,1]=4 3254 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,1,0,0,0,0|1,0,1]=4 3255 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,1,0,0,0,0|0,0,1]=3 3256 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,1,0,0,0,0|1,0,1]=4 3257 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,1,0,0,0,0|1,0,1]=4 3258 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,1,0,0,0,0|1,0,1]=4 3259 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,1,0,0,0,0|1,0,1]=4 3260 B10R1.30 C=Cc1cc(cnc1C)C 271570a_100011290941_100009817436 [1,1,0,0,0,0|1,0,1]=4 3261 B10R1.30 C=Cc1cc(cnc1Cl)C 271570a_100011290941_100010210167 [1,1,0,0,0,0|1,0,1]=4 3262 B10R1.30 C=Cc1cc(cnc1F)C 271570a_100011290941_100000049784 [1,1,0,0,0,0|1,0,1]=4 3263 B10R1.30 C=Cc1cc(cnc1N)C 271570a_100011290941_100000049664 [1,1,0,0,0,0|1,0,1]=4 3264 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [1,1,0,0,0,0|1,0,1]=4 3265 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [1,1,0,0,0,0|1,0,1]=4 3266 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [1,1,0,0,0,0|1,0,1]=4 3267 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [1,1,0,0,0,0|1,0,1]=4 3268 B10R1.30 C=Cc1cn(ccc1=O)C 271570a_100011290941_100010750718 [1,1,0,0,0,0|1,0,1]=4 3269 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [1,1,0,0,0,0|1,0,1]=4 3270 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [1,1,0,0,0,0|1,0,1]=4 3271 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [1,1,0,0,0,0|1,0,1]=4 3272 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [1,1,0,0,0,0|1,0,1]=4 3273 B10R1.30 CCc1cc(ccc1Br)O 271570a_203496583355_100010244631 [1,1,0,0,0,0|1,0,1]=4 3274 B10R1.30 CCc1cc(ccc1F)O 271570a_203496583355_100010244625 [1,1,0,0,0,0|1,0,1]=4 3275 B10R1.30 CCc1cc(ccc1N)O 271570a_203496583355_100000686106 [1,1,0,0,0,0|1,0,1]=4 3276 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [1,1,0,0,0,0|1,0,1]=4 3277 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [1,1,0,0,0,0|1,0,1]=4 3278 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [1,1,0,0,0,0|1,0,1]=4 3279 B10R1.30 CNc1cc(ccc1Br)Br 34a_100000737762_200000210301 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.30 CNc1cc(ccc1Br)C 34a_100000745044_200000210301 [1,1,0,0,0,0|1,0,0]=3 3281 B10R1.30 CNc1cc(ccc1Br)Cl 34a_100000687073_200000210301 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.30 CNc1cc(ccc1Br)F 34a_100000687223_200000210301 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.30 CNc1cc(ccc1Br)O 34a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.30 CNc1cc(ccc1C)Br 34a_100000741167_200000210301 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.30 CNc1cc(ccc1C)Br 7a_100000741167_200000210301 [1,1,0,0,0,0|2,0,0]=4 3286 B10R1.30 CNc1cc(ccc1C)C 2230a_100000185781_200000210301 [1,1,0,0,0,0|1,0,0]=3 3287 B10R1.30 CNc1cc(ccc1C)C 34a_100000185781_200000210301 [1,1,0,0,0,0|1,0,0]=3 3288 B10R1.30 CNc1cc(ccc1C)C 7a_100000185781_200000210301 [1,1,0,0,0,0|1,0,0]=3 3289 B10R1.30 CNc1cc(ccc1C)Cl 34a_100000211374_200000210301 [1,1,0,0,0,0|2,0,0]=4 3290 B10R1.30 CNc1cc(ccc1C)Cl 7a_100000211374_200000210301 [1,1,0,0,0,0|2,0,0]=4 3291 B10R1.30 CNc1cc(ccc1C)F 34a_100000211107_200000210301 [1,1,0,0,0,0|2,0,0]=4 3292 B10R1.30 CNc1cc(ccc1C)F 7a_100000211107_200000210301 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.30 CNc1cc(ccc1C)I 7a_100000761890_200000210301 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.30 CNc1cc(ccc1C)O 271570a_203496583355_100020629602 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.30 CNc1cc(ccc1C)O 34a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 3296 B10R1.30 CNc1cc(ccc1Cl)Br 34a_100000750497_200000210301 [1,1,0,0,0,0|2,0,0]=4 3297 B10R1.30 CNc1cc(ccc1Cl)C 34a_100011215360_200000210301 [1,1,0,0,0,0|1,0,0]=3 3298 B10R1.30 CNc1cc(ccc1Cl)Cl 34a_100000184485_200000210301 [1,1,0,0,0,0|2,0,0]=4 3299 B10R1.30 CNc1cc(ccc1Cl)F 34a_100000751338_200000210301 [1,1,0,0,0,0|2,0,0]=4 3300 B10R1.30 CNc1cc(ccc1Cl)I 34a_200000761891_200000210301 [1,1,0,0,0,0|2,0,0]=4 3301 B10R1.30 CNc1cc(ccc1Cl)O 34a_100011934297_200000210301 [1,1,0,0,0,0|2,0,0]=4 3302 B10R1.30 CNc1cc(ccc1F)Br 34a_100000740924_200000210301 [1,1,0,0,0,0|2,0,0]=4 3303 B10R1.30 CNc1cc(ccc1F)C 34a_100000211285_200000210301 [1,1,0,0,0,0|1,0,0]=3 3304 B10R1.30 CNc1cc(ccc1F)Cl 34a_100000212115_200000210301 [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.30 CNc1cc(ccc1F)F 34a_100000210742_200000210301 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.30 CNc1cc(ccc1F)I 34a_100011464823_200000210301 [1,1,0,0,0,0|2,0,0]=4 3307 B10R1.30 CNc1cc(ccc1F)O 271570a_203496583355_100011314990 [1,1,0,0,0,0|2,0,0]=4 3308 B10R1.30 CNc1cc(ccc1F)O 34a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 3309 B10R1.30 CNc1cc(ccc1I)Br 34a_100000743836_200000210301 [1,1,0,0,0,0|2,0,0]=4 3310 B10R1.30 CNc1cc(ccc1I)C 34a_100011216686_200000210301 [1,1,0,0,0,0|1,0,0]=3 3311 B10R1.30 CNc1cc(ccc1I)Cl 34a_100000761886_200000210301 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.30 CNc1cc(ccc1I)F 34a_100011218093_200000210301 [1,1,0,0,0,0|2,0,0]=4 3313 B10R1.30 CNc1cc(ccc1N)O 271570a_203496583355_100000694363 [1,1,0,0,0,0|2,0,0]=4 3314 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 3315 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 3316 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 3317 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [1,1,0,0,0,0|2,0,0]=4 3318 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 3319 B10R1.30 CNc1cc(cnc1F)C 27a_100102657272_100009820679 [1,1,0,0,0,0|2,0,0]=4 3320 B10R1.30 CNc1cc(ncc1F)C 27a_100102657272_100009867690 [1,1,0,0,0,0|2,0,0]=4 3321 B10R1.30 COc1cc(ccc1Br)Br 34a_100011220040_200000210301 [1,1,0,0,0,0|2,0,0]=4 3322 B10R1.30 COc1cc(ccc1Br)Br 7a_100011220040_200000210301 [1,1,0,0,0,0|2,0,0]=4 3323 B10R1.30 COc1cc(ccc1Br)C 34a_100012002257_200000210301 [1,1,0,0,0,0|1,0,0]=3 3324 B10R1.30 COc1cc(ccc1Br)C 7a_100012002257_200000210301 [1,1,0,0,0,0|1,0,0]=3 3325 B10R1.30 COc1cc(ccc1Br)Cl 34a_100012339455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3326 B10R1.30 COc1cc(ccc1Br)Cl 7a_100012339455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3327 B10R1.30 COc1cc(ccc1Br)F 34a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.30 COc1cc(ccc1Br)F 7a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 3329 B10R1.30 COc1cc(ccc1Br)I 34a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.30 COc1cc(ccc1Br)I 7a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 3331 B10R1.30 COc1cc(ccc1Br)O 271570a_203496583355_100012353699 [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.30 COc1cc(ccc1C)Br 34a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 3333 B10R1.30 COc1cc(ccc1C)Br 7a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 3334 B10R1.30 COc1cc(ccc1C)C 34a_100000210931_200000210301 [1,1,0,0,0,0|1,0,0]=3 3335 B10R1.30 COc1cc(ccc1C)C 7a_100000210931_200000210301 [1,1,0,0,0,0|1,0,0]=3 3336 B10R1.30 COc1cc(ccc1C)Cl 34a_100000756515_200000210301 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.30 COc1cc(ccc1C)Cl 7a_100000756515_200000210301 [1,1,0,0,0,0|2,0,0]=4 3338 B10R1.30 COc1cc(ccc1C)F 34a_100000690566_200000210301 [1,1,0,0,0,0|2,0,0]=4 3339 B10R1.30 COc1cc(ccc1C)F 7a_100000690566_200000210301 [1,1,0,0,0,0|2,0,0]=4 3340 B10R1.30 COc1cc(ccc1C)I 7a_100000766334_200000210301 [1,1,0,0,0,0|2,0,0]=4 3341 B10R1.30 COc1cc(ccc1C)N 34a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 3342 B10R1.30 COc1cc(ccc1C)N 7a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 3343 B10R1.30 COc1cc(ccc1C)O 271570a_203496583355_100011830276 [1,1,0,0,0,0|2,0,0]=4 3344 B10R1.30 COc1cc(ccc1Cl)Br 34a_100000738945_200000210301 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.30 COc1cc(ccc1Cl)Br 7a_100000738945_200000210301 [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.30 COc1cc(ccc1Cl)C 34a_100000211493_200000210301 [1,1,0,0,0,0|1,0,0]=3 3347 B10R1.30 COc1cc(ccc1Cl)C 7a_100000211493_200000210301 [1,1,0,0,0,0|1,0,0]=3 3348 B10R1.30 COc1cc(ccc1Cl)Cl 34a_100000211422_200000210301 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.30 COc1cc(ccc1Cl)Cl 7a_100000211422_200000210301 [1,1,0,0,0,0|2,0,0]=4 3350 B10R1.30 COc1cc(ccc1Cl)F 34a_100000692107_200000210301 [1,1,0,0,0,0|2,0,0]=4 3351 B10R1.30 COc1cc(ccc1Cl)F 7a_100000692107_200000210301 [1,1,0,0,0,0|2,0,0]=4 3352 B10R1.30 COc1cc(ccc1Cl)I 34a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.30 COc1cc(ccc1Cl)I 7a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.30 COc1cc(ccc1Cl)N 34a_100011934209_200000210301 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.30 COc1cc(ccc1Cl)O 271570a_203496583355_100011356853 [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.30 COc1cc(ccc1F)Br 34a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 3357 B10R1.30 COc1cc(ccc1F)Br 7a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 3358 B10R1.30 COc1cc(ccc1F)C 34a_100000759540_200000210301 [1,1,0,0,0,0|1,0,0]=3 3359 B10R1.30 COc1cc(ccc1F)C 7a_100000759540_200000210301 [1,1,0,0,0,0|1,0,0]=3 3360 B10R1.30 COc1cc(ccc1F)Cl 34a_100000757397_200000210301 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.30 COc1cc(ccc1F)Cl 7a_100000757397_200000210301 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.30 COc1cc(ccc1F)F 34a_100000752141_200000210301 [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.30 COc1cc(ccc1F)F 7a_100000752141_200000210301 [1,1,0,0,0,0|2,0,0]=4 3364 B10R1.30 COc1cc(ccc1F)I 34a_100009958187_200000210301 [1,1,0,0,0,0|2,0,0]=4 3365 B10R1.30 COc1cc(ccc1F)I 7a_100009958187_200000210301 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.30 COc1cc(ccc1F)N 34a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.30 COc1cc(ccc1F)N 7a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.30 COc1cc(ccc1F)O 271570a_203496583355_100011934186 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.30 COc1cc(ccc1I)Br 34a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.30 COc1cc(ccc1I)Br 7a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.30 COc1cc(ccc1I)Cl 34a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.30 COc1cc(ccc1I)Cl 7a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.30 COc1cc(ccc1I)F 34a_100010084537_200000210301 [1,1,0,0,0,0|2,0,0]=4 3374 B10R1.30 COc1cc(ccc1I)F 7a_100010084537_200000210301 [1,1,0,0,0,0|2,0,0]=4 3375 B10R1.30 COc1cc(ccc1N)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 3376 B10R1.30 COc1cc(ccc1N)Br 7a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 3377 B10R1.30 COc1cc(ccc1N)C 34a_100000211527_200000210301 [1,1,0,0,0,0|1,0,0]=3 3378 B10R1.30 COc1cc(ccc1N)C 7a_100000211527_200000210301 [1,1,0,0,0,0|1,0,0]=3 3379 B10R1.30 COc1cc(ccc1N)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.30 COc1cc(ccc1N)Cl 7a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.30 COc1cc(ccc1N)F 34a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.30 COc1cc(ccc1N)F 7a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.30 COc1cc(ccc1N)I 34a_100000057187_200000210301 [1,1,0,0,0,0|2,0,0]=4 3384 B10R1.30 COc1cc(ccc1N)I 7a_100000057187_200000210301 [1,1,0,0,0,0|2,0,0]=4 3385 B10R1.30 COc1cc(ccc1N)N 34a_100025717382_200000210301 [1,1,0,0,0,0|2,0,0]=4 3386 B10R1.30 COc1cc(ccc1N)O 271570a_203496583355_100011279103 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [1,1,0,0,0,0|2,0,0]=4 3388 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [1,1,0,0,0,0|1,0,0]=3 3389 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [1,1,0,0,0,0|2,0,0]=4 3390 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [1,1,0,0,0,0|2,0,0]=4 3391 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [1,1,0,0,0,0|2,0,0]=4 3392 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [1,1,0,0,0,0|2,0,0]=4 3393 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [1,1,0,0,0,0|2,0,0]=4 3394 B10R1.30 COc1cc(cnc1Cl)C 34a_100012000487_200000210301 [1,1,0,0,0,0|2,0,0]=4 3395 B10R1.30 COc1cc(cnc1Cl)C 7a_100012000487_200000210301 [1,1,0,0,0,0|2,0,0]=4 3396 B10R1.30 COc1cc(cnc1F)C 34a_100009849810_200000210301 [1,1,0,0,0,0|2,0,0]=4 3397 B10R1.30 COc1cc(cnc1F)C 7a_100009849810_200000210301 [1,1,0,0,0,0|2,0,0]=4 3398 B10R1.30 COc1cc(cnc1O)C 271570a_203496583355_200000118316 [1,1,0,0,0,0|2,0,0]=4 3399 B10R1.30 COc1cc(ncc1Br)C 34a_100011016184_200000210301 [1,1,0,0,0,0|2,0,0]=4 3400 B10R1.30 COc1cc(ncc1O)C 271570a_203496583355_100000717771 [1,1,0,0,0,0|2,0,0]=4 3401 B10R1.30 COc1nc(ccc1Br)C 34a_100009817604_200000210301 [1,1,0,0,0,0|2,0,0]=4 3402 B10R1.30 COc1nc(ccc1N)C 34a_100000687486_200000210301 [1,1,0,0,0,0|2,0,0]=4 3403 B10R1.30 COc1nc(ccc1O)C 271570a_203496583355_100010138632 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.30 CSc1cc(ccc1Br)Br 62a_100011483371_200000210301 [1,1,0,0,0,0|2,0,0]=4 3405 B10R1.30 CSc1cc(ccc1Br)Br 62a_200000210301_100011483371 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.30 CSc1cc(ccc1Br)C 62a_100012353751_200000210301 [1,1,0,0,0,0|1,0,0]=3 3407 B10R1.30 CSc1cc(ccc1Br)C 62a_200000210301_100012353751 [1,1,0,0,0,0|1,0,0]=3 3408 B10R1.30 CSc1cc(ccc1Br)Cl 62a_100012339723_200000210301 [1,1,0,0,0,0|2,0,0]=4 3409 B10R1.30 CSc1cc(ccc1Br)Cl 62a_200000210301_100012339723 [1,1,0,0,0,0|2,0,0]=4 3410 B10R1.30 CSc1cc(ccc1Br)F 62a_100011217576_200000210301 [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.30 CSc1cc(ccc1Br)F 62a_200000210301_100011217576 [1,1,0,0,0,0|2,0,0]=4 3412 B10R1.30 CSc1cc(ccc1Br)N 62a_100000750459_200000210301 [1,1,0,0,0,0|2,0,0]=4 3413 B10R1.30 CSc1cc(ccc1Br)N 62a_200000210301_100000750459 [1,1,0,0,0,0|2,0,0]=4 3414 B10R1.30 CSc1cc(ccc1Br)O 62a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 3415 B10R1.30 CSc1cc(ccc1Br)O 62a_200000210301_100012339312 [1,1,0,0,0,0|2,0,0]=4 3416 B10R1.30 CSc1cc(ccc1C)Br 62a_100011344865_200000210301 [1,1,0,0,0,0|2,0,0]=4 3417 B10R1.30 CSc1cc(ccc1C)Br 62a_200000210301_100011344865 [1,1,0,0,0,0|2,0,0]=4 3418 B10R1.30 CSc1cc(ccc1C)C 62a_100000210833_200000210301 [1,1,0,0,0,0|1,0,0]=3 3419 B10R1.30 CSc1cc(ccc1C)C 62a_200000210301_100000210833 [1,1,0,0,0,0|1,0,0]=3 3420 B10R1.30 CSc1cc(ccc1C)Cl 62a_100011263213_200000210301 [1,1,0,0,0,0|2,0,0]=4 3421 B10R1.30 CSc1cc(ccc1C)Cl 62a_200000210301_100011263213 [1,1,0,0,0,0|2,0,0]=4 3422 B10R1.30 CSc1cc(ccc1C)F 62a_100011218078_200000210301 [1,1,0,0,0,0|2,0,0]=4 3423 B10R1.30 CSc1cc(ccc1C)F 62a_200000210301_100011218078 [1,1,0,0,0,0|2,0,0]=4 3424 B10R1.30 CSc1cc(ccc1C)N 62a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 3425 B10R1.30 CSc1cc(ccc1C)N 62a_200000210301_100000736455 [1,1,0,0,0,0|2,0,0]=4 3426 B10R1.30 CSc1cc(ccc1C)O 62a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 3427 B10R1.30 CSc1cc(ccc1C)O 62a_200000210301_100011380479 [1,1,0,0,0,0|2,0,0]=4 3428 B10R1.30 CSc1cc(ccc1Cl)Br 62a_100011772130_200000210301 [1,1,0,0,0,0|2,0,0]=4 3429 B10R1.30 CSc1cc(ccc1Cl)Br 62a_200000210301_100011772130 [1,1,0,0,0,0|2,0,0]=4 3430 B10R1.30 CSc1cc(ccc1Cl)C 62a_100012356289_200000210301 [1,1,0,0,0,0|1,0,0]=3 3431 B10R1.30 CSc1cc(ccc1Cl)C 62a_200000210301_100012356289 [1,1,0,0,0,0|1,0,0]=3 3432 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_100000707729_200000210301 [1,1,0,0,0,0|2,0,0]=4 3433 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_200000210301_100000707729 [1,1,0,0,0,0|2,0,0]=4 3434 B10R1.30 CSc1cc(ccc1Cl)F 62a_100011217299_200000210301 [1,1,0,0,0,0|2,0,0]=4 3435 B10R1.30 CSc1cc(ccc1Cl)F 62a_200000210301_100011217299 [1,1,0,0,0,0|2,0,0]=4 3436 B10R1.30 CSc1cc(ccc1Cl)N 62a_100012360549_200000210301 [1,1,0,0,0,0|2,0,0]=4 3437 B10R1.30 CSc1cc(ccc1Cl)N 62a_200000210301_100012360549 [1,1,0,0,0,0|2,0,0]=4 3438 B10R1.30 CSc1cc(ccc1Cl)O 62a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 3439 B10R1.30 CSc1cc(ccc1Cl)O 62a_200000210301_100000049588 [1,1,0,0,0,0|2,0,0]=4 3440 B10R1.30 CSc1cc(ccc1F)Br 62a_100011217312_200000210301 [1,1,0,0,0,0|2,0,0]=4 3441 B10R1.30 CSc1cc(ccc1F)Br 62a_200000210301_100011217312 [1,1,0,0,0,0|2,0,0]=4 3442 B10R1.30 CSc1cc(ccc1F)C 62a_100000736223_200000210301 [1,1,0,0,0,0|1,0,0]=3 3443 B10R1.30 CSc1cc(ccc1F)C 62a_200000210301_100000736223 [1,1,0,0,0,0|1,0,0]=3 3444 B10R1.30 CSc1cc(ccc1F)Cl 62a_100011218116_200000210301 [1,1,0,0,0,0|2,0,0]=4 3445 B10R1.30 CSc1cc(ccc1F)Cl 62a_200000210301_100011218116 [1,1,0,0,0,0|2,0,0]=4 3446 B10R1.30 CSc1cc(ccc1F)F 62a_100011219198_200000210301 [1,1,0,0,0,0|2,0,0]=4 3447 B10R1.30 CSc1cc(ccc1F)F 62a_200000210301_100011219198 [1,1,0,0,0,0|2,0,0]=4 3448 B10R1.30 CSc1cc(ccc1F)N 62a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 3449 B10R1.30 CSc1cc(ccc1F)N 62a_200000210301_100000760356 [1,1,0,0,0,0|2,0,0]=4 3450 B10R1.30 CSc1cc(ccc1F)O 271570a_203496583355_100010341305 [1,1,0,0,0,0|2,0,0]=4 3451 B10R1.30 CSc1cc(ccc1F)O 62a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 3452 B10R1.30 CSc1cc(ccc1F)O 62a_200000210301_100000693481 [1,1,0,0,0,0|2,0,0]=4 3453 B10R1.30 CSc1cc(ccc1N)Br 62a_100000187925_200000210301 [1,1,0,0,0,0|2,0,0]=4 3454 B10R1.30 CSc1cc(ccc1N)Br 62a_200000210301_100000187925 [1,1,0,0,0,0|2,0,0]=4 3455 B10R1.30 CSc1cc(ccc1N)C 62a_100011356834_200000210301 [1,1,0,0,0,0|1,0,0]=3 3456 B10R1.30 CSc1cc(ccc1N)C 62a_200000210301_100011356834 [1,1,0,0,0,0|1,0,0]=3 3457 B10R1.30 CSc1cc(ccc1N)Cl 62a_100000761889_200000210301 [1,1,0,0,0,0|2,0,0]=4 3458 B10R1.30 CSc1cc(ccc1N)Cl 62a_200000210301_100000761889 [1,1,0,0,0,0|2,0,0]=4 3459 B10R1.30 CSc1cc(ccc1N)F 62a_100000760547_200000210301 [1,1,0,0,0,0|2,0,0]=4 3460 B10R1.30 CSc1cc(ccc1N)F 62a_200000210301_100000760547 [1,1,0,0,0,0|2,0,0]=4 3461 B10R1.30 CSc1cc(ccc1N)N 62a_100011534242_200000210301 [1,1,0,0,0,0|2,0,0]=4 3462 B10R1.30 CSc1cc(ccc1N)N 62a_200000210301_100011534242 [1,1,0,0,0,0|2,0,0]=4 3463 B10R1.30 CSc1cc(ccc1N)O 62a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 3464 B10R1.30 CSc1cc(ccc1N)O 62a_200000210301_100012001276 [1,1,0,0,0,0|2,0,0]=4 3465 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 3466 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [1,1,0,0,0,0|2,0,0]=4 3467 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [1,1,0,0,0,0|1,0,0]=3 3468 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 3469 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [1,1,0,0,0,0|1,0,0]=3 3470 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 3471 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [1,1,0,0,0,0|2,0,0]=4 3472 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 3473 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [1,1,0,0,0,0|2,0,0]=4 3474 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 3475 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [1,1,0,0,0,0|2,0,0]=4 3476 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [1,1,0,0,0,0|2,0,0]=4 3477 B10R1.30 CSc1cc(cnc1C)C 62a_100009817436_200000210301 [1,1,0,0,0,0|2,0,0]=4 3478 B10R1.30 CSc1cc(cnc1C)C 62a_200000210301_100009817436 [1,1,0,0,0,0|2,0,0]=4 3479 B10R1.30 CSc1cc(cnc1Cl)C 62a_100010210167_200000210301 [1,1,0,0,0,0|2,0,0]=4 3480 B10R1.30 CSc1cc(cnc1Cl)C 62a_200000210301_100010210167 [1,1,0,0,0,0|2,0,0]=4 3481 B10R1.30 CSc1cc(cnc1F)C 62a_100000049784_200000210301 [1,1,0,0,0,0|2,0,0]=4 3482 B10R1.30 CSc1cc(cnc1F)C 62a_200000210301_100000049784 [1,1,0,0,0,0|2,0,0]=4 3483 B10R1.30 CSc1cc(cnc1N)C 62a_100000049664_200000210301 [1,1,0,0,0,0|2,0,0]=4 3484 B10R1.30 CSc1cc(cnc1N)C 62a_200000210301_100000049664 [1,1,0,0,0,0|2,0,0]=4 3485 B10R1.30 CSc1cc(cnc1O)C 271570a_203496583355_100010884634 [1,1,0,0,0,0|2,0,0]=4 3486 B10R1.30 CSc1cc(cnc1O)C 62a_100000719714_200000210301 [1,1,0,0,0,0|2,0,0]=4 3487 B10R1.30 CSc1cc(cnc1O)C 62a_200000210301_100000719714 [1,1,0,0,0,0|2,0,0]=4 3488 B10R1.30 CSc1cc(ncc1C)C 62a_100009862788_200000210301 [1,1,0,0,0,0|2,0,0]=4 3489 B10R1.30 CSc1cc(ncc1C)C 62a_200000210301_100009862788 [1,1,0,0,0,0|2,0,0]=4 3490 B10R1.30 CSc1cc(ncc1F)C 62a_100009867690_200000210301 [1,1,0,0,0,0|2,0,0]=4 3491 B10R1.30 CSc1cc(ncc1F)C 62a_200000210301_100009867690 [1,1,0,0,0,0|2,0,0]=4 3492 B10R1.30 CSc1cc(ncc1O)C 62a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 3493 B10R1.30 CSc1cc(ncc1O)C 62a_200000210301_100009843476 [1,1,0,0,0,0|2,0,0]=4 3494 B10R1.30 CSc1cn(ccc1=O)C 62a_100010750718_200000210301 [1,1,0,0,0,0|2,0,0]=4 3495 B10R1.30 CSc1cn(ccc1=O)C 62a_200000210301_100010750718 [1,1,0,0,0,0|2,0,0]=4 3496 B10R1.30 CSc1nc(ccc1C)C 62a_100009854376_200000210301 [1,1,0,0,0,0|2,0,0]=4 3497 B10R1.30 CSc1nc(ccc1C)C 62a_200000210301_100009854376 [1,1,0,0,0,0|2,0,0]=4 3498 B10R1.30 CSc1nc(ccc1F)C 62a_100009817602_200000210301 [1,1,0,0,0,0|2,0,0]=4 3499 B10R1.30 CSc1nc(ccc1F)C 62a_200000210301_100009817602 [1,1,0,0,0,0|2,0,0]=4 3500 B10R1.30 CSc1nc(ccc1N)C 62a_100000685570_200000210301 [1,1,0,0,0,0|2,0,0]=4 3501 B10R1.30 CSc1nc(ccc1N)C 62a_200000210301_100000685570 [1,1,0,0,0,0|2,0,0]=4 3502 B10R1.30 CSc1nc(ccc1O)C 62a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 3503 B10R1.30 CSc1nc(ccc1O)C 62a_200000210301_100000702858 [1,1,0,0,0,0|2,0,0]=4 3504 B10R1.30 Cc1cc(c(cn1)Br)O[13CH3] 34a_100011016184_200025704644 [1,1,0,0,0,0|2,0,0]=4 3505 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_100009862788_200025704644 [1,1,0,0,0,0|2,0,0]=4 3506 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100009862788 [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.30 Cc1cc(c(cn1)F)S[13CH3] 62a_100009867690_200025704644 [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.30 Cc1cc(c(cn1)F)S[13CH3] 62a_200025704644_100009867690 [1,1,0,0,0,0|2,0,0]=4 3509 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 3510 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_200025704644_100009843476 [1,1,0,0,0,0|2,0,0]=4 3511 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [1,1,0,0,0,0|1,0,1]=4 3512 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,1,0,0,0,0|0,0,0]=2 3513 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [1,1,0,0,0,0|0,0,2]=4 3514 B10R1.30 Cc1ccc(c(c1)N[13CH3])Br 34a_100000745044_200025704644 [1,1,0,0,0,0|1,0,0]=3 3515 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 2230a_100000185781_200025704644 [1,1,0,0,0,0|1,0,0]=3 3516 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 34a_100000185781_200025704644 [1,1,0,0,0,0|1,0,0]=3 3517 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 7a_100000185781_200025704644 [1,1,0,0,0,0|1,0,0]=3 3518 B10R1.30 Cc1ccc(c(c1)N[13CH3])Cl 34a_100011215360_200025704644 [1,1,0,0,0,0|1,0,0]=3 3519 B10R1.30 Cc1ccc(c(c1)N[13CH3])F 34a_100000211285_200025704644 [1,1,0,0,0,0|1,0,0]=3 3520 B10R1.30 Cc1ccc(c(c1)N[13CH3])I 34a_100011216686_200025704644 [1,1,0,0,0,0|1,0,0]=3 3521 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 3522 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 34a_100012002257_200025704644 [1,1,0,0,0,0|1,0,0]=3 3523 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 7a_100012002257_200025704644 [1,1,0,0,0,0|1,0,0]=3 3524 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 34a_100000210931_200025704644 [1,1,0,0,0,0|1,0,0]=3 3525 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 7a_100000210931_200025704644 [1,1,0,0,0,0|1,0,0]=3 3526 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 34a_100000211493_200025704644 [1,1,0,0,0,0|1,0,0]=3 3527 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 7a_100000211493_200025704644 [1,1,0,0,0,0|1,0,0]=3 3528 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 34a_100000759540_200025704644 [1,1,0,0,0,0|1,0,0]=3 3529 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 7a_100000759540_200025704644 [1,1,0,0,0,0|1,0,0]=3 3530 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 34a_100000211527_200025704644 [1,1,0,0,0,0|1,0,0]=3 3531 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 7a_100000211527_200025704644 [1,1,0,0,0,0|1,0,0]=3 3532 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_100012353751_200025704644 [1,1,0,0,0,0|1,0,0]=3 3533 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012353751 [1,1,0,0,0,0|1,0,0]=3 3534 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_100000210833_200025704644 [1,1,0,0,0,0|1,0,0]=3 3535 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000210833 [1,1,0,0,0,0|1,0,0]=3 3536 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_100012356289_200025704644 [1,1,0,0,0,0|1,0,0]=3 3537 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100012356289 [1,1,0,0,0,0|1,0,0]=3 3538 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_100000736223_200025704644 [1,1,0,0,0,0|1,0,0]=3 3539 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000736223 [1,1,0,0,0,0|1,0,0]=3 3540 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_100011356834_200025704644 [1,1,0,0,0,0|1,0,0]=3 3541 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_200025704644_100011356834 [1,1,0,0,0,0|1,0,0]=3 3542 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 3543 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [1,1,0,0,0,0|1,0,0]=3 3544 B10R1.30 Cc1ccc(c(n1)C=O)O 271570a_203496583355_100010173661 [1,1,0,0,0,0|1,0,0]=3 3545 B10R1.30 Cc1ccc(c(n1)O[13CH3])Br 34a_100009817604_200025704644 [1,1,0,0,0,0|2,0,0]=4 3546 B10R1.30 Cc1ccc(c(n1)O[13CH3])N 34a_100000687486_200025704644 [1,1,0,0,0,0|2,0,0]=4 3547 B10R1.30 Cc1ccc(c(n1)S[13CH3])C 62a_100009854376_200025704644 [1,1,0,0,0,0|2,0,0]=4 3548 B10R1.30 Cc1ccc(c(n1)S[13CH3])C 62a_200025704644_100009854376 [1,1,0,0,0,0|2,0,0]=4 3549 B10R1.30 Cc1ccc(c(n1)S[13CH3])F 62a_100009817602_200025704644 [1,1,0,0,0,0|2,0,0]=4 3550 B10R1.30 Cc1ccc(c(n1)S[13CH3])F 62a_200025704644_100009817602 [1,1,0,0,0,0|2,0,0]=4 3551 B10R1.30 Cc1ccc(c(n1)S[13CH3])N 62a_100000685570_200025704644 [1,1,0,0,0,0|2,0,0]=4 3552 B10R1.30 Cc1ccc(c(n1)S[13CH3])N 62a_200025704644_100000685570 [1,1,0,0,0,0|2,0,0]=4 3553 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 3554 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_200025704644_100000702858 [1,1,0,0,0,0|2,0,0]=4 3555 B10R1.30 Cc1ccc(cc1C=O)O 271570a_203496583355_100011361606 [1,1,0,0,0,0|1,0,0]=3 3556 B10R1.30 Cc1ccc(cc1N[13CH3])Br 34a_100000741167_200025704644 [1,1,0,0,0,0|2,0,0]=4 3557 B10R1.30 Cc1ccc(cc1N[13CH3])Br 7a_100000741167_200025704644 [1,1,0,0,0,0|2,0,0]=4 3558 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 34a_100000211374_200025704644 [1,1,0,0,0,0|2,0,0]=4 3559 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 7a_100000211374_200025704644 [1,1,0,0,0,0|2,0,0]=4 3560 B10R1.30 Cc1ccc(cc1N[13CH3])F 34a_100000211107_200025704644 [1,1,0,0,0,0|2,0,0]=4 3561 B10R1.30 Cc1ccc(cc1N[13CH3])F 7a_100000211107_200025704644 [1,1,0,0,0,0|2,0,0]=4 3562 B10R1.30 Cc1ccc(cc1N[13CH3])I 7a_100000761890_200025704644 [1,1,0,0,0,0|2,0,0]=4 3563 B10R1.30 Cc1ccc(cc1N[13CH3])O 34a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 3564 B10R1.30 Cc1ccc(cc1O[13CH3])Br 34a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 3565 B10R1.30 Cc1ccc(cc1O[13CH3])Br 7a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 3566 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 34a_100000756515_200025704644 [1,1,0,0,0,0|2,0,0]=4 3567 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 7a_100000756515_200025704644 [1,1,0,0,0,0|2,0,0]=4 3568 B10R1.30 Cc1ccc(cc1O[13CH3])F 34a_100000690566_200025704644 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.30 Cc1ccc(cc1O[13CH3])F 7a_100000690566_200025704644 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.30 Cc1ccc(cc1O[13CH3])I 7a_100000766334_200025704644 [1,1,0,0,0,0|2,0,0]=4 3571 B10R1.30 Cc1ccc(cc1O[13CH3])N 34a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 3572 B10R1.30 Cc1ccc(cc1O[13CH3])N 7a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 3573 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_100011344865_200025704644 [1,1,0,0,0,0|2,0,0]=4 3574 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_200025704644_100011344865 [1,1,0,0,0,0|2,0,0]=4 3575 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_100011263213_200025704644 [1,1,0,0,0,0|2,0,0]=4 3576 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_200025704644_100011263213 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_100011218078_200025704644 [1,1,0,0,0,0|2,0,0]=4 3578 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_200025704644_100011218078 [1,1,0,0,0,0|2,0,0]=4 3579 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3580 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_200025704644_100000736455 [1,1,0,0,0,0|2,0,0]=4 3581 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 3582 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_200025704644_100011380479 [1,1,0,0,0,0|2,0,0]=4 3583 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [1,1,0,0,0,0|1,0,0]=3 3584 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 34a_100012000487_200025704644 [1,1,0,0,0,0|2,0,0]=4 3585 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 7a_100012000487_200025704644 [1,1,0,0,0,0|2,0,0]=4 3586 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 34a_100009849810_200025704644 [1,1,0,0,0,0|2,0,0]=4 3587 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 7a_100009849810_200025704644 [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_100009817436_200025704644 [1,1,0,0,0,0|2,0,0]=4 3589 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_200025704644_100009817436 [1,1,0,0,0,0|2,0,0]=4 3590 B10R1.30 Cc1cnc(c(c1)S[13CH3])Cl 62a_100010210167_200025704644 [1,1,0,0,0,0|2,0,0]=4 3591 B10R1.30 Cc1cnc(c(c1)S[13CH3])Cl 62a_200025704644_100010210167 [1,1,0,0,0,0|2,0,0]=4 3592 B10R1.30 Cc1cnc(c(c1)S[13CH3])F 62a_100000049784_200025704644 [1,1,0,0,0,0|2,0,0]=4 3593 B10R1.30 Cc1cnc(c(c1)S[13CH3])F 62a_200025704644_100000049784 [1,1,0,0,0,0|2,0,0]=4 3594 B10R1.30 Cc1cnc(c(c1)S[13CH3])N 62a_100000049664_200025704644 [1,1,0,0,0,0|2,0,0]=4 3595 B10R1.30 Cc1cnc(c(c1)S[13CH3])N 62a_200025704644_100000049664 [1,1,0,0,0,0|2,0,0]=4 3596 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_100000719714_200025704644 [1,1,0,0,0,0|2,0,0]=4 3597 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_200025704644_100000719714 [1,1,0,0,0,0|2,0,0]=4 3598 B10R1.30 Cn1ccc(=O)c(c1)S[13CH3] 62a_100010750718_200025704644 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.30 Cn1ccc(=O)c(c1)S[13CH3] 62a_200025704644_100010750718 [1,1,0,0,0,0|2,0,0]=4 3600 B10R1.30 Nc1ccc(cc1C=O)O 271570a_203496583355_100011935258 [1,1,0,0,0,0|1,0,0]=3 3601 B10R1.30 Nc1ncc(cc1C=O)O 271570a_203496583355_100009814808 [1,1,0,0,0,0|2,0,0]=4 3602 B10R1.30 O=Cc1cc(ccc1Br)O 271570a_203496583355_100010185652 [1,1,0,0,0,0|1,0,0]=3 3603 B10R1.30 O=Cc1cc(ccc1Cl)O 271570a_203496583355_100010254384 [1,1,0,0,0,0|1,0,0]=3 3604 B10R1.30 O=Cc1cc(ccc1F)O 271570a_203496583355_100000211465 [1,1,0,0,0,0|1,0,0]=3 3605 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [1,1,0,0,0,0|1,0,0]=3 3606 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [1,1,0,0,0,0|1,0,0]=3 3607 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [1,1,0,0,0,0|1,0,0]=3 3608 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [1,1,0,0,0,0|1,0,0]=3 3609 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [1,1,0,0,0,0|1,0,0]=3 3610 B10R1.30 O=Cc1cc(cnc1F)O 271570a_203496583355_100009814789 [1,1,0,0,0,0|2,0,0]=4 3611 B10R1.30 O=Cc1cc(cnc1O)F 271570a_203496583355_100000079965 [1,1,0,0,0,0|2,0,0]=4 3612 B10R1.30 O=Cc1cc(ncc1F)O 271570a_203496583355_100000707870 [1,1,0,0,0,0|2,0,0]=4 3613 B10R1.30 O=Cc1nc(ccc1F)O 271570a_203496583355_100009814804 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.30 [13CH3]Nc1cc(ccc1Br)Br 34a_100000737762_200025704644 [1,1,0,0,0,0|2,0,0]=4 3615 B10R1.30 [13CH3]Nc1cc(ccc1Br)Cl 34a_100000687073_200025704644 [1,1,0,0,0,0|2,0,0]=4 3616 B10R1.30 [13CH3]Nc1cc(ccc1Br)F 34a_100000687223_200025704644 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.30 [13CH3]Nc1cc(ccc1Br)O 34a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 3618 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Br 34a_100000750497_200025704644 [1,1,0,0,0,0|2,0,0]=4 3619 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Cl 34a_100000184485_200025704644 [1,1,0,0,0,0|2,0,0]=4 3620 B10R1.30 [13CH3]Nc1cc(ccc1Cl)F 34a_100000751338_200025704644 [1,1,0,0,0,0|2,0,0]=4 3621 B10R1.30 [13CH3]Nc1cc(ccc1Cl)I 34a_200000761891_200025704644 [1,1,0,0,0,0|2,0,0]=4 3622 B10R1.30 [13CH3]Nc1cc(ccc1Cl)O 34a_100011934297_200025704644 [1,1,0,0,0,0|2,0,0]=4 3623 B10R1.30 [13CH3]Nc1cc(ccc1F)Br 34a_100000740924_200025704644 [1,1,0,0,0,0|2,0,0]=4 3624 B10R1.30 [13CH3]Nc1cc(ccc1F)Cl 34a_100000212115_200025704644 [1,1,0,0,0,0|2,0,0]=4 3625 B10R1.30 [13CH3]Nc1cc(ccc1F)F 34a_100000210742_200025704644 [1,1,0,0,0,0|2,0,0]=4 3626 B10R1.30 [13CH3]Nc1cc(ccc1F)I 34a_100011464823_200025704644 [1,1,0,0,0,0|2,0,0]=4 3627 B10R1.30 [13CH3]Nc1cc(ccc1F)O 34a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 3628 B10R1.30 [13CH3]Nc1cc(ccc1I)Br 34a_100000743836_200025704644 [1,1,0,0,0,0|2,0,0]=4 3629 B10R1.30 [13CH3]Nc1cc(ccc1I)Cl 34a_100000761886_200025704644 [1,1,0,0,0,0|2,0,0]=4 3630 B10R1.30 [13CH3]Nc1cc(ccc1I)F 34a_100011218093_200025704644 [1,1,0,0,0,0|2,0,0]=4 3631 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 3632 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 3633 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 3634 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 34a_100011220040_200025704644 [1,1,0,0,0,0|2,0,0]=4 3635 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 7a_100011220040_200025704644 [1,1,0,0,0,0|2,0,0]=4 3636 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 34a_100012339455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3637 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 7a_100012339455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3638 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 34a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 3639 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 7a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 3640 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 34a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 3641 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 7a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 34a_100000738945_200025704644 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 7a_100000738945_200025704644 [1,1,0,0,0,0|2,0,0]=4 3644 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 34a_100000211422_200025704644 [1,1,0,0,0,0|2,0,0]=4 3645 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 7a_100000211422_200025704644 [1,1,0,0,0,0|2,0,0]=4 3646 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 34a_100000692107_200025704644 [1,1,0,0,0,0|2,0,0]=4 3647 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 7a_100000692107_200025704644 [1,1,0,0,0,0|2,0,0]=4 3648 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 34a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 3649 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 7a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 3650 B10R1.30 [13CH3]Oc1cc(ccc1Cl)N 34a_100011934209_200025704644 [1,1,0,0,0,0|2,0,0]=4 3651 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 34a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 3652 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 7a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 3653 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 34a_100000757397_200025704644 [1,1,0,0,0,0|2,0,0]=4 3654 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 7a_100000757397_200025704644 [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.30 [13CH3]Oc1cc(ccc1F)F 34a_100000752141_200025704644 [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.30 [13CH3]Oc1cc(ccc1F)F 7a_100000752141_200025704644 [1,1,0,0,0,0|2,0,0]=4 3657 B10R1.30 [13CH3]Oc1cc(ccc1F)I 34a_100009958187_200025704644 [1,1,0,0,0,0|2,0,0]=4 3658 B10R1.30 [13CH3]Oc1cc(ccc1F)I 7a_100009958187_200025704644 [1,1,0,0,0,0|2,0,0]=4 3659 B10R1.30 [13CH3]Oc1cc(ccc1F)N 34a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 3660 B10R1.30 [13CH3]Oc1cc(ccc1F)N 7a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 34a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 3662 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 7a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 34a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3664 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 7a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.30 [13CH3]Oc1cc(ccc1I)F 34a_100010084537_200025704644 [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.30 [13CH3]Oc1cc(ccc1I)F 7a_100010084537_200025704644 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 3668 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 7a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 3669 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 3670 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 7a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 3671 B10R1.30 [13CH3]Oc1cc(ccc1N)F 34a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.30 [13CH3]Oc1cc(ccc1N)F 7a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 3673 B10R1.30 [13CH3]Oc1cc(ccc1N)I 34a_100000057187_200025704644 [1,1,0,0,0,0|2,0,0]=4 3674 B10R1.30 [13CH3]Oc1cc(ccc1N)I 7a_100000057187_200025704644 [1,1,0,0,0,0|2,0,0]=4 3675 B10R1.30 [13CH3]Oc1cc(ccc1N)N 34a_100025717382_200025704644 [1,1,0,0,0,0|2,0,0]=4 3676 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_100011483371_200025704644 [1,1,0,0,0,0|2,0,0]=4 3677 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_200025704644_100011483371 [1,1,0,0,0,0|2,0,0]=4 3678 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_100012339723_200025704644 [1,1,0,0,0,0|2,0,0]=4 3679 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_200025704644_100012339723 [1,1,0,0,0,0|2,0,0]=4 3680 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_100011217576_200025704644 [1,1,0,0,0,0|2,0,0]=4 3681 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_200025704644_100011217576 [1,1,0,0,0,0|2,0,0]=4 3682 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_100000750459_200025704644 [1,1,0,0,0,0|2,0,0]=4 3683 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_200025704644_100000750459 [1,1,0,0,0,0|2,0,0]=4 3684 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3685 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_200025704644_100012339312 [1,1,0,0,0,0|2,0,0]=4 3686 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_100011772130_200025704644 [1,1,0,0,0,0|2,0,0]=4 3687 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_200025704644_100011772130 [1,1,0,0,0,0|2,0,0]=4 3688 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_100000707729_200025704644 [1,1,0,0,0,0|2,0,0]=4 3689 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_200025704644_100000707729 [1,1,0,0,0,0|2,0,0]=4 3690 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_100011217299_200025704644 [1,1,0,0,0,0|2,0,0]=4 3691 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_200025704644_100011217299 [1,1,0,0,0,0|2,0,0]=4 3692 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_100012360549_200025704644 [1,1,0,0,0,0|2,0,0]=4 3693 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_200025704644_100012360549 [1,1,0,0,0,0|2,0,0]=4 3694 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 3695 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_200025704644_100000049588 [1,1,0,0,0,0|2,0,0]=4 3696 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_100011217312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3697 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_200025704644_100011217312 [1,1,0,0,0,0|2,0,0]=4 3698 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_100011218116_200025704644 [1,1,0,0,0,0|2,0,0]=4 3699 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_200025704644_100011218116 [1,1,0,0,0,0|2,0,0]=4 3700 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_100011219198_200025704644 [1,1,0,0,0,0|2,0,0]=4 3701 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_200025704644_100011219198 [1,1,0,0,0,0|2,0,0]=4 3702 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 3703 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_200025704644_100000760356 [1,1,0,0,0,0|2,0,0]=4 3704 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 3705 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_200025704644_100000693481 [1,1,0,0,0,0|2,0,0]=4 3706 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_100000187925_200025704644 [1,1,0,0,0,0|2,0,0]=4 3707 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_200025704644_100000187925 [1,1,0,0,0,0|2,0,0]=4 3708 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_100000761889_200025704644 [1,1,0,0,0,0|2,0,0]=4 3709 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_200025704644_100000761889 [1,1,0,0,0,0|2,0,0]=4 3710 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_100000760547_200025704644 [1,1,0,0,0,0|2,0,0]=4 3711 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_200025704644_100000760547 [1,1,0,0,0,0|2,0,0]=4 3712 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_100011534242_200025704644 [1,1,0,0,0,0|2,0,0]=4 3713 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_200025704644_100011534242 [1,1,0,0,0,0|2,0,0]=4 3714 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 3715 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_200025704644_100012001276 [1,1,0,0,0,0|2,0,0]=4 3716 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 3717 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [1,1,0,0,0,0|2,0,0]=4 3718 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 3719 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [1,1,0,0,0,0|2,0,0]=4 3720 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 3721 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [1,1,0,0,0,0|2,0,0]=4 3722 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 3723 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [1,1,0,0,0,0|2,0,0]=4 3724 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [1,1,0,0,0,0|2,0,0]=4 3725 B10R1.172 C#Cc1cccc(c1)NC 2230a_100000735509_200000210301 [1,1,0,0,0,0|0,0,2]=4 3726 B10R1.172 C#Cc1cccc(c1)NC 34a_100000735509_200000210301 [1,1,0,0,0,0|0,0,2]=4 3727 B10R1.172 C#Cc1cccc(c1)N[13CH3] 2230a_100000735509_200025704644 [1,1,0,0,0,0|0,0,2]=4 3728 B10R1.172 C#Cc1cccc(c1)N[13CH3] 34a_100000735509_200025704644 [1,1,0,0,0,0|0,0,2]=4 3729 B10R1.172 C#Cc1cccc(c1)OC 34a_100011216014_200000210301 [1,1,0,0,0,0|0,0,2]=4 3730 B10R1.172 C#Cc1cccc(c1)OC 7a_100011216014_200000210301 [1,1,0,0,0,0|0,0,2]=4 3731 B10R1.172 C#Cc1cccc(c1)O[13CH3] 34a_100011216014_200025704644 [1,1,0,0,0,0|0,0,2]=4 3732 B10R1.172 C#Cc1cccc(c1)O[13CH3] 7a_100011216014_200025704644 [1,1,0,0,0,0|0,0,2]=4 3733 B10R1.172 C=Cc1cc(ccn1)C=O 271570a_100011290941_100011290808 [1,1,0,0,0,0|1,0,1]=4 3734 B10R1.172 C=Cc1cc(ccn1)CC 271570a_100011290941_100009817561 [1,1,0,0,0,0|1,0,1]=4 3735 B10R1.172 C=Cc1cc(ccn1)CO 271570a_100011290941_100009814636 [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.172 C=Cc1cc(ccn1)NC 271570a_100011290941_100009869472 [1,1,0,0,0,0|1,0,1]=4 3737 B10R1.172 C=Cc1cc(ccn1)OC 271570a_100011290941_100011216251 [1,1,0,0,0,0|1,0,1]=4 3738 B10R1.172 C=Cc1cc(ccn1)SC 271570a_100011290941_100010883326 [1,1,0,0,0,0|1,0,1]=4 3739 B10R1.172 C=Cc1cc(ccn1)SC 62a_100009845566_200000210301 [1,1,0,0,0,0|1,0,1]=4 3740 B10R1.172 C=Cc1cc(ccn1)SC 62a_200000210301_100009845566 [1,1,0,0,0,0|1,0,1]=4 3741 B10R1.172 C=Cc1cc(ccn1)S[13CH3] 62a_100009845566_200025704644 [1,1,0,0,0,0|1,0,1]=4 3742 B10R1.172 C=Cc1cc(ccn1)S[13CH3] 62a_200025704644_100009845566 [1,1,0,0,0,0|1,0,1]=4 3743 B10R1.172 C=Cc1cccc(c1)C#N 271570a_100011290941_100000189340 [1,1,0,0,0,0|0,0,2]=4 3744 B10R1.172 C=Cc1cccc(c1)C=O 271570a_100011290941_100000014684 [1,1,0,0,0,0|0,0,1]=3 3745 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [1,1,0,0,0,0|0,0,1]=3 3746 B10R1.172 C=Cc1cccc(c1)CF 271570a_100011290941_100010878472 [1,1,0,0,0,0|0,0,1]=3 3747 B10R1.172 C=Cc1cccc(c1)CN 271570a_100011290941_100000106179 [1,1,0,0,0,0|0,0,1]=3 3748 B10R1.172 C=Cc1cccc(c1)CO 271570a_100011290941_100000687537 [1,1,0,0,0,0|0,0,1]=3 3749 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [1,1,0,0,0,0|0,0,1]=3 3750 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [1,1,0,0,0,0|0,0,1]=3 3751 B10R1.172 C=Cc1cccc(c1)NN 271570a_100011290941_100000217339 [1,1,0,0,0,0|1,0,1]=4 3752 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [1,1,0,0,0,0|0,0,1]=3 3753 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [1,1,0,0,0,0|0,0,1]=3 3754 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [1,1,0,0,0,0|0,0,1]=3 3755 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [1,1,0,0,0,0|0,0,1]=3 3756 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [1,1,0,0,0,0|0,0,1]=3 3757 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [1,1,0,0,0,0|0,0,1]=3 3758 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [1,1,0,0,0,0|0,0,1]=3 3759 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [1,1,0,0,0,0|0,0,1]=3 3760 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [1,1,0,0,0,0|0,0,1]=3 3761 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [1,1,0,0,0,0|0,0,1]=3 3762 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [1,1,0,0,0,0|0,0,1]=3 3763 B10R1.172 C=Cc1cccc(n1)C=O 271570a_100011290941_100000688028 [1,1,0,0,0,0|1,0,1]=4 3764 B10R1.172 C=Cc1cccc(n1)CC 271570a_100011290941_100009856026 [1,1,0,0,0,0|1,0,1]=4 3765 B10R1.172 C=Cc1cccc(n1)CN 271570a_100011290941_100016990191 [1,1,0,0,0,0|1,0,1]=4 3766 B10R1.172 C=Cc1cccc(n1)CO 271570a_100011290941_100000694195 [1,1,0,0,0,0|1,0,1]=4 3767 B10R1.172 C=Cc1cccc(n1)NC 271570a_100011290941_100000703281 [1,1,0,0,0,0|1,0,1]=4 3768 B10R1.172 C=Cc1cccc(n1)OC 271570a_100011290941_100000760917 [1,1,0,0,0,0|1,0,1]=4 3769 B10R1.172 C=Cc1cccc(n1)SC 271570a_100011290941_100011960944 [1,1,0,0,0,0|1,0,1]=4 3770 B10R1.172 C=Cc1ccnc(c1)C=O 271570a_100011290941_100011998288 [1,1,0,0,0,0|1,0,1]=4 3771 B10R1.172 C=Cc1ccnc(c1)CC 271570a_100011290941_100009820011 [1,1,0,0,0,0|1,0,1]=4 3772 B10R1.172 C=Cc1ccnc(c1)CN 271570a_100011290941_100000085674 [1,1,0,0,0,0|1,0,1]=4 3773 B10R1.172 C=Cc1ccnc(c1)CO 271570a_100011290941_100009819072 [1,1,0,0,0,0|1,0,1]=4 3774 B10R1.172 C=Cc1ccnc(c1)NC 271570a_100011290941_100009819592 [1,1,0,0,0,0|1,0,1]=4 3775 B10R1.172 C=Cc1ccnc(c1)OC 271570a_100011290941_100000117307 [1,1,0,0,0,0|1,0,1]=4 3776 B10R1.172 C=Cc1cncc(c1)C=O 271570a_100011290941_100000687066 [1,1,0,0,0,0|1,0,1]=4 3777 B10R1.172 C=Cc1cncc(c1)CC 271570a_100011290941_200009819073 [1,1,0,0,0,0|1,0,1]=4 3778 B10R1.172 C=Cc1cncc(c1)CN 271570a_100011290941_100011249555 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.172 C=Cc1cncc(c1)CO 271570a_100011290941_100011259137 [1,1,0,0,0,0|1,0,1]=4 3780 B10R1.172 C=Cc1cncc(c1)NC 271570a_100011290941_100012184536 [1,1,0,0,0,0|1,0,1]=4 3781 B10R1.172 C=Cc1cncc(c1)OC 271570a_100011290941_100000684773 [1,1,0,0,0,0|1,0,1]=4 3782 B10R1.172 C=Cc1cncc(c1)SC 271570a_100011290941_100009816972 [1,1,0,0,0,0|1,0,1]=4 3783 B10R1.172 C=Cc1cncc(c1)SC 62a_200000210301_200012180632 [1,1,0,0,0,0|1,0,1]=4 3784 B10R1.172 C=Cc1cncc(c1)SC 62a_200012180632_200000210301 [1,1,0,0,0,0|1,0,1]=4 3785 B10R1.172 C=Cc1cncc(c1)S[13CH3] 62a_200012180632_200025704644 [1,1,0,0,0,0|1,0,1]=4 3786 B10R1.172 C=Cc1cncc(c1)S[13CH3] 62a_200025704644_200012180632 [1,1,0,0,0,0|1,0,1]=4 3787 B10R1.172 CC[n+]1cccc(c1)OC 34a_100000731997_200000210301 [1,1,0,0,0,0|1,0,1]=4 3788 B10R1.172 CC[n+]1cccc(c1)OC 7a_100000731997_200000210301 [1,1,0,0,0,0|1,0,1]=4 3789 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 34a_100000731997_200025704644 [1,1,0,0,0,0|1,0,1]=4 3790 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 7a_100000731997_200025704644 [1,1,0,0,0,0|1,0,1]=4 3791 B10R1.172 CCc1cc(ccn1)NC 27a_100102657272_100009820011 [1,1,0,0,0,0|1,0,1]=4 3792 B10R1.172 CCc1cc(ccn1)SC 62a_100009820011_200000210301 [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.172 CCc1cc(ccn1)SC 62a_200000210301_100009820011 [1,1,0,0,0,0|1,0,1]=4 3794 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_100009820011_200025704644 [1,1,0,0,0,0|1,0,1]=4 3795 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_200025704644_100009820011 [1,1,0,0,0,0|1,0,1]=4 3796 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [1,1,0,0,0,0|0,0,1]=3 3797 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [1,1,0,0,0,0|0,0,1]=3 3798 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [1,1,0,0,0,0|0,0,1]=3 3799 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [1,1,0,0,0,0|0,0,1]=3 3800 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [1,1,0,0,0,0|0,0,1]=3 3801 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [1,1,0,0,0,0|0,0,1]=3 3802 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [1,1,0,0,0,0|0,0,1]=3 3803 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [1,1,0,0,0,0|0,0,1]=3 3804 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [1,1,0,0,0,0|0,0,1]=3 3805 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [1,1,0,0,0,0|0,0,1]=3 3806 B10R1.172 CCc1cccc(c1)SC 62a_100011263222_200000210301 [1,1,0,0,0,0|0,0,1]=3 3807 B10R1.172 CCc1cccc(c1)SC 62a_200000210301_100011263222 [1,1,0,0,0,0|0,0,1]=3 3808 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_100011263222_200025704644 [1,1,0,0,0,0|0,0,1]=3 3809 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_200025704644_100011263222 [1,1,0,0,0,0|0,0,1]=3 3810 B10R1.172 CCc1cccc(n1)SC 62a_100009856026_200000210301 [1,1,0,0,0,0|1,0,1]=4 3811 B10R1.172 CCc1cccc(n1)SC 62a_200000210301_100009856026 [1,1,0,0,0,0|1,0,1]=4 3812 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_100009856026_200025704644 [1,1,0,0,0,0|1,0,1]=4 3813 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_200025704644_100009856026 [1,1,0,0,0,0|1,0,1]=4 3814 B10R1.172 CCc1ccnc(c1)NC 27a_100102657272_100009817561 [1,1,0,0,0,0|1,0,1]=4 3815 B10R1.172 CCc1ccnc(c1)SC 62a_100009817561_200000210301 [1,1,0,0,0,0|1,0,1]=4 3816 B10R1.172 CCc1ccnc(c1)SC 62a_200000210301_100009817561 [1,1,0,0,0,0|1,0,1]=4 3817 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_100009817561_200025704644 [1,1,0,0,0,0|1,0,1]=4 3818 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_200025704644_100009817561 [1,1,0,0,0,0|1,0,1]=4 3819 B10R1.172 CCc1cncc(c1)OC 34a_200009861530_200000210301 [1,1,0,0,0,0|1,0,1]=4 3820 B10R1.172 CCc1cncc(c1)OC 7a_200009861530_200000210301 [1,1,0,0,0,0|1,0,1]=4 3821 B10R1.172 CCc1cncc(c1)O[13CH3] 34a_200009861530_200025704644 [1,1,0,0,0,0|1,0,1]=4 3822 B10R1.172 CCc1cncc(c1)O[13CH3] 7a_200009861530_200025704644 [1,1,0,0,0,0|1,0,1]=4 3823 B10R1.172 CCc1cncc(c1)SC 62a_200000210301_200009819073 [1,1,0,0,0,0|1,0,1]=4 3824 B10R1.172 CCc1cncc(c1)SC 62a_200009819073_200000210301 [1,1,0,0,0,0|1,0,1]=4 3825 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200009819073_200025704644 [1,1,0,0,0,0|1,0,1]=4 3826 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200025704644_200009819073 [1,1,0,0,0,0|1,0,1]=4 3827 B10R1.172 CNc1cc(ccn1)SC 62a_100009819592_200000210301 [1,1,0,0,0,0|2,0,0]=4 3828 B10R1.172 CNc1cc(ccn1)SC 62a_200000210301_100009819592 [1,1,0,0,0,0|2,0,0]=4 3829 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_100009819592_200025704644 [1,1,0,0,0,0|2,0,0]=4 3830 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_200025704644_100009819592 [1,1,0,0,0,0|2,0,0]=4 3831 B10R1.172 CNc1cccc(c1)C#N 34a_100000210922_200000210301 [1,1,0,0,0,0|1,0,1]=4 3832 B10R1.172 CNc1cccc(c1)C#N 7a_100000210922_200000210301 [1,1,0,0,0,0|1,0,1]=4 3833 B10R1.172 CNc1cccc(c1)CF 2230a_100000126320_200000210301 [1,1,0,0,0,0|1,0,0]=3 3834 B10R1.172 CNc1cccc(c1)CF 34a_100000126320_200000210301 [1,1,0,0,0,0|1,0,0]=3 3835 B10R1.172 CNc1cccc(c1)CF 7a_100000126320_200000210301 [1,1,0,0,0,0|1,0,0]=3 3836 B10R1.172 CNc1cccc(c1)CO 2230a_100000211919_200000210301 [1,1,0,0,0,0|1,0,0]=3 3837 B10R1.172 CNc1cccc(c1)CO 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,0]=3 3838 B10R1.172 CNc1cccc(c1)OC 34a_100000210024_200000210301 [1,1,0,0,0,0|1,0,0]=3 3839 B10R1.172 CNc1cccc(c1)OC 34a_100000756613_200000210301 [1,1,0,0,0,0|1,0,0]=3 3840 B10R1.172 CNc1cccc(c1)OC 7a_100000756613_200000210301 [1,1,0,0,0,0|1,0,0]=3 3841 B10R1.172 CNc1cccc(c1)O[13CH3] 34a_100000756613_200025704644 [1,1,0,0,0,0|1,0,0]=3 3842 B10R1.172 CNc1cccc(c1)O[13CH3] 7a_100000756613_200025704644 [1,1,0,0,0,0|1,0,0]=3 3843 B10R1.172 CNc1cccc(c1)SC 2230a_100000210049_200000210301 [1,1,0,0,0,0|1,0,0]=3 3844 B10R1.172 CNc1cccc(c1)SC 34a_100000210049_200000210301 [1,1,0,0,0,0|1,0,0]=3 3845 B10R1.172 CNc1cccc(c1)SC 62a_100000219648_200000210301 [1,1,0,0,0,0|1,0,0]=3 3846 B10R1.172 CNc1cccc(c1)SC 62a_200000210301_100000219648 [1,1,0,0,0,0|1,0,0]=3 3847 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_100000219648_200025704644 [1,1,0,0,0,0|1,0,0]=3 3848 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_200025704644_100000219648 [1,1,0,0,0,0|1,0,0]=3 3849 B10R1.172 CNc1cccc(n1)SC 62a_100000703281_200000210301 [1,1,0,0,0,0|2,0,0]=4 3850 B10R1.172 CNc1cccc(n1)SC 62a_200000210301_100000703281 [1,1,0,0,0,0|2,0,0]=4 3851 B10R1.172 CNc1cccc(n1)S[13CH3] 62a_100000703281_200025704644 [1,1,0,0,0,0|2,0,0]=4 3852 B10R1.172 CNc1cccc(n1)S[13CH3] 62a_200025704644_100000703281 [1,1,0,0,0,0|2,0,0]=4 3853 B10R1.172 CNc1ccnc(c1)CO 27a_100102657272_100000748867 [1,1,0,0,0,0|2,0,0]=4 3854 B10R1.172 CNc1ccnc(c1)SC 62a_100009869472_200000210301 [1,1,0,0,0,0|2,0,0]=4 3855 B10R1.172 CNc1ccnc(c1)SC 62a_200000210301_100009869472 [1,1,0,0,0,0|2,0,0]=4 3856 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_100009869472_200025704644 [1,1,0,0,0,0|2,0,0]=4 3857 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_200025704644_100009869472 [1,1,0,0,0,0|2,0,0]=4 3858 B10R1.172 CNc1cncc(c1)SC 62a_100012184536_200000210301 [1,1,0,0,0,0|2,0,0]=4 3859 B10R1.172 CNc1cncc(c1)SC 62a_200000210301_100012184536 [1,1,0,0,0,0|2,0,0]=4 3860 B10R1.172 CNc1cncc(c1)S[13CH3] 62a_100012184536_200025704644 [1,1,0,0,0,0|2,0,0]=4 3861 B10R1.172 CNc1cncc(c1)S[13CH3] 62a_200025704644_100012184536 [1,1,0,0,0,0|2,0,0]=4 3862 B10R1.172 COc1cc(ccn1)CN 34a_100000748557_200000210301 [1,1,0,0,0,0|2,0,0]=4 3863 B10R1.172 COc1cc(ccn1)O[13CH3] 34a_100012181050_200025704644 [1,1,0,0,0,0|2,0,0]=4 3864 B10R1.172 COc1cc(ccn1)SC 62a_100000117307_200000210301 [1,1,0,0,0,0|2,0,0]=4 3865 B10R1.172 COc1cc(ccn1)SC 62a_200000210301_100000117307 [1,1,0,0,0,0|2,0,0]=4 3866 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_100000117307_200025704644 [1,1,0,0,0,0|2,0,0]=4 3867 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_200025704644_100000117307 [1,1,0,0,0,0|2,0,0]=4 3868 B10R1.172 COc1cccc(c1)C#N 34a_100000184713_200000210301 [1,1,0,0,0,0|1,0,1]=4 3869 B10R1.172 COc1cccc(c1)C#N 7a_100000184713_200000210301 [1,1,0,0,0,0|1,0,1]=4 3870 B10R1.172 COc1cccc(c1)CBr 34a_100011660834_200000210301 [1,1,0,0,0,0|1,0,0]=3 3871 B10R1.172 COc1cccc(c1)CBr 7a_100011660834_200000210301 [1,1,0,0,0,0|1,0,0]=3 3872 B10R1.172 COc1cccc(c1)CCl 34a_100000084143_200000210301 [1,1,0,0,0,0|1,0,0]=3 3873 B10R1.172 COc1cccc(c1)CCl 7a_100000084143_200000210301 [1,1,0,0,0,0|1,0,0]=3 3874 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [1,1,0,0,0,0|1,0,0]=3 3875 B10R1.172 COc1cccc(c1)CO 34a_100011214949_200000210301 [1,1,0,0,0,0|1,0,0]=3 3876 B10R1.172 COc1cccc(c1)CO 7a_100011214949_200000210301 [1,1,0,0,0,0|1,0,0]=3 3877 B10R1.172 COc1cccc(c1)N[13CH3] 34a_100000210024_200025704644 [1,1,0,0,0,0|1,0,0]=3 3878 B10R1.172 COc1cccc(c1)OC 34a_100000211255_200000210301 [1,1,0,0,0,0|1,0,0]=3 3879 B10R1.172 COc1cccc(c1)OC 7a_100000211255_200000210301 [1,1,0,0,0,0|1,0,0]=3 3880 B10R1.172 COc1cccc(c1)O[13CH3] 34a_100000211255_200025704644 [1,1,0,0,0,0|1,0,0]=3 3881 B10R1.172 COc1cccc(c1)O[13CH3] 7a_100000211255_200025704644 [1,1,0,0,0,0|1,0,0]=3 3882 B10R1.172 COc1cccc(c1)SC 34a_100011265683_200000210301 [1,1,0,0,0,0|1,0,0]=3 3883 B10R1.172 COc1cccc(c1)SC 62a_200000210301_100000170001 [1,1,0,0,0,0|1,0,0]=3 3884 B10R1.172 COc1cccc(c1)SC 7a_100011265683_200000210301 [1,1,0,0,0,0|1,0,0]=3 3885 B10R1.172 COc1cccc(c1)S[13CH3] 62a_200025704644_100000170001 [1,1,0,0,0,0|1,0,0]=3 3886 B10R1.172 COc1cccc(n1)SC 62a_100000760917_200000210301 [1,1,0,0,0,0|2,0,0]=4 3887 B10R1.172 COc1cccc(n1)SC 62a_200000210301_100000760917 [1,1,0,0,0,0|2,0,0]=4 3888 B10R1.172 COc1cccc(n1)S[13CH3] 62a_100000760917_200025704644 [1,1,0,0,0,0|2,0,0]=4 3889 B10R1.172 COc1cccc(n1)S[13CH3] 62a_200025704644_100000760917 [1,1,0,0,0,0|2,0,0]=4 3890 B10R1.172 COc1ccnc(c1)OC 34a_100012181050_200000210301 [1,1,0,0,0,0|2,0,0]=4 3891 B10R1.172 COc1ccnc(c1)SC 62a_100009817693_200000210301 [1,1,0,0,0,0|2,0,0]=4 3892 B10R1.172 COc1ccnc(c1)SC 62a_200000210301_100011216251 [1,1,0,0,0,0|2,0,0]=4 3893 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_100009817693_200025704644 [1,1,0,0,0,0|2,0,0]=4 3894 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_200025704644_100011216251 [1,1,0,0,0,0|2,0,0]=4 3895 B10R1.172 COc1cncc(c1)OC 34a_100000084572_200000210301 [1,1,0,0,0,0|2,0,0]=4 3896 B10R1.172 COc1cncc(c1)OC 7a_100000084572_200000210301 [1,1,0,0,0,0|2,0,0]=4 3897 B10R1.172 COc1cncc(c1)O[13CH3] 34a_100000084572_200025704644 [1,1,0,0,0,0|2,0,0]=4 3898 B10R1.172 COc1cncc(c1)O[13CH3] 7a_100000084572_200025704644 [1,1,0,0,0,0|2,0,0]=4 3899 B10R1.172 COc1cncc(c1)SC 62a_100000050176_200000210301 [1,1,0,0,0,0|2,0,0]=4 3900 B10R1.172 COc1cncc(c1)SC 62a_200000210301_100000050176 [1,1,0,0,0,0|2,0,0]=4 3901 B10R1.172 COc1cncc(c1)S[13CH3] 62a_100000050176_200025704644 [1,1,0,0,0,0|2,0,0]=4 3902 B10R1.172 COc1cncc(c1)S[13CH3] 62a_200025704644_100000050176 [1,1,0,0,0,0|2,0,0]=4 3903 B10R1.172 CSc1cc(ccn1)C=O 62a_100011290808_200000210301 [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.172 CSc1cc(ccn1)C=O 62a_200000210301_100011290808 [1,1,0,0,0,0|1,0,0]=3 3905 B10R1.172 CSc1cc(ccn1)CN 62a_100025757509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3906 B10R1.172 CSc1cc(ccn1)CN 62a_200000210301_100025757509 [1,1,0,0,0,0|2,0,0]=4 3907 B10R1.172 CSc1cc(ccn1)CO 62a_100009814636_200000210301 [1,1,0,0,0,0|2,0,0]=4 3908 B10R1.172 CSc1cc(ccn1)CO 62a_200000210301_100009814636 [1,1,0,0,0,0|2,0,0]=4 3909 B10R1.172 CSc1cccc(c1)C#N 62a_200000210301_100000189340 [1,1,0,0,0,0|1,0,1]=4 3910 B10R1.172 CSc1cccc(c1)C=O 62a_100000014684_200000210301 [1,1,0,0,0,0|0,0,0]=2 3911 B10R1.172 CSc1cccc(c1)C=O 62a_200000210301_100000014684 [1,1,0,0,0,0|0,0,0]=2 3912 B10R1.172 CSc1cccc(c1)CF 62a_100010878472_200000210301 [1,1,0,0,0,0|1,0,0]=3 3913 B10R1.172 CSc1cccc(c1)CF 62a_200000210301_100010878472 [1,1,0,0,0,0|1,0,0]=3 3914 B10R1.172 CSc1cccc(c1)CN 62a_100000106179_200000210301 [1,1,0,0,0,0|1,0,0]=3 3915 B10R1.172 CSc1cccc(c1)CN 62a_200000210301_100000106179 [1,1,0,0,0,0|1,0,0]=3 3916 B10R1.172 CSc1cccc(c1)CO 62a_100000687537_200000210301 [1,1,0,0,0,0|1,0,0]=3 3917 B10R1.172 CSc1cccc(c1)CO 62a_200000210301_100000687537 [1,1,0,0,0,0|1,0,0]=3 3918 B10R1.172 CSc1cccc(c1)NN 62a_100000217339_200000210301 [1,1,0,0,0,0|2,0,0]=4 3919 B10R1.172 CSc1cccc(c1)NN 62a_200000210301_100000217339 [1,1,0,0,0,0|2,0,0]=4 3920 B10R1.172 CSc1cccc(c1)N[13CH3] 2230a_100000210049_200025704644 [1,1,0,0,0,0|1,0,0]=3 3921 B10R1.172 CSc1cccc(c1)N[13CH3] 34a_100000210049_200025704644 [1,1,0,0,0,0|1,0,0]=3 3922 B10R1.172 CSc1cccc(c1)O[13CH3] 34a_100011265683_200025704644 [1,1,0,0,0,0|1,0,0]=3 3923 B10R1.172 CSc1cccc(c1)O[13CH3] 7a_100011265683_200025704644 [1,1,0,0,0,0|1,0,0]=3 3924 B10R1.172 CSc1cccc(c1)SC 62a_100011215954_200000210301 [1,1,0,0,0,0|1,0,0]=3 3925 B10R1.172 CSc1cccc(c1)SC 62a_200000210301_100011215954 [1,1,0,0,0,0|1,0,0]=3 3926 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_100011215954_200025704644 [1,1,0,0,0,0|1,0,0]=3 3927 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_200025704644_100011215954 [1,1,0,0,0,0|1,0,0]=3 3928 B10R1.172 CSc1cccc(n1)C=O 62a_100000688028_200000210301 [1,1,0,0,0,0|1,0,0]=3 3929 B10R1.172 CSc1cccc(n1)C=O 62a_200000210301_100000688028 [1,1,0,0,0,0|1,0,0]=3 3930 B10R1.172 CSc1cccc(n1)CN 62a_100016990191_200000210301 [1,1,0,0,0,0|2,0,0]=4 3931 B10R1.172 CSc1cccc(n1)CN 62a_200000210301_100016990191 [1,1,0,0,0,0|2,0,0]=4 3932 B10R1.172 CSc1cccc(n1)CO 62a_100000694195_200000210301 [1,1,0,0,0,0|2,0,0]=4 3933 B10R1.172 CSc1cccc(n1)CO 62a_200000210301_100000694195 [1,1,0,0,0,0|2,0,0]=4 3934 B10R1.172 CSc1cccc(n1)SC 62a_100011960944_200000210301 [1,1,0,0,0,0|2,0,0]=4 3935 B10R1.172 CSc1cccc(n1)SC 62a_200000210301_100011960944 [1,1,0,0,0,0|2,0,0]=4 3936 B10R1.172 CSc1cccc(n1)S[13CH3] 62a_100011960944_200025704644 [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.172 CSc1cccc(n1)S[13CH3] 62a_200025704644_100011960944 [1,1,0,0,0,0|2,0,0]=4 3938 B10R1.172 CSc1ccnc(c1)C=O 62a_100011998288_200000210301 [1,1,0,0,0,0|1,0,0]=3 3939 B10R1.172 CSc1ccnc(c1)C=O 62a_200000210301_100011998288 [1,1,0,0,0,0|1,0,0]=3 3940 B10R1.172 CSc1ccnc(c1)CN 62a_100000085674_200000210301 [1,1,0,0,0,0|2,0,0]=4 3941 B10R1.172 CSc1ccnc(c1)CN 62a_200000210301_100000085674 [1,1,0,0,0,0|2,0,0]=4 3942 B10R1.172 CSc1ccnc(c1)CO 62a_100000748867_200000210301 [1,1,0,0,0,0|2,0,0]=4 3943 B10R1.172 CSc1ccnc(c1)CO 62a_200000210301_100000748867 [1,1,0,0,0,0|2,0,0]=4 3944 B10R1.172 CSc1ccnc(c1)SC 62a_100010883326_200000210301 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.172 CSc1ccnc(c1)SC 62a_200000210301_100010883326 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_100010883326_200025704644 [1,1,0,0,0,0|2,0,0]=4 3947 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_200025704644_100010883326 [1,1,0,0,0,0|2,0,0]=4 3948 B10R1.172 CSc1cncc(c1)C=O 62a_100000687066_200000210301 [1,1,0,0,0,0|1,0,0]=3 3949 B10R1.172 CSc1cncc(c1)C=O 62a_200000210301_100000687066 [1,1,0,0,0,0|1,0,0]=3 3950 B10R1.172 CSc1cncc(c1)CN 62a_100011249555_200000210301 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.172 CSc1cncc(c1)CN 62a_200000210301_100011249555 [1,1,0,0,0,0|2,0,0]=4 3952 B10R1.172 CSc1cncc(c1)CO 62a_100011259137_200000210301 [1,1,0,0,0,0|2,0,0]=4 3953 B10R1.172 CSc1cncc(c1)CO 62a_200000210301_100011259137 [1,1,0,0,0,0|2,0,0]=4 3954 B10R1.172 CSc1cncc(c1)SC 62a_100009816972_200000210301 [1,1,0,0,0,0|2,0,0]=4 3955 B10R1.172 CSc1cncc(c1)SC 62a_200000210301_100009816972 [1,1,0,0,0,0|2,0,0]=4 3956 B10R1.172 CSc1cncc(c1)S[13CH3] 62a_100009816972_200025704644 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.172 CSc1cncc(c1)S[13CH3] 62a_200025704644_100009816972 [1,1,0,0,0,0|2,0,0]=4 3958 B10R1.172 [13CH3]Nc1cccc(c1)C#N 34a_100000210922_200025704644 [1,1,0,0,0,0|1,0,1]=4 3959 B10R1.172 [13CH3]Nc1cccc(c1)C#N 7a_100000210922_200025704644 [1,1,0,0,0,0|1,0,1]=4 3960 B10R1.172 [13CH3]Nc1cccc(c1)CF 2230a_100000126320_200025704644 [1,1,0,0,0,0|1,0,0]=3 3961 B10R1.172 [13CH3]Nc1cccc(c1)CF 34a_100000126320_200025704644 [1,1,0,0,0,0|1,0,0]=3 3962 B10R1.172 [13CH3]Nc1cccc(c1)CF 7a_100000126320_200025704644 [1,1,0,0,0,0|1,0,0]=3 3963 B10R1.172 [13CH3]Nc1cccc(c1)CO 2230a_100000211919_200025704644 [1,1,0,0,0,0|1,0,0]=3 3964 B10R1.172 [13CH3]Nc1cccc(c1)CO 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,0]=3 3965 B10R1.172 [13CH3]Oc1cc(ccn1)CN 34a_100000748557_200025704644 [1,1,0,0,0,0|2,0,0]=4 3966 B10R1.172 [13CH3]Oc1cccc(c1)C#N 34a_100000184713_200025704644 [1,1,0,0,0,0|1,0,1]=4 3967 B10R1.172 [13CH3]Oc1cccc(c1)C#N 7a_100000184713_200025704644 [1,1,0,0,0,0|1,0,1]=4 3968 B10R1.172 [13CH3]Oc1cccc(c1)CBr 34a_100011660834_200025704644 [1,1,0,0,0,0|1,0,0]=3 3969 B10R1.172 [13CH3]Oc1cccc(c1)CBr 7a_100011660834_200025704644 [1,1,0,0,0,0|1,0,0]=3 3970 B10R1.172 [13CH3]Oc1cccc(c1)CCl 34a_100000084143_200025704644 [1,1,0,0,0,0|1,0,0]=3 3971 B10R1.172 [13CH3]Oc1cccc(c1)CCl 7a_100000084143_200025704644 [1,1,0,0,0,0|1,0,0]=3 3972 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [1,1,0,0,0,0|1,0,0]=3 3973 B10R1.172 [13CH3]Oc1cccc(c1)CO 34a_100011214949_200025704644 [1,1,0,0,0,0|1,0,0]=3 3974 B10R1.172 [13CH3]Oc1cccc(c1)CO 7a_100011214949_200025704644 [1,1,0,0,0,0|1,0,0]=3 3975 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_100011290808_200025704644 [1,1,0,0,0,0|1,0,0]=3 3976 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_200025704644_100011290808 [1,1,0,0,0,0|1,0,0]=3 3977 B10R1.172 [13CH3]Sc1cc(ccn1)CN 62a_100025757509_200025704644 [1,1,0,0,0,0|2,0,0]=4 3978 B10R1.172 [13CH3]Sc1cc(ccn1)CN 62a_200025704644_100025757509 [1,1,0,0,0,0|2,0,0]=4 3979 B10R1.172 [13CH3]Sc1cc(ccn1)CO 62a_100009814636_200025704644 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.172 [13CH3]Sc1cc(ccn1)CO 62a_200025704644_100009814636 [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.172 [13CH3]Sc1cccc(c1)C#N 62a_200025704644_100000189340 [1,1,0,0,0,0|1,0,1]=4 3982 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_100000014684_200025704644 [1,1,0,0,0,0|0,0,0]=2 3983 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_200025704644_100000014684 [1,1,0,0,0,0|0,0,0]=2 3984 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_100010878472_200025704644 [1,1,0,0,0,0|1,0,0]=3 3985 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_200025704644_100010878472 [1,1,0,0,0,0|1,0,0]=3 3986 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_100000106179_200025704644 [1,1,0,0,0,0|1,0,0]=3 3987 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_200025704644_100000106179 [1,1,0,0,0,0|1,0,0]=3 3988 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_100000687537_200025704644 [1,1,0,0,0,0|1,0,0]=3 3989 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_200025704644_100000687537 [1,1,0,0,0,0|1,0,0]=3 3990 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_100000217339_200025704644 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_200025704644_100000217339 [1,1,0,0,0,0|2,0,0]=4 3992 B10R1.172 [13CH3]Sc1cccc(n1)C=O 62a_100000688028_200025704644 [1,1,0,0,0,0|1,0,0]=3 3993 B10R1.172 [13CH3]Sc1cccc(n1)C=O 62a_200025704644_100000688028 [1,1,0,0,0,0|1,0,0]=3 3994 B10R1.172 [13CH3]Sc1cccc(n1)CN 62a_100016990191_200025704644 [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.172 [13CH3]Sc1cccc(n1)CN 62a_200025704644_100016990191 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.172 [13CH3]Sc1cccc(n1)CO 62a_100000694195_200025704644 [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.172 [13CH3]Sc1cccc(n1)CO 62a_200025704644_100000694195 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.172 [13CH3]Sc1ccnc(c1)C=O 62a_100011998288_200025704644 [1,1,0,0,0,0|1,0,0]=3 3999 B10R1.172 [13CH3]Sc1ccnc(c1)C=O 62a_200025704644_100011998288 [1,1,0,0,0,0|1,0,0]=3 4000 B10R1.172 [13CH3]Sc1ccnc(c1)CN 62a_100000085674_200025704644 [1,1,0,0,0,0|2,0,0]=4 4001 B10R1.172 [13CH3]Sc1ccnc(c1)CN 62a_200025704644_100000085674 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.172 [13CH3]Sc1ccnc(c1)CO 62a_100000748867_200025704644 [1,1,0,0,0,0|2,0,0]=4 4003 B10R1.172 [13CH3]Sc1ccnc(c1)CO 62a_200025704644_100000748867 [1,1,0,0,0,0|2,0,0]=4 4004 B10R1.172 [13CH3]Sc1cncc(c1)C=O 62a_100000687066_200025704644 [1,1,0,0,0,0|1,0,0]=3 4005 B10R1.172 [13CH3]Sc1cncc(c1)C=O 62a_200025704644_100000687066 [1,1,0,0,0,0|1,0,0]=3 4006 B10R1.172 [13CH3]Sc1cncc(c1)CN 62a_100011249555_200025704644 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.172 [13CH3]Sc1cncc(c1)CN 62a_200025704644_100011249555 [1,1,0,0,0,0|2,0,0]=4 4008 B10R1.172 [13CH3]Sc1cncc(c1)CO 62a_100011259137_200025704644 [1,1,0,0,0,0|2,0,0]=4 4009 B10R1.172 [13CH3]Sc1cncc(c1)CO 62a_200025704644_100011259137 [1,1,0,0,0,0|2,0,0]=4 4010 B10R1.176 C=Cc1cc(c(cn1)Br)C 271570a_100011290941_100012356354 [1,1,0,0,0,0|1,0,1]=4 4011 B10R1.176 C=Cc1cc(c(cn1)C)C 271570a_100011290941_100009850809 [1,1,0,0,0,0|1,0,1]=4 4012 B10R1.176 C=Cc1cc(c(cn1)F)C 271570a_100011290941_100009818257 [1,1,0,0,0,0|1,0,1]=4 4013 B10R1.176 C=Cc1cc(c(cn1)N)C 271570a_100011290941_100000765520 [1,1,0,0,0,0|1,0,1]=4 4014 B10R1.176 C=Cc1cc(c(cn1)O)C 271570a_100011290941_100000692680 [1,1,0,0,0,0|1,0,1]=4 4015 B10R1.176 C=Cc1ccc(=O)n(c1)C 271570a_100011290941_100011245003 [1,1,0,0,0,0|1,0,1]=4 4016 B10R1.176 C=Cc1ccc(c(c1)Br)Br 271570a_100011290941_100012356285 [1,1,0,0,0,0|1,0,1]=4 4017 B10R1.176 C=Cc1ccc(c(c1)Br)C 271570a_100011290941_100011847877 [1,1,0,0,0,0|1,0,1]=4 4018 B10R1.176 C=Cc1ccc(c(c1)Br)Cl 271570a_100011290941_100012353702 [1,1,0,0,0,0|1,0,1]=4 4019 B10R1.176 C=Cc1ccc(c(c1)Br)F 271570a_100011290941_100012047266 [1,1,0,0,0,0|1,0,1]=4 4020 B10R1.176 C=Cc1ccc(c(c1)Br)N 271570a_100011290941_100000750455 [1,1,0,0,0,0|1,0,1]=4 4021 B10R1.176 C=Cc1ccc(c(c1)Br)O 271570a_100011290941_100012361655 [1,1,0,0,0,0|1,0,1]=4 4022 B10R1.176 C=Cc1ccc(c(c1)C)Br 271570a_100011290941_100009813585 [1,1,0,0,0,0|0,0,1]=3 4023 B10R1.176 C=Cc1ccc(c(c1)C)C 271570a_100011290941_100011215607 [1,1,0,0,0,0|0,0,1]=3 4024 B10R1.176 C=Cc1ccc(c(c1)C)Cl 271570a_100011290941_100000049509 [1,1,0,0,0,0|0,0,1]=3 4025 B10R1.176 C=Cc1ccc(c(c1)C)F 271570a_100011290941_100011218330 [1,1,0,0,0,0|0,0,1]=3 4026 B10R1.176 C=Cc1ccc(c(c1)C)N 271570a_100011290941_100000211769 [1,1,0,0,0,0|0,0,1]=3 4027 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [1,1,0,0,0,0|0,0,1]=3 4028 B10R1.176 C=Cc1ccc(c(c1)Cl)Br 271570a_100011290941_100012047281 [1,1,0,0,0,0|1,0,1]=4 4029 B10R1.176 C=Cc1ccc(c(c1)Cl)C 271570a_100011290941_100011216363 [1,1,0,0,0,0|1,0,1]=4 4030 B10R1.176 C=Cc1ccc(c(c1)Cl)Cl 271570a_100011290941_100011214914 [1,1,0,0,0,0|1,0,1]=4 4031 B10R1.176 C=Cc1ccc(c(c1)Cl)F 271570a_100011290941_100011215976 [1,1,0,0,0,0|1,0,1]=4 4032 B10R1.176 C=Cc1ccc(c(c1)Cl)N 271570a_100011290941_100011218065 [1,1,0,0,0,0|1,0,1]=4 4033 B10R1.176 C=Cc1ccc(c(c1)Cl)O 271570a_100011290941_100012360047 [1,1,0,0,0,0|1,0,1]=4 4034 B10R1.176 C=Cc1ccc(c(c1)F)Br 271570a_100011290941_100000685389 [1,1,0,0,0,0|1,0,1]=4 4035 B10R1.176 C=Cc1ccc(c(c1)F)C 271570a_100011290941_100000720648 [1,1,0,0,0,0|1,0,1]=4 4036 B10R1.176 C=Cc1ccc(c(c1)F)Cl 271570a_100011290941_100011216805 [1,1,0,0,0,0|1,0,1]=4 4037 B10R1.176 C=Cc1ccc(c(c1)F)F 271570a_100011290941_100000750028 [1,1,0,0,0,0|1,0,1]=4 4038 B10R1.176 C=Cc1ccc(c(c1)F)N 271570a_100011290941_100011215594 [1,1,0,0,0,0|1,0,1]=4 4039 B10R1.176 C=Cc1ccc(c(c1)F)O 271570a_100011290941_100000185481 [1,1,0,0,0,0|1,0,1]=4 4040 B10R1.176 C=Cc1ccc(c(c1)N)Br 271570a_100011290941_100000750456 [1,1,0,0,0,0|1,0,1]=4 4041 B10R1.176 C=Cc1ccc(c(c1)N)C 271570a_100011290941_100000761890 [1,1,0,0,0,0|1,0,1]=4 4042 B10R1.176 C=Cc1ccc(c(c1)N)Cl 271570a_100011290941_200000761891 [1,1,0,0,0,0|1,0,1]=4 4043 B10R1.176 C=Cc1ccc(c(c1)N)F 271570a_100011290941_100000740924 [1,1,0,0,0,0|1,0,1]=4 4044 B10R1.176 C=Cc1ccc(c(c1)N)N 271570a_100011290941_100000741789 [1,1,0,0,0,0|1,0,1]=4 4045 B10R1.176 C=Cc1ccc(c(c1)N)O 271570a_100011290941_100000752626 [1,1,0,0,0,0|1,0,1]=4 4046 B10R1.176 C=Cc1ccc(c(c1)O)Br 271570a_100011290941_100012356990 [1,1,0,0,0,0|1,0,1]=4 4047 B10R1.176 C=Cc1ccc(c(c1)O)C 271570a_100011290941_100000766334 [1,1,0,0,0,0|1,0,1]=4 4048 B10R1.176 C=Cc1ccc(c(c1)O)Cl 271570a_100011290941_100011356854 [1,1,0,0,0,0|1,0,1]=4 4049 B10R1.176 C=Cc1ccc(c(c1)O)F 271570a_100011290941_100000686035 [1,1,0,0,0,0|1,0,1]=4 4050 B10R1.176 C=Cc1ccc(c(c1)O)N 271570a_100011290941_100000739049 [1,1,0,0,0,0|1,0,1]=4 4051 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [1,1,0,0,0,0|1,0,1]=4 4052 B10R1.176 C=Cc1ccc(c(n1)C)Br 271570a_100011290941_100012360386 [1,1,0,0,0,0|1,0,1]=4 4053 B10R1.176 C=Cc1ccc(c(n1)C)C 271570a_100011290941_100000103781 [1,1,0,0,0,0|1,0,1]=4 4054 B10R1.176 C=Cc1ccc(c(n1)C)F 271570a_100011290941_100009814307 [1,1,0,0,0,0|1,0,1]=4 4055 B10R1.176 C=Cc1ccc(c(n1)C)N 271570a_100011290941_100000760127 [1,1,0,0,0,0|1,0,1]=4 4056 B10R1.176 C=Cc1ccc(c(n1)C)O 271570a_100011290941_100010233687 [1,1,0,0,0,0|1,0,1]=4 4057 B10R1.176 C=Cc1cnc(c(c1)C)Br 271570a_100011290941_100009816107 [1,1,0,0,0,0|1,0,1]=4 4058 B10R1.176 C=Cc1cnc(c(c1)C)C 271570a_100011290941_100000697892 [1,1,0,0,0,0|1,0,1]=4 4059 B10R1.176 C=Cc1cnc(c(c1)C)Cl 271570a_100011290941_100009922867 [1,1,0,0,0,0|1,0,1]=4 4060 B10R1.176 C=Cc1cnc(c(c1)C)F 271570a_100011290941_100000709442 [1,1,0,0,0,0|1,0,1]=4 4061 B10R1.176 C=Cc1cnc(c(c1)C)N 271570a_100011290941_100000186686 [1,1,0,0,0,0|1,0,1]=4 4062 B10R1.176 C=Cc1cnc(c(c1)C)O 271570a_100011290941_100000685391 [1,1,0,0,0,0|1,0,1]=4 4063 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [1,1,0,0,0,0|1,0,1]=4 4064 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [1,1,0,0,0,0|1,0,1]=4 4065 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [1,1,0,0,0,0|1,0,1]=4 4066 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [1,1,0,0,0,0|1,0,1]=4 4067 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [1,1,0,0,0,0|1,0,1]=4 4068 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [1,1,0,0,0,0|2,0,0]=4 4069 B10R1.176 CNc1ccc(c(c1)Br)Br 2230a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 4070 B10R1.176 CNc1ccc(c(c1)Br)Br 34a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 4071 B10R1.176 CNc1ccc(c(c1)Br)Br 7a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 4072 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 4073 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 4074 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [1,1,0,0,0,0|2,0,0]=4 4075 B10R1.176 CNc1ccc(c(c1)Br)Cl 2230a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 4076 B10R1.176 CNc1ccc(c(c1)Br)Cl 34a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 4077 B10R1.176 CNc1ccc(c(c1)Br)F 2230a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 4078 B10R1.176 CNc1ccc(c(c1)Br)F 34a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 4079 B10R1.176 CNc1ccc(c(c1)Br)F 7a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 4080 B10R1.176 CNc1ccc(c(c1)Br)I 34a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 4081 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 4082 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 4083 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 4084 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [1,1,0,0,0,0|1,0,0]=3 4085 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 4086 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 4087 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 4088 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 4089 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 4090 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [1,1,0,0,0,0|1,0,0]=3 4091 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 4092 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 4093 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [1,1,0,0,0,0|1,0,0]=3 4094 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [1,1,0,0,0,0|1,0,0]=3 4095 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [1,1,0,0,0,0|1,0,0]=3 4096 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [1,1,0,0,0,0|1,0,0]=3 4097 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 4098 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [1,1,0,0,0,0|1,0,0]=3 4099 B10R1.176 CNc1ccc(c(c1)Cl)Br 2230a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 4100 B10R1.176 CNc1ccc(c(c1)Cl)Br 34a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 4101 B10R1.176 CNc1ccc(c(c1)Cl)Br 7a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 4102 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 4103 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 4104 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [1,1,0,0,0,0|2,0,0]=4 4105 B10R1.176 CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 4106 B10R1.176 CNc1ccc(c(c1)Cl)Cl 34a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 4107 B10R1.176 CNc1ccc(c(c1)Cl)F 2230a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 4108 B10R1.176 CNc1ccc(c(c1)Cl)F 34a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 4109 B10R1.176 CNc1ccc(c(c1)Cl)F 7a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 4110 B10R1.176 CNc1ccc(c(c1)Cl)I 34a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 4111 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 4112 B10R1.176 CNc1ccc(c(c1)F)Br 2230a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 4113 B10R1.176 CNc1ccc(c(c1)F)Br 34a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 4114 B10R1.176 CNc1ccc(c(c1)F)Br 7a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 4115 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 4116 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 4117 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [1,1,0,0,0,0|2,0,0]=4 4118 B10R1.176 CNc1ccc(c(c1)F)Cl 2230a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 4119 B10R1.176 CNc1ccc(c(c1)F)Cl 34a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 4120 B10R1.176 CNc1ccc(c(c1)F)Cl 7a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 4121 B10R1.176 CNc1ccc(c(c1)F)F 2230a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 4122 B10R1.176 CNc1ccc(c(c1)F)F 34a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 4123 B10R1.176 CNc1ccc(c(c1)F)F 7a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 4124 B10R1.176 CNc1ccc(c(c1)F)I 34a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 4125 B10R1.176 CNc1ccc(c(c1)F)I 7a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 4126 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [1,1,0,0,0,0|2,0,0]=4 4127 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 4128 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 4129 B10R1.176 CNc1ccc(c(c1)I)Br 34a_100000750459_200000210301 [1,1,0,0,0,0|2,0,0]=4 4130 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 4131 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [1,1,0,0,0,0|2,0,0]=4 4132 B10R1.176 CNc1ccc(c(c1)I)Cl 34a_100012360549_200000210301 [1,1,0,0,0,0|2,0,0]=4 4133 B10R1.176 CNc1ccc(c(c1)I)F 34a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 4134 B10R1.176 CNc1ccc(c(c1)I)F 7a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 4135 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [1,1,0,0,0,0|2,0,0]=4 4136 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 4137 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [1,1,0,0,0,0|2,0,0]=4 4138 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [1,1,0,0,0,0|2,0,0]=4 4139 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 4140 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 4141 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [1,1,0,0,0,0|2,0,0]=4 4142 B10R1.176 COc1cc(c(cn1)Br)C 34a_100000766222_200000210301 [1,1,0,0,0,0|2,0,0]=4 4143 B10R1.176 COc1cc(c(cn1)Cl)C 34a_200000085746_200000210301 [1,1,0,0,0,0|2,0,0]=4 4144 B10R1.176 COc1cc(c(cn1)O)C 271570a_203496583355_100011934368 [1,1,0,0,0,0|2,0,0]=4 4145 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 4146 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,1,0,0,0,0|2,0,0]=4 4147 B10R1.176 COc1ccc(c(c1)Br)Cl 34a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 4148 B10R1.176 COc1ccc(c(c1)Br)Cl 7a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 4149 B10R1.176 COc1ccc(c(c1)Br)F 34a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 4150 B10R1.176 COc1ccc(c(c1)Br)F 7a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 4151 B10R1.176 COc1ccc(c(c1)Br)I 34a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 4152 B10R1.176 COc1ccc(c(c1)Br)I 7a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 4153 B10R1.176 COc1ccc(c(c1)Br)N 34a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 4154 B10R1.176 COc1ccc(c(c1)Br)N 7a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 4155 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [1,1,0,0,0,0|2,0,0]=4 4156 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [1,1,0,0,0,0|1,0,0]=3 4157 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [1,1,0,0,0,0|1,0,0]=3 4158 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 4159 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 4160 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [1,1,0,0,0,0|1,0,0]=3 4161 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [1,1,0,0,0,0|1,0,0]=3 4162 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [1,1,0,0,0,0|1,0,0]=3 4163 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [1,1,0,0,0,0|1,0,0]=3 4164 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [1,1,0,0,0,0|1,0,0]=3 4165 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [1,1,0,0,0,0|1,0,0]=3 4166 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [1,1,0,0,0,0|1,0,0]=3 4167 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [1,1,0,0,0,0|1,0,0]=3 4168 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [1,1,0,0,0,0|1,0,0]=3 4169 B10R1.176 COc1ccc(c(c1)Cl)Br 34a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.176 COc1ccc(c(c1)Cl)Br 7a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 4171 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 4172 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,1,0,0,0,0|2,0,0]=4 4173 B10R1.176 COc1ccc(c(c1)Cl)Cl 34a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 4174 B10R1.176 COc1ccc(c(c1)Cl)Cl 7a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 4175 B10R1.176 COc1ccc(c(c1)Cl)F 34a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 4176 B10R1.176 COc1ccc(c(c1)Cl)F 7a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 4177 B10R1.176 COc1ccc(c(c1)Cl)I 34a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 4178 B10R1.176 COc1ccc(c(c1)Cl)I 7a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 4179 B10R1.176 COc1ccc(c(c1)Cl)N 34a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 4180 B10R1.176 COc1ccc(c(c1)Cl)N 7a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 4181 B10R1.176 COc1ccc(c(c1)F)Br 34a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 4182 B10R1.176 COc1ccc(c(c1)F)Br 7a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 4183 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.176 COc1ccc(c(c1)F)Cl 34a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.176 COc1ccc(c(c1)F)Cl 7a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 4187 B10R1.176 COc1ccc(c(c1)F)F 34a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 4188 B10R1.176 COc1ccc(c(c1)F)F 7a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 4189 B10R1.176 COc1ccc(c(c1)F)I 34a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 4190 B10R1.176 COc1ccc(c(c1)F)I 7a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 4191 B10R1.176 COc1ccc(c(c1)F)N 34a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 4192 B10R1.176 COc1ccc(c(c1)F)N 7a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 4193 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [1,1,0,0,0,0|2,0,0]=4 4194 B10R1.176 COc1ccc(c(c1)I)Br 34a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 4195 B10R1.176 COc1ccc(c(c1)I)Br 7a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 4196 B10R1.176 COc1ccc(c(c1)I)Cl 34a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 4197 B10R1.176 COc1ccc(c(c1)I)Cl 7a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 4198 B10R1.176 COc1ccc(c(c1)I)N 34a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 4199 B10R1.176 COc1ccc(c(c1)I)N 7a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 4200 B10R1.176 COc1ccc(c(c1)N)Br 34a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 4201 B10R1.176 COc1ccc(c(c1)N)Br 7a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 4202 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 4203 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,1,0,0,0,0|2,0,0]=4 4204 B10R1.176 COc1ccc(c(c1)N)Cl 34a_100011934297_200000210301 [1,1,0,0,0,0|2,0,0]=4 4205 B10R1.176 COc1ccc(c(c1)N)F 34a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 4206 B10R1.176 COc1ccc(c(c1)N)F 7a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 4207 B10R1.176 COc1ccc(c(c1)N)N 34a_100025771000_200000210301 [1,1,0,0,0,0|2,0,0]=4 4208 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [1,1,0,0,0,0|2,0,0]=4 4209 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [1,1,0,0,0,0|2,0,0]=4 4210 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,1,0,0,0,0|2,0,0]=4 4211 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [1,1,0,0,0,0|2,0,0]=4 4212 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [1,1,0,0,0,0|2,0,0]=4 4213 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [1,1,0,0,0,0|2,0,0]=4 4214 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [1,1,0,0,0,0|2,0,0]=4 4215 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [1,1,0,0,0,0|2,0,0]=4 4216 B10R1.176 COc1ccc(c(n1)C)Br 34a_100000691680_200000210301 [1,1,0,0,0,0|2,0,0]=4 4217 B10R1.176 COc1ccc(c(n1)C)Cl 34a_200009863735_200000210301 [1,1,0,0,0,0|2,0,0]=4 4218 B10R1.176 COc1ccc(c(n1)C)O 271570a_203496583355_100000766551 [1,1,0,0,0,0|2,0,0]=4 4219 B10R1.176 COc1cnc(c(c1)C)Br 34a_100012000486_200000210301 [1,1,0,0,0,0|2,0,0]=4 4220 B10R1.176 COc1cnc(c(c1)C)Br 7a_100012000486_200000210301 [1,1,0,0,0,0|2,0,0]=4 4221 B10R1.176 COc1cnc(c(c1)C)C 34a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 4222 B10R1.176 COc1cnc(c(c1)C)C 7a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 4223 B10R1.176 COc1cnc(c(c1)C)Cl 34a_100012002680_200000210301 [1,1,0,0,0,0|2,0,0]=4 4224 B10R1.176 COc1cnc(c(c1)C)Cl 7a_100012002680_200000210301 [1,1,0,0,0,0|2,0,0]=4 4225 B10R1.176 COc1cnc(c(c1)C)F 34a_100000094615_200000210301 [1,1,0,0,0,0|2,0,0]=4 4226 B10R1.176 COc1cnc(c(c1)C)F 7a_100000094615_200000210301 [1,1,0,0,0,0|2,0,0]=4 4227 B10R1.176 COc1cnc(c(c1)C)O 271570a_203496583355_200009851512 [1,1,0,0,0,0|2,0,0]=4 4228 B10R1.176 CSc1cc(c(cn1)Br)C 62a_100012356354_200000210301 [1,1,0,0,0,0|2,0,0]=4 4229 B10R1.176 CSc1cc(c(cn1)Br)C 62a_200000210301_100012356354 [1,1,0,0,0,0|2,0,0]=4 4230 B10R1.176 CSc1cc(c(cn1)C)C 62a_100009850809_200000210301 [1,1,0,0,0,0|2,0,0]=4 4231 B10R1.176 CSc1cc(c(cn1)C)C 62a_200000210301_100009850809 [1,1,0,0,0,0|2,0,0]=4 4232 B10R1.176 CSc1cc(c(cn1)F)C 62a_100009818257_200000210301 [1,1,0,0,0,0|2,0,0]=4 4233 B10R1.176 CSc1cc(c(cn1)F)C 62a_200000210301_100009818257 [1,1,0,0,0,0|2,0,0]=4 4234 B10R1.176 CSc1cc(c(cn1)N)C 62a_100000067204_200000210301 [1,1,0,0,0,0|2,0,0]=4 4235 B10R1.176 CSc1cc(c(cn1)N)C 62a_200000210301_100000067204 [1,1,0,0,0,0|2,0,0]=4 4236 B10R1.176 CSc1cc(c(cn1)O)C 62a_200000210301_100000692680 [1,1,0,0,0,0|2,0,0]=4 4237 B10R1.176 CSc1ccc(=O)n(c1)C 62a_100011245003_200000210301 [1,1,0,0,0,0|2,0,0]=4 4238 B10R1.176 CSc1ccc(=O)n(c1)C 62a_200000210301_100011245003 [1,1,0,0,0,0|2,0,0]=4 4239 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_100012356285_200000210301 [1,1,0,0,0,0|2,0,0]=4 4240 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_200000210301_100012356285 [1,1,0,0,0,0|2,0,0]=4 4241 B10R1.176 CSc1ccc(c(c1)Br)C 62a_100011847877_200000210301 [1,1,0,0,0,0|2,0,0]=4 4242 B10R1.176 CSc1ccc(c(c1)Br)C 62a_200000210301_100011847877 [1,1,0,0,0,0|2,0,0]=4 4243 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_100012353702_200000210301 [1,1,0,0,0,0|2,0,0]=4 4244 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_200000210301_100012353702 [1,1,0,0,0,0|2,0,0]=4 4245 B10R1.176 CSc1ccc(c(c1)Br)F 62a_100012047266_200000210301 [1,1,0,0,0,0|2,0,0]=4 4246 B10R1.176 CSc1ccc(c(c1)Br)F 62a_200000210301_100012047266 [1,1,0,0,0,0|2,0,0]=4 4247 B10R1.176 CSc1ccc(c(c1)Br)N 62a_100000750455_200000210301 [1,1,0,0,0,0|2,0,0]=4 4248 B10R1.176 CSc1ccc(c(c1)Br)N 62a_200000210301_100000750455 [1,1,0,0,0,0|2,0,0]=4 4249 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 4250 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [1,1,0,0,0,0|2,0,0]=4 4251 B10R1.176 CSc1ccc(c(c1)C)Br 62a_100009813585_200000210301 [1,1,0,0,0,0|1,0,0]=3 4252 B10R1.176 CSc1ccc(c(c1)C)Br 62a_200000210301_100009813585 [1,1,0,0,0,0|1,0,0]=3 4253 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [1,1,0,0,0,0|1,0,0]=3 4254 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [1,1,0,0,0,0|1,0,0]=3 4255 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_100000049509_200000210301 [1,1,0,0,0,0|1,0,0]=3 4256 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_200000210301_100000049509 [1,1,0,0,0,0|1,0,0]=3 4257 B10R1.176 CSc1ccc(c(c1)C)F 62a_100011218330_200000210301 [1,1,0,0,0,0|1,0,0]=3 4258 B10R1.176 CSc1ccc(c(c1)C)F 62a_200000210301_100011218330 [1,1,0,0,0,0|1,0,0]=3 4259 B10R1.176 CSc1ccc(c(c1)C)N 62a_100000211769_200000210301 [1,1,0,0,0,0|1,0,0]=3 4260 B10R1.176 CSc1ccc(c(c1)C)N 62a_200000210301_100000211769 [1,1,0,0,0,0|1,0,0]=3 4261 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [1,1,0,0,0,0|1,0,0]=3 4262 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_100012047281_200000210301 [1,1,0,0,0,0|2,0,0]=4 4263 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_200000210301_100012047281 [1,1,0,0,0,0|2,0,0]=4 4264 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_100011216363_200000210301 [1,1,0,0,0,0|2,0,0]=4 4265 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_200000210301_100011216363 [1,1,0,0,0,0|2,0,0]=4 4266 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_100011214914_200000210301 [1,1,0,0,0,0|2,0,0]=4 4267 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_200000210301_100011214914 [1,1,0,0,0,0|2,0,0]=4 4268 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_100011215976_200000210301 [1,1,0,0,0,0|2,0,0]=4 4269 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_200000210301_100011215976 [1,1,0,0,0,0|2,0,0]=4 4270 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 4271 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_200000210301_100011218065 [1,1,0,0,0,0|2,0,0]=4 4272 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 4273 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [1,1,0,0,0,0|2,0,0]=4 4274 B10R1.176 CSc1ccc(c(c1)F)Br 62a_100000685389_200000210301 [1,1,0,0,0,0|2,0,0]=4 4275 B10R1.176 CSc1ccc(c(c1)F)Br 62a_200000210301_100000685389 [1,1,0,0,0,0|2,0,0]=4 4276 B10R1.176 CSc1ccc(c(c1)F)C 62a_100000720648_200000210301 [1,1,0,0,0,0|2,0,0]=4 4277 B10R1.176 CSc1ccc(c(c1)F)C 62a_200000210301_100000720648 [1,1,0,0,0,0|2,0,0]=4 4278 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_100011216805_200000210301 [1,1,0,0,0,0|2,0,0]=4 4279 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_200000210301_100011216805 [1,1,0,0,0,0|2,0,0]=4 4280 B10R1.176 CSc1ccc(c(c1)F)F 62a_100000703953_200000210301 [1,1,0,0,0,0|2,0,0]=4 4281 B10R1.176 CSc1ccc(c(c1)F)F 62a_200000210301_100000703953 [1,1,0,0,0,0|2,0,0]=4 4282 B10R1.176 CSc1ccc(c(c1)F)N 62a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 4283 B10R1.176 CSc1ccc(c(c1)F)N 62a_200000210301_100011215594 [1,1,0,0,0,0|2,0,0]=4 4284 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [1,1,0,0,0,0|2,0,0]=4 4285 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 4286 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [1,1,0,0,0,0|2,0,0]=4 4287 B10R1.176 CSc1ccc(c(c1)N)Br 62a_100000750456_200000210301 [1,1,0,0,0,0|2,0,0]=4 4288 B10R1.176 CSc1ccc(c(c1)N)Br 62a_200000210301_100000750456 [1,1,0,0,0,0|2,0,0]=4 4289 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,1,0,0,0,0|2,0,0]=4 4290 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,1,0,0,0,0|2,0,0]=4 4291 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000210301_200000761891 [1,1,0,0,0,0|2,0,0]=4 4292 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000761891_200000210301 [1,1,0,0,0,0|2,0,0]=4 4293 B10R1.176 CSc1ccc(c(c1)N)F 62a_100000740924_200000210301 [1,1,0,0,0,0|2,0,0]=4 4294 B10R1.176 CSc1ccc(c(c1)N)F 62a_200000210301_100000740924 [1,1,0,0,0,0|2,0,0]=4 4295 B10R1.176 CSc1ccc(c(c1)N)N 62a_100000741789_200000210301 [1,1,0,0,0,0|2,0,0]=4 4296 B10R1.176 CSc1ccc(c(c1)N)N 62a_200000210301_100011534411 [1,1,0,0,0,0|2,0,0]=4 4297 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 4298 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [1,1,0,0,0,0|2,0,0]=4 4299 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 4300 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [1,1,0,0,0,0|2,0,0]=4 4301 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [1,1,0,0,0,0|2,0,0]=4 4302 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [1,1,0,0,0,0|2,0,0]=4 4303 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 4304 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [1,1,0,0,0,0|2,0,0]=4 4305 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [1,1,0,0,0,0|2,0,0]=4 4306 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 4307 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [1,1,0,0,0,0|2,0,0]=4 4308 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 4309 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [1,1,0,0,0,0|2,0,0]=4 4310 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [1,1,0,0,0,0|2,0,0]=4 4311 B10R1.176 CSc1ccc(c(n1)C)Br 62a_100012360386_200000210301 [1,1,0,0,0,0|2,0,0]=4 4312 B10R1.176 CSc1ccc(c(n1)C)Br 62a_200000210301_100012360386 [1,1,0,0,0,0|2,0,0]=4 4313 B10R1.176 CSc1ccc(c(n1)C)C 62a_100000103781_200000210301 [1,1,0,0,0,0|2,0,0]=4 4314 B10R1.176 CSc1ccc(c(n1)C)C 62a_200000210301_100000103781 [1,1,0,0,0,0|2,0,0]=4 4315 B10R1.176 CSc1ccc(c(n1)C)F 62a_100009814307_200000210301 [1,1,0,0,0,0|2,0,0]=4 4316 B10R1.176 CSc1ccc(c(n1)C)F 62a_200000210301_100009814307 [1,1,0,0,0,0|2,0,0]=4 4317 B10R1.176 CSc1ccc(c(n1)C)N 62a_100000720120_200000210301 [1,1,0,0,0,0|2,0,0]=4 4318 B10R1.176 CSc1ccc(c(n1)C)N 62a_200000210301_100000720120 [1,1,0,0,0,0|2,0,0]=4 4319 B10R1.176 CSc1ccc(c(n1)C)O 62a_100010233687_200000210301 [1,1,0,0,0,0|2,0,0]=4 4320 B10R1.176 CSc1ccc(c(n1)C)O 62a_200000210301_100010233687 [1,1,0,0,0,0|2,0,0]=4 4321 B10R1.176 CSc1cnc(c(c1)C)Br 62a_100009816107_200000210301 [1,1,0,0,0,0|2,0,0]=4 4322 B10R1.176 CSc1cnc(c(c1)C)Br 62a_200000210301_100009816107 [1,1,0,0,0,0|2,0,0]=4 4323 B10R1.176 CSc1cnc(c(c1)C)C 62a_100000697892_200000210301 [1,1,0,0,0,0|2,0,0]=4 4324 B10R1.176 CSc1cnc(c(c1)C)C 62a_200000210301_100000697892 [1,1,0,0,0,0|2,0,0]=4 4325 B10R1.176 CSc1cnc(c(c1)C)Cl 62a_100009922867_200000210301 [1,1,0,0,0,0|2,0,0]=4 4326 B10R1.176 CSc1cnc(c(c1)C)Cl 62a_200000210301_100009922867 [1,1,0,0,0,0|2,0,0]=4 4327 B10R1.176 CSc1cnc(c(c1)C)F 62a_100000709442_200000210301 [1,1,0,0,0,0|2,0,0]=4 4328 B10R1.176 CSc1cnc(c(c1)C)F 62a_200000210301_100000709442 [1,1,0,0,0,0|2,0,0]=4 4329 B10R1.176 CSc1cnc(c(c1)C)N 62a_100000684428_200000210301 [1,1,0,0,0,0|2,0,0]=4 4330 B10R1.176 CSc1cnc(c(c1)C)N 62a_200000210301_100000684428 [1,1,0,0,0,0|2,0,0]=4 4331 B10R1.176 CSc1cnc(c(c1)C)O 271570a_203496583355_203440288091 [1,1,0,0,0,0|2,0,0]=4 4332 B10R1.176 CSc1cnc(c(c1)C)O 62a_100000685391_200000210301 [1,1,0,0,0,0|2,0,0]=4 4333 B10R1.176 CSc1cnc(c(c1)C)O 62a_200000210301_100000685391 [1,1,0,0,0,0|2,0,0]=4 4334 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 4335 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 4336 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [1,1,0,0,0,0|1,0,0]=3 4337 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [1,1,0,0,0,0|1,0,0]=3 4338 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [1,1,0,0,0,0|1,0,0]=3 4339 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_100009813585_200025704644 [1,1,0,0,0,0|1,0,0]=3 4340 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_200025704644_100009813585 [1,1,0,0,0,0|1,0,0]=3 4341 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 4342 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 4343 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [1,1,0,0,0,0|1,0,0]=3 4344 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [1,1,0,0,0,0|1,0,0]=3 4345 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [1,1,0,0,0,0|1,0,0]=3 4346 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_100000049509_200025704644 [1,1,0,0,0,0|1,0,0]=3 4347 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100000049509 [1,1,0,0,0,0|1,0,0]=3 4348 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 4349 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 4350 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [1,1,0,0,0,0|1,0,0]=3 4351 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [1,1,0,0,0,0|1,0,0]=3 4352 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [1,1,0,0,0,0|1,0,0]=3 4353 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_100011218330_200025704644 [1,1,0,0,0,0|1,0,0]=3 4354 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100011218330 [1,1,0,0,0,0|1,0,0]=3 4355 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [1,1,0,0,0,0|1,0,0]=3 4356 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [1,1,0,0,0,0|1,0,0]=3 4357 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [1,1,0,0,0,0|1,0,0]=3 4358 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [1,1,0,0,0,0|1,0,0]=3 4359 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [1,1,0,0,0,0|1,0,0]=3 4360 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [1,1,0,0,0,0|1,0,0]=3 4361 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_100000211769_200025704644 [1,1,0,0,0,0|1,0,0]=3 4362 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_200025704644_100000211769 [1,1,0,0,0,0|1,0,0]=3 4363 B10R1.176 Cc1cc(ccc1O)C#N 271570a_203496583355_100000212329 [1,1,0,0,0,0|1,0,1]=4 4364 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [1,1,0,0,0,0|0,0,0]=2 4365 B10R1.176 Cc1cc(ccc1O)CN 271570a_203496583355_100015205234 [1,1,0,0,0,0|1,0,1]=4 4366 B10R1.176 Cc1cc(ccc1O)CO 271570a_203496583355_100000718852 [1,1,0,0,0,0|0,0,2]=4 4367 B10R1.176 Cc1cc(ccc1O)NN 271570a_203496583355_100000745493 [1,1,0,0,0,0|2,0,0]=4 4368 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 4369 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [1,1,0,0,0,0|1,0,0]=3 4370 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [1,1,0,0,0,0|1,0,0]=3 4371 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 34a_100012000486_200025704644 [1,1,0,0,0,0|2,0,0]=4 4372 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 7a_100012000486_200025704644 [1,1,0,0,0,0|2,0,0]=4 4373 B10R1.176 Cc1cc(cnc1Br)S[13CH3] 62a_100009816107_200025704644 [1,1,0,0,0,0|2,0,0]=4 4374 B10R1.176 Cc1cc(cnc1Br)S[13CH3] 62a_200025704644_100009816107 [1,1,0,0,0,0|2,0,0]=4 4375 B10R1.176 Cc1cc(cnc1C)O[13CH3] 34a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 4376 B10R1.176 Cc1cc(cnc1C)O[13CH3] 7a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 4377 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_100000697892_200025704644 [1,1,0,0,0,0|2,0,0]=4 4378 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_200025704644_100000697892 [1,1,0,0,0,0|2,0,0]=4 4379 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 34a_100012002680_200025704644 [1,1,0,0,0,0|2,0,0]=4 4380 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 7a_100012002680_200025704644 [1,1,0,0,0,0|2,0,0]=4 4381 B10R1.176 Cc1cc(cnc1Cl)S[13CH3] 62a_100009922867_200025704644 [1,1,0,0,0,0|2,0,0]=4 4382 B10R1.176 Cc1cc(cnc1Cl)S[13CH3] 62a_200025704644_100009922867 [1,1,0,0,0,0|2,0,0]=4 4383 B10R1.176 Cc1cc(cnc1F)O[13CH3] 34a_100000094615_200025704644 [1,1,0,0,0,0|2,0,0]=4 4384 B10R1.176 Cc1cc(cnc1F)O[13CH3] 7a_100000094615_200025704644 [1,1,0,0,0,0|2,0,0]=4 4385 B10R1.176 Cc1cc(cnc1F)S[13CH3] 62a_100000709442_200025704644 [1,1,0,0,0,0|2,0,0]=4 4386 B10R1.176 Cc1cc(cnc1F)S[13CH3] 62a_200025704644_100000709442 [1,1,0,0,0,0|2,0,0]=4 4387 B10R1.176 Cc1cc(cnc1N)S[13CH3] 62a_100000684428_200025704644 [1,1,0,0,0,0|2,0,0]=4 4388 B10R1.176 Cc1cc(cnc1N)S[13CH3] 62a_200025704644_100000684428 [1,1,0,0,0,0|2,0,0]=4 4389 B10R1.176 Cc1cc(cnc1O)C=O 271570a_203496583355_100000070293 [1,1,0,0,0,0|1,0,0]=3 4390 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_100000685391_200025704644 [1,1,0,0,0,0|2,0,0]=4 4391 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_200025704644_100000685391 [1,1,0,0,0,0|2,0,0]=4 4392 B10R1.176 Cc1cc(ncc1Br)O[13CH3] 34a_100000766222_200025704644 [1,1,0,0,0,0|2,0,0]=4 4393 B10R1.176 Cc1cc(ncc1Br)S[13CH3] 62a_100012356354_200025704644 [1,1,0,0,0,0|2,0,0]=4 4394 B10R1.176 Cc1cc(ncc1Br)S[13CH3] 62a_200025704644_100012356354 [1,1,0,0,0,0|2,0,0]=4 4395 B10R1.176 Cc1cc(ncc1Cl)O[13CH3] 34a_200000085746_200025704644 [1,1,0,0,0,0|2,0,0]=4 4396 B10R1.176 Cc1cc(ncc1F)S[13CH3] 62a_100009818257_200025704644 [1,1,0,0,0,0|2,0,0]=4 4397 B10R1.176 Cc1cc(ncc1F)S[13CH3] 62a_200025704644_100009818257 [1,1,0,0,0,0|2,0,0]=4 4398 B10R1.176 Cc1cc(ncc1N)S[13CH3] 62a_100000067204_200025704644 [1,1,0,0,0,0|2,0,0]=4 4399 B10R1.176 Cc1cc(ncc1N)S[13CH3] 62a_200025704644_100000067204 [1,1,0,0,0,0|2,0,0]=4 4400 B10R1.176 Cc1cc(ncc1O)C=O 271570a_203496583355_100009814806 [1,1,0,0,0,0|1,0,0]=3 4401 B10R1.176 Cc1cc(ncc1O)S[13CH3] 62a_200025704644_100000692680 [1,1,0,0,0,0|2,0,0]=4 4402 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 4403 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 4404 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [1,1,0,0,0,0|2,0,0]=4 4405 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 4406 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,1,0,0,0,0|2,0,0]=4 4407 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_100011847877_200025704644 [1,1,0,0,0,0|2,0,0]=4 4408 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011847877 [1,1,0,0,0,0|2,0,0]=4 4409 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 4410 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 4411 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 4412 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 4413 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 4414 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [1,1,0,0,0,0|1,0,0]=3 4415 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [1,1,0,0,0,0|1,0,0]=3 4416 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 4417 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 4418 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [1,1,0,0,0,0|2,0,0]=4 4419 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 4420 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,1,0,0,0,0|2,0,0]=4 4421 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_100011216363_200025704644 [1,1,0,0,0,0|2,0,0]=4 4422 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011216363 [1,1,0,0,0,0|2,0,0]=4 4423 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 4424 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 4425 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [1,1,0,0,0,0|2,0,0]=4 4426 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 4427 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,1,0,0,0,0|2,0,0]=4 4428 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_100000720648_200025704644 [1,1,0,0,0,0|2,0,0]=4 4429 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000720648 [1,1,0,0,0,0|2,0,0]=4 4430 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 4431 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [1,1,0,0,0,0|2,0,0]=4 4432 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 4433 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,1,0,0,0,0|2,0,0]=4 4434 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,1,0,0,0,0|2,0,0]=4 4435 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,1,0,0,0,0|2,0,0]=4 4436 B10R1.176 Cc1ccc(cc1O)C=O 271570a_203496583355_100000695567 [1,1,0,0,0,0|1,0,0]=3 4437 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 4438 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [1,1,0,0,0,0|2,0,0]=4 4439 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [1,1,0,0,0,0|2,0,0]=4 4440 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [1,1,0,0,0,0|2,0,0]=4 4441 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_100000103781_200025704644 [1,1,0,0,0,0|2,0,0]=4 4442 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_200025704644_100000103781 [1,1,0,0,0,0|2,0,0]=4 4443 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_100009850809_200025704644 [1,1,0,0,0,0|2,0,0]=4 4444 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_200025704644_100009850809 [1,1,0,0,0,0|2,0,0]=4 4445 B10R1.176 Cc1cnc(cc1O)C=O 271570a_203496583355_100010174032 [1,1,0,0,0,0|2,0,0]=4 4446 B10R1.176 Cc1nc(ccc1Br)O[13CH3] 34a_100000691680_200025704644 [1,1,0,0,0,0|2,0,0]=4 4447 B10R1.176 Cc1nc(ccc1Br)S[13CH3] 62a_100012360386_200025704644 [1,1,0,0,0,0|2,0,0]=4 4448 B10R1.176 Cc1nc(ccc1Br)S[13CH3] 62a_200025704644_100012360386 [1,1,0,0,0,0|2,0,0]=4 4449 B10R1.176 Cc1nc(ccc1Cl)O[13CH3] 34a_200009863735_200025704644 [1,1,0,0,0,0|2,0,0]=4 4450 B10R1.176 Cc1nc(ccc1F)S[13CH3] 62a_100009814307_200025704644 [1,1,0,0,0,0|2,0,0]=4 4451 B10R1.176 Cc1nc(ccc1F)S[13CH3] 62a_200025704644_100009814307 [1,1,0,0,0,0|2,0,0]=4 4452 B10R1.176 Cc1nc(ccc1N)S[13CH3] 62a_100000720120_200025704644 [1,1,0,0,0,0|2,0,0]=4 4453 B10R1.176 Cc1nc(ccc1N)S[13CH3] 62a_200025704644_100000720120 [1,1,0,0,0,0|2,0,0]=4 4454 B10R1.176 Cc1nc(ccc1O)C=O 271570a_203496583355_100010238520 [1,1,0,0,0,0|1,0,0]=3 4455 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_100010233687_200025704644 [1,1,0,0,0,0|2,0,0]=4 4456 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_200025704644_100010233687 [1,1,0,0,0,0|2,0,0]=4 4457 B10R1.176 Cn1cc(ccc1=O)S[13CH3] 62a_100011245003_200025704644 [1,1,0,0,0,0|2,0,0]=4 4458 B10R1.176 Cn1cc(ccc1=O)S[13CH3] 62a_200025704644_100011245003 [1,1,0,0,0,0|2,0,0]=4 4459 B10R1.176 Nc1ncc(cc1O)C=O 271570a_203496583355_100010064899 [1,1,0,0,0,0|2,0,0]=4 4460 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [1,1,0,0,0,0|1,0,0]=3 4461 B10R1.176 O=Cc1ccc(c(c1)O)Br 271570a_203496583355_100010146563 [1,1,0,0,0,0|1,0,0]=3 4462 B10R1.176 O=Cc1ccc(c(c1)O)Cl 271570a_203496583355_100010209939 [1,1,0,0,0,0|1,0,0]=3 4463 B10R1.176 O=Cc1ccc(c(c1)O)F 271570a_203496583355_100000211747 [1,1,0,0,0,0|1,0,0]=3 4464 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [1,1,0,0,0,0|1,0,0]=3 4465 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [1,1,0,0,0,0|1,0,0]=3 4466 B10R1.176 O=Cc1cnc(c(c1)F)O 271570a_203496583355_100009866847 [1,1,0,0,0,0|2,0,0]=4 4467 B10R1.176 O=Cc1cnc(c(c1)O)O 271570a_203496583355_100010064886 [1,1,0,0,0,0|2,0,0]=4 4468 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 2230a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 4469 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 34a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 4470 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 7a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 4471 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 2230a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 4472 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 34a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 4473 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 2230a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 4474 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 34a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 4475 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 7a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 4476 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)I 34a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 4477 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 4478 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 2230a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 4479 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 34a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 4480 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 7a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 4481 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 4482 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 34a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 4483 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 2230a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 4484 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 34a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 4485 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 7a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 4486 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)I 34a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 4487 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 4488 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 2230a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 4489 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 34a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 4490 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 7a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 4491 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 2230a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 4492 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 34a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 4493 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 7a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 4494 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 2230a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 4495 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 34a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 4496 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 7a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 4497 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 34a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 4498 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 7a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 4499 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 4500 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 4501 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Br 34a_100000750459_200025704644 [1,1,0,0,0,0|2,0,0]=4 4502 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Cl 34a_100012360549_200025704644 [1,1,0,0,0,0|2,0,0]=4 4503 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 34a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 4504 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 7a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 4505 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [1,1,0,0,0,0|2,0,0]=4 4506 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 4507 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 4508 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [1,1,0,0,0,0|2,0,0]=4 4509 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 34a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 4510 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 7a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 4511 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 34a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 4512 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 7a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 4513 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 34a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 4514 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 7a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 4515 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 34a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 4516 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 7a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 4517 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 34a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 4518 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 7a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 4519 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 34a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 4520 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 7a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 4521 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 34a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 4522 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 7a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 4523 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 34a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 4524 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 7a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 4525 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 34a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 4526 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 7a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 4527 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 34a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 4528 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 7a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 4529 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 34a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 4530 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 7a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 4531 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 34a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 4532 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 7a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 4533 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 34a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 4534 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 7a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 4535 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 34a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 4536 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 7a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 4537 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 34a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 4538 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 7a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 4539 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 34a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 4540 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 7a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 4541 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 34a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 4542 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 7a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 4543 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 34a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 4544 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 7a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 4545 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Cl 34a_100011934297_200025704644 [1,1,0,0,0,0|2,0,0]=4 4546 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 34a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 4547 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 7a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 4548 B10R1.176 [13CH3]Oc1ccc(c(c1)N)N 34a_100025771000_200025704644 [1,1,0,0,0,0|2,0,0]=4 4549 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_100012356285_200025704644 [1,1,0,0,0,0|2,0,0]=4 4550 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_200025704644_100012356285 [1,1,0,0,0,0|2,0,0]=4 4551 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_100012353702_200025704644 [1,1,0,0,0,0|2,0,0]=4 4552 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_200025704644_100012353702 [1,1,0,0,0,0|2,0,0]=4 4553 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_100012047266_200025704644 [1,1,0,0,0,0|2,0,0]=4 4554 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_200025704644_100012047266 [1,1,0,0,0,0|2,0,0]=4 4555 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_100000750455_200025704644 [1,1,0,0,0,0|2,0,0]=4 4556 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_200025704644_100000750455 [1,1,0,0,0,0|2,0,0]=4 4557 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 4558 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [1,1,0,0,0,0|2,0,0]=4 4559 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_100012047281_200025704644 [1,1,0,0,0,0|2,0,0]=4 4560 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_200025704644_100012047281 [1,1,0,0,0,0|2,0,0]=4 4561 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_100011214914_200025704644 [1,1,0,0,0,0|2,0,0]=4 4562 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_200025704644_100011214914 [1,1,0,0,0,0|2,0,0]=4 4563 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_100011215976_200025704644 [1,1,0,0,0,0|2,0,0]=4 4564 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_200025704644_100011215976 [1,1,0,0,0,0|2,0,0]=4 4565 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 4566 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_200025704644_100011218065 [1,1,0,0,0,0|2,0,0]=4 4567 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 4568 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [1,1,0,0,0,0|2,0,0]=4 4569 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_100000685389_200025704644 [1,1,0,0,0,0|2,0,0]=4 4570 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_200025704644_100000685389 [1,1,0,0,0,0|2,0,0]=4 4571 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_100011216805_200025704644 [1,1,0,0,0,0|2,0,0]=4 4572 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_200025704644_100011216805 [1,1,0,0,0,0|2,0,0]=4 4573 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_100000703953_200025704644 [1,1,0,0,0,0|2,0,0]=4 4574 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_200025704644_100000703953 [1,1,0,0,0,0|2,0,0]=4 4575 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 4576 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_200025704644_100011215594 [1,1,0,0,0,0|2,0,0]=4 4577 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 4578 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [1,1,0,0,0,0|2,0,0]=4 4579 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_100000750456_200025704644 [1,1,0,0,0,0|2,0,0]=4 4580 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_200025704644_100000750456 [1,1,0,0,0,0|2,0,0]=4 4581 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200000761891_200025704644 [1,1,0,0,0,0|2,0,0]=4 4582 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200025704644_200000761891 [1,1,0,0,0,0|2,0,0]=4 4583 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_100000740924_200025704644 [1,1,0,0,0,0|2,0,0]=4 4584 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_200025704644_100000740924 [1,1,0,0,0,0|2,0,0]=4 4585 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_100000741789_200025704644 [1,1,0,0,0,0|2,0,0]=4 4586 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_200025704644_100011534411 [1,1,0,0,0,0|2,0,0]=4 4587 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 4588 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [1,1,0,0,0,0|2,0,0]=4 4589 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 4590 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [1,1,0,0,0,0|2,0,0]=4 4591 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 4592 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [1,1,0,0,0,0|2,0,0]=4 4593 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 4594 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [1,1,0,0,0,0|2,0,0]=4 4595 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 4596 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [1,1,0,0,0,0|2,0,0]=4 4597 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [1,1,0,0,0,0|2,0,0]=4 4598 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [1,1,0,0,0,0|2,0,0]=4 4599 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [1,1,0,0,0,0|2,0,0]=4 4600 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,1,0,0,0,0|1,0,0]=3 4601 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,1,0,0,0,0|1,0,0]=3 4602 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,1,0,0,0,0|1,0,0]=3 4603 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,1,0,0,0,0|1,0,0]=3 4604 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,1,0,0,0,0|1,0,0]=3 4605 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,1,0,0,0,0|1,0,0]=3 4606 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,1,0,0,0,0|1,0,0]=3 4607 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [1,1,0,0,0,0|2,0,0]=4 4608 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [1,1,0,0,0,0|2,0,0]=4 4609 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [1,1,0,0,0,0|2,0,0]=4 4610 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [1,1,0,0,0,0|2,0,0]=4 4611 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [1,1,0,0,0,0|2,0,0]=4 4612 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,1,0,0,0,0|2,0,0]=4 4613 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [1,1,0,0,0,0|2,0,0]=4 4614 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [1,1,0,0,0,0|2,0,0]=4 4615 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [1,1,0,0,0,0|2,0,0]=4 4616 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [1,1,0,0,0,0|2,0,0]=4 4617 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [1,1,0,0,0,0|2,0,0]=4 4618 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,1,0,0,0,0|0,0,0]=2 4619 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,1,0,0,0,0|0,0,0]=2 4620 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,1,0,0,0,0|0,0,0]=2 4621 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,1,0,0,0,0|0,0,0]=2 4622 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,1,0,0,0,0|0,0,0]=2 4623 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,1,0,0,0,0|0,0,0]=2 4624 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,1,0,0,0,0|0,0,0]=2 4625 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,1,0,0,0,0|1,0,0]=3 4626 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,1,0,0,0,0|1,0,0]=3 4627 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [1,1,0,0,0,0|2,0,0]=4 4628 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [1,1,0,0,0,0|2,0,0]=4 4629 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [1,1,0,0,0,0|2,0,0]=4 4630 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,1,0,0,0,0|1,0,1]=4 4631 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,1,0,0,0,0|0,0,2]=4 4632 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4633 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4634 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [1,1,0,0,0,0|2,0,0]=4 4635 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4636 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4637 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [1,1,0,0,0,0|2,0,0]=4 4638 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4639 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4640 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [1,1,0,0,0,0|2,0,0]=4 4641 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4642 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4643 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [1,1,0,0,0,0|2,0,0]=4 4644 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,1,0,0,0,0|2,0,0]=4 4645 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,1,0,0,0,0|2,0,0]=4 4646 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,1,0,0,0,0|2,0,0]=4 4647 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4648 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4649 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [1,1,0,0,0,0|2,0,0]=4 4650 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4651 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4652 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [1,1,0,0,0,0|2,0,0]=4 4653 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4654 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4655 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [1,1,0,0,0,0|2,0,0]=4 4656 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4657 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4658 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [1,1,0,0,0,0|2,0,0]=4 4659 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,1,0,0,0,0|2,0,0]=4 4660 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,1,0,0,0,0|2,0,0]=4 4661 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,1,0,0,0,0|1,0,0]=3 4662 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,1,0,0,0,0|1,0,1]=4 4663 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,1,0,0,0,0|1,0,1]=4 4664 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,1,0,0,0,0|0,0,0]=2 4665 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4666 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4667 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,1,0,0,0,0|2,0,0]=4 4668 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4669 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4670 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,1,0,0,0,0|2,0,0]=4 4671 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,1,0,0,0,0|1,0,0]=3 4672 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,1,0,0,0,0|2,0,0]=4 4673 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,1,0,0,0,0|2,0,0]=4 4674 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,1,0,0,0,0|0,0,0]=2 4675 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,1,0,0,0,0|0,0,0]=2 4676 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,1,0,0,0,0|0,0,0]=2 4677 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,1,0,0,0,0|0,0,0]=2 4678 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,1,0,0,0,0|0,0,0]=2 4679 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|0,1,1]=4 4680 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|0,1,1]=4 4681 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|0,0,0]=2 4682 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|2,0,0]=4 4683 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 4684 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|2,0,0]=4 4685 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 4686 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|2,0,0]=4 4687 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 4688 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 4689 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 4690 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 4691 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 4692 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 4693 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|0,0,0]=2 4694 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 4695 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 4696 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 4697 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 4698 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,1]=4 4699 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,1]=4 4700 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 4701 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,1]=4 4702 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|0,0,2]=4 4703 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|0,0,2]=4 4704 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|0,0,2]=4 4705 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|0,1,1]=4 4706 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|0,1,1]=4 4707 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,1]=4 4708 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|0,0,2]=4 4709 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|0,0,2]=4 4710 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,1,0,0,0,0|0,0,0]=2 4711 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [1,1,0,0,0,0|2,0,0]=4 4712 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [1,1,0,0,0,0|2,0,0]=4 4713 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [1,1,0,0,0,0|2,0,0]=4 4714 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [1,1,0,0,0,0|2,0,0]=4 4715 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [1,1,0,0,0,0|2,0,0]=4 4716 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,0]=3 4717 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,0]=3 4718 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,0]=3 4719 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,0]=3 4720 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,0]=3 4721 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|1,0,0]=3 4722 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,1,0,0,0,0|2,0,0]=4 4723 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,1,0,0,0,0|2,0,0]=4 4724 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,1,0,0,0,0|2,0,0]=4 4725 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,1,0,0,0,0|2,0,0]=4 4726 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,1,0,0,0,0|2,0,0]=4 4727 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [1,1,0,0,0,0|2,0,0]=4 4728 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [1,1,0,0,0,0|2,0,0]=4 4729 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [1,1,0,0,0,0|2,0,0]=4 4730 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [1,1,0,0,0,0|2,0,0]=4 4731 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,1,0,0,0,0|2,0,0]=4 4732 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|2,0,0]=4 4733 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [1,1,0,0,0,0|2,0,0]=4 4734 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [1,1,0,0,0,0|2,0,0]=4 4735 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [1,1,0,0,0,0|2,0,0]=4 4736 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [1,1,0,0,0,0|2,0,0]=4 4737 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,1,0,0,0,0|2,0,0]=4 4738 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,1,0,0,0,0|2,0,0]=4 4739 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,1,0,0,0,0|2,0,0]=4 4740 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,1,0,0,0,0|2,0,0]=4 4741 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,1,0,0,0,0|2,0,0]=4 4742 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,1,0,0,0,0|2,0,0]=4 4743 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|2,0,0]=4 4744 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|0,0,0]=2 4745 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|0,0,0]=2 4746 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|0,0,0]=2 4747 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|0,0,0]=2 4748 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|0,0,0]=2 4749 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,0]=2 4750 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,0]=2 4751 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,0]=2 4752 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,0]=3 4753 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,0]=3 4754 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,0]=3 4755 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,0]=3 4756 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,1,0,0,0,0|2,0,0]=4 4757 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|1,0,1]=4 4758 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|1,0,1]=4 4759 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,2]=4 4760 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 4761 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 4762 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 4763 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 4764 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 4765 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 4766 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 4767 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 4768 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 4769 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 4770 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|2,0,0]=4 4771 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|2,0,0]=4 4772 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 4773 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 4774 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 4775 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 4776 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 4777 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 4778 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 4779 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 4780 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 4781 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 4782 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|2,0,0]=4 4783 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,0]=3 4784 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|0,0,0]=2 4785 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 4786 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 4787 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 4788 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 4789 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 4790 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 4791 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|1,0,0]=3 4792 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,1,0,0,0,0|2,0,0]=4 4793 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,1,0,0,0,0|2,0,0]=4 4794 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,1,0,0,0,0|2,0,0]=4 4795 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,1,0,0,0,0|2,0,0]=4 4796 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|0,0,0]=2 4797 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|0,0,0]=2 4798 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|0,0,0]=2 4799 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|0,0,0]=2 4800 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,0]=2 4801 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,0]=2 4802 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,1,0,0,1,0|2,0,0]=4 4803 B10R1.14 CNC(=O)c1ccc(o1)O 271570a_203496583355_100000159859 [0,1,0,0,1,0|2,0,0]=4 4804 B10R1.14 CNC(=O)c1ccc(s1)O 271570a_203496583355_200000155069 [0,1,0,0,1,0|2,0,0]=4 4805 B10R1.14 COC(=O)c1c[nH]c(c1)O 271570a_203496583355_100009840242 [0,1,0,0,1,0|2,0,0]=4 4806 B10R1.14 COC(=O)c1cc(co1)O 271570a_203496583355_100009992624 [0,1,0,0,1,0|2,0,0]=4 4807 B10R1.14 COC(=O)c1cc(cs1)O 271570a_203496583355_100009815473 [0,1,0,0,1,0|2,0,0]=4 4808 B10R1.14 COC(=O)c1ccc([nH]1)O 271570a_203496583355_100000687774 [0,1,0,0,1,0|2,0,0]=4 4809 B10R1.14 COC(=O)c1ccc(o1)O 271570a_203496583355_100000148852 [0,1,0,0,1,0|2,0,0]=4 4810 B10R1.14 COC(=O)c1ccc(s1)O 271570a_203496583355_100000148107 [0,1,0,0,1,0|2,0,0]=4 4811 B10R1.14 COC(=O)c1csc(c1)O 271570a_203496583355_100000692058 [0,1,0,0,1,0|2,0,0]=4 4812 B10R1.31 C=C(C)c1ccc(o1)CN 271570a_100000694244_100000708654 [0,1,0,0,1,0|2,0,0]=4 4813 B10R1.31 C=C(C)c1ccc(o1)CO 271570a_100000694244_100000246276 [0,1,0,0,1,0|2,0,0]=4 4814 B10R1.31 C=C(C)c1ccc(s1)CC 271570a_100000694244_100009844052 [0,1,0,0,1,0|2,0,0]=4 4815 B10R1.31 C=C(C)c1ccc(s1)CN 271570a_100000694244_100000737305 [0,1,0,0,1,0|2,0,0]=4 4816 B10R1.31 C=C(C)c1ccc(s1)CO 271570a_100000694244_100000246291 [0,1,0,0,1,0|2,0,0]=4 4817 B10R1.31 C=C(C)c1csc(c1)CC 271570a_100000694244_100009846239 [0,1,0,0,1,0|2,0,0]=4 4818 B10R1.31 C=C(C)c1csc(c1)CO 271570a_100000694244_100000238369 [0,1,0,0,1,0|2,0,0]=4 4819 B10R1.31 C=C(C)c1csc(c1)SC 271570a_100000694244_200010256830 [0,1,0,0,1,0|2,0,0]=4 4820 B10R1.31 C=Cc1cc(cs1)C(=O)C 271570a_100011290941_200012344231 [0,1,0,0,1,0|1,0,1]=4 4821 B10R1.31 C=Cc1ccc([nH]1)C(=O)C 271570a_100011290941_200010494458 [0,1,0,0,1,0|1,0,1]=4 4822 B10R1.31 C=Cc1ccc(o1)C(=O)C 271570a_100011290941_100000229899 [0,1,0,0,1,0|1,0,1]=4 4823 B10R1.31 C=Cc1ccc(s1)C(=O)C 271570a_100011290941_100000183331 [0,1,0,0,1,0|1,0,1]=4 4824 B10R1.31 C=Cc1csc(c1)C(=O)C 271570a_100011290941_100000718618 [0,1,0,0,1,0|1,0,1]=4 4825 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_100000718618_200025704644 [0,1,0,0,1,0|1,0,0]=3 4826 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100000718618 [0,1,0,0,1,0|1,0,0]=3 4827 B10R1.31 CC(=O)c1ccc([nH]1)S[13CH3] 62a_200010494458_200025704644 [0,1,0,0,1,0|1,0,0]=3 4828 B10R1.31 CC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000229899 [0,1,0,0,1,0|1,0,0]=3 4829 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_100000183331_200025704644 [0,1,0,0,1,0|1,0,0]=3 4830 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000034408 [0,1,0,0,1,0|1,0,0]=3 4831 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200010173910_200025704644 [0,1,0,0,1,0|2,0,0]=4 4832 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200025704644_200010173910 [0,1,0,0,1,0|2,0,0]=4 4833 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200012344231_200025704644 [0,1,0,0,1,0|1,0,0]=3 4834 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200025704644_200012344231 [0,1,0,0,1,0|1,0,0]=3 4835 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_100010231720_200025704644 [0,1,0,0,1,0|2,0,0]=4 4836 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_200025704644_100010231720 [0,1,0,0,1,0|2,0,0]=4 4837 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_100000693680_200025704644 [0,1,0,0,1,0|2,0,0]=4 4838 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_200025704644_100000693680 [0,1,0,0,1,0|2,0,0]=4 4839 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_100010205889_200025704644 [0,1,0,0,1,0|2,0,0]=4 4840 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_200025704644_100010205889 [0,1,0,0,1,0|2,0,0]=4 4841 B10R1.31 CNc1ncc(s1)C(=O)C 27a_100102657272_200010173910 [0,1,0,0,1,0|2,0,0]=4 4842 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_100000229580_200000210301 [0,1,0,0,1,0|2,0,0]=4 4843 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_200000210301_100000229580 [0,1,0,0,1,0|2,0,0]=4 4844 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200000210301_200012344231 [0,1,0,0,1,0|1,0,0]=3 4845 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200012344231_200000210301 [0,1,0,0,1,0|1,0,0]=3 4846 B10R1.31 CSc1cc(cs1)C(=O)N 62a_100000747962_200000210301 [0,1,0,0,1,0|2,0,0]=4 4847 B10R1.31 CSc1cc(cs1)C(=O)N 62a_200000210301_100000747962 [0,1,0,0,1,0|2,0,0]=4 4848 B10R1.31 CSc1ccc([nH]1)C(=O)C 62a_200010494458_200000210301 [0,1,0,0,1,0|1,0,0]=3 4849 B10R1.31 CSc1ccc(o1)C(=O)C 62a_200000210301_100000229899 [0,1,0,0,1,0|1,0,0]=3 4850 B10R1.31 CSc1ccc(s1)C(=O)C 62a_100000183331_200000210301 [0,1,0,0,1,0|1,0,0]=3 4851 B10R1.31 CSc1ccc(s1)C(=O)C 62a_200000210301_200000034408 [0,1,0,0,1,0|1,0,0]=3 4852 B10R1.31 CSc1ccc(s1)C(=O)N 62a_100000162267_200000210301 [0,1,0,0,1,0|2,0,0]=4 4853 B10R1.31 CSc1cnc(s1)C(=O)C 62a_100000693680_200000210301 [0,1,0,0,1,0|2,0,0]=4 4854 B10R1.31 CSc1cnc(s1)C(=O)C 62a_200000210301_100000693680 [0,1,0,0,1,0|2,0,0]=4 4855 B10R1.31 CSc1cnn(c1)C(=O)C 62a_100010205889_200000210301 [0,1,0,0,1,0|2,0,0]=4 4856 B10R1.31 CSc1cnn(c1)C(=O)C 62a_200000210301_100010205889 [0,1,0,0,1,0|2,0,0]=4 4857 B10R1.31 CSc1coc(c1)C(=O)N 62a_200000210301_200009817131 [0,1,0,0,1,0|2,0,0]=4 4858 B10R1.31 CSc1coc(c1)C(=O)N 62a_200009817131_200000210301 [0,1,0,0,1,0|2,0,0]=4 4859 B10R1.31 CSc1csc(c1)C(=O)C 62a_100000718618_200000210301 [0,1,0,0,1,0|1,0,0]=3 4860 B10R1.31 CSc1csc(c1)C(=O)C 62a_200000210301_100000718618 [0,1,0,0,1,0|1,0,0]=3 4861 B10R1.31 CSc1csc(c1)C(=O)N 62a_100009812991_200000210301 [0,1,0,0,1,0|2,0,0]=4 4862 B10R1.31 CSc1csc(c1)C(=O)N 62a_200000210301_100009812991 [0,1,0,0,1,0|2,0,0]=4 4863 B10R1.31 CSc1csc(n1)C(=O)C 62a_100010231720_200000210301 [0,1,0,0,1,0|2,0,0]=4 4864 B10R1.31 CSc1csc(n1)C(=O)C 62a_200000210301_100010231720 [0,1,0,0,1,0|2,0,0]=4 4865 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200000210301_200010173910 [0,1,0,0,1,0|2,0,0]=4 4866 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200010173910_200000210301 [0,1,0,0,1,0|2,0,0]=4 4867 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_100000229580_200025704644 [0,1,0,0,1,0|2,0,0]=4 4868 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_200025704644_100000229580 [0,1,0,0,1,0|2,0,0]=4 4869 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_100000747962_200025704644 [0,1,0,0,1,0|2,0,0]=4 4870 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_200025704644_100000747962 [0,1,0,0,1,0|2,0,0]=4 4871 B10R1.31 [13CH3]Sc1ccc(s1)C(=O)N 62a_100000162267_200025704644 [0,1,0,0,1,0|2,0,0]=4 4872 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200009817131_200025704644 [0,1,0,0,1,0|2,0,0]=4 4873 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200025704644_200009817131 [0,1,0,0,1,0|2,0,0]=4 4874 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_100009812991_200025704644 [0,1,0,0,1,0|2,0,0]=4 4875 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_200025704644_100009812991 [0,1,0,0,1,0|2,0,0]=4 4876 B10R1.58 C=C(C)c1cc(c(s1)C)C 271570a_100000694244_100009850898 [0,1,0,0,1,0|2,0,0]=4 4877 B10R1.58 CC(=O)c1cc(c(s1)O)C 271570a_203496583355_100000729792 [0,1,0,0,1,0|1,0,0]=3 4878 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,1,0,0,1,0|2,0,0]=4 4879 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,1,0,0,1,0|2,0,0]=4 4880 B10R1.194 C=C(C)c1csc(c1C)C 271570a_100000694244_100009820295 [0,1,0,0,1,0|2,0,0]=4 4881 B10R1.194 CC(=O)c1c[nH]c(c1C)O 271570a_203496583355_200010235672 [0,1,0,0,1,0|2,0,0]=4 4882 B10R1.39 C=C(C)c1ccsc1CO 271570a_100000694244_100000702026 [0,1,0,0,1,0|2,0,0]=4 4883 B10R1.39 C=C(C)c1ccsc1SC 271570a_100000694244_200010341309 [0,1,0,0,1,0|2,0,0]=4 4884 B10R1.39 C=C(C)c1cscc1CC 271570a_100000694244_100011068457 [0,1,0,0,1,0|2,0,0]=4 4885 B10R1.39 C=C(C)c1cscc1CO 271570a_100000694244_100000724555 [0,1,0,0,1,0|2,0,0]=4 4886 B10R1.39 C=C(C)c1sccc1CC 271570a_100000694244_200009875468 [0,1,0,0,1,0|2,0,0]=4 4887 B10R1.39 C=C(C)c1sccc1CN 271570a_100000694244_100000727803 [0,1,0,0,1,0|2,0,0]=4 4888 B10R1.39 C=C(C)c1sccc1CO 271570a_100000694244_100009816922 [0,1,0,0,1,0|2,0,0]=4 4889 B10R1.39 C=Cc1ccsc1C(=O)C 271570a_100011290941_100000738688 [0,1,0,0,1,0|1,0,1]=4 4890 B10R1.39 CC(=O)c1sccc1S[13CH3] 62a_100000738688_200025704644 [0,1,0,0,1,0|1,0,0]=3 4891 B10R1.39 CC(=O)c1scnc1S[13CH3] 62a_200010339033_200025704644 [0,1,0,0,1,0|2,0,0]=4 4892 B10R1.39 CC(=O)c1scnc1S[13CH3] 62a_200025704644_200010339033 [0,1,0,0,1,0|2,0,0]=4 4893 B10R1.39 CSc1ccsc1C(=O)C 62a_100000738688_200000210301 [0,1,0,0,1,0|1,0,0]=3 4894 B10R1.39 CSc1cscc1C(=O)N 62a_100009817205_200000210301 [0,1,0,0,1,0|2,0,0]=4 4895 B10R1.39 CSc1cscc1C(=O)N 62a_200000210301_100009817205 [0,1,0,0,1,0|2,0,0]=4 4896 B10R1.39 CSc1ncsc1C(=O)C 62a_200000210301_200010339033 [0,1,0,0,1,0|2,0,0]=4 4897 B10R1.39 CSc1ncsc1C(=O)C 62a_200010339033_200000210301 [0,1,0,0,1,0|2,0,0]=4 4898 B10R1.39 [13CH3]Sc1cscc1C(=O)N 62a_100009817205_200025704644 [0,1,0,0,1,0|2,0,0]=4 4899 B10R1.39 [13CH3]Sc1cscc1C(=O)N 62a_200025704644_100009817205 [0,1,0,0,1,0|2,0,0]=4 4900 B10R1.149 COC(=O)c1[nH]ccc1O 271570a_203496583355_100102525103 [0,1,0,0,1,0|2,0,0]=4 4901 B10R1.149 COC(=O)c1ccoc1O 271570a_203496583355_100011935261 [0,1,0,0,1,0|2,0,0]=4 4902 B10R1.149 COC(=O)c1ccsc1O 271570a_203496583355_100009822520 [0,1,0,0,1,0|2,0,0]=4 4903 B10R1.149 COC(=O)c1cscc1O 271570a_203496583355_100012351140 [0,1,0,0,1,0|2,0,0]=4 4904 B10R1.149 COC(=O)c1occc1O 271570a_203496583355_100012676306 [0,1,0,0,1,0|2,0,0]=4 4905 B10R1.149 COC(=O)c1sccc1O 271570a_203496583355_100000730364 [0,1,0,0,1,0|2,0,0]=4 4906 B10R1.192 CC(=O)c1c(cnn1C)O 271570a_203496583355_100012349272 [0,1,0,0,1,0|2,0,0]=4 4907 B12R1.19 CC(=Cc1cc(c(cn1)Br)C)C 271570a_100102525489_100012356354 [0,1,0,0,0,1|2,0,0]=4 4908 B12R1.19 CC(=Cc1cc(c(cn1)C)C)C 271570a_100102525489_100009850809 [0,1,0,0,0,1|2,0,0]=4 4909 B12R1.19 CC(=Cc1cc(c(cn1)F)C)C 271570a_100102525489_100009818257 [0,1,0,0,0,1|2,0,0]=4 4910 B12R1.19 CC(=Cc1cc(c(cn1)N)C)C 271570a_100102525489_100000765520 [0,1,0,0,0,1|2,0,0]=4 4911 B12R1.19 CC(=Cc1cc(c(cn1)O)C)C 271570a_100102525489_100000692680 [0,1,0,0,0,1|2,0,0]=4 4912 B12R1.19 CC(=Cc1ccc(=O)n(c1)C)C 271570a_100102525489_100011245003 [0,1,0,0,0,1|2,0,0]=4 4913 B12R1.19 CC(=Cc1ccc(c(c1)Br)Br)C 271570a_100102525489_100012356285 [0,1,0,0,0,1|2,0,0]=4 4914 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [0,1,0,0,0,1|2,0,0]=4 4915 B12R1.19 CC(=Cc1ccc(c(c1)Br)Cl)C 271570a_100102525489_100012353702 [0,1,0,0,0,1|2,0,0]=4 4916 B12R1.19 CC(=Cc1ccc(c(c1)Br)F)C 271570a_100102525489_100012047266 [0,1,0,0,0,1|2,0,0]=4 4917 B12R1.19 CC(=Cc1ccc(c(c1)Br)N)C 271570a_100102525489_100000750455 [0,1,0,0,0,1|2,0,0]=4 4918 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,1,0,0,0,1|2,0,0]=4 4919 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [0,1,0,0,0,1|1,0,0]=3 4920 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [0,1,0,0,0,1|1,0,0]=3 4921 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [0,1,0,0,0,1|1,0,0]=3 4922 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [0,1,0,0,0,1|1,0,0]=3 4923 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [0,1,0,0,0,1|1,0,0]=3 4924 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,1,0,0,0,1|1,0,0]=3 4925 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Br)C 271570a_100102525489_100012047281 [0,1,0,0,0,1|2,0,0]=4 4926 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [0,1,0,0,0,1|2,0,0]=4 4927 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Cl)C 271570a_100102525489_100011214914 [0,1,0,0,0,1|2,0,0]=4 4928 B12R1.19 CC(=Cc1ccc(c(c1)Cl)F)C 271570a_100102525489_100011215976 [0,1,0,0,0,1|2,0,0]=4 4929 B12R1.19 CC(=Cc1ccc(c(c1)Cl)N)C 271570a_100102525489_100011218065 [0,1,0,0,0,1|2,0,0]=4 4930 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,1,0,0,0,1|2,0,0]=4 4931 B12R1.19 CC(=Cc1ccc(c(c1)F)Br)C 271570a_100102525489_100000685389 [0,1,0,0,0,1|2,0,0]=4 4932 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [0,1,0,0,0,1|2,0,0]=4 4933 B12R1.19 CC(=Cc1ccc(c(c1)F)Cl)C 271570a_100102525489_100011216805 [0,1,0,0,0,1|2,0,0]=4 4934 B12R1.19 CC(=Cc1ccc(c(c1)F)F)C 271570a_100102525489_100000750028 [0,1,0,0,0,1|2,0,0]=4 4935 B12R1.19 CC(=Cc1ccc(c(c1)F)N)C 271570a_100102525489_100011215594 [0,1,0,0,0,1|2,0,0]=4 4936 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,1,0,0,0,1|2,0,0]=4 4937 B12R1.19 CC(=Cc1ccc(c(c1)N)Br)C 271570a_100102525489_100000750456 [0,1,0,0,0,1|2,0,0]=4 4938 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [0,1,0,0,0,1|2,0,0]=4 4939 B12R1.19 CC(=Cc1ccc(c(c1)N)Cl)C 271570a_100102525489_200000761891 [0,1,0,0,0,1|2,0,0]=4 4940 B12R1.19 CC(=Cc1ccc(c(c1)N)F)C 271570a_100102525489_100000740924 [0,1,0,0,0,1|2,0,0]=4 4941 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C 271570a_100102525489_100000741789 [0,1,0,0,0,1|2,0,0]=4 4942 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,1,0,0,0,1|2,0,0]=4 4943 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [0,1,0,0,0,1|2,0,0]=4 4944 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [0,1,0,0,0,1|2,0,0]=4 4945 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [0,1,0,0,0,1|2,0,0]=4 4946 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [0,1,0,0,0,1|2,0,0]=4 4947 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [0,1,0,0,0,1|2,0,0]=4 4948 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,1,0,0,0,1|2,0,0]=4 4949 B12R1.19 CC(=Cc1ccc(c(n1)C)Br)C 271570a_100102525489_100012360386 [0,1,0,0,0,1|2,0,0]=4 4950 B12R1.19 CC(=Cc1ccc(c(n1)C)C)C 271570a_100102525489_100000103781 [0,1,0,0,0,1|2,0,0]=4 4951 B12R1.19 CC(=Cc1ccc(c(n1)C)F)C 271570a_100102525489_100009814307 [0,1,0,0,0,1|2,0,0]=4 4952 B12R1.19 CC(=Cc1ccc(c(n1)C)N)C 271570a_100102525489_100000760127 [0,1,0,0,0,1|2,0,0]=4 4953 B12R1.19 CC(=Cc1ccc(c(n1)C)O)C 271570a_100102525489_100010233687 [0,1,0,0,0,1|2,0,0]=4 4954 B12R1.19 CC(=Cc1cnc(c(c1)C)Br)C 271570a_100102525489_100009816107 [0,1,0,0,0,1|2,0,0]=4 4955 B12R1.19 CC(=Cc1cnc(c(c1)C)C)C 271570a_100102525489_100000697892 [0,1,0,0,0,1|2,0,0]=4 4956 B12R1.19 CC(=Cc1cnc(c(c1)C)Cl)C 271570a_100102525489_100009922867 [0,1,0,0,0,1|2,0,0]=4 4957 B12R1.19 CC(=Cc1cnc(c(c1)C)F)C 271570a_100102525489_100000709442 [0,1,0,0,0,1|2,0,0]=4 4958 B12R1.19 CC(=Cc1cnc(c(c1)C)N)C 271570a_100102525489_100000186686 [0,1,0,0,0,1|2,0,0]=4 4959 B12R1.19 CC(=Cc1cnc(c(c1)C)O)C 271570a_100102525489_100000685391 [0,1,0,0,0,1|2,0,0]=4 4960 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [0,1,0,0,0,1|2,0,0]=4 4961 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [0,1,0,0,0,1|1,0,0]=3 4962 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [0,1,0,0,0,1|1,0,0]=3 4963 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [0,1,0,0,0,1|1,0,0]=3 4964 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [0,1,0,0,0,1|1,0,0]=3 4965 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [0,1,0,0,0,1|1,0,0]=3 4966 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [0,1,0,0,0,1|1,0,0]=3 4967 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [0,1,0,0,0,1|1,0,0]=3 4968 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,1,0,0,0,1|1,0,0]=3 4969 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [0,1,0,0,0,1|0,0,0]=2 4970 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [0,1,0,0,0,1|0,0,0]=2 4971 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [0,1,0,0,0,1|0,0,0]=2 4972 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [0,1,0,0,0,1|0,0,0]=2 4973 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [0,1,0,0,0,1|0,0,0]=2 4974 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [0,1,0,0,0,1|0,0,0]=2 4975 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [0,1,0,0,0,1|0,0,0]=2 4976 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,1,0,0,0,1|0,0,0]=2 4977 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [0,1,0,0,0,1|1,0,0]=3 4978 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [0,1,0,0,0,1|1,0,0]=3 4979 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [0,1,0,0,0,1|1,0,0]=3 4980 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [0,1,0,0,0,1|1,0,0]=3 4981 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [0,1,0,0,0,1|1,0,0]=3 4982 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [0,1,0,0,0,1|1,0,0]=3 4983 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [0,1,0,0,0,1|1,0,0]=3 4984 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [0,1,0,0,0,1|1,0,0]=3 4985 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,1,0,0,0,1|1,0,0]=3 4986 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [0,1,0,0,0,1|1,0,0]=3 4987 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [0,1,0,0,0,1|1,0,0]=3 4988 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [0,1,0,0,0,1|1,0,0]=3 4989 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [0,1,0,0,0,1|1,0,0]=3 4990 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [0,1,0,0,0,1|1,0,0]=3 4991 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [0,1,0,0,0,1|1,0,0]=3 4992 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [0,1,0,0,0,1|1,0,0]=3 4993 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [0,1,0,0,0,1|1,0,0]=3 4994 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [0,1,0,0,0,1|1,0,0]=3 4995 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [0,1,0,0,0,1|1,0,0]=3 4996 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,1,0,0,0,1|1,0,0]=3 4997 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [0,1,0,0,0,1|1,0,0]=3 4998 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [0,1,0,0,0,1|1,0,0]=3 4999 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [0,1,0,0,0,1|1,0,0]=3 5000 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [0,1,0,0,0,1|1,0,0]=3 5001 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,1,0,0,0,1|1,0,0]=3 5002 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,1,0,0,0,1|1,0,0]=3 5003 B12R1.19 CC(=O)Cc1cnc(c(c1)Br)F 1458a_100000070787_200010066439 [0,1,0,0,0,1|2,0,0]=4 5004 B12R1.19 CC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000070787_100009843750 [0,1,0,0,0,1|2,0,0]=4 5005 B12R1.19 CC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000070787_100011072623 [0,1,0,0,0,1|2,0,0]=4 5006 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [0,1,0,0,0,1|1,0,0]=3 5007 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100015343762 [0,1,0,0,0,1|1,0,0]=3 5008 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100015343762 [0,1,0,0,0,1|1,0,0]=3 5009 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000070787 [0,1,0,0,0,1|1,0,0]=3 5010 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100103153847 [0,1,0,0,0,1|1,0,0]=3 5011 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100015343762 [0,1,0,0,0,1|1,0,0]=3 5012 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100015343762 [0,1,0,0,0,1|1,0,0]=3 5013 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000070787 [0,1,0,0,0,1|1,0,0]=3 5014 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100103153847 [0,1,0,0,0,1|1,0,0]=3 5015 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100015343762 [0,1,0,0,0,1|1,0,0]=3 5016 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100015343762 [0,1,0,0,0,1|1,0,0]=3 5017 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000070787 [0,1,0,0,0,1|1,0,0]=3 5018 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100103153847 [0,1,0,0,0,1|1,0,0]=3 5019 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100015343762 [0,1,0,0,0,1|1,0,0]=3 5020 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100015343762 [0,1,0,0,0,1|1,0,0]=3 5021 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000070787 [0,1,0,0,0,1|1,0,0]=3 5022 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100103153847 [0,1,0,0,0,1|1,0,0]=3 5023 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100015343762 [0,1,0,0,0,1|1,0,0]=3 5024 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100015343762 [0,1,0,0,0,1|1,0,0]=3 5025 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000070787 [0,1,0,0,0,1|1,0,0]=3 5026 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100103153847 [0,1,0,0,0,1|1,0,0]=3 5027 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,1,0,0,0,1|1,0,0]=3 5028 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,1,0,0,0,1|1,0,0]=3 5029 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [0,1,0,0,0,1|0,0,0]=2 5030 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [0,1,0,0,0,1|0,0,0]=2 5031 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [0,1,0,0,0,1|0,0,0]=2 5032 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [0,1,0,0,0,1|0,0,0]=2 5033 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [0,1,0,0,0,1|0,0,0]=2 5034 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [0,1,0,0,0,1|0,0,0]=2 5035 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [0,1,0,0,0,1|0,0,0]=2 5036 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [0,1,0,0,0,1|0,0,0]=2 5037 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [0,1,0,0,0,1|0,0,0]=2 5038 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [0,1,0,0,0,1|0,0,0]=2 5039 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [0,1,0,0,0,1|0,0,0]=2 5040 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [0,1,0,0,0,1|0,0,0]=2 5041 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [0,1,0,0,0,1|0,0,0]=2 5042 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [0,1,0,0,0,1|0,0,0]=2 5043 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [0,1,0,0,0,1|0,0,0]=2 5044 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [0,1,0,0,0,1|0,0,0]=2 5045 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [0,1,0,0,0,1|0,0,0]=2 5046 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [0,1,0,0,0,1|0,0,0]=2 5047 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [0,1,0,0,0,1|0,0,0]=2 5048 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [0,1,0,0,0,1|0,0,0]=2 5049 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,1,0,0,0,1|0,0,0]=2 5050 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,1,0,0,0,1|0,0,0]=2 5051 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,1,0,0,0,1|0,0,0]=2 5052 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,1,0,0,0,1|0,0,0]=2 5053 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100015343762 [0,1,0,0,0,1|1,0,0]=3 5054 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100015343762 [0,1,0,0,0,1|1,0,0]=3 5055 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000070787 [0,1,0,0,0,1|1,0,0]=3 5056 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100103153847 [0,1,0,0,0,1|1,0,0]=3 5057 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100015343762 [0,1,0,0,0,1|1,0,0]=3 5058 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100015343762 [0,1,0,0,0,1|1,0,0]=3 5059 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000070787 [0,1,0,0,0,1|1,0,0]=3 5060 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100103153847 [0,1,0,0,0,1|1,0,0]=3 5061 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100015343762 [0,1,0,0,0,1|1,0,0]=3 5062 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100015343762 [0,1,0,0,0,1|1,0,0]=3 5063 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000070787 [0,1,0,0,0,1|1,0,0]=3 5064 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100103153847 [0,1,0,0,0,1|1,0,0]=3 5065 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100015343762 [0,1,0,0,0,1|1,0,0]=3 5066 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100015343762 [0,1,0,0,0,1|1,0,0]=3 5067 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000070787 [0,1,0,0,0,1|1,0,0]=3 5068 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100103153847 [0,1,0,0,0,1|1,0,0]=3 5069 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100015343762 [0,1,0,0,0,1|1,0,0]=3 5070 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100015343762 [0,1,0,0,0,1|1,0,0]=3 5071 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000070787 [0,1,0,0,0,1|1,0,0]=3 5072 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,1,0,0,0,1|1,0,0]=3 5073 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100015343762 [0,1,0,0,0,1|1,0,0]=3 5074 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100015343762 [0,1,0,0,0,1|1,0,0]=3 5075 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000070787 [0,1,0,0,0,1|1,0,0]=3 5076 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100103153847 [0,1,0,0,0,1|1,0,0]=3 5077 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100015343762 [0,1,0,0,0,1|1,0,0]=3 5078 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100015343762 [0,1,0,0,0,1|1,0,0]=3 5079 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000070787 [0,1,0,0,0,1|1,0,0]=3 5080 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100103153847 [0,1,0,0,0,1|1,0,0]=3 5081 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100015343762 [0,1,0,0,0,1|1,0,0]=3 5082 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100015343762 [0,1,0,0,0,1|1,0,0]=3 5083 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000070787 [0,1,0,0,0,1|1,0,0]=3 5084 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100015343762 [0,1,0,0,0,1|1,0,0]=3 5085 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100015343762 [0,1,0,0,0,1|1,0,0]=3 5086 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000070787 [0,1,0,0,0,1|1,0,0]=3 5087 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100015343762 [0,1,0,0,0,1|1,0,0]=3 5088 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100015343762 [0,1,0,0,0,1|1,0,0]=3 5089 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000070787 [0,1,0,0,0,1|1,0,0]=3 5090 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,1,0,0,0,1|1,0,0]=3 5091 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,1,0,0,0,1|1,0,0]=3 5092 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,1,0,0,0,1|1,0,0]=3 5093 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100015343762 [0,1,0,0,0,1|1,0,0]=3 5094 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100015343762 [0,1,0,0,0,1|1,0,0]=3 5095 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000070787 [0,1,0,0,0,1|1,0,0]=3 5096 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100103153847 [0,1,0,0,0,1|1,0,0]=3 5097 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100015343762 [0,1,0,0,0,1|1,0,0]=3 5098 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100015343762 [0,1,0,0,0,1|1,0,0]=3 5099 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000070787 [0,1,0,0,0,1|1,0,0]=3 5100 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100103153847 [0,1,0,0,0,1|1,0,0]=3 5101 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100015343762 [0,1,0,0,0,1|1,0,0]=3 5102 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100015343762 [0,1,0,0,0,1|1,0,0]=3 5103 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000070787 [0,1,0,0,0,1|1,0,0]=3 5104 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100103153847 [0,1,0,0,0,1|1,0,0]=3 5105 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100015343762 [0,1,0,0,0,1|1,0,0]=3 5106 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100015343762 [0,1,0,0,0,1|1,0,0]=3 5107 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000070787 [0,1,0,0,0,1|1,0,0]=3 5108 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100103153847 [0,1,0,0,0,1|1,0,0]=3 5109 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [0,1,0,0,0,1|1,0,0]=3 5110 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [0,1,0,0,0,1|1,0,0]=3 5111 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [0,1,0,0,0,1|1,0,0]=3 5112 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [0,1,0,0,0,1|1,0,0]=3 5113 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [0,1,0,0,0,1|1,0,0]=3 5114 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [0,1,0,0,0,1|1,0,0]=3 5115 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [0,1,0,0,0,1|1,0,0]=3 5116 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [0,1,0,0,0,1|1,0,0]=3 5117 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,1,0,0,0,1|1,0,0]=3 5118 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,1,0,0,0,1|1,0,0]=3 5119 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [0,1,0,0,0,1|1,0,0]=3 5120 B12R1.19 CC(=O)Nc1ccc(c(n1)F)O 271570a_203496583355_100000050017 [0,1,0,0,0,1|2,0,0]=4 5121 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [0,1,0,0,0,1|1,0,0]=3 5122 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [0,1,0,0,0,1|0,0,0]=2 5123 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [0,1,0,0,0,1|2,0,0]=4 5124 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [0,1,0,0,0,1|2,0,0]=4 5125 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [0,1,0,0,0,1|2,0,0]=4 5126 B12R1.19 Cc1cc(ccc1Br)NC(C)C 2230a_100000210723_100000210206 [0,1,0,0,0,1|1,0,1]=4 5127 B12R1.19 Cc1cc(ccc1Br)NC(C)C 34a_100000210723_100000210206 [0,1,0,0,0,1|1,0,1]=4 5128 B12R1.19 Cc1cc(ccc1Br)NC(C)C 7a_100000210723_100000210206 [0,1,0,0,0,1|1,0,1]=4 5129 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [0,1,0,0,0,1|1,0,1]=4 5130 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [0,1,0,0,0,1|1,0,1]=4 5131 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100000210206_100009813585 [0,1,0,0,0,1|1,0,1]=4 5132 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100009813585_100000210206 [0,1,0,0,0,1|1,0,1]=4 5133 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [0,1,0,0,0,1|2,0,0]=4 5134 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [0,1,0,0,0,1|2,0,0]=4 5135 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [0,1,0,0,0,1|2,0,0]=4 5136 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 2230a_100000187808_100000210206 [0,1,0,0,0,1|1,0,1]=4 5137 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 34a_100000187808_100000210206 [0,1,0,0,0,1|1,0,1]=4 5138 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 7a_100000187808_100000210206 [0,1,0,0,0,1|1,0,1]=4 5139 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [0,1,0,0,0,1|1,0,1]=4 5140 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [0,1,0,0,0,1|1,0,1]=4 5141 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000049509_100000210206 [0,1,0,0,0,1|1,0,1]=4 5142 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000210206_100000049509 [0,1,0,0,0,1|1,0,1]=4 5143 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [0,1,0,0,0,1|0,0,0]=2 5144 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [0,1,0,0,0,1|2,0,0]=4 5145 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [0,1,0,0,0,1|2,0,0]=4 5146 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [0,1,0,0,0,1|2,0,0]=4 5147 B12R1.19 Cc1cc(ccc1F)NC(C)C 2230a_100000750164_100000210206 [0,1,0,0,0,1|1,0,1]=4 5148 B12R1.19 Cc1cc(ccc1F)NC(C)C 34a_100000750164_100000210206 [0,1,0,0,0,1|1,0,1]=4 5149 B12R1.19 Cc1cc(ccc1F)NC(C)C 7a_100000750164_100000210206 [0,1,0,0,0,1|1,0,1]=4 5150 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [0,1,0,0,0,1|1,0,1]=4 5151 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [0,1,0,0,0,1|1,0,1]=4 5152 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100000210206_100011218330 [0,1,0,0,0,1|1,0,1]=4 5153 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100011218330_100000210206 [0,1,0,0,0,1|1,0,1]=4 5154 B12R1.19 Cc1cc(ccc1I)NC(C)C 34a_100000198070_100000210206 [0,1,0,0,0,1|1,0,1]=4 5155 B12R1.19 Cc1cc(ccc1I)NC(C)C 7a_100000198070_100000210206 [0,1,0,0,0,1|1,0,1]=4 5156 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [0,1,0,0,0,1|1,0,1]=4 5157 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [0,1,0,0,0,1|1,0,1]=4 5158 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [0,1,0,0,0,1|1,0,1]=4 5159 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [0,1,0,0,0,1|1,0,1]=4 5160 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000210206_100000211769 [0,1,0,0,0,1|1,0,1]=4 5161 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000211769_100000210206 [0,1,0,0,0,1|1,0,1]=4 5162 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,1,0,0,0,1|0,0,0]=2 5163 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [0,1,0,0,0,1|1,0,0]=3 5164 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [0,1,0,0,0,1|1,0,1]=4 5165 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [0,1,0,0,0,1|1,0,1]=4 5166 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [0,1,0,0,0,1|1,0,1]=4 5167 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [0,1,0,0,0,1|1,0,0]=3 5168 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [0,1,0,0,0,1|0,0,0]=2 5169 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 5170 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [0,1,0,0,0,1|2,0,0]=4 5171 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 5172 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [0,1,0,0,0,1|2,0,0]=4 5173 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [0,1,0,0,0,1|2,0,0]=4 5174 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 5175 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 5176 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 5177 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 5178 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 5179 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 5180 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 5181 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [0,1,0,0,0,1|1,0,1]=4 5182 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [0,1,0,0,0,1|1,0,1]=4 5183 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [0,1,0,0,0,1|1,0,1]=4 5184 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [0,1,0,0,0,1|1,0,1]=4 5185 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [0,1,0,0,0,1|1,0,0]=3 5186 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [0,1,0,0,0,1|1,0,0]=3 5187 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [0,1,0,0,0,1|1,0,0]=3 5188 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [0,1,0,0,0,1|1,0,0]=3 5189 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,1,0,0,0,1|1,0,0]=3 5190 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [0,1,0,0,0,1|1,0,0]=3 5191 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [0,1,0,0,0,1|1,0,0]=3 5192 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [0,1,0,0,0,1|1,0,0]=3 5193 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,1,0,0,0,1|1,0,0]=3 5194 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [0,1,0,0,0,1|1,0,0]=3 5195 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [0,1,0,0,0,1|1,0,0]=3 5196 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [0,1,0,0,0,1|1,0,0]=3 5197 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [0,1,0,0,0,1|1,0,0]=3 5198 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,1,0,0,0,1|1,0,0]=3 5199 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,1,0,0,0,1|1,0,0]=3 5200 B12R1.50 C#CC(=O)Cc1cc(ccn1)C 1458a_100000211873_100000718516 [0,1,0,0,0,1|1,0,1]=4 5201 B12R1.50 C#CC(=O)Cc1cccc(c1)Br 1458a_100000211873_100000211773 [0,1,0,0,0,1|1,0,1]=4 5202 B12R1.50 C#CC(=O)Cc1cccc(c1)C 1458a_100000211873_100000211840 [0,1,0,0,0,1|0,0,1]=3 5203 B12R1.50 C#CC(=O)Cc1cccc(c1)Cl 1458a_100000211873_100000181238 [0,1,0,0,0,1|1,0,1]=4 5204 B12R1.50 C#CC(=O)Cc1cccc(c1)F 1458a_100000211873_100000230114 [0,1,0,0,0,1|1,0,1]=4 5205 B12R1.50 C#CC(=O)Cc1cccc(c1)I 1458a_100000211873_100011218688 [0,1,0,0,0,1|1,0,1]=4 5206 B12R1.50 C#CC(=O)Cc1cccc(c1)O 1458a_100000211873_100011660834 [0,1,0,0,0,1|1,0,1]=4 5207 B12R1.50 C#CC(=O)Cc1cccc(n1)C 1458a_100000211873_100000757606 [0,1,0,0,0,1|1,0,1]=4 5208 B12R1.50 C#CC(=O)Cc1ccnc(c1)C 1458a_100000211873_200020672517 [0,1,0,0,0,1|1,0,1]=4 5209 B12R1.50 C#CC(=O)Cc1cncc(c1)C 1458a_100000211873_100000716715 [0,1,0,0,0,1|1,0,1]=4 5210 B12R1.50 C#CC(C)Nc1cccc(c1)C 34a_100000188690_200000035995 [0,1,0,0,0,1|1,0,1]=4 5211 B12R1.50 C#CC(C)Oc1cccc(c1)C 34a_100000210337_200000035995 [0,1,0,0,0,1|1,0,1]=4 5212 B12R1.50 C#CC(C)Sc1cccc(c1)C 62a_200000035995_100011215228 [0,1,0,0,0,1|1,0,1]=4 5213 B12R1.50 C=CC(=O)Cc1cc(ccn1)C 1458a_100000185746_100000718516 [0,1,0,0,0,1|1,0,1]=4 5214 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [0,1,0,0,0,1|1,0,1]=4 5215 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,1,0,0,0,1|0,0,1]=3 5216 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [0,1,0,0,0,1|1,0,1]=4 5217 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [0,1,0,0,0,1|1,0,1]=4 5218 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [0,1,0,0,0,1|1,0,1]=4 5219 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [0,1,0,0,0,1|1,0,1]=4 5220 B12R1.50 C=CC(=O)Cc1cccc(n1)C 1458a_100000185746_100000757606 [0,1,0,0,0,1|1,0,1]=4 5221 B12R1.50 C=CC(=O)Cc1ccnc(c1)C 1458a_100000185746_200020672517 [0,1,0,0,0,1|1,0,1]=4 5222 B12R1.50 C=CC(=O)Cc1cncc(c1)C 1458a_100000185746_100000716715 [0,1,0,0,0,1|1,0,1]=4 5223 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [0,1,0,0,0,1|1,0,1]=4 5224 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [0,1,0,0,0,1|1,0,1]=4 5225 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,1,0,0,0,1|0,0,1]=3 5226 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,1,0,0,0,1|0,0,1]=3 5227 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [0,1,0,0,0,1|1,0,1]=4 5228 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [0,1,0,0,0,1|1,0,1]=4 5229 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [0,1,0,0,0,1|1,0,1]=4 5230 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [0,1,0,0,0,1|1,0,1]=4 5231 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [0,1,0,0,0,1|1,0,1]=4 5232 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [0,1,0,0,0,1|1,0,1]=4 5233 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [0,1,0,0,0,1|1,0,1]=4 5234 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [0,1,0,0,0,1|1,0,1]=4 5235 B12R1.50 C=CC(C)Sc1cccc(c1)C 62a_100011215867_100011215228 [0,1,0,0,0,1|1,0,1]=4 5236 B12R1.50 CC(=Cc1cccc(c1)Br)C#N 6a_100000210085_200000212204 [0,1,0,0,0,1|2,0,0]=4 5237 B12R1.50 CC(=Cc1cccc(c1)F)C#N 6a_100000210812_200000212204 [0,1,0,0,0,1|2,0,0]=4 5238 B12R1.50 CC(=Cc1cccc(c1)I)C#N 6a_100000014684_200000212204 [0,1,0,0,0,1|2,0,0]=4 5239 B12R1.50 CC(=Cc1cncc(c1)C)C#N 6a_100011998712_200000212204 [0,1,0,0,0,1|2,0,0]=4 5240 B12R1.50 CCC(=O)Cc1cc(ccn1)Br 1458a_100000210414_100010173614 [0,1,0,0,0,1|2,0,0]=4 5241 B12R1.50 CCC(=O)Cc1cc(ccn1)C 1458a_100000210414_100000718516 [0,1,0,0,0,1|1,0,0]=3 5242 B12R1.50 CCC(=O)Cc1cc(ccn1)Cl 1458a_100000210414_100016988179 [0,1,0,0,0,1|2,0,0]=4 5243 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000210414_100000211773 [0,1,0,0,0,1|1,0,0]=3 5244 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210202 [0,1,0,0,0,1|1,0,0]=3 5245 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100000210414_100000211840 [0,1,0,0,0,1|0,0,0]=2 5246 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210202 [0,1,0,0,0,1|0,0,0]=2 5247 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000210414_100000181238 [0,1,0,0,0,1|1,0,0]=3 5248 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210202 [0,1,0,0,0,1|1,0,0]=3 5249 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000210414_100000230114 [0,1,0,0,0,1|1,0,0]=3 5250 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210202 [0,1,0,0,0,1|1,0,0]=3 5251 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000210414_100011218688 [0,1,0,0,0,1|1,0,0]=3 5252 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210202 [0,1,0,0,0,1|1,0,0]=3 5253 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [0,1,0,0,0,1|1,0,0]=3 5254 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [0,1,0,0,0,1|1,0,0]=3 5255 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100000210414_100009889011 [0,1,0,0,0,1|2,0,0]=4 5256 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210202 [0,1,0,0,0,1|2,0,0]=4 5257 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100000210414_100000757606 [0,1,0,0,0,1|1,0,0]=3 5258 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210202 [0,1,0,0,0,1|1,0,0]=3 5259 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210202 [0,1,0,0,0,1|2,0,0]=4 5260 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000210414_100000086093 [0,1,0,0,0,1|2,0,0]=4 5261 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210202 [0,1,0,0,0,1|2,0,0]=4 5262 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000210414_100009819644 [0,1,0,0,0,1|2,0,0]=4 5263 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100000210414_100010243470 [0,1,0,0,0,1|2,0,0]=4 5264 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210202 [0,1,0,0,0,1|2,0,0]=4 5265 B12R1.50 CCC(=O)Cc1ccnc(c1)C 1458a_100000210414_200020672517 [0,1,0,0,0,1|1,0,0]=3 5266 B12R1.50 CCC(=O)Cc1ccnc(c1)Cl 1458a_100000210414_100000764220 [0,1,0,0,0,1|2,0,0]=4 5267 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000210414_100011740620 [0,1,0,0,0,1|2,0,0]=4 5268 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210202 [0,1,0,0,0,1|2,0,0]=4 5269 B12R1.50 CCC(=O)Cc1cncc(c1)C 1458a_100000210414_100000716715 [0,1,0,0,0,1|1,0,0]=3 5270 B12R1.50 CCC(=O)Cc1cncc(c1)Cl 1458a_100000210414_100016992070 [0,1,0,0,0,1|2,0,0]=4 5271 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100000210414_100000725299 [0,1,0,0,0,1|2,0,0]=4 5272 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210202 [0,1,0,0,0,1|2,0,0]=4 5273 B12R1.50 CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 5274 B12R1.50 CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 5275 B12R1.50 CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 5276 B12R1.50 CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210414 [0,1,0,0,0,1|1,0,0]=3 5277 B12R1.50 CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210414 [0,1,0,0,0,1|0,0,0]=2 5278 B12R1.50 CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210414 [0,1,0,0,0,1|0,0,0]=2 5279 B12R1.50 CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210414 [0,1,0,0,0,1|0,0,0]=2 5280 B12R1.50 CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210414 [0,1,0,0,0,1|0,0,0]=2 5281 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 5282 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 5283 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210414 [0,1,0,0,0,1|1,0,0]=3 5284 B12R1.50 CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 5285 B12R1.50 CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 5286 B12R1.50 CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 5287 B12R1.50 CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210414 [0,1,0,0,0,1|1,0,0]=3 5288 B12R1.50 CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 5289 B12R1.50 CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 5290 B12R1.50 CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 5291 B12R1.50 CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210414 [0,1,0,0,0,1|1,0,0]=3 5292 B12R1.50 CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 5293 B12R1.50 CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 5294 B12R1.50 CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210414 [0,1,0,0,0,1|1,0,0]=3 5295 B12R1.50 CCC(C)Nc1cccc(c1)C 2230a_100000188690_100000758301 [0,1,0,0,0,1|1,0,1]=4 5296 B12R1.50 CCC(C)Nc1cccc(c1)C 34a_100000188690_100011215416 [0,1,0,0,0,1|1,0,1]=4 5297 B12R1.50 CCC(C)Oc1cccc(c1)C 34a_100000210337_100011215416 [0,1,0,0,0,1|1,0,1]=4 5298 B12R1.50 CCC(C)Oc1cccc(c1)C 7a_100000210337_100000758301 [0,1,0,0,0,1|1,0,1]=4 5299 B12R1.50 CCC(C)Sc1cccc(c1)C 62a_100000758301_100011215228 [0,1,0,0,0,1|1,0,1]=4 5300 B12R1.50 CCC(C)Sc1cccc(c1)C 62a_100011215228_100000758301 [0,1,0,0,0,1|1,0,1]=4 5301 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_100000225621_100000211840 [0,1,0,0,0,1|2,0,0]=4 5302 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_102495364743_100000210202 [0,1,0,0,0,1|2,0,0]=4 5303 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_102516607250_200000210301 [0,1,0,0,0,1|2,0,0]=4 5304 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_100000225621_100000211840 [0,1,0,0,0,1|2,0,0]=4 5305 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_102495364743_100000204670 [0,1,0,0,0,1|2,0,0]=4 5306 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_102516607250_200000210301 [0,1,0,0,0,1|2,0,0]=4 5307 B12R1.50 CCN(C)Cc1cccc(c1)C 34a_102495364743_100000210202 [0,1,0,0,0,1|2,0,0]=4 5308 B12R1.50 CCN([13CH3])Cc1cccc(c1)C 2230a_102516607250_200025704644 [0,1,0,0,0,1|2,0,0]=4 5309 B12R1.50 CCN([13CH3])Cc1cccc(c1)C 269982a_102516607250_200025704644 [0,1,0,0,0,1|2,0,0]=4 5310 B12R1.50 CNC(=O)Cc1cccc(c1)Br 11a_106832991635_100000747190 [0,1,0,0,0,1|1,0,0]=3 5311 B12R1.50 CNC(=O)Cc1cccc(c1)Br 240690a_100102657272_100000747190 [0,1,0,0,0,1|1,0,0]=3 5312 B12R1.50 CNC(=O)Cc1cccc(c1)Br 527a_100102657272_100000747190 [0,1,0,0,0,1|1,0,0]=3 5313 B12R1.50 CNC(=O)Cc1cccc(c1)C 11a_106832991635_100011206899 [0,1,0,0,0,1|0,0,0]=2 5314 B12R1.50 CNC(=O)Cc1cccc(c1)C 1626a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 5315 B12R1.50 CNC(=O)Cc1cccc(c1)C 240690a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 5316 B12R1.50 CNC(=O)Cc1cccc(c1)C 527a_100102657272_100011206899 [0,1,0,0,0,1|0,0,0]=2 5317 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 11a_106832991635_100000749307 [0,1,0,0,0,1|1,0,0]=3 5318 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 1626a_100102657272_100000749307 [0,1,0,0,0,1|1,0,0]=3 5319 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 240690a_100102657272_100000749307 [0,1,0,0,0,1|1,0,0]=3 5320 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 527a_100102657272_100000749307 [0,1,0,0,0,1|1,0,0]=3 5321 B12R1.50 CNC(=O)Cc1cccc(c1)F 11a_106832991635_100000211661 [0,1,0,0,0,1|1,0,0]=3 5322 B12R1.50 CNC(=O)Cc1cccc(c1)F 1626a_100102657272_100000211661 [0,1,0,0,0,1|1,0,0]=3 5323 B12R1.50 CNC(=O)Cc1cccc(c1)F 240690a_100102657272_100000211661 [0,1,0,0,0,1|1,0,0]=3 5324 B12R1.50 CNC(=O)Cc1cccc(c1)F 527a_100102657272_100000211661 [0,1,0,0,0,1|1,0,0]=3 5325 B12R1.50 CNC(=O)Cc1cccc(c1)I 11a_106832991635_100000238430 [0,1,0,0,0,1|1,0,0]=3 5326 B12R1.50 CNC(=O)Cc1cccc(c1)I 1626a_100102657272_100000238430 [0,1,0,0,0,1|1,0,0]=3 5327 B12R1.50 CNC(=O)Cc1cccc(c1)I 240690a_100102657272_100000238430 [0,1,0,0,0,1|1,0,0]=3 5328 B12R1.50 CNC(=O)Cc1cccc(c1)I 527a_100102657272_100000238430 [0,1,0,0,0,1|1,0,0]=3 5329 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [0,1,0,0,0,1|1,0,0]=3 5330 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [0,1,0,0,0,1|1,0,0]=3 5331 B12R1.50 CNC(=O)Cc1cccc(n1)Br 11a_106832991635_100010201708 [0,1,0,0,0,1|2,0,0]=4 5332 B12R1.50 CNC(=O)Cc1cccc(n1)Br 240690a_100102657272_100010201708 [0,1,0,0,0,1|2,0,0]=4 5333 B12R1.50 CNC(=O)Cc1cccc(n1)Br 527a_100102657272_100010201708 [0,1,0,0,0,1|2,0,0]=4 5334 B12R1.50 CNC(=O)Cc1cccc(n1)C 11a_106832991635_100012001110 [0,1,0,0,0,1|1,0,0]=3 5335 B12R1.50 CNC(=O)Cc1cccc(n1)C 1626a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 5336 B12R1.50 CNC(=O)Cc1cccc(n1)C 240690a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 5337 B12R1.50 CNC(=O)Cc1cccc(n1)C 527a_100102657272_100012001110 [0,1,0,0,0,1|1,0,0]=3 5338 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 11a_106832991635_100000090259 [0,1,0,0,0,1|2,0,0]=4 5339 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 1626a_100102657272_100000090259 [0,1,0,0,0,1|2,0,0]=4 5340 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 240690a_100102657272_100000090259 [0,1,0,0,0,1|2,0,0]=4 5341 B12R1.50 CNC(=O)Cc1cccc(n1)F 11a_106832991635_100000096803 [0,1,0,0,0,1|2,0,0]=4 5342 B12R1.50 CNC(=O)Cc1cccc(n1)F 1626a_100102657272_100000096803 [0,1,0,0,0,1|2,0,0]=4 5343 B12R1.50 CNC(=O)Cc1cccc(n1)F 240690a_100102657272_100000096803 [0,1,0,0,0,1|2,0,0]=4 5344 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 11a_106832991635_100010126891 [0,1,0,0,0,1|2,0,0]=4 5345 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 240690a_100102657272_100010126891 [0,1,0,0,0,1|2,0,0]=4 5346 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 527a_100102657272_100010126891 [0,1,0,0,0,1|2,0,0]=4 5347 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 11a_106832991635_100000085289 [0,1,0,0,0,1|2,0,0]=4 5348 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 1626a_100102657272_100000085289 [0,1,0,0,0,1|2,0,0]=4 5349 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 240690a_100102657272_100000085289 [0,1,0,0,0,1|2,0,0]=4 5350 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 527a_100102657272_100000085289 [0,1,0,0,0,1|2,0,0]=4 5351 B12R1.50 CNC(=O)Cc1cncc(c1)Br 11a_106832991635_100000239331 [0,1,0,0,0,1|2,0,0]=4 5352 B12R1.50 CNC(=O)Cc1cncc(c1)Br 240690a_100102657272_100000239331 [0,1,0,0,0,1|2,0,0]=4 5353 B12R1.50 CNC(=O)Cc1cncc(c1)Br 527a_100102657272_100000239331 [0,1,0,0,0,1|2,0,0]=4 5354 B12R1.50 CNC(=O)Cc1cncc(c1)F 11a_106832991635_100011667516 [0,1,0,0,0,1|2,0,0]=4 5355 B12R1.50 CNC(=O)Cc1cncc(c1)F 240690a_100102657272_100011667516 [0,1,0,0,0,1|2,0,0]=4 5356 B12R1.50 CNC(=O)Cc1cncc(c1)F 527a_100102657272_100011667516 [0,1,0,0,0,1|2,0,0]=4 5357 B12R1.50 CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100102657272 [0,1,0,0,0,1|1,0,0]=3 5358 B12R1.50 CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100102657272 [0,1,0,0,0,1|1,0,0]=3 5359 B12R1.50 CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100102657272 [0,1,0,0,0,1|0,0,0]=2 5360 B12R1.50 CNC(=O)Nc1cccc(c1)C 512a_100000188690_100102657272 [0,1,0,0,0,1|0,0,0]=2 5361 B12R1.50 CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100102657272 [0,1,0,0,0,1|1,0,0]=3 5362 B12R1.50 CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100102657272 [0,1,0,0,0,1|1,0,0]=3 5363 B12R1.50 CNC(=O)Nc1cccc(c1)F 512a_100000210047_100102657272 [0,1,0,0,0,1|1,0,0]=3 5364 B12R1.50 CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100102657272 [0,1,0,0,0,1|1,0,0]=3 5365 B12R1.50 CNC(=O)Nc1cccc(c1)I 512a_100000211102_100102657272 [0,1,0,0,0,1|1,0,0]=3 5366 B12R1.50 CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100102657272 [0,1,0,0,0,1|1,0,0]=3 5367 B12R1.50 CNC(=O)Nc1cccc(c1)O 512a_100000210217_100102657272 [0,1,0,0,0,1|1,0,0]=3 5368 B12R1.50 COC(=O)Cc1cc(ccn1)O 271570a_203496583355_100010275543 [0,1,0,0,0,1|2,0,0]=4 5369 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [0,1,0,0,0,1|1,0,0]=3 5370 B12R1.50 COC(=O)Cc1cccc(n1)O 271570a_203496583355_100000094215 [0,1,0,0,0,1|2,0,0]=4 5371 B12R1.50 COC(=O)Cc1ccnc(c1)O 271570a_203496583355_100010135589 [0,1,0,0,0,1|2,0,0]=4 5372 B12R1.50 COC(C)Sc1cccc(c1)C 62a_100009879195_100011215228 [0,1,0,0,0,1|0,0,2]=4 5373 B12R1.50 COC(C)Sc1cccc(c1)C 62a_100011215228_100009879195 [0,1,0,0,0,1|0,0,2]=4 5374 B12R1.50 Cc1cc(ccn1)CC(=O)CO 1458a_100000210174_200020672517 [0,1,0,0,0,1|1,0,0]=3 5375 B12R1.50 Cc1cccc(c1)CC(=O)CF 1458a_100011206899_100015361967 [0,1,0,0,0,1|0,0,0]=2 5376 B12R1.50 Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211840 [0,1,0,0,0,1|0,0,0]=2 5377 B12R1.50 Cc1cccc(c1)CN(C)CF 269982a_102495364743_100015361967 [0,1,0,0,0,1|2,0,0]=4 5378 B12R1.50 Cc1cccc(c1)CN(C)CF 34a_102495364743_100015361967 [0,1,0,0,0,1|2,0,0]=4 5379 B12R1.50 Cc1cccc(c1)NC(=O)CO 22a_100000188690_100000210174 [0,1,0,0,0,1|0,0,0]=2 5380 B12R1.50 Cc1cccc(c1)NC(=O)CO 527a_100000188690_100000210174 [0,1,0,0,0,1|0,0,0]=2 5381 B12R1.50 Cc1cccc(c1)NC(C)C#N 2230a_100000188690_100000184139 [0,1,0,0,0,1|1,0,1]=4 5382 B12R1.50 Cc1cccc(c1)NC(C)CO 2230a_100000188690_100012180447 [0,1,0,0,0,1|0,0,2]=4 5383 B12R1.50 Cc1cccc(c1)NC(C)CO 34a_100000188690_100012180447 [0,1,0,0,0,1|0,0,2]=4 5384 B12R1.50 Cc1cccc(c1)OC(C)C#N 7a_100000210337_100000703298 [0,1,0,0,0,1|1,0,1]=4 5385 B12R1.50 Cc1cccc(c1)OC(C)CO 34a_100000210337_100012180447 [0,1,0,0,0,1|0,0,2]=4 5386 B12R1.50 Cc1cccc(c1)OC(C)CO 7a_100000210337_100012180447 [0,1,0,0,0,1|0,0,2]=4 5387 B12R1.50 Cc1cccc(c1)SC(C)C#N 62a_100000703298_100011215228 [0,1,0,0,0,1|1,0,1]=4 5388 B12R1.50 Cc1cccc(c1)SC(C)C#N 62a_100011215228_100000703298 [0,1,0,0,0,1|1,0,1]=4 5389 B12R1.50 Cc1cccc(c1)SC(C)CO 62a_100012180447_100011215228 [0,1,0,0,0,1|0,0,2]=4 5390 B12R1.50 Cc1cccc(c1)S[C@H](C)CO 62a_100011215228_100016084084 [0,1,0,0,0,1|0,0,2]=4 5391 B12R1.50 Cc1cccc(c1)S[C@H](C)CO 62a_100016084084_100011215228 [0,1,0,0,0,1|0,0,2]=4 5392 B12R1.50 Cc1cccc(n1)CC(=O)CF 1458a_100012001110_100015361967 [0,1,0,0,0,1|1,0,0]=3 5393 B12R1.50 Cc1cccc(n1)CC(=O)CO 1458a_100000210174_100000757606 [0,1,0,0,0,1|1,0,0]=3 5394 B12R1.50 Cc1ccnc(c1)CC(=O)CO 1458a_100000210174_100000718516 [0,1,0,0,0,1|1,0,0]=3 5395 B12R1.50 Cc1cncc(c1)CC(=O)CO 1458a_100000210174_100000716715 [0,1,0,0,0,1|1,0,0]=3 5396 B12R1.50 O=C(CF)Cc1cccc(c1)Br 1458a_100000747190_100015361967 [0,1,0,0,0,1|1,0,0]=3 5397 B12R1.50 O=C(CF)Cc1cccc(c1)Cl 1458a_100000749307_100015361967 [0,1,0,0,0,1|1,0,0]=3 5398 B12R1.50 O=C(CF)Cc1cccc(c1)F 1458a_100000211661_100015361967 [0,1,0,0,0,1|1,0,0]=3 5399 B12R1.50 O=C(CF)Cc1cccc(c1)I 1458a_100000238430_100015361967 [0,1,0,0,0,1|1,0,0]=3 5400 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [0,1,0,0,0,1|1,0,0]=3 5401 B12R1.50 O=C(CF)Cc1cccc(n1)Br 1458a_100010201708_100015361967 [0,1,0,0,0,1|2,0,0]=4 5402 B12R1.50 O=C(CF)Cc1cccc(n1)Cl 1458a_100000090259_100015361967 [0,1,0,0,0,1|2,0,0]=4 5403 B12R1.50 O=C(CF)Cc1cccc(n1)F 1458a_100000096803_100015361967 [0,1,0,0,0,1|2,0,0]=4 5404 B12R1.50 O=C(CF)Cc1ccnc(c1)Br 1458a_100010126891_100015361967 [0,1,0,0,0,1|2,0,0]=4 5405 B12R1.50 O=C(CF)Cc1cncc(c1)Br 1458a_100000239331_100015361967 [0,1,0,0,0,1|2,0,0]=4 5406 B12R1.50 O=C(CF)Cc1cncc(c1)F 1458a_100011667516_100015361967 [0,1,0,0,0,1|2,0,0]=4 5407 B12R1.50 O=C(CO)Cc1cc(ccn1)Br 1458a_100000210174_100010173614 [0,1,0,0,0,1|2,0,0]=4 5408 B12R1.50 O=C(CO)Cc1cc(ccn1)Cl 1458a_100000210174_100016988179 [0,1,0,0,0,1|2,0,0]=4 5409 B12R1.50 O=C(CO)Cc1cccc(c1)Br 1458a_100000210174_100000211773 [0,1,0,0,0,1|1,0,0]=3 5410 B12R1.50 O=C(CO)Cc1cccc(c1)Cl 1458a_100000210174_100000181238 [0,1,0,0,0,1|1,0,0]=3 5411 B12R1.50 O=C(CO)Cc1cccc(c1)F 1458a_100000210174_100000230114 [0,1,0,0,0,1|1,0,0]=3 5412 B12R1.50 O=C(CO)Cc1cccc(c1)I 1458a_100000210174_100011218688 [0,1,0,0,0,1|1,0,0]=3 5413 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [0,1,0,0,0,1|1,0,0]=3 5414 B12R1.50 O=C(CO)Cc1cccc(n1)Br 1458a_100000210174_100009889011 [0,1,0,0,0,1|2,0,0]=4 5415 B12R1.50 O=C(CO)Cc1cccc(n1)Cl 1458a_100000210174_100000086093 [0,1,0,0,0,1|2,0,0]=4 5416 B12R1.50 O=C(CO)Cc1cccc(n1)F 1458a_100000210174_100009819644 [0,1,0,0,0,1|2,0,0]=4 5417 B12R1.50 O=C(CO)Cc1ccnc(c1)Br 1458a_100000210174_100010243470 [0,1,0,0,0,1|2,0,0]=4 5418 B12R1.50 O=C(CO)Cc1ccnc(c1)Cl 1458a_100000210174_100000764220 [0,1,0,0,0,1|2,0,0]=4 5419 B12R1.50 O=C(CO)Cc1cncc(c1)Br 1458a_100000210174_100011740620 [0,1,0,0,0,1|2,0,0]=4 5420 B12R1.50 O=C(CO)Cc1cncc(c1)Cl 1458a_100000210174_100016992070 [0,1,0,0,0,1|2,0,0]=4 5421 B12R1.50 O=C(CO)Cc1cncc(c1)F 1458a_100000210174_100000725299 [0,1,0,0,0,1|2,0,0]=4 5422 B12R1.50 O=C(CO)Nc1cccc(c1)Br 22a_100000210019_100000210174 [0,1,0,0,0,1|1,0,0]=3 5423 B12R1.50 O=C(CO)Nc1cccc(c1)Br 527a_100000210019_100000210174 [0,1,0,0,0,1|1,0,0]=3 5424 B12R1.50 O=C(CO)Nc1cccc(c1)Cl 22a_100000185859_100000210174 [0,1,0,0,0,1|1,0,0]=3 5425 B12R1.50 O=C(CO)Nc1cccc(c1)F 22a_100000210047_100000210174 [0,1,0,0,0,1|1,0,0]=3 5426 B12R1.50 O=C(CO)Nc1cccc(c1)F 527a_100000210047_100000210174 [0,1,0,0,0,1|1,0,0]=3 5427 B12R1.50 O=C(CO)Nc1cccc(c1)I 22a_100000211102_100000210174 [0,1,0,0,0,1|1,0,0]=3 5428 B12R1.50 O=C(CO)Nc1cccc(c1)I 527a_100000211102_100000210174 [0,1,0,0,0,1|1,0,0]=3 5429 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [0,1,0,0,0,1|1,0,0]=3 5430 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [0,1,0,0,0,1|1,0,0]=3 5431 B12R1.101 CC(=Cc1cc([nH]c(=O)c1)C)C 271570a_100102525489_100009861981 [0,1,0,0,0,1|2,0,0]=4 5432 B12R1.101 CC(=Cc1cc(cc(c1)Br)Br)C 271570a_100102525489_100009814770 [0,1,0,0,0,1|2,0,0]=4 5433 B12R1.101 CC(=Cc1cc(cc(c1)Br)Cl)C 271570a_100102525489_100009814755 [0,1,0,0,0,1|2,0,0]=4 5434 B12R1.101 CC(=Cc1cc(cc(c1)Br)F)C 271570a_100102525489_100009814764 [0,1,0,0,0,1|2,0,0]=4 5435 B12R1.101 CC(=Cc1cc(cc(c1)Br)N)C 271570a_100102525489_100009814763 [0,1,0,0,0,1|2,0,0]=4 5436 B12R1.101 CC(=Cc1cc(cc(c1)Br)O)C 271570a_100102525489_100010068917 [0,1,0,0,0,1|2,0,0]=4 5437 B12R1.101 CC(=Cc1cc(cc(c1)C)C)C 271570a_100102525489_100011215608 [0,1,0,0,0,1|1,0,0]=3 5438 B12R1.101 CC(=Cc1cc(cc(c1)Cl)C)C 271570a_100102525489_100010172791 [0,1,0,0,0,1|1,0,0]=3 5439 B12R1.101 CC(=Cc1cc(cc(c1)Cl)Cl)C 271570a_100102525489_100000747138 [0,1,0,0,0,1|2,0,0]=4 5440 B12R1.101 CC(=Cc1cc(cc(c1)Cl)F)C 271570a_100102525489_100013859453 [0,1,0,0,0,1|2,0,0]=4 5441 B12R1.101 CC(=Cc1cc(cc(c1)Cl)N)C 271570a_100102525489_100010147676 [0,1,0,0,0,1|2,0,0]=4 5442 B12R1.101 CC(=Cc1cc(cc(c1)Cl)O)C 271570a_100102525489_100010068924 [0,1,0,0,0,1|2,0,0]=4 5443 B12R1.101 CC(=Cc1cc(cc(c1)F)C)C 271570a_100102525489_100011356977 [0,1,0,0,0,1|1,0,0]=3 5444 B12R1.101 CC(=Cc1cc(cc(c1)F)F)C 271570a_100102525489_100011218498 [0,1,0,0,0,1|2,0,0]=4 5445 B12R1.101 CC(=Cc1cc(cc(c1)F)N)C 271570a_100102525489_100011356972 [0,1,0,0,0,1|2,0,0]=4 5446 B12R1.101 CC(=Cc1cc(cc(c1)F)O)C 271570a_100102525489_100000717995 [0,1,0,0,0,1|2,0,0]=4 5447 B12R1.101 CC(=Cc1cc(cc(c1)N)C)C 271570a_100102525489_100000695972 [0,1,0,0,0,1|1,0,0]=3 5448 B12R1.101 CC(=Cc1cc(cc(c1)N)N)C 271570a_100102525489_100011999608 [0,1,0,0,0,1|2,0,0]=4 5449 B12R1.101 CC(=Cc1cc(cc(c1)O)C)C 271570a_100102525489_100011999630 [0,1,0,0,0,1|1,0,0]=3 5450 B12R1.101 CC(=Cc1cc(cc(c1)O)O)C 271570a_100102525489_100009868816 [0,1,0,0,0,1|2,0,0]=4 5451 B12R1.101 CC(=Cc1cc(cc(n1)C)C)C 271570a_100102525489_100000069240 [0,1,0,0,0,1|2,0,0]=4 5452 B12R1.101 CC(=Cc1cc(cc(n1)F)C)C 271570a_100102525489_100009819601 [0,1,0,0,0,1|2,0,0]=4 5453 B12R1.101 CC(=Cc1cc(cc(n1)N)C)C 271570a_100102525489_100009819863 [0,1,0,0,0,1|2,0,0]=4 5454 B12R1.101 CC(=Cc1cc(nc(c1)C)C)C 271570a_100102525489_100009816552 [0,1,0,0,0,1|2,0,0]=4 5455 B12R1.101 CC(=Cc1cc(nc(c1)F)C)C 271570a_100102525489_100010006595 [0,1,0,0,0,1|2,0,0]=4 5456 B12R1.101 CC(=Cc1cc(nc(c1)N)C)C 271570a_100102525489_100000076705 [0,1,0,0,0,1|2,0,0]=4 5457 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000070787_100011216082 [0,1,0,0,0,1|1,0,0]=3 5458 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200000210301 [0,1,0,0,0,1|1,0,0]=3 5459 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)C 1458a_100000070787_100012348363 [0,1,0,0,0,1|0,0,0]=2 5460 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100000070787_100000766940 [0,1,0,0,0,1|1,0,0]=3 5461 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200000210301 [0,1,0,0,0,1|1,0,0]=3 5462 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100000070787_100000181317 [0,1,0,0,0,1|0,0,0]=2 5463 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_200000210301 [0,1,0,0,0,1|0,0,0]=2 5464 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000070787_100011219208 [0,1,0,0,0,1|1,0,0]=3 5465 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200000210301 [0,1,0,0,0,1|1,0,0]=3 5466 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000070787_100011219885 [0,1,0,0,0,1|1,0,0]=3 5467 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200000210301 [0,1,0,0,0,1|1,0,0]=3 5468 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100000070787_100011219130 [0,1,0,0,0,1|0,0,0]=2 5469 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_200000210301 [0,1,0,0,0,1|0,0,0]=2 5470 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100000070787_100000697002 [0,1,0,0,0,1|1,0,0]=3 5471 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200000210301 [0,1,0,0,0,1|1,0,0]=3 5472 B12R1.101 CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000070787_100010146614 [0,1,0,0,0,1|1,0,0]=3 5473 B12R1.101 CC(=O)Cc1cc(cc(c1)I)F 1458a_100000070787_100010149605 [0,1,0,0,0,1|1,0,0]=3 5474 B12R1.101 CC(=O)Cc1cc(cc(n1)C)C 1458a_100000070787_100012357514 [0,1,0,0,0,1|1,0,0]=3 5475 B12R1.101 CC(=O)Cc1cc(nc(c1)C)C 1458a_100000070787_200000139866 [0,1,0,0,0,1|1,0,0]=3 5476 B12R1.101 CC(=O)Cc1cc(nc(c1)Cl)Cl 1458a_100000070787_100000052781 [0,1,0,0,0,1|2,0,0]=4 5477 B12R1.101 CC(=O)Cc1nc(cc(n1)C)C 1458a_100000070787_100011935097 [0,1,0,0,0,1|2,0,0]=4 5478 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100015343762 [0,1,0,0,0,1|1,0,0]=3 5479 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100015343762 [0,1,0,0,0,1|1,0,0]=3 5480 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000070787 [0,1,0,0,0,1|1,0,0]=3 5481 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100103153847 [0,1,0,0,0,1|1,0,0]=3 5482 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100015343762 [0,1,0,0,0,1|0,0,0]=2 5483 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100015343762 [0,1,0,0,0,1|0,0,0]=2 5484 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000070787 [0,1,0,0,0,1|0,0,0]=2 5485 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100103153847 [0,1,0,0,0,1|0,0,0]=2 5486 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100015343762 [0,1,0,0,0,1|1,0,0]=3 5487 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100015343762 [0,1,0,0,0,1|1,0,0]=3 5488 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000070787 [0,1,0,0,0,1|1,0,0]=3 5489 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100015343762 [0,1,0,0,0,1|1,0,0]=3 5490 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100015343762 [0,1,0,0,0,1|1,0,0]=3 5491 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000070787 [0,1,0,0,0,1|1,0,0]=3 5492 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100015343762 [0,1,0,0,0,1|0,0,0]=2 5493 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100015343762 [0,1,0,0,0,1|0,0,0]=2 5494 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000070787 [0,1,0,0,0,1|0,0,0]=2 5495 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100103153847 [0,1,0,0,0,1|0,0,0]=2 5496 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100015343762 [0,1,0,0,0,1|0,0,0]=2 5497 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100015343762 [0,1,0,0,0,1|0,0,0]=2 5498 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000070787 [0,1,0,0,0,1|0,0,0]=2 5499 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100015343762 [0,1,0,0,0,1|1,0,0]=3 5500 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100015343762 [0,1,0,0,0,1|1,0,0]=3 5501 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000070787 [0,1,0,0,0,1|1,0,0]=3 5502 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100015343762 [0,1,0,0,0,1|1,0,0]=3 5503 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100015343762 [0,1,0,0,0,1|1,0,0]=3 5504 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000070787 [0,1,0,0,0,1|1,0,0]=3 5505 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100015343762 [0,1,0,0,0,1|1,0,0]=3 5506 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000070787 [0,1,0,0,0,1|1,0,0]=3 5507 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100015343762 [0,1,0,0,0,1|0,0,0]=2 5508 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100015343762 [0,1,0,0,0,1|0,0,0]=2 5509 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000070787 [0,1,0,0,0,1|0,0,0]=2 5510 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100103153847 [0,1,0,0,0,1|0,0,0]=2 5511 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100015343762 [0,1,0,0,0,1|1,0,0]=3 5512 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100015343762 [0,1,0,0,0,1|1,0,0]=3 5513 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000070787 [0,1,0,0,0,1|1,0,0]=3 5514 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100015343762 [0,1,0,0,0,1|1,0,0]=3 5515 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100015343762 [0,1,0,0,0,1|1,0,0]=3 5516 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000070787 [0,1,0,0,0,1|1,0,0]=3 5517 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100103153847 [0,1,0,0,0,1|1,0,0]=3 5518 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100015343762 [0,1,0,0,0,1|1,0,0]=3 5519 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100015343762 [0,1,0,0,0,1|1,0,0]=3 5520 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000070787 [0,1,0,0,0,1|1,0,0]=3 5521 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100015343762 [0,1,0,0,0,1|1,0,0]=3 5522 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100015343762 [0,1,0,0,0,1|1,0,0]=3 5523 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000070787 [0,1,0,0,0,1|1,0,0]=3 5524 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100015343762 [0,1,0,0,0,1|1,0,0]=3 5525 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100015343762 [0,1,0,0,0,1|1,0,0]=3 5526 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000070787 [0,1,0,0,0,1|1,0,0]=3 5527 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100103153847 [0,1,0,0,0,1|1,0,0]=3 5528 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100015343762 [0,1,0,0,0,1|0,0,0]=2 5529 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000070787 [0,1,0,0,0,1|0,0,0]=2 5530 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100103153847 [0,1,0,0,0,1|0,0,0]=2 5531 B12R1.101 CC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100103153847 [0,1,0,0,0,1|1,0,0]=3 5532 B12R1.101 CC(=O)Oc1cc(cc(c1)F)O 271570a_203496583355_200015324874 [0,1,0,0,0,1|1,0,0]=3 5533 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])C 1458a_100011202310_200025704644 [0,1,0,0,0,1|0,0,0]=2 5534 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])F 1458a_100011216671_200025704644 [0,1,0,0,0,1|0,0,0]=2 5535 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 2230a_100102631434_100012348363 [0,1,0,0,0,1|2,0,0]=4 5536 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 269982a_100102631434_100012348363 [0,1,0,0,0,1|2,0,0]=4 5537 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 270004a_100102631434_100000686105 [0,1,0,0,0,1|2,0,0]=4 5538 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 2230a_100102631434_100000181317 [0,1,0,0,0,1|2,0,0]=4 5539 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 269982a_100102631434_100000181317 [0,1,0,0,0,1|2,0,0]=4 5540 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 270004a_100102631434_100000745632 [0,1,0,0,0,1|2,0,0]=4 5541 B12R1.101 Cc1cc(cc(c1)CN(C)C)Cl 270004a_100102631434_100000684525 [0,1,0,0,0,1|2,0,0]=4 5542 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 2230a_100102631434_100011219130 [0,1,0,0,0,1|2,0,0]=4 5543 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 269982a_100102631434_100011219130 [0,1,0,0,0,1|2,0,0]=4 5544 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 270004a_100102631434_100011217087 [0,1,0,0,0,1|2,0,0]=4 5545 B12R1.101 Cc1cc(cc(c1)CN(C)C)O 270004a_100102631434_100009853434 [0,1,0,0,0,1|2,0,0]=4 5546 B12R1.101 Cc1cc(cc(c1)NC(C)C)Br 34a_100000695972_100000210206 [0,1,0,0,0,1|1,0,1]=4 5547 B12R1.101 Cc1cc(cc(c1)NC(C)C)Br 7a_100000695972_100000210206 [0,1,0,0,0,1|1,0,1]=4 5548 B12R1.101 Cc1cc(cc(c1)NC(C)C)C 2230a_100000210930_100000210206 [0,1,0,0,0,1|1,0,1]=4 5549 B12R1.101 Cc1cc(cc(c1)NC(C)C)C 34a_100000210930_100000210206 [0,1,0,0,0,1|1,0,1]=4 5550 B12R1.101 Cc1cc(cc(c1)NC(C)C)C 7a_100000210930_100000210206 [0,1,0,0,0,1|1,0,1]=4 5551 B12R1.101 Cc1cc(cc(c1)NC(C)C)Cl 2230a_100012022512_100000210206 [0,1,0,0,0,1|1,0,1]=4 5552 B12R1.101 Cc1cc(cc(c1)NC(C)C)Cl 34a_100012022512_100000210206 [0,1,0,0,0,1|1,0,1]=4 5553 B12R1.101 Cc1cc(cc(c1)NC(C)C)Cl 7a_100012022512_100000210206 [0,1,0,0,0,1|1,0,1]=4 5554 B12R1.101 Cc1cc(cc(c1)NC(C)C)F 2230a_100000742734_100000210206 [0,1,0,0,0,1|1,0,1]=4 5555 B12R1.101 Cc1cc(cc(c1)NC(C)C)F 34a_100000742734_100000210206 [0,1,0,0,0,1|1,0,1]=4 5556 B12R1.101 Cc1cc(cc(c1)NC(C)C)F 7a_100000742734_100000210206 [0,1,0,0,0,1|1,0,1]=4 5557 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 34a_100011995906_100000210206 [0,1,0,0,0,1|1,0,1]=4 5558 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 7a_100011995906_100000210206 [0,1,0,0,0,1|1,0,1]=4 5559 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br 34a_100011999630_100000210206 [0,1,0,0,0,1|1,0,1]=4 5560 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br 7a_100011999630_100000210206 [0,1,0,0,0,1|1,0,1]=4 5561 B12R1.101 Cc1cc(cc(c1)OC(C)C)C 34a_100000210933_100000210206 [0,1,0,0,0,1|1,0,1]=4 5562 B12R1.101 Cc1cc(cc(c1)OC(C)C)C 7a_100000210933_100000210206 [0,1,0,0,0,1|1,0,1]=4 5563 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl 34a_100000087485_100000210206 [0,1,0,0,0,1|1,0,1]=4 5564 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl 7a_100000087485_100000210206 [0,1,0,0,0,1|1,0,1]=4 5565 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 34a_100011830401_100000210206 [0,1,0,0,0,1|1,0,1]=4 5566 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 7a_100011830401_100000210206 [0,1,0,0,0,1|1,0,1]=4 5567 B12R1.101 Cc1cc(cc(c1)OC(C)C)N 34a_100011995906_100000210206 [0,1,0,0,0,1|1,0,1]=4 5568 B12R1.101 Cc1cc(cc(c1)OC(C)C)N 7a_100011995906_100000210206 [0,1,0,0,0,1|1,0,1]=4 5569 B12R1.101 Cc1cc(cc(c1)SC(C)C)C 62a_100000210206_100011215608 [0,1,0,0,0,1|1,0,1]=4 5570 B12R1.101 Cc1cc(cc(c1)SC(C)C)C 62a_100011215608_100000210206 [0,1,0,0,0,1|1,0,1]=4 5571 B12R1.101 Cc1cc(cc(c1)SC(C)C)Cl 62a_100000210206_100010172791 [0,1,0,0,0,1|1,0,1]=4 5572 B12R1.101 Cc1cc(cc(c1)SC(C)C)Cl 62a_100010172791_100000210206 [0,1,0,0,0,1|1,0,1]=4 5573 B12R1.101 Cc1cc(cc(c1)SC(C)C)F 62a_100000210206_100011356977 [0,1,0,0,0,1|1,0,1]=4 5574 B12R1.101 Cc1cc(cc(c1)SC(C)C)F 62a_100011356977_100000210206 [0,1,0,0,0,1|1,0,1]=4 5575 B12R1.101 Cc1cc(cc(c1)SC(C)C)N 62a_100000210206_100000695972 [0,1,0,0,0,1|1,0,1]=4 5576 B12R1.101 Cc1cc(cc(c1)SC(C)C)N 62a_100000695972_100000210206 [0,1,0,0,0,1|1,0,1]=4 5577 B12R1.101 Cc1cc(cc(c1)SC(C)C)O 62a_100000210206_100011999630 [0,1,0,0,0,1|1,0,1]=4 5578 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200025704644 [0,1,0,0,0,1|1,0,0]=3 5579 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200025704644 [0,1,0,0,0,1|1,0,0]=3 5580 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200025704644 [0,1,0,0,0,1|1,0,0]=3 5581 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200025704644 [0,1,0,0,0,1|1,0,0]=3 5582 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200025704644 [0,1,0,0,0,1|1,0,0]=3 5583 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [0,1,0,0,0,1|2,0,0]=4 5584 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Br 40a_100000210019_100000738038 [0,1,0,0,0,1|2,0,0]=4 5585 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Cl 40a_100000185859_100000738038 [0,1,0,0,0,1|2,0,0]=4 5586 B12R1.119 CS(=O)(=O)Nc1cccc(c1)F 40a_100000210047_100000738038 [0,1,0,0,0,1|2,0,0]=4 5587 B12R1.119 CS(=O)(=O)Nc1cccc(c1)I 40a_100000211102_100000738038 [0,1,0,0,0,1|2,0,0]=4 5588 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 271570a_203496583355_100000165606 [0,1,0,0,0,1|2,0,0]=4 5589 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 40a_100000210217_100000738038 [0,1,0,0,0,1|2,0,0]=4 5590 B12R1.119 Cc1cccc(c1)NC(C)(C)C 34a_100000188690_100000210625 [0,1,0,0,0,1|1,0,1]=4 5591 B12R1.119 Cc1cccc(c1)NS(=O)(=O)C 40a_100000188690_100000738038 [0,1,0,0,0,1|1,0,0]=3 5592 B12R1.119 Cc1cccc(c1)OC(C)(C)C 34a_100000210337_100000210625 [0,1,0,0,0,1|1,0,1]=4 5593 B12R1.119 Cc1cccc(c1)SC(C)(C)C 62a_100000211941_100011215228 [0,1,0,0,0,1|1,0,1]=4 5594 B12R1.119 Cc1cccc(c1)SC(C)(C)C 62a_100011215228_100000211941 [0,1,0,0,0,1|1,0,1]=4 5595 B12R1.127 CC(=Cc1cc(ccc1Br)Br)C 271570a_100102525489_100011483371 [0,1,0,0,0,1|2,0,0]=4 5596 B12R1.127 CC(=Cc1cc(ccc1Br)C)C 271570a_100102525489_100012353751 [0,1,0,0,0,1|1,0,0]=3 5597 B12R1.127 CC(=Cc1cc(ccc1Br)Cl)C 271570a_100102525489_100012339723 [0,1,0,0,0,1|2,0,0]=4 5598 B12R1.127 CC(=Cc1cc(ccc1Br)F)C 271570a_100102525489_100011217576 [0,1,0,0,0,1|2,0,0]=4 5599 B12R1.127 CC(=Cc1cc(ccc1Br)N)C 271570a_100102525489_100000750459 [0,1,0,0,0,1|2,0,0]=4 5600 B12R1.127 CC(=Cc1cc(ccc1Br)O)C 271570a_100102525489_100012339312 [0,1,0,0,0,1|2,0,0]=4 5601 B12R1.127 CC(=Cc1cc(ccc1C)Br)C 271570a_100102525489_100011344865 [0,1,0,0,0,1|2,0,0]=4 5602 B12R1.127 CC(=Cc1cc(ccc1C)C)C 271570a_100102525489_100000210833 [0,1,0,0,0,1|1,0,0]=3 5603 B12R1.127 CC(=Cc1cc(ccc1C)Cl)C 271570a_100102525489_100011263213 [0,1,0,0,0,1|2,0,0]=4 5604 B12R1.127 CC(=Cc1cc(ccc1C)F)C 271570a_100102525489_100011218078 [0,1,0,0,0,1|2,0,0]=4 5605 B12R1.127 CC(=Cc1cc(ccc1C)N)C 271570a_100102525489_100000736455 [0,1,0,0,0,1|2,0,0]=4 5606 B12R1.127 CC(=Cc1cc(ccc1C)O)C 271570a_100102525489_100011380479 [0,1,0,0,0,1|2,0,0]=4 5607 B12R1.127 CC(=Cc1cc(ccc1Cl)Br)C 271570a_100102525489_100011772130 [0,1,0,0,0,1|2,0,0]=4 5608 B12R1.127 CC(=Cc1cc(ccc1Cl)C)C 271570a_100102525489_100012356289 [0,1,0,0,0,1|1,0,0]=3 5609 B12R1.127 CC(=Cc1cc(ccc1Cl)Cl)C 271570a_100102525489_100000707729 [0,1,0,0,0,1|2,0,0]=4 5610 B12R1.127 CC(=Cc1cc(ccc1Cl)F)C 271570a_100102525489_100011217299 [0,1,0,0,0,1|2,0,0]=4 5611 B12R1.127 CC(=Cc1cc(ccc1Cl)N)C 271570a_100102525489_100012360549 [0,1,0,0,0,1|2,0,0]=4 5612 B12R1.127 CC(=Cc1cc(ccc1Cl)O)C 271570a_100102525489_100000049588 [0,1,0,0,0,1|2,0,0]=4 5613 B12R1.127 CC(=Cc1cc(ccc1F)Br)C 271570a_100102525489_100011217312 [0,1,0,0,0,1|2,0,0]=4 5614 B12R1.127 CC(=Cc1cc(ccc1F)C)C 271570a_100102525489_100000736223 [0,1,0,0,0,1|1,0,0]=3 5615 B12R1.127 CC(=Cc1cc(ccc1F)Cl)C 271570a_100102525489_100011218116 [0,1,0,0,0,1|2,0,0]=4 5616 B12R1.127 CC(=Cc1cc(ccc1F)F)C 271570a_100102525489_100000750033 [0,1,0,0,0,1|2,0,0]=4 5617 B12R1.127 CC(=Cc1cc(ccc1F)N)C 271570a_100102525489_100000760356 [0,1,0,0,0,1|2,0,0]=4 5618 B12R1.127 CC(=Cc1cc(ccc1F)O)C 271570a_100102525489_100000693481 [0,1,0,0,0,1|2,0,0]=4 5619 B12R1.127 CC(=Cc1cc(ccc1N)Br)C 271570a_100102525489_100000187925 [0,1,0,0,0,1|2,0,0]=4 5620 B12R1.127 CC(=Cc1cc(ccc1N)C)C 271570a_100102525489_100000210942 [0,1,0,0,0,1|1,0,0]=3 5621 B12R1.127 CC(=Cc1cc(ccc1N)Cl)C 271570a_100102525489_100000761889 [0,1,0,0,0,1|2,0,0]=4 5622 B12R1.127 CC(=Cc1cc(ccc1N)F)C 271570a_100102525489_100000760547 [0,1,0,0,0,1|2,0,0]=4 5623 B12R1.127 CC(=Cc1cc(ccc1N)N)C 271570a_100102525489_100011534242 [0,1,0,0,0,1|2,0,0]=4 5624 B12R1.127 CC(=Cc1cc(ccc1N)O)C 271570a_100102525489_100012001276 [0,1,0,0,0,1|2,0,0]=4 5625 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,1,0,0,0,1|2,0,0]=4 5626 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,1,0,0,0,1|1,0,0]=3 5627 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,1,0,0,0,1|2,0,0]=4 5628 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,1,0,0,0,1|2,0,0]=4 5629 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,1,0,0,0,1|2,0,0]=4 5630 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,1,0,0,0,1|2,0,0]=4 5631 B12R1.127 CC(=Cc1cc(cnc1C)C)C 271570a_100102525489_100009817436 [0,1,0,0,0,1|2,0,0]=4 5632 B12R1.127 CC(=Cc1cc(cnc1Cl)C)C 271570a_100102525489_100010210167 [0,1,0,0,0,1|2,0,0]=4 5633 B12R1.127 CC(=Cc1cc(cnc1F)C)C 271570a_100102525489_100000049784 [0,1,0,0,0,1|2,0,0]=4 5634 B12R1.127 CC(=Cc1cc(cnc1N)C)C 271570a_100102525489_100000049664 [0,1,0,0,0,1|2,0,0]=4 5635 B12R1.127 CC(=Cc1cc(cnc1O)C)C 271570a_100102525489_100000049931 [0,1,0,0,0,1|2,0,0]=4 5636 B12R1.127 CC(=Cc1cc(ncc1C)C)C 271570a_100102525489_100009862788 [0,1,0,0,0,1|2,0,0]=4 5637 B12R1.127 CC(=Cc1cc(ncc1F)C)C 271570a_100102525489_100009867690 [0,1,0,0,0,1|2,0,0]=4 5638 B12R1.127 CC(=Cc1cc(ncc1O)C)C 271570a_100102525489_100009843476 [0,1,0,0,0,1|2,0,0]=4 5639 B12R1.127 CC(=Cc1cn(ccc1=O)C)C 271570a_100102525489_100010750718 [0,1,0,0,0,1|2,0,0]=4 5640 B12R1.127 CC(=Cc1nc(ccc1C)C)C 271570a_100102525489_100009854376 [0,1,0,0,0,1|2,0,0]=4 5641 B12R1.127 CC(=Cc1nc(ccc1F)C)C 271570a_100102525489_100009817602 [0,1,0,0,0,1|2,0,0]=4 5642 B12R1.127 CC(=Cc1nc(ccc1N)C)C 271570a_100102525489_100000685570 [0,1,0,0,0,1|2,0,0]=4 5643 B12R1.127 CC(=Cc1nc(ccc1O)C)C 271570a_100102525489_100000702858 [0,1,0,0,0,1|2,0,0]=4 5644 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,1,0,0,0,1|1,0,0]=3 5645 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,1,0,0,0,1|1,0,0]=3 5646 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,1,0,0,0,1|0,0,0]=2 5647 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,1,0,0,0,1|1,0,0]=3 5648 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,1,0,0,0,1|1,0,0]=3 5649 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,1,0,0,0,1|1,0,0]=3 5650 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,1,0,0,0,1|1,0,0]=3 5651 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,1,0,0,0,1|1,0,0]=3 5652 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,1,0,0,0,1|1,0,0]=3 5653 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,1,0,0,0,1|0,0,0]=2 5654 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,1,0,0,0,1|0,0,0]=2 5655 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,1,0,0,0,1|1,0,0]=3 5656 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,1,0,0,0,1|1,0,0]=3 5657 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,1,0,0,0,1|1,0,0]=3 5658 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,1,0,0,0,1|1,0,0]=3 5659 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,1,0,0,0,1|1,0,0]=3 5660 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,1,0,0,0,1|0,0,0]=2 5661 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,1,0,0,0,1|1,0,0]=3 5662 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,1,0,0,0,1|1,0,0]=3 5663 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,1,0,0,0,1|1,0,0]=3 5664 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,1,0,0,0,1|1,0,0]=3 5665 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,1,0,0,0,1|1,0,0]=3 5666 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,1,0,0,0,1|1,0,0]=3 5667 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,1,0,0,0,1|1,0,0]=3 5668 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,1,0,0,0,1|0,0,0]=2 5669 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,1,0,0,0,1|0,0,0]=2 5670 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,1,0,0,0,1|1,0,0]=3 5671 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,1,0,0,0,1|1,0,0]=3 5672 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,1,0,0,0,1|1,0,0]=3 5673 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,1,0,0,0,1|1,0,0]=3 5674 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,1,0,0,0,1|1,0,0]=3 5675 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,1,0,0,0,1|1,0,0]=3 5676 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,1,0,0,0,1|1,0,0]=3 5677 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,1,0,0,0,1|1,0,0]=3 5678 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,1,0,0,0,1|1,0,0]=3 5679 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,1,0,0,0,1|1,0,0]=3 5680 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,1,0,0,0,1|1,0,0]=3 5681 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,1,0,0,0,1|1,0,0]=3 5682 B12R1.127 CC(=O)Cc1cc(cnc1Br)Br 1458a_100000070787_100010253922 [0,1,0,0,0,1|2,0,0]=4 5683 B12R1.127 CC(=O)Cc1cc(cnc1Cl)Br 1458a_100000070787_100009816982 [0,1,0,0,0,1|2,0,0]=4 5684 B12R1.127 CC(=O)Cc1nc(ccc1Cl)C 1458a_100000070787_200009852033 [0,1,0,0,0,1|1,0,0]=3 5685 B12R1.127 CC(=O)Cc1nc(ccc1Cl)Cl 1458a_100000070787_100000059412 [0,1,0,0,0,1|2,0,0]=4 5686 B12R1.127 CC(=O)Cc1nc(ccc1F)Br 1458a_100000070787_100010065826 [0,1,0,0,0,1|2,0,0]=4 5687 B12R1.127 CC(=O)Cc1nc(ccc1F)Cl 1458a_100000070787_100009881012 [0,1,0,0,0,1|2,0,0]=4 5688 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,1,0,0,0,1|1,0,0]=3 5689 B12R1.127 CC(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200000210301 [0,1,0,0,0,1|2,0,0]=4 5690 B12R1.127 CC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_200000210301 [0,1,0,0,0,1|1,0,0]=3 5691 B12R1.127 CC(=O)Cn1nc(ccc1=O)C 1458a_100000752069_200000210301 [0,1,0,0,0,1|2,0,0]=4 5692 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [0,1,0,0,0,1|1,0,0]=3 5693 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [0,1,0,0,0,1|1,0,0]=3 5694 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [0,1,0,0,0,1|0,0,0]=2 5695 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [0,1,0,0,0,1|0,0,0]=2 5696 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [0,1,0,0,0,1|1,0,0]=3 5697 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [0,1,0,0,0,1|1,0,0]=3 5698 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [0,1,0,0,0,1|1,0,0]=3 5699 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [0,1,0,0,0,1|1,0,0]=3 5700 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [0,1,0,0,0,1|1,0,0]=3 5701 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [0,1,0,0,0,1|1,0,0]=3 5702 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [0,1,0,0,0,1|1,0,0]=3 5703 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [0,1,0,0,0,1|1,0,0]=3 5704 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [0,1,0,0,0,1|1,0,0]=3 5705 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [0,1,0,0,0,1|1,0,0]=3 5706 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [0,1,0,0,0,1|1,0,0]=3 5707 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [0,1,0,0,0,1|1,0,0]=3 5708 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [0,1,0,0,0,1|0,0,0]=2 5709 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [0,1,0,0,0,1|0,0,0]=2 5710 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [0,1,0,0,0,1|0,0,0]=2 5711 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [0,1,0,0,0,1|1,0,0]=3 5712 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [0,1,0,0,0,1|1,0,0]=3 5713 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [0,1,0,0,0,1|1,0,0]=3 5714 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [0,1,0,0,0,1|1,0,0]=3 5715 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [0,1,0,0,0,1|1,0,0]=3 5716 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [0,1,0,0,0,1|1,0,0]=3 5717 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [0,1,0,0,0,1|1,0,0]=3 5718 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [0,1,0,0,0,1|1,0,0]=3 5719 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [0,1,0,0,0,1|1,0,0]=3 5720 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [0,1,0,0,0,1|1,0,0]=3 5721 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [0,1,0,0,0,1|1,0,0]=3 5722 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [0,1,0,0,0,1|1,0,0]=3 5723 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [0,1,0,0,0,1|1,0,0]=3 5724 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [0,1,0,0,0,1|1,0,0]=3 5725 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [0,1,0,0,0,1|1,0,0]=3 5726 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [0,1,0,0,0,1|1,0,0]=3 5727 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [0,1,0,0,0,1|0,0,0]=2 5728 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [0,1,0,0,0,1|0,0,0]=2 5729 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [0,1,0,0,0,1|0,0,0]=2 5730 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [0,1,0,0,0,1|1,0,0]=3 5731 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [0,1,0,0,0,1|1,0,0]=3 5732 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [0,1,0,0,0,1|1,0,0]=3 5733 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [0,1,0,0,0,1|1,0,0]=3 5734 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [0,1,0,0,0,1|1,0,0]=3 5735 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [0,1,0,0,0,1|1,0,0]=3 5736 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [0,1,0,0,0,1|1,0,0]=3 5737 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [0,1,0,0,0,1|1,0,0]=3 5738 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [0,1,0,0,0,1|1,0,0]=3 5739 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [0,1,0,0,0,1|1,0,0]=3 5740 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [0,1,0,0,0,1|0,0,0]=2 5741 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [0,1,0,0,0,1|0,0,0]=2 5742 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [0,1,0,0,0,1|0,0,0]=2 5743 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [0,1,0,0,0,1|0,0,0]=2 5744 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [0,1,0,0,0,1|1,0,0]=3 5745 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [0,1,0,0,0,1|1,0,0]=3 5746 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [0,1,0,0,0,1|1,0,0]=3 5747 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [0,1,0,0,0,1|1,0,0]=3 5748 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [0,1,0,0,0,1|1,0,0]=3 5749 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [0,1,0,0,0,1|1,0,0]=3 5750 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [0,1,0,0,0,1|1,0,0]=3 5751 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [0,1,0,0,0,1|1,0,0]=3 5752 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [0,1,0,0,0,1|1,0,0]=3 5753 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [0,1,0,0,0,1|1,0,0]=3 5754 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [0,1,0,0,0,1|1,0,0]=3 5755 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [0,1,0,0,0,1|1,0,0]=3 5756 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [0,1,0,0,0,1|1,0,0]=3 5757 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [0,1,0,0,0,1|0,0,0]=2 5758 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [0,1,0,0,0,1|0,0,0]=2 5759 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [0,1,0,0,0,1|1,0,0]=3 5760 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [0,1,0,0,0,1|1,0,0]=3 5761 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [0,1,0,0,0,1|1,0,0]=3 5762 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [0,1,0,0,0,1|1,0,0]=3 5763 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [0,1,0,0,0,1|1,0,0]=3 5764 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,1,0,0,0,1|1,0,0]=3 5765 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,1,0,0,0,1|1,0,0]=3 5766 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,1,0,0,0,1|0,0,0]=2 5767 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,1,0,0,0,1|0,0,0]=2 5768 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,1,0,0,0,1|0,0,0]=2 5769 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,1,0,0,0,1|1,0,0]=3 5770 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,1,0,0,0,1|1,0,0]=3 5771 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,1,0,0,0,1|1,0,0]=3 5772 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,1,0,0,0,1|1,0,0]=3 5773 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,1,0,0,0,1|1,0,0]=3 5774 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,1,0,0,0,1|1,0,0]=3 5775 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,1,0,0,0,1|1,0,0]=3 5776 B12R1.127 CC(=O)Nc1cc(cnc1C)O 271570a_203496583355_100010117071 [0,1,0,0,0,1|2,0,0]=4 5777 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [0,1,0,0,0,1|1,0,0]=3 5778 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,1,0,0,0,1|1,0,0]=3 5779 B12R1.127 Cc1ccc(=O)n(c1)CC(=O)[13CH3] 1458a_100009850670_200025704644 [0,1,0,0,0,1|1,0,0]=3 5780 B12R1.127 Cc1ccc(=O)n(n1)CC(=O)[13CH3] 1458a_100000752069_200025704644 [0,1,0,0,0,1|2,0,0]=4 5781 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,1,0,0,0,1|0,0,0]=2 5782 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,1,0,0,0,1|0,0,0]=2 5783 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,1,0,0,0,1|0,0,0]=2 5784 B12R1.127 Cc1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100011551863 [0,1,0,0,0,1|2,0,0]=4 5785 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 2230a_100102631434_100000184699 [0,1,0,0,0,1|2,0,0]=4 5786 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 269982a_100102631434_100000184699 [0,1,0,0,0,1|2,0,0]=4 5787 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100000211343 [0,1,0,0,0,1|2,0,0]=4 5788 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100009871730 [0,1,0,0,0,1|2,0,0]=4 5789 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100009871730 [0,1,0,0,0,1|2,0,0]=4 5790 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100011551332 [0,1,0,0,0,1|2,0,0]=4 5791 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_100102631434_100011260760 [0,1,0,0,0,1|2,0,0]=4 5792 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_102515433075_200000210301 [0,1,0,0,0,1|2,0,0]=4 5793 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_100102631434_100011260760 [0,1,0,0,0,1|2,0,0]=4 5794 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_102515433075_200000210301 [0,1,0,0,0,1|2,0,0]=4 5795 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 270004a_100102631434_100000756917 [0,1,0,0,0,1|2,0,0]=4 5796 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 34a_102515433075_200000210301 [0,1,0,0,0,1|2,0,0]=4 5797 B12R1.127 Cc1ccc(c(c1)CN(C)C)I 270004a_100102631434_100010150105 [0,1,0,0,0,1|2,0,0]=4 5798 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 2230a_102515433075_200025704644 [0,1,0,0,0,1|2,0,0]=4 5799 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 269982a_102515433075_200025704644 [0,1,0,0,0,1|2,0,0]=4 5800 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 34a_102515433075_200025704644 [0,1,0,0,0,1|2,0,0]=4 5801 B12R1.127 Cc1ccc(c(c1)NC(C)C)Br 34a_100000745044_100000210206 [0,1,0,0,0,1|1,0,1]=4 5802 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 2230a_100000185781_100000210206 [0,1,0,0,0,1|1,0,1]=4 5803 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 34a_100000185781_100000210206 [0,1,0,0,0,1|1,0,1]=4 5804 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 7a_100000185781_100000210206 [0,1,0,0,0,1|1,0,1]=4 5805 B12R1.127 Cc1ccc(c(c1)NC(C)C)Cl 34a_100011215360_100000210206 [0,1,0,0,0,1|1,0,1]=4 5806 B12R1.127 Cc1ccc(c(c1)NC(C)C)F 34a_100000211285_100000210206 [0,1,0,0,0,1|1,0,1]=4 5807 B12R1.127 Cc1ccc(c(c1)NC(C)C)I 34a_100011216686_100000210206 [0,1,0,0,0,1|1,0,1]=4 5808 B12R1.127 Cc1ccc(c(c1)NC(C)C)O 34a_100011215204_100000210206 [0,1,0,0,0,1|1,0,1]=4 5809 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 34a_100012002257_100000210206 [0,1,0,0,0,1|1,0,1]=4 5810 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 7a_100012002257_100000210206 [0,1,0,0,0,1|1,0,1]=4 5811 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 34a_100000210931_100000210206 [0,1,0,0,0,1|1,0,1]=4 5812 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 7a_100000210931_100000210206 [0,1,0,0,0,1|1,0,1]=4 5813 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 34a_100000211493_100000210206 [0,1,0,0,0,1|1,0,1]=4 5814 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 7a_100000211493_100000210206 [0,1,0,0,0,1|1,0,1]=4 5815 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 34a_100000759540_100000210206 [0,1,0,0,0,1|1,0,1]=4 5816 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 7a_100000759540_100000210206 [0,1,0,0,0,1|1,0,1]=4 5817 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 34a_100000211527_100000210206 [0,1,0,0,0,1|1,0,1]=4 5818 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 7a_100000211527_100000210206 [0,1,0,0,0,1|1,0,1]=4 5819 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100000210206_100012353751 [0,1,0,0,0,1|1,0,1]=4 5820 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100012353751_100000210206 [0,1,0,0,0,1|1,0,1]=4 5821 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210206_100000210833 [0,1,0,0,0,1|1,0,1]=4 5822 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210833_100000210206 [0,1,0,0,0,1|1,0,1]=4 5823 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100000210206_100012356289 [0,1,0,0,0,1|1,0,1]=4 5824 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100012356289_100000210206 [0,1,0,0,0,1|1,0,1]=4 5825 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000210206_100000736223 [0,1,0,0,0,1|1,0,1]=4 5826 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000736223_100000210206 [0,1,0,0,0,1|1,0,1]=4 5827 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100000210206_100011356834 [0,1,0,0,0,1|1,0,1]=4 5828 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100011356834_100000210206 [0,1,0,0,0,1|1,0,1]=4 5829 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000765521 [0,1,0,0,0,1|1,0,1]=4 5830 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000765521_100000210206 [0,1,0,0,0,1|1,0,1]=4 5831 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,1,0,0,0,1|1,0,0]=3 5832 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,1,0,0,0,1|1,0,0]=3 5833 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,1,0,0,0,1|1,0,0]=3 5834 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,1,0,0,0,1|1,0,0]=3 5835 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,1,0,0,0,1|1,0,0]=3 5836 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,1,0,0,0,1|1,0,0]=3 5837 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,1,0,0,0,1|1,0,0]=3 5838 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,1,0,0,0,1|1,0,0]=3 5839 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,1,0,0,0,1|1,0,0]=3 5840 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,1,0,0,0,1|1,0,0]=3 5841 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,1,0,0,0,1|1,0,0]=3 5842 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,1,0,0,0,1|1,0,0]=3 5843 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,1,0,0,0,1|1,0,0]=3 5844 B12R1.127 [13CH3]C(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200025704644 [0,1,0,0,0,1|2,0,0]=4 5845 B12R1.224 CC(=Cc1cccc(c1Br)O)C 271570a_100102525489_100010187914 [0,1,0,0,0,1|2,0,0]=4 5846 B12R1.224 CC(=Cc1cccc(c1C)Br)C 271570a_100102525489_100012353703 [0,1,0,0,0,1|2,0,0]=4 5847 B12R1.224 CC(=Cc1cccc(c1C)C)C 271570a_100102525489_100011214922 [0,1,0,0,0,1|1,0,0]=3 5848 B12R1.224 CC(=Cc1cccc(c1C)Cl)C 271570a_100102525489_100000726075 [0,1,0,0,0,1|2,0,0]=4 5849 B12R1.224 CC(=Cc1cccc(c1C)F)C 271570a_100102525489_100011216893 [0,1,0,0,0,1|2,0,0]=4 5850 B12R1.224 CC(=Cc1cccc(c1C)N)C 271570a_100102525489_100000761887 [0,1,0,0,0,1|2,0,0]=4 5851 B12R1.224 CC(=Cc1cccc(c1C)O)C 271570a_100102525489_100012002258 [0,1,0,0,0,1|2,0,0]=4 5852 B12R1.224 CC(=Cc1cccc(c1Cl)Br)C 271570a_100102525489_100010142854 [0,1,0,0,0,1|2,0,0]=4 5853 B12R1.224 CC(=Cc1cccc(c1Cl)C)C 271570a_100102525489_200012352035 [0,1,0,0,0,1|1,0,0]=3 5854 B12R1.224 CC(=Cc1cccc(c1Cl)Cl)C 271570a_100102525489_100011215384 [0,1,0,0,0,1|2,0,0]=4 5855 B12R1.224 CC(=Cc1cccc(c1Cl)F)C 271570a_100102525489_200010234923 [0,1,0,0,0,1|2,0,0]=4 5856 B12R1.224 CC(=Cc1cccc(c1Cl)O)C 271570a_100102525489_100000049636 [0,1,0,0,0,1|2,0,0]=4 5857 B12R1.224 CC(=Cc1cccc(c1F)Br)C 271570a_100102525489_100000702267 [0,1,0,0,0,1|2,0,0]=4 5858 B12R1.224 CC(=Cc1cccc(c1F)C)C 271570a_100102525489_100000717567 [0,1,0,0,0,1|1,0,0]=3 5859 B12R1.224 CC(=Cc1cccc(c1F)Cl)C 271570a_100102525489_100011217346 [0,1,0,0,0,1|2,0,0]=4 5860 B12R1.224 CC(=Cc1cccc(c1F)F)C 271570a_100102525489_100000694657 [0,1,0,0,0,1|2,0,0]=4 5861 B12R1.224 CC(=Cc1cccc(c1F)N)C 271570a_100102525489_100011935091 [0,1,0,0,0,1|2,0,0]=4 5862 B12R1.224 CC(=Cc1cccc(c1F)O)C 271570a_100102525489_100009817021 [0,1,0,0,0,1|2,0,0]=4 5863 B12R1.224 CC(=Cc1cccc(c1N)Br)C 271570a_100102525489_100010146558 [0,1,0,0,0,1|2,0,0]=4 5864 B12R1.224 CC(=Cc1cccc(c1N)C)C 271570a_100102525489_100011834072 [0,1,0,0,0,1|1,0,0]=3 5865 B12R1.224 CC(=Cc1cccc(c1N)Cl)C 271570a_100102525489_100010190421 [0,1,0,0,0,1|2,0,0]=4 5866 B12R1.224 CC(=Cc1cccc(c1N)F)C 271570a_100102525489_100000042321 [0,1,0,0,0,1|2,0,0]=4 5867 B12R1.224 CC(=Cc1cccc(c1N)N)C 271570a_100102525489_100015191791 [0,1,0,0,0,1|2,0,0]=4 5868 B12R1.224 CC(=Cc1cccc(c1N)O)C 271570a_100102525489_100011934926 [0,1,0,0,0,1|2,0,0]=4 5869 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,1,0,0,0,1|2,0,0]=4 5870 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,1,0,0,0,1|1,0,0]=3 5871 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,1,0,0,0,1|2,0,0]=4 5872 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,1,0,0,0,1|2,0,0]=4 5873 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,1,0,0,0,1|2,0,0]=4 5874 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,1,0,0,0,1|2,0,0]=4 5875 B12R1.224 CC(=Cc1cccn(c1=O)C)C 271570a_100102525489_100000687173 [0,1,0,0,0,1|2,0,0]=4 5876 B12R1.224 CC(=Cc1ccnc(c1C)C)C 271570a_100102525489_100009846815 [0,1,0,0,0,1|2,0,0]=4 5877 B12R1.224 CC(=Cc1ccnc(c1Cl)C)C 271570a_100102525489_100000698670 [0,1,0,0,0,1|2,0,0]=4 5878 B12R1.224 CC(=Cc1ccnc(c1F)C)C 271570a_100102525489_100009849794 [0,1,0,0,0,1|2,0,0]=4 5879 B12R1.224 CC(=Cc1ccnc(c1N)C)C 271570a_100102525489_100009885578 [0,1,0,0,0,1|2,0,0]=4 5880 B12R1.224 CC(=Cc1cncc(c1C)C)C 271570a_100102525489_100009864703 [0,1,0,0,0,1|2,0,0]=4 5881 B12R1.224 CC(=Cc1cncc(c1N)C)C 271570a_100102525489_100009818025 [0,1,0,0,0,1|2,0,0]=4 5882 B12R1.224 CC(=Cc1nccc(c1C)C)C 271570a_100102525489_100009847204 [0,1,0,0,0,1|2,0,0]=4 5883 B12R1.224 CC(=Cc1nccc(c1F)C)C 271570a_100102525489_100009817629 [0,1,0,0,0,1|2,0,0]=4 5884 B12R1.224 CC(=Cc1nccc(c1N)C)C 271570a_100102525489_100000763560 [0,1,0,0,0,1|2,0,0]=4 5885 B12R1.224 CC(=Cc1nccc(c1O)C)C 271570a_100102525489_100000696282 [0,1,0,0,0,1|2,0,0]=4 5886 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,1,0,0,0,1|0,0,0]=2 5887 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,1,0,0,0,1|0,0,0]=2 5888 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,1,0,0,0,1|1,0,0]=3 5889 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,1,0,0,0,1|1,0,0]=3 5890 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,1,0,0,0,1|1,0,0]=3 5891 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,1,0,0,0,1|1,0,0]=3 5892 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,1,0,0,0,1|1,0,0]=3 5893 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,1,0,0,0,1|1,0,0]=3 5894 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,1,0,0,0,1|0,0,0]=2 5895 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,1,0,0,0,1|0,0,0]=2 5896 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,1,0,0,0,1|1,0,0]=3 5897 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,1,0,0,0,1|1,0,0]=3 5898 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,1,0,0,0,1|1,0,0]=3 5899 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,1,0,0,0,1|1,0,0]=3 5900 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,1,0,0,0,1|1,0,0]=3 5901 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,1,0,0,0,1|1,0,0]=3 5902 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,1,0,0,0,1|1,0,0]=3 5903 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,1,0,0,0,1|1,0,0]=3 5904 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,1,0,0,0,1|1,0,0]=3 5905 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,1,0,0,0,1|1,0,0]=3 5906 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,1,0,0,0,1|1,0,0]=3 5907 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,1,0,0,0,1|1,0,0]=3 5908 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,1,0,0,0,1|0,0,0]=2 5909 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,1,0,0,0,1|1,0,0]=3 5910 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,1,0,0,0,1|1,0,0]=3 5911 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,1,0,0,0,1|1,0,0]=3 5912 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,1,0,0,0,1|1,0,0]=3 5913 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,1,0,0,0,1|1,0,0]=3 5914 B12R1.224 CC(=O)Cc1nccc(c1C)Cl 1458a_100000070787_100020614443 [0,1,0,0,0,1|2,0,0]=4 5915 B12R1.224 CC(=O)Cn1cccc(c1=O)C 1458a_100000697016_200000210301 [0,1,0,0,0,1|1,0,0]=3 5916 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,1,0,0,0,1|0,0,0]=2 5917 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,1,0,0,0,1|0,0,0]=2 5918 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,1,0,0,0,1|0,0,0]=2 5919 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100015343762 [0,1,0,0,0,1|1,0,0]=3 5920 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100015343762 [0,1,0,0,0,1|1,0,0]=3 5921 B12R1.224 CC(=O)Nc1cccc(c1Br)F 11a_100011934729_100015343762 [0,1,0,0,0,1|1,0,0]=3 5922 B12R1.224 CC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100015343762 [0,1,0,0,0,1|1,0,0]=3 5923 B12R1.224 CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000070787 [0,1,0,0,0,1|1,0,0]=3 5924 B12R1.224 CC(=O)Nc1cccc(c1C)Br 11a_100000750434_100015343762 [0,1,0,0,0,1|1,0,0]=3 5925 B12R1.224 CC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100015343762 [0,1,0,0,0,1|1,0,0]=3 5926 B12R1.224 CC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000070787 [0,1,0,0,0,1|1,0,0]=3 5927 B12R1.224 CC(=O)Nc1cccc(c1C)Br 527a_100000750434_100103153847 [0,1,0,0,0,1|1,0,0]=3 5928 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,1,0,0,0,1|0,0,0]=2 5929 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,1,0,0,0,1|0,0,0]=2 5930 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,1,0,0,0,1|0,0,0]=2 5931 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,1,0,0,0,1|0,0,0]=2 5932 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100015343762 [0,1,0,0,0,1|1,0,0]=3 5933 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100015343762 [0,1,0,0,0,1|1,0,0]=3 5934 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000070787 [0,1,0,0,0,1|1,0,0]=3 5935 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100103153847 [0,1,0,0,0,1|1,0,0]=3 5936 B12R1.224 CC(=O)Nc1cccc(c1C)F 11a_100000745574_100015343762 [0,1,0,0,0,1|1,0,0]=3 5937 B12R1.224 CC(=O)Nc1cccc(c1C)F 1626a_100000745574_100015343762 [0,1,0,0,0,1|1,0,0]=3 5938 B12R1.224 CC(=O)Nc1cccc(c1C)F 22a_100000745574_100000070787 [0,1,0,0,0,1|1,0,0]=3 5939 B12R1.224 CC(=O)Nc1cccc(c1C)F 527a_100000745574_100103153847 [0,1,0,0,0,1|1,0,0]=3 5940 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [0,1,0,0,0,1|1,0,0]=3 5941 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [0,1,0,0,0,1|1,0,0]=3 5942 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [0,1,0,0,0,1|1,0,0]=3 5943 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [0,1,0,0,0,1|1,0,0]=3 5944 B12R1.224 CC(=O)Nc1cccc(c1C)O 11a_100011216573_100015343762 [0,1,0,0,0,1|1,0,0]=3 5945 B12R1.224 CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000070787 [0,1,0,0,0,1|1,0,0]=3 5946 B12R1.224 CC(=O)Nc1cccc(c1C)O 527a_100011216573_100103153847 [0,1,0,0,0,1|1,0,0]=3 5947 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100015343762 [0,1,0,0,0,1|1,0,0]=3 5948 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100015343762 [0,1,0,0,0,1|1,0,0]=3 5949 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100103153847 [0,1,0,0,0,1|1,0,0]=3 5950 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,1,0,0,0,1|0,0,0]=2 5951 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,1,0,0,0,1|0,0,0]=2 5952 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,1,0,0,0,1|0,0,0]=2 5953 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100015343762 [0,1,0,0,0,1|1,0,0]=3 5954 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100015343762 [0,1,0,0,0,1|1,0,0]=3 5955 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100015343762 [0,1,0,0,0,1|1,0,0]=3 5956 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100015343762 [0,1,0,0,0,1|1,0,0]=3 5957 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000070787 [0,1,0,0,0,1|1,0,0]=3 5958 B12R1.224 CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000070787 [0,1,0,0,0,1|1,0,0]=3 5959 B12R1.224 CC(=O)Nc1cccc(c1F)Br 11a_100011935091_100015343762 [0,1,0,0,0,1|1,0,0]=3 5960 B12R1.224 CC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100015343762 [0,1,0,0,0,1|1,0,0]=3 5961 B12R1.224 CC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000070787 [0,1,0,0,0,1|1,0,0]=3 5962 B12R1.224 CC(=O)Nc1cccc(c1F)Br 527a_100011935091_100103153847 [0,1,0,0,0,1|1,0,0]=3 5963 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,1,0,0,0,1|0,0,0]=2 5964 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,1,0,0,0,1|0,0,0]=2 5965 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,1,0,0,0,1|0,0,0]=2 5966 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100015343762 [0,1,0,0,0,1|1,0,0]=3 5967 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100015343762 [0,1,0,0,0,1|1,0,0]=3 5968 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000070787 [0,1,0,0,0,1|1,0,0]=3 5969 B12R1.224 CC(=O)Nc1cccc(c1F)F 11a_100000743855_100015343762 [0,1,0,0,0,1|1,0,0]=3 5970 B12R1.224 CC(=O)Nc1cccc(c1F)F 1626a_100000743855_100015343762 [0,1,0,0,0,1|1,0,0]=3 5971 B12R1.224 CC(=O)Nc1cccc(c1F)F 22a_100000743855_100000070787 [0,1,0,0,0,1|1,0,0]=3 5972 B12R1.224 CC(=O)Nc1cccc(c1I)Br 11a_100020590159_100015343762 [0,1,0,0,0,1|1,0,0]=3 5973 B12R1.224 CC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100015343762 [0,1,0,0,0,1|1,0,0]=3 5974 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,1,0,0,0,1|0,0,0]=2 5975 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,1,0,0,0,1|0,0,0]=2 5976 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100015343762 [0,1,0,0,0,1|1,0,0]=3 5977 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100015343762 [0,1,0,0,0,1|1,0,0]=3 5978 B12R1.224 CC(=O)Nc1cccc(c1I)F 11a_100000690935_100015343762 [0,1,0,0,0,1|1,0,0]=3 5979 B12R1.224 CC(=O)Nc1cccc(c1I)F 1626a_100000690935_100015343762 [0,1,0,0,0,1|1,0,0]=3 5980 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,1,0,0,0,1|1,0,0]=3 5981 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,1,0,0,0,1|1,0,0]=3 5982 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,1,0,0,0,1|0,0,0]=2 5983 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,1,0,0,0,1|0,0,0]=2 5984 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,1,0,0,0,1|0,0,0]=2 5985 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,1,0,0,0,1|0,0,0]=2 5986 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,1,0,0,0,1|1,0,0]=3 5987 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,1,0,0,0,1|1,0,0]=3 5988 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,1,0,0,0,1|1,0,0]=3 5989 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,1,0,0,0,1|1,0,0]=3 5990 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,1,0,0,0,1|1,0,0]=3 5991 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,1,0,0,0,1|1,0,0]=3 5992 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,1,0,0,0,1|1,0,0]=3 5993 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,1,0,0,0,1|1,0,0]=3 5994 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,1,0,0,0,1|1,0,0]=3 5995 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,1,0,0,0,1|0,0,0]=2 5996 B12R1.224 Cc1cccc(c1Br)CN(C)C 2230a_100102631434_200012349612 [0,1,0,0,0,1|2,0,0]=4 5997 B12R1.224 Cc1cccc(c1Br)CN(C)C 269982a_100102631434_200012349612 [0,1,0,0,0,1|2,0,0]=4 5998 B12R1.224 Cc1cccc(c1Br)CN(C)C 270004a_100102631434_100012186367 [0,1,0,0,0,1|2,0,0]=4 5999 B12R1.224 Cc1cccc(c1Br)NC(C)C 34a_100000684715_100000210206 [0,1,0,0,0,1|1,0,1]=4 6000 B12R1.224 Cc1cccc(c1Br)OC(C)C 34a_100000686692_100000210206 [0,1,0,0,0,1|1,0,1]=4 6001 B12R1.224 Cc1cccc(c1Br)OC(C)C 7a_100000686692_100000210206 [0,1,0,0,0,1|1,0,1]=4 6002 B12R1.224 Cc1cccc(c1Br)SC(C)C 62a_100000210206_100012362457 [0,1,0,0,0,1|1,0,1]=4 6003 B12R1.224 Cc1cccc(c1Br)SC(C)C 62a_100012362457_100000210206 [0,1,0,0,0,1|1,0,1]=4 6004 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,1,0,0,0,1|0,0,0]=2 6005 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100000207598_200000210301 [0,1,0,0,0,1|2,0,0]=4 6006 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100102631434_100011515928 [0,1,0,0,0,1|2,0,0]=4 6007 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100000207598_200000210301 [0,1,0,0,0,1|2,0,0]=4 6008 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100102631434_100011515928 [0,1,0,0,0,1|2,0,0]=4 6009 B12R1.224 Cc1cccc(c1C)CN(C)C 270004a_100102631434_100000229941 [0,1,0,0,0,1|2,0,0]=4 6010 B12R1.224 Cc1cccc(c1C)CN(C)C 34a_100000207598_200000210301 [0,1,0,0,0,1|2,0,0]=4 6011 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 2230a_100000207598_200025704644 [0,1,0,0,0,1|2,0,0]=4 6012 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 269982a_100000207598_200025704644 [0,1,0,0,0,1|2,0,0]=4 6013 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 34a_100000207598_200025704644 [0,1,0,0,0,1|2,0,0]=4 6014 B12R1.224 Cc1cccc(c1C)NC(C)C 2230a_100000210026_100000210206 [0,1,0,0,0,1|1,0,1]=4 6015 B12R1.224 Cc1cccc(c1C)NC(C)C 34a_100000210026_100000210206 [0,1,0,0,0,1|1,0,1]=4 6016 B12R1.224 Cc1cccc(c1C)NC(C)C 7a_100000210026_100000210206 [0,1,0,0,0,1|1,0,1]=4 6017 B12R1.224 Cc1cccc(c1C)OC(C)C 34a_100000185855_100000210206 [0,1,0,0,0,1|1,0,1]=4 6018 B12R1.224 Cc1cccc(c1C)OC(C)C 7a_100000185855_100000210206 [0,1,0,0,0,1|1,0,1]=4 6019 B12R1.224 Cc1cccc(c1C)SC(C)C 62a_100000210206_100011214922 [0,1,0,0,0,1|1,0,1]=4 6020 B12R1.224 Cc1cccc(c1C)SC(C)C 62a_100011214922_100000210206 [0,1,0,0,0,1|1,0,1]=4 6021 B12R1.224 Cc1cccc(c1Cl)CN(C)C 270004a_100102631434_100012017286 [0,1,0,0,0,1|2,0,0]=4 6022 B12R1.224 Cc1cccc(c1Cl)NC(C)C 34a_100000765562_100000210206 [0,1,0,0,0,1|1,0,1]=4 6023 B12R1.224 Cc1cccc(c1Cl)NC(C)C 7a_100000765562_100000210206 [0,1,0,0,0,1|1,0,1]=4 6024 B12R1.224 Cc1cccc(c1Cl)OC(C)C 34a_100000695629_100000210206 [0,1,0,0,0,1|1,0,1]=4 6025 B12R1.224 Cc1cccc(c1Cl)OC(C)C 7a_100000695629_100000210206 [0,1,0,0,0,1|1,0,1]=4 6026 B12R1.224 Cc1cccc(c1Cl)SC(C)C 62a_100000210206_200012352035 [0,1,0,0,0,1|1,0,1]=4 6027 B12R1.224 Cc1cccc(c1Cl)SC(C)C 62a_200012352035_100000210206 [0,1,0,0,0,1|1,0,1]=4 6028 B12R1.224 Cc1cccc(c1F)CN(C)C 2230a_100102631434_100011216058 [0,1,0,0,0,1|2,0,0]=4 6029 B12R1.224 Cc1cccc(c1F)CN(C)C 269982a_100102631434_100011216058 [0,1,0,0,0,1|2,0,0]=4 6030 B12R1.224 Cc1cccc(c1F)CN(C)C 270004a_100102631434_100011219516 [0,1,0,0,0,1|2,0,0]=4 6031 B12R1.224 Cc1cccc(c1F)NC(C)C 2230a_100000697159_100000210206 [0,1,0,0,0,1|1,0,1]=4 6032 B12R1.224 Cc1cccc(c1F)NC(C)C 34a_100000697159_100000210206 [0,1,0,0,0,1|1,0,1]=4 6033 B12R1.224 Cc1cccc(c1F)NC(C)C 7a_100000697159_100000210206 [0,1,0,0,0,1|1,0,1]=4 6034 B12R1.224 Cc1cccc(c1F)OC(C)C 34a_100000751311_100000210206 [0,1,0,0,0,1|1,0,1]=4 6035 B12R1.224 Cc1cccc(c1F)OC(C)C 7a_100000751311_100000210206 [0,1,0,0,0,1|1,0,1]=4 6036 B12R1.224 Cc1cccc(c1F)SC(C)C 62a_100000210206_100000717567 [0,1,0,0,0,1|1,0,1]=4 6037 B12R1.224 Cc1cccc(c1F)SC(C)C 62a_100000717567_100000210206 [0,1,0,0,0,1|1,0,1]=4 6038 B12R1.224 Cc1cccc(c1I)NC(C)C 34a_100000761888_100000210206 [0,1,0,0,0,1|1,0,1]=4 6039 B12R1.224 Cc1cccc(c1I)OC(C)C 34a_100010083724_100000210206 [0,1,0,0,0,1|1,0,1]=4 6040 B12R1.224 Cc1cccc(c1I)OC(C)C 7a_100010083724_100000210206 [0,1,0,0,0,1|1,0,1]=4 6041 B12R1.224 Cc1cccc(c1N)OC(C)C 34a_100000743429_100000210206 [0,1,0,0,0,1|1,0,1]=4 6042 B12R1.224 Cc1cccc(c1N)OC(C)C 7a_100000743429_100000210206 [0,1,0,0,0,1|1,0,1]=4 6043 B12R1.224 Cc1cccc(c1N)SC(C)C 62a_100000210206_100011834072 [0,1,0,0,0,1|1,0,1]=4 6044 B12R1.224 Cc1cccc(c1N)SC(C)C 62a_100011834072_100000210206 [0,1,0,0,0,1|1,0,1]=4 6045 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,1,0,0,0,1|1,0,0]=3 6046 B12R1.224 Cc1cccc(c1O)NC(C)C 34a_100000756359_100000210206 [0,1,0,0,0,1|1,0,1]=4 6047 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100000210206_100009817157 [0,1,0,0,0,1|1,0,1]=4 6048 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100009817157_100000210206 [0,1,0,0,0,1|1,0,1]=4 6049 B12R1.224 Cc1cccn(c1=O)CC(=O)[13CH3] 1458a_100000697016_200025704644 [0,1,0,0,0,1|1,0,0]=3 6050 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,1,0,0,0,1|1,0,0]=3 6051 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,1,0,0,0,1|1,0,0]=3 6052 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,1,0,0,0,1|1,0,0]=3 6053 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,1,0,0,0,1|1,0,0]=3 6054 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,1,0,0,0,1|1,0,0]=3 6055 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,1,0,0,0,1|1,0,0]=3 6056 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,1,0,0,0,1|1,0,0]=3 6057 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,1,0,0,0,1|1,0,0]=3 6058 B12R1.225 CC(=C(C)c1cc(ccn1)C)C 271570a_200000049429_100000750283 [0,1,0,0,0,1|2,0,0]=4 6059 B12R1.225 CC(=C(C)c1ccc[n+](c1)C)C 271570a_200000049429_100009996589 [0,1,0,0,0,1|2,0,0]=4 6060 B12R1.225 CC(=C(C)c1cccc(c1)Br)C 271570a_200000049429_100000691529 [0,1,0,0,0,1|2,0,0]=4 6061 B12R1.225 CC(=C(C)c1cccc(c1)C)C 271570a_200000049429_100011215228 [0,1,0,0,0,1|1,0,0]=3 6062 B12R1.225 CC(=C(C)c1cccc(c1)Cl)C 271570a_200000049429_100000699651 [0,1,0,0,0,1|2,0,0]=4 6063 B12R1.225 CC(=C(C)c1cccc(c1)F)C 271570a_200000049429_100000685547 [0,1,0,0,0,1|2,0,0]=4 6064 B12R1.225 CC(=C(C)c1cccc(c1)N)C 271570a_200000049429_100000210019 [0,1,0,0,0,1|2,0,0]=4 6065 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,1,0,0,0,1|2,0,0]=4 6066 B12R1.225 CC(=C(C)c1cccc(c1)[S])C 271570a_200000049429_114929384022 [0,1,0,0,0,1|2,0,0]=4 6067 B12R1.225 CC(=C(C)c1cccc(n1)C)C 271570a_200000049429_100000742759 [0,1,0,0,0,1|2,0,0]=4 6068 B12R1.225 CC(=C(C)c1ccnc(c1)C)C 271570a_200000049429_100000758586 [0,1,0,0,0,1|2,0,0]=4 6069 B12R1.225 CC(=C(C)c1cncc(c1)C)C 271570a_200000049429_100000760492 [0,1,0,0,0,1|2,0,0]=4 6070 B12R1.225 CC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_200000210301 [0,1,0,0,0,1|1,0,0]=3 6071 B12R1.225 CC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_200000210301 [0,1,0,0,0,1|1,0,0]=3 6072 B12R1.225 CC(=O)C(C)c1cccc(c1)F 1458a_100000762896_200000210301 [0,1,0,0,0,1|1,0,0]=3 6073 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,1,0,0,0,1|0,0,0]=2 6074 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,1,0,0,0,1|1,0,0]=3 6075 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,1,0,0,0,1|1,0,0]=3 6076 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100015343762 [0,1,0,0,0,1|1,0,0]=3 6077 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100015343762 [0,1,0,0,0,1|1,0,0]=3 6078 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000070787 [0,1,0,0,0,1|1,0,0]=3 6079 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100103153847 [0,1,0,0,0,1|1,0,0]=3 6080 B12R1.225 CC(=O)N(C)c1cccc(c1)C 11a_100000219674_100015343762 [0,1,0,0,0,1|0,0,0]=2 6081 B12R1.225 CC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100015343762 [0,1,0,0,0,1|0,0,0]=2 6082 B12R1.225 CC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000070787 [0,1,0,0,0,1|0,0,0]=2 6083 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100015343762 [0,1,0,0,0,1|1,0,0]=3 6084 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100015343762 [0,1,0,0,0,1|1,0,0]=3 6085 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000070787 [0,1,0,0,0,1|1,0,0]=3 6086 B12R1.225 CC(=O)N(C)c1cccc(c1)F 11a_100020633736_100015343762 [0,1,0,0,0,1|1,0,0]=3 6087 B12R1.225 CC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100015343762 [0,1,0,0,0,1|1,0,0]=3 6088 B12R1.225 CC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000070787 [0,1,0,0,0,1|1,0,0]=3 6089 B12R1.225 CC(=O)N(C)c1cccc(c1)I 11a_100000221217_100015343762 [0,1,0,0,0,1|1,0,0]=3 6090 B12R1.225 CC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100015343762 [0,1,0,0,0,1|1,0,0]=3 6091 B12R1.225 CC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000070787 [0,1,0,0,0,1|1,0,0]=3 6092 B12R1.225 CC(=O)N(C)c1cccc(c1)O 527a_100000756613_100103153847 [0,1,0,0,0,1|1,0,0]=3 6093 B12R1.225 CC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_200000210301 [0,1,0,0,0,1|0,0,0]=2 6094 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000722698_200025704644 [0,1,0,0,0,1|1,0,0]=3 6095 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000762818_200025704644 [0,1,0,0,0,1|1,0,0]=3 6096 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)F 1458a_100000762896_200025704644 [0,1,0,0,0,1|1,0,0]=3 6097 B12R1.225 Cc1cccc(c1)C(=O)C(C)C 1458a_100000189346_100000210206 [0,1,0,0,0,1|1,0,1]=4 6098 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 11a_100102631434_100000189346 [0,1,0,0,0,1|2,0,0]=4 6099 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100000189346 [0,1,0,0,0,1|2,0,0]=4 6100 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100000189346 [0,1,0,0,0,1|2,0,0]=4 6101 B12R1.225 Cc1cccc(c1)C(=O)N(C)C 527a_100102631434_100000189346 [0,1,0,0,0,1|2,0,0]=4 6102 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,1,0,0,0,1|0,0,0]=2 6103 B12R1.225 Cc1cccc(c1)N(C)C(C)C 2230a_100000219674_100000210206 [0,1,0,0,0,1|1,0,1]=4 6104 B12R1.225 Cc1cccc(c1)N(C)C(C)C 269982a_100000219674_100000210206 [0,1,0,0,0,1|1,0,1]=4 6105 B12R1.225 Cc1cccc(c1)N(C)C(C)C 34a_100000219674_100000210206 [0,1,0,0,0,1|1,0,1]=4 6106 B12R1.225 Cc1cccc(c1)[C@@H](C)C(=O)[13CH3] 1458a_200009911544_200025704644 [0,1,0,0,0,1|0,0,0]=2 6107 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,1,0,0,0,1|1,0,0]=3 6108 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,1,0,0,0,1|1,0,0]=3 6109 B12R1.438 C#Cc1cccc(c1)NC(=O)C 11a_100000735509_100015343762 [0,1,0,0,0,1|0,0,1]=3 6110 B12R1.438 C#Cc1cccc(c1)NC(=O)C 1626a_100000735509_100015343762 [0,1,0,0,0,1|0,0,1]=3 6111 B12R1.438 C#Cc1cccc(c1)NC(=O)C 22a_100000735509_100000070787 [0,1,0,0,0,1|0,0,1]=3 6112 B12R1.438 C#Cc1cccc(c1)NC(=O)C 527a_100000735509_100103153847 [0,1,0,0,0,1|0,0,1]=3 6113 B12R1.438 C=Cc1cc(ccn1)NC(=O)C 271570a_100011290941_100000238608 [0,1,0,0,0,1|1,0,1]=4 6114 B12R1.438 C=Cc1cccc(c1)CC(=O)C 271570a_100011290941_100000689217 [0,1,0,0,0,1|0,0,1]=3 6115 B12R1.438 C=Cc1cccc(c1)CC(=O)N 271570a_100011290941_100011586816 [0,1,0,0,0,1|1,0,1]=4 6116 B12R1.438 C=Cc1cccc(c1)NC(=O)C 11a_100011827668_100015343762 [0,1,0,0,0,1|0,0,1]=3 6117 B12R1.438 C=Cc1cccc(c1)NC(=O)C 1626a_100011827668_100015343762 [0,1,0,0,0,1|0,0,1]=3 6118 B12R1.438 C=Cc1cccc(c1)NC(=O)C 22a_100011827668_100000070787 [0,1,0,0,0,1|0,0,1]=3 6119 B12R1.438 C=Cc1cccc(c1)NC(=O)C 271570a_100011290941_100000153616 [0,1,0,0,0,1|0,0,1]=3 6120 B12R1.438 C=Cc1cccc(c1)NC(=O)C 527a_100011827668_100103153847 [0,1,0,0,0,1|0,0,1]=3 6121 B12R1.438 C=Cc1cccc(c1)NC(=O)N 271570a_100011290941_100000238923 [0,1,0,0,0,1|1,0,1]=4 6122 B12R1.438 C=Cc1cccc(c1)OC(=O)C 271570a_100011290941_100009811612 [0,1,0,0,0,1|0,0,1]=3 6123 B12R1.438 C=Cc1cccc(n1)NC(=O)C 271570a_100011290941_200011307899 [0,1,0,0,0,1|1,0,1]=4 6124 B12R1.438 C=Cc1ccnc(c1)NC(=O)C 271570a_100011290941_100012362434 [0,1,0,0,0,1|1,0,1]=4 6125 B12R1.438 C=Cc1cncc(c1)NC(=O)C 271570a_100011290941_100012351681 [0,1,0,0,0,1|1,0,1]=4 6126 B12R1.438 CC(=Cc1cc(ccn1)CO)C 271570a_100102525489_100009814636 [0,1,0,0,0,1|2,0,0]=4 6127 B12R1.438 CC(=Cc1cccc(c1)C#N)C 271570a_100102525489_100000189340 [0,1,0,0,0,1|1,0,1]=4 6128 B12R1.438 CC(=Cc1cccc(c1)C=O)C 271570a_100102525489_100000014684 [0,1,0,0,0,1|1,0,1]=4 6129 B12R1.438 CC(=Cc1cccc(c1)CF)C 271570a_100102525489_100010878472 [0,1,0,0,0,1|1,0,0]=3 6130 B12R1.438 CC(=Cc1cccc(c1)CN)C 271570a_100102525489_100000106179 [0,1,0,0,0,1|1,0,0]=3 6131 B12R1.438 CC(=Cc1cccc(c1)CO)C 271570a_100102525489_100000687537 [0,1,0,0,0,1|1,0,0]=3 6132 B12R1.438 CC(=Cc1cccc(c1)NN)C 271570a_100102525489_100000217339 [0,1,0,0,0,1|2,0,0]=4 6133 B12R1.438 CC(=Cc1cccc(n1)CN)C 271570a_100102525489_100016990191 [0,1,0,0,0,1|2,0,0]=4 6134 B12R1.438 CC(=Cc1cccc(n1)CO)C 271570a_100102525489_100000694195 [0,1,0,0,0,1|2,0,0]=4 6135 B12R1.438 CC(=Cc1ccnc(c1)CN)C 271570a_100102525489_100000085674 [0,1,0,0,0,1|2,0,0]=4 6136 B12R1.438 CC(=Cc1ccnc(c1)CO)C 271570a_100102525489_100009819072 [0,1,0,0,0,1|2,0,0]=4 6137 B12R1.438 CC(=Cc1cncc(c1)CN)C 271570a_100102525489_100011249555 [0,1,0,0,0,1|2,0,0]=4 6138 B12R1.438 CC(=Cc1cncc(c1)CO)C 271570a_100102525489_100011259137 [0,1,0,0,0,1|2,0,0]=4 6139 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000070787_100000233786 [0,1,0,0,0,1|0,0,1]=3 6140 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000684415_200000210301 [0,1,0,0,0,1|0,0,1]=3 6141 B12R1.438 CC(=O)Cc1cccc(c1)C=O 1458a_100000070787_100009816774 [0,1,0,0,0,1|0,0,1]=3 6142 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [0,1,0,0,0,1|0,0,0]=2 6143 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [0,1,0,0,0,1|0,0,0]=2 6144 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [0,1,0,0,0,1|0,0,0]=2 6145 B12R1.438 CC(=O)Cc1cccc(n1)C#N 1458a_100000070787_100000097530 [0,1,0,0,0,1|1,0,1]=4 6146 B12R1.438 CC(=O)Cc1cccc(n1)CO 1458a_100000070787_100009813551 [0,1,0,0,0,1|1,0,0]=3 6147 B12R1.438 CC(=O)Cc1cncc(c1)C#N 1458a_100000070787_200020634941 [0,1,0,0,0,1|1,0,1]=4 6148 B12R1.438 CC(=O)Nc1cc(ccn1)S[13CH3] 62a_200025704644_100012362434 [0,1,0,0,0,1|1,0,0]=3 6149 B12R1.438 CC(=O)Nc1cccc(c1)C#N 11a_100000210922_100015343762 [0,1,0,0,0,1|0,0,1]=3 6150 B12R1.438 CC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100015343762 [0,1,0,0,0,1|0,0,1]=3 6151 B12R1.438 CC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000070787 [0,1,0,0,0,1|0,0,1]=3 6152 B12R1.438 CC(=O)Nc1cccc(c1)C#N 527a_100000210922_100103153847 [0,1,0,0,0,1|0,0,1]=3 6153 B12R1.438 CC(=O)Nc1cccc(c1)CF 11a_100000126320_100015343762 [0,1,0,0,0,1|0,0,0]=2 6154 B12R1.438 CC(=O)Nc1cccc(c1)CF 1626a_100000126320_100015343762 [0,1,0,0,0,1|0,0,0]=2 6155 B12R1.438 CC(=O)Nc1cccc(c1)CF 22a_100000126320_100000070787 [0,1,0,0,0,1|0,0,0]=2 6156 B12R1.438 CC(=O)Nc1cccc(c1)CF 527a_100000126320_100103153847 [0,1,0,0,0,1|0,0,0]=2 6157 B12R1.438 CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000070787 [0,1,0,0,0,1|0,0,0]=2 6158 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [0,1,0,0,0,1|0,0,0]=2 6159 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [0,1,0,0,0,1|0,0,0]=2 6160 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [0,1,0,0,0,1|0,0,0]=2 6161 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [0,1,0,0,0,1|0,0,0]=2 6162 B12R1.438 CC(=O)Nc1cccc(n1)S[13CH3] 62a_200025704644_200011307899 [0,1,0,0,0,1|1,0,0]=3 6163 B12R1.438 CC(=O)Nc1ccnc(c1)S[13CH3] 62a_200025704644_100000238608 [0,1,0,0,0,1|1,0,0]=3 6164 B12R1.438 CC(=O)Nc1cncc(c1)S[13CH3] 62a_200025704644_100012351681 [0,1,0,0,0,1|1,0,0]=3 6165 B12R1.438 CC(=O)Nc1cncc(n1)S[13CH3] 62a_200025704644_100000703374 [0,1,0,0,0,1|2,0,0]=4 6166 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [0,1,0,0,0,1|0,0,0]=2 6167 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [0,1,0,0,0,1|0,0,0]=2 6168 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [0,1,0,0,0,1|1,0,1]=4 6169 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [0,1,0,0,0,1|1,0,1]=4 6170 B12R1.438 CC(C)Nc1cccc(c1)CF 2230a_100000126320_100000210206 [0,1,0,0,0,1|1,0,1]=4 6171 B12R1.438 CC(C)Nc1cccc(c1)CF 34a_100000126320_100000210206 [0,1,0,0,0,1|1,0,1]=4 6172 B12R1.438 CC(C)Nc1cccc(c1)CF 7a_100000126320_100000210206 [0,1,0,0,0,1|1,0,1]=4 6173 B12R1.438 CC(C)Nc1cccc(c1)CO 2230a_100000211919_100000210206 [0,1,0,0,0,1|1,0,1]=4 6174 B12R1.438 CC(C)Nc1cccc(c1)CO 34a_100000211919_100000210206 [0,1,0,0,0,1|1,0,1]=4 6175 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_100000219649_200025704644 [0,1,0,0,0,1|1,0,1]=4 6176 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000219649 [0,1,0,0,0,1|1,0,1]=4 6177 B12R1.438 CC(C)Oc1cccc(c1)CBr 34a_100011660834_100000210206 [0,1,0,0,0,1|1,0,1]=4 6178 B12R1.438 CC(C)Oc1cccc(c1)CBr 7a_100011660834_100000210206 [0,1,0,0,0,1|1,0,1]=4 6179 B12R1.438 CC(C)Oc1cccc(c1)CCl 34a_100000084143_100000210206 [0,1,0,0,0,1|1,0,1]=4 6180 B12R1.438 CC(C)Oc1cccc(c1)CCl 7a_100000084143_100000210206 [0,1,0,0,0,1|1,0,1]=4 6181 B12R1.438 CC(C)Oc1cccc(c1)CN 34a_100000743036_100000210206 [0,1,0,0,0,1|1,0,1]=4 6182 B12R1.438 CC(C)Oc1cccc(c1)CO 34a_100011214949_100000210206 [0,1,0,0,0,1|1,0,1]=4 6183 B12R1.438 CC(C)Oc1cccc(c1)CO 7a_100011214949_100000210206 [0,1,0,0,0,1|1,0,1]=4 6184 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 2230a_100011194262_200025704644 [0,1,0,0,0,1|1,0,1]=4 6185 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 34a_100011194262_200025704644 [0,1,0,0,0,1|1,0,1]=4 6186 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 7a_100011194262_200025704644 [0,1,0,0,0,1|1,0,1]=4 6187 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [0,1,0,0,0,1|1,0,1]=4 6188 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [0,1,0,0,0,1|1,0,1]=4 6189 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_100000170003_200025704644 [0,1,0,0,0,1|1,0,1]=4 6190 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_200025704644_100000170003 [0,1,0,0,0,1|1,0,1]=4 6191 B12R1.438 CC(C)Sc1cccc(c1)CF 62a_100000210206_100010878472 [0,1,0,0,0,1|1,0,1]=4 6192 B12R1.438 CC(C)Sc1cccc(c1)CF 62a_100010878472_100000210206 [0,1,0,0,0,1|1,0,1]=4 6193 B12R1.438 CC(C)Sc1cccc(c1)CN 62a_100000106179_100000210206 [0,1,0,0,0,1|1,0,1]=4 6194 B12R1.438 CC(C)Sc1cccc(c1)CN 62a_100000210206_100000106179 [0,1,0,0,0,1|1,0,1]=4 6195 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000210206_100000687537 [0,1,0,0,0,1|1,0,1]=4 6196 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000687537_100000210206 [0,1,0,0,0,1|1,0,1]=4 6197 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_100009815759_200025704644 [0,1,0,0,0,1|1,0,1]=4 6198 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_200025704644_100009815759 [0,1,0,0,0,1|1,0,1]=4 6199 B12R1.438 CCc1cc(ccn1)C=C(C)C 271570a_100102525489_100009820011 [0,1,0,0,0,1|2,0,0]=4 6200 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [0,1,0,0,0,1|1,0,0]=3 6201 B12R1.438 CCc1cccc(c1)CN(C)C 270004a_100102631434_100011999841 [0,1,0,0,0,1|2,0,0]=4 6202 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,1,0,0,0,1|0,0,0]=2 6203 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,1,0,0,0,1|0,0,0]=2 6204 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,1,0,0,0,1|0,0,0]=2 6205 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,1,0,0,0,1|0,0,0]=2 6206 B12R1.438 CCc1cccc(c1)NC(C)C 2230a_100000211250_100000210206 [0,1,0,0,0,1|1,0,1]=4 6207 B12R1.438 CCc1cccc(c1)NC(C)C 34a_100000211250_100000210206 [0,1,0,0,0,1|1,0,1]=4 6208 B12R1.438 CCc1cccc(c1)NC(C)C 7a_100000211250_100000210206 [0,1,0,0,0,1|1,0,1]=4 6209 B12R1.438 CCc1cccc(c1)OC(C)C 34a_100000211550_100000210206 [0,1,0,0,0,1|1,0,1]=4 6210 B12R1.438 CCc1cccc(c1)OC(C)C 7a_100000211550_100000210206 [0,1,0,0,0,1|1,0,1]=4 6211 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100000210206_100011263222 [0,1,0,0,0,1|1,0,1]=4 6212 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100011263222_100000210206 [0,1,0,0,0,1|1,0,1]=4 6213 B12R1.438 CCc1cccc(n1)C=C(C)C 271570a_100102525489_100009856026 [0,1,0,0,0,1|2,0,0]=4 6214 B12R1.438 CCc1ccnc(c1)C=C(C)C 271570a_100102525489_100009817561 [0,1,0,0,0,1|2,0,0]=4 6215 B12R1.438 CCc1cncc(c1)C=C(C)C 271570a_100102525489_200009819073 [0,1,0,0,0,1|2,0,0]=4 6216 B12R1.438 CN(C)Cc1cccc(c1)CO 2230a_100102631434_100010188025 [0,1,0,0,0,1|2,0,0]=4 6217 B12R1.438 CN(C)Cc1cccc(c1)CO 269982a_100102631434_100010188025 [0,1,0,0,0,1|2,0,0]=4 6218 B12R1.438 CN(C)Cc1cccc(c1)CO 270004a_100102631434_200000050894 [0,1,0,0,0,1|2,0,0]=4 6219 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_100000174759_200025704644 [0,1,0,0,0,1|2,0,0]=4 6220 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000174759 [0,1,0,0,0,1|2,0,0]=4 6221 B12R1.438 CNc1cc(ccn1)C=C(C)C 271570a_100102525489_100009819592 [0,1,0,0,0,1|2,0,0]=4 6222 B12R1.438 CNc1cccc(c1)C=C(C)C 271570a_100102525489_100000219648 [0,1,0,0,0,1|1,0,0]=3 6223 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [0,1,0,0,0,1|1,0,0]=3 6224 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [0,1,0,0,0,1|1,0,0]=3 6225 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [0,1,0,0,0,1|0,0,0]=2 6226 B12R1.438 CNc1cccc(c1)NC(=O)N 34a_100000736001_200000210301 [0,1,0,0,0,1|1,0,0]=3 6227 B12R1.438 CNc1cccc(c1)OC(C)C 2230a_100011194262_200000210301 [0,1,0,0,0,1|1,0,1]=4 6228 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100000756613_100000210206 [0,1,0,0,0,1|1,0,1]=4 6229 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100011194262_200000210301 [0,1,0,0,0,1|1,0,1]=4 6230 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100000756613_100000210206 [0,1,0,0,0,1|1,0,1]=4 6231 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100011194262_200000210301 [0,1,0,0,0,1|1,0,1]=4 6232 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000210206_100000219648 [0,1,0,0,0,1|1,0,1]=4 6233 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000219648_100000210206 [0,1,0,0,0,1|1,0,1]=4 6234 B12R1.438 CNc1cccc(n1)C=C(C)C 271570a_100102525489_100000703281 [0,1,0,0,0,1|2,0,0]=4 6235 B12R1.438 CNc1ccnc(c1)C=C(C)C 271570a_100102525489_100009869472 [0,1,0,0,0,1|2,0,0]=4 6236 B12R1.438 CNc1cncc(c1)C=C(C)C 271570a_100102525489_100012184536 [0,1,0,0,0,1|2,0,0]=4 6237 B12R1.438 COc1cc(ccn1)C=C(C)C 271570a_100102525489_100000117307 [0,1,0,0,0,1|2,0,0]=4 6238 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [0,1,0,0,0,1|1,0,0]=3 6239 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [0,1,0,0,0,1|1,0,0]=3 6240 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [0,1,0,0,0,1|1,0,0]=3 6241 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [0,1,0,0,0,1|1,0,0]=3 6242 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [0,1,0,0,0,1|0,0,0]=2 6243 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [0,1,0,0,0,1|0,0,0]=2 6244 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,1,0,0,0,1|1,0,0]=3 6245 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,1,0,0,0,1|1,0,0]=3 6246 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [0,1,0,0,0,1|0,0,0]=2 6247 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [0,1,0,0,0,1|2,0,0]=4 6248 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [0,1,0,0,0,1|2,0,0]=4 6249 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [0,1,0,0,0,1|2,0,0]=4 6250 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [0,1,0,0,0,1|2,0,0]=4 6251 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [0,1,0,0,0,1|2,0,0]=4 6252 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [0,1,0,0,0,1|2,0,0]=4 6253 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [0,1,0,0,0,1|2,0,0]=4 6254 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [0,1,0,0,0,1|0,0,0]=2 6255 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [0,1,0,0,0,1|0,0,0]=2 6256 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [0,1,0,0,0,1|0,0,0]=2 6257 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [0,1,0,0,0,1|0,0,0]=2 6258 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [0,1,0,0,0,1|0,0,0]=2 6259 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [0,1,0,0,0,1|0,0,0]=2 6260 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [0,1,0,0,0,1|1,0,0]=3 6261 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [0,1,0,0,0,1|1,0,0]=3 6262 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [0,1,0,0,0,1|1,1,0]=4 6263 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [0,1,0,0,0,1|1,0,1]=4 6264 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [0,1,0,0,0,1|0,0,0]=2 6265 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [0,1,0,0,0,1|1,0,1]=4 6266 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [0,1,0,0,0,1|1,0,1]=4 6267 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [0,1,0,0,0,1|1,0,1]=4 6268 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [0,1,0,0,0,1|1,0,1]=4 6269 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [0,1,0,0,0,1|1,0,1]=4 6270 B12R1.438 COc1cccc(n1)C=C(C)C 271570a_100102525489_100000760917 [0,1,0,0,0,1|2,0,0]=4 6271 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [0,1,0,0,0,1|1,0,0]=3 6272 B12R1.438 COc1ccnc(c1)C=C(C)C 271570a_100102525489_100011216251 [0,1,0,0,0,1|2,0,0]=4 6273 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [0,1,0,0,0,1|1,0,0]=3 6274 B12R1.438 COc1cncc(c1)C=C(C)C 271570a_100102525489_100000684773 [0,1,0,0,0,1|2,0,0]=4 6275 B12R1.438 CSc1cc(ccn1)NC(=O)C 62a_200000210301_100000238608 [0,1,0,0,0,1|1,0,0]=3 6276 B12R1.438 CSc1cccc(c1)C=C(C)C 271570a_100102525489_100011215954 [0,1,0,0,0,1|1,0,0]=3 6277 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [0,1,0,0,0,1|0,0,0]=2 6278 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [0,1,0,0,0,1|0,0,0]=2 6279 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [0,1,0,0,0,1|0,0,0]=2 6280 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [0,1,0,0,0,1|1,0,0]=3 6281 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [0,1,0,0,0,1|1,0,0]=3 6282 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [0,1,0,0,0,1|0,0,0]=2 6283 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [0,1,0,0,0,1|1,0,1]=4 6284 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [0,1,0,0,0,1|1,0,1]=4 6285 B12R1.438 CSc1cccc(c1)CN(C)C 2230a_100011934695_200000210301 [0,1,0,0,0,1|2,0,0]=4 6286 B12R1.438 CSc1cccc(c1)CN(C)C 269982a_100011934695_200000210301 [0,1,0,0,0,1|2,0,0]=4 6287 B12R1.438 CSc1cccc(c1)CN(C)C 270004a_100102631434_100011935093 [0,1,0,0,0,1|2,0,0]=4 6288 B12R1.438 CSc1cccc(c1)CN(C)C 62a_100000174759_200000210301 [0,1,0,0,0,1|2,0,0]=4 6289 B12R1.438 CSc1cccc(c1)CN(C)C 62a_200000210301_100000174759 [0,1,0,0,0,1|2,0,0]=4 6290 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 2230a_100011934695_200025704644 [0,1,0,0,0,1|2,0,0]=4 6291 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 269982a_100011934695_200025704644 [0,1,0,0,0,1|2,0,0]=4 6292 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [0,1,0,0,0,1|0,0,0]=2 6293 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [0,1,0,0,0,1|0,0,0]=2 6294 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [0,1,0,0,0,1|0,0,0]=2 6295 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [0,1,0,0,0,1|0,0,0]=2 6296 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [0,1,0,0,0,1|0,0,0]=2 6297 B12R1.438 CSc1cccc(c1)NC(=O)N 62a_200000210301_100000238923 [0,1,0,0,0,1|1,0,0]=3 6298 B12R1.438 CSc1cccc(c1)NC(C)C 2230a_100000210049_100000210206 [0,1,0,0,0,1|1,0,1]=4 6299 B12R1.438 CSc1cccc(c1)NC(C)C 34a_100000210049_100000210206 [0,1,0,0,0,1|1,0,1]=4 6300 B12R1.438 CSc1cccc(c1)NC(C)C 62a_100000219649_200000210301 [0,1,0,0,0,1|1,0,1]=4 6301 B12R1.438 CSc1cccc(c1)NC(C)C 62a_200000210301_100000219649 [0,1,0,0,0,1|1,0,1]=4 6302 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [0,1,0,0,0,1|0,0,0]=2 6303 B12R1.438 CSc1cccc(c1)OC(C)C 34a_100011265683_100000210206 [0,1,0,0,0,1|1,0,1]=4 6304 B12R1.438 CSc1cccc(c1)OC(C)C 62a_100000170003_200000210301 [0,1,0,0,0,1|1,0,1]=4 6305 B12R1.438 CSc1cccc(c1)OC(C)C 62a_200000210301_100000170003 [0,1,0,0,0,1|1,0,1]=4 6306 B12R1.438 CSc1cccc(c1)OC(C)C 7a_100011265683_100000210206 [0,1,0,0,0,1|1,0,1]=4 6307 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100000210206_100011215954 [0,1,0,0,0,1|1,0,1]=4 6308 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100009815759_200000210301 [0,1,0,0,0,1|1,0,1]=4 6309 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100011215954_100000210206 [0,1,0,0,0,1|1,0,1]=4 6310 B12R1.438 CSc1cccc(c1)SC(C)C 62a_200000210301_100009815759 [0,1,0,0,0,1|1,0,1]=4 6311 B12R1.438 CSc1cccc(n1)C=C(C)C 271570a_100102525489_100011960944 [0,1,0,0,0,1|2,0,0]=4 6312 B12R1.438 CSc1cccc(n1)NC(=O)C 62a_200000210301_200011307899 [0,1,0,0,0,1|1,0,0]=3 6313 B12R1.438 CSc1ccnc(c1)C=C(C)C 271570a_100102525489_100010883326 [0,1,0,0,0,1|2,0,0]=4 6314 B12R1.438 CSc1ccnc(c1)NC(=O)C 62a_200000210301_100012362434 [0,1,0,0,0,1|1,0,0]=3 6315 B12R1.438 CSc1cncc(c1)C=C(C)C 271570a_100102525489_100009816972 [0,1,0,0,0,1|2,0,0]=4 6316 B12R1.438 CSc1cncc(c1)NC(=O)C 62a_200000210301_100012351681 [0,1,0,0,0,1|1,0,0]=3 6317 B12R1.438 CSc1cncc(n1)NC(=O)C 62a_200000210301_100000703374 [0,1,0,0,0,1|2,0,0]=4 6318 B12R1.438 [13CH3]C(=O)Cc1cccc(c1)C#N 1458a_100000684415_200025704644 [0,1,0,0,0,1|0,0,1]=3 6319 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [0,1,0,0,0,1|1,0,0]=3 6320 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [0,1,0,0,0,1|1,0,0]=3 6321 B12R1.438 [13CH3]Nc1cccc(c1)NC(=O)N 34a_100000736001_200025704644 [0,1,0,0,0,1|1,0,0]=3 6322 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,1,0,0,0,1|1,0,0]=3 6323 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,1,0,0,0,1|1,0,0]=3 6324 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [0,1,0,0,0,1|1,0,0]=3 6325 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [0,1,0,0,0,1|1,0,0]=3 6326 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [0,1,0,0,0,1|1,1,0]=4 6327 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [0,1,0,0,0,1|1,0,0]=3 6328 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [0,1,0,0,0,1|1,0,0]=3 6329 B12R1.438 [13CH3]Sc1cccc(c1)NC(=O)N 62a_200025704644_100000238923 [0,1,0,0,0,1|1,0,0]=3 6330 B12R1.23 CS(=O)(=O)c1ccc(c(c1)F)O 271570a_203496583355_100010234714 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.23 CS(=O)(=O)c1ccc(c(c1)N)O 271570a_203496583355_200015322649 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)F 271570a_203496583355_200000048130 [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000743533 [0,2,0,0,0,0|2,0,0]=4 6334 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)C 271570a_203496583355_200010713620 [0,2,0,0,0,0|1,0,0]=3 6335 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)N 271570a_203496583355_100000164573 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.23 Cc1cc(ncc1O)S(=O)(=O)C 271570a_203496583355_100015714225 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)C 271570a_203496583355_100010175561 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.48 C#Cc1ccc(cc1C)C(=O)C 1458a_100013243528_200000210301 [0,2,0,0,0,0|0,0,0]=2 6339 B12R1.48 C#Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100013243528_200025704644 [0,2,0,0,0,0|0,0,0]=2 6340 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)C 1458a_100014797261_200000210301 [0,2,0,0,0,0|1,0,0]=3 6341 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100014797261_200025704644 [0,2,0,0,0,0|1,0,0]=3 6342 B12R1.48 C=C(C)c1cc(c(cn1)C#N)C 271570a_100000694244_100012183107 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.48 C=C(C)c1cc(c(cn1)C=O)C 271570a_100000694244_100000085382 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.48 C=C(C)c1cc(c(cn1)CO)C 271570a_100000694244_100010277336 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.48 C=C(C)c1ccc(c(c1)Br)C#N 271570a_100000694244_100012349582 [0,2,0,0,0,0|2,0,0]=4 6346 B12R1.48 C=C(C)c1ccc(c(c1)Br)C=O 271570a_100000694244_100010185650 [0,2,0,0,0,0|2,0,0]=4 6347 B12R1.48 C=C(C)c1ccc(c(c1)Br)CO 271570a_100000694244_100010240206 [0,2,0,0,0,0|2,0,0]=4 6348 B12R1.48 C=C(C)c1ccc(c(c1)Br)OC 271570a_100000694244_100011249507 [0,2,0,0,0,0|2,0,0]=4 6349 B12R1.48 C=C(C)c1ccc(c(c1)C)C#N 271570a_100000694244_100000687762 [0,2,0,0,0,0|1,0,0]=3 6350 B12R1.48 C=C(C)c1ccc(c(c1)C)C=O 271570a_100000694244_100000687586 [0,2,0,0,0,0|1,0,0]=3 6351 B12R1.48 C=C(C)c1ccc(c(c1)C)CF 271570a_100000694244_200010711859 [0,2,0,0,0,0|1,0,0]=3 6352 B12R1.48 C=C(C)c1ccc(c(c1)C)CN 271570a_100000694244_100000753881 [0,2,0,0,0,0|1,0,0]=3 6353 B12R1.48 C=C(C)c1ccc(c(c1)C)CO 271570a_100000694244_100000748258 [0,2,0,0,0,0|1,0,0]=3 6354 B12R1.48 C=C(C)c1ccc(c(c1)C)NC 271570a_100000694244_100000221803 [0,2,0,0,0,0|1,0,0]=3 6355 B12R1.48 C=C(C)c1ccc(c(c1)C)NN 271570a_100000694244_100000751375 [0,2,0,0,0,0|1,0,0]=3 6356 B12R1.48 C=C(C)c1ccc(c(c1)C)OC 271570a_100000694244_100011219705 [0,2,0,0,0,0|1,0,0]=3 6357 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C#N 271570a_100000694244_100012349662 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C=O 271570a_100000694244_100000727542 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.48 C=C(C)c1ccc(c(c1)Cl)OC 271570a_100000694244_100012355395 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.48 C=C(C)c1ccc(c(c1)Cl)SC 271570a_100000694244_206447510565 [0,2,0,0,0,0|2,0,0]=4 6361 B12R1.48 C=C(C)c1ccc(c(c1)F)C#N 271570a_100000694244_100000037869 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.48 C=C(C)c1ccc(c(c1)F)C=O 271570a_100000694244_100000211676 [0,2,0,0,0,0|2,0,0]=4 6363 B12R1.48 C=C(C)c1ccc(c(c1)F)CC 271570a_100000694244_200010071577 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.48 C=C(C)c1ccc(c(c1)F)CN 271570a_100000694244_100000754580 [0,2,0,0,0,0|2,0,0]=4 6365 B12R1.48 C=C(C)c1ccc(c(c1)F)CO 271570a_100000694244_100011191541 [0,2,0,0,0,0|2,0,0]=4 6366 B12R1.48 C=C(C)c1ccc(c(c1)F)NC 271570a_100000694244_100000743884 [0,2,0,0,0,0|2,0,0]=4 6367 B12R1.48 C=C(C)c1ccc(c(c1)F)NN 271570a_100000694244_100000751572 [0,2,0,0,0,0|2,0,0]=4 6368 B12R1.48 C=C(C)c1ccc(c(c1)F)OC 271570a_100000694244_100000185480 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.48 C=C(C)c1ccc(c(c1)F)SC 271570a_100000694244_100010161220 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.48 C=C(C)c1ccc(c(c1)N)C#N 271570a_100000694244_100000699244 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.48 C=C(C)c1ccc(c(c1)N)C=O 271570a_100000694244_100009814810 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.48 C=C(C)c1ccc(c(c1)N)CC 271570a_100000694244_100012354963 [0,2,0,0,0,0|2,0,0]=4 6373 B12R1.48 C=C(C)c1ccc(c(c1)N)CO 271570a_100000694244_100000718831 [0,2,0,0,0,0|2,0,0]=4 6374 B12R1.48 C=C(C)c1ccc(c(c1)N)NC 271570a_100000694244_100000741790 [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.48 C=C(C)c1ccc(c(c1)N)OC 271570a_100000694244_100000743470 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.48 C=C(C)c1ccc(c(c1)O)C#N 271570a_100000694244_100011934713 [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.48 C=C(C)c1ccc(c(c1)O)C=O 271570a_100000694244_100011277552 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.48 C=C(C)c1ccc(c(c1)O)CO 271570a_100000694244_100000071718 [0,2,0,0,0,0|2,0,0]=4 6379 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.48 C=C(C)c1ccc(c(n1)C)C#N 271570a_100000694244_100000756285 [0,2,0,0,0,0|2,0,0]=4 6381 B12R1.48 C=C(C)c1ccc(c(n1)C)C=O 271570a_100000694244_100000050599 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.48 C=C(C)c1ccc(c(n1)C)OC 271570a_100000694244_100010244750 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.48 C=C(C)c1cnc(c(c1)C)C#N 271570a_100000694244_100009852605 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.48 C=C(C)c1cnc(c(c1)C)C=O 271570a_100000694244_100010185443 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.48 C=C(C)c1cnc(c(c1)C)CO 271570a_100000694244_100010116297 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.48 C=C(C)c1cnc(c(c1)C)NC 271570a_100000694244_100012357622 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.48 C=C(C)c1cnc(c(c1)C)OC 271570a_100000694244_100011290809 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.48 C=Cc1ccc(cc1Br)C(=O)C 271570a_100011290941_100010146554 [0,2,0,0,0,0|1,0,0]=3 6389 B12R1.48 C=Cc1ccc(cc1Br)C(=O)N 271570a_100011290941_100009814583 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.48 C=Cc1ccc(cc1C)C(=O)C 271570a_100011290941_100000697869 [0,2,0,0,0,0|0,0,0]=2 6391 B12R1.48 C=Cc1ccc(cc1C)C(=O)N 271570a_100011290941_100011218126 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.48 C=Cc1ccc(cc1C)N(C)C 271570a_100011290941_100011934168 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.48 C=Cc1ccc(cc1F)C(=O)C 271570a_100011290941_100000690002 [0,2,0,0,0,0|1,0,0]=3 6394 B12R1.48 C=Cc1ccc(cc1F)C(=O)N 271570a_100011290941_100000686215 [0,2,0,0,0,0|2,0,0]=4 6395 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [0,2,0,0,0,0|1,0,0]=3 6396 B12R1.48 C=Cc1ccc(cc1O)C(=O)N 271570a_100011290941_100012344895 [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.48 C=Cc1cnc(cc1C)C(=O)C 271570a_100011290941_100011011822 [0,2,0,0,0,0|1,0,0]=3 6398 B12R1.48 C=Cc1ncc(cc1C)C(=O)C 271570a_100011290941_100009864263 [0,2,0,0,0,0|1,0,0]=3 6399 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_100011011822_200025704644 [0,2,0,0,0,0|1,0,0]=3 6400 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100011011822 [0,2,0,0,0,0|1,0,0]=3 6401 B12R1.48 CC(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200000210301 [0,2,0,0,0,0|1,0,0]=3 6402 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [0,2,0,0,0,0|1,0,0]=3 6403 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [0,2,0,0,0,0|1,0,0]=3 6404 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100010146554_200025704644 [0,2,0,0,0,0|1,0,0]=3 6405 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100010146554 [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.48 CC(=O)c1ccc(c(c1)C)C#N 1458a_100012180287_200000210301 [0,2,0,0,0,0|0,0,0]=2 6407 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [0,2,0,0,0,0|0,0,0]=2 6408 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [0,2,0,0,0,0|0,0,0]=2 6409 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [0,2,0,0,0,0|0,0,0]=2 6410 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [0,2,0,0,0,0|0,0,0]=2 6411 B12R1.48 CC(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200000210301 [0,2,0,0,0,0|1,0,0]=3 6412 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [0,2,0,0,0,0|1,0,0]=3 6413 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [0,2,0,0,0,0|1,0,0]=3 6414 B12R1.48 CC(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200000210301 [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.48 CC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200000210301 [0,2,0,0,0,0|1,0,0]=3 6416 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000690002_200025704644 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000690002 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.48 CC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100009816534_200025704644 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_100009864263_200025704644 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009864263 [0,2,0,0,0,0|1,0,0]=3 6425 B12R1.48 CCc1ccc(cc1Br)C(=O)C 1458a_100012340589_200000210301 [0,2,0,0,0,0|1,0,0]=3 6426 B12R1.48 CCc1ccc(cc1Br)C(=O)[13CH3] 1458a_100012340589_200025704644 [0,2,0,0,0,0|1,0,0]=3 6427 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [0,2,0,0,0,0|1,0,0]=3 6428 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [0,2,0,0,0,0|1,0,0]=3 6429 B12R1.48 CNc1ccc(cc1Br)C(=O)N 27a_100102657272_100009814583 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.48 CNc1ccc(cc1C)C(=O)N 27a_100102657272_100011218126 [0,2,0,0,0,0|1,0,0]=3 6431 B12R1.48 CNc1ccc(cc1C)C(=O)N 34a_100000746439_200000210301 [0,2,0,0,0,0|1,0,0]=3 6432 B12R1.48 CNc1ccc(cc1C)C(=O)N 7a_100000746439_200000210301 [0,2,0,0,0,0|1,0,0]=3 6433 B12R1.48 CNc1ccc(cc1C)N(C)C 34a_100000246174_200000210301 [0,2,0,0,0,0|2,0,0]=4 6434 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 2230a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 34a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 7a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 6437 B12R1.48 CNc1ccc(cc1F)C(=O)N 27a_100102657272_100000686215 [0,2,0,0,0,0|2,0,0]=4 6438 B12R1.48 CNc1ncc(cc1C)C(=O)C 27a_100102657272_100009864263 [0,2,0,0,0,0|1,0,0]=3 6439 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [0,2,0,0,0,0|1,0,0]=3 6440 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [0,2,0,0,0,0|1,0,0]=3 6441 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [0,2,0,0,0,0|1,0,0]=3 6442 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [0,2,0,0,0,0|1,0,0]=3 6443 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [0,2,0,0,0,0|0,0,0]=2 6444 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [0,2,0,0,0,0|0,0,0]=2 6445 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [0,2,0,0,0,0|0,0,0]=2 6446 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [0,2,0,0,0,0|0,0,0]=2 6447 B12R1.48 COc1ccc(cc1C)C(C)C 34a_200012180908_200000210301 [0,2,0,0,0,0|1,0,1]=4 6448 B12R1.48 COc1ccc(cc1C)C(C)C 7a_200012180908_200000210301 [0,2,0,0,0,0|1,0,1]=4 6449 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 34a_100000744956_200000210301 [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 7a_100000744956_200000210301 [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [0,2,0,0,0,0|1,0,0]=3 6452 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [0,2,0,0,0,0|1,0,0]=3 6453 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [0,2,0,0,0,0|1,0,0]=3 6454 B12R1.48 COc1ccc(cc1Cl)C(=O)N 34a_200000192832_200000210301 [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.48 COc1ccc(cc1Cl)C(=O)N 7a_200000192832_200000210301 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [0,2,0,0,0,0|1,0,0]=3 6457 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [0,2,0,0,0,0|1,0,0]=3 6458 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [0,2,0,0,0,0|1,0,0]=3 6459 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [0,2,0,0,0,0|1,0,0]=3 6460 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [0,2,0,0,0,0|1,0,0]=3 6462 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [0,2,0,0,0,0|1,0,0]=3 6463 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [0,2,0,0,0,0|1,0,0]=3 6464 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [0,2,0,0,0,0|1,0,0]=3 6465 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,2,0,0,0,0|1,0,0]=3 6467 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,2,0,0,0,0|1,0,0]=3 6468 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_100010146554_200000210301 [0,2,0,0,0,0|1,0,0]=3 6469 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_200000210301_100010146554 [0,2,0,0,0,0|1,0,0]=3 6470 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_100009814583_200000210301 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_200000210301_100009814583 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [0,2,0,0,0,0|0,0,0]=2 6473 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [0,2,0,0,0,0|0,0,0]=2 6474 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_100011218126_200000210301 [0,2,0,0,0,0|1,0,0]=3 6475 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_200000210301_100011218126 [0,2,0,0,0,0|1,0,0]=3 6476 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_100011934168_200000210301 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_200000210301_100011934168 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_100000690002_200000210301 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_200000210301_100000690002 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_100000686215_200000210301 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_200000210301_100000686215 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.48 CSc1ccc(cc1N)C(=O)C 62a_100009816534_200000210301 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_100012344895_200000210301 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_200000210301_100012344895 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_100011011822_200000210301 [0,2,0,0,0,0|1,0,0]=3 6486 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_200000210301_100011011822 [0,2,0,0,0,0|1,0,0]=3 6487 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_100009864263_200000210301 [0,2,0,0,0,0|1,0,0]=3 6488 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_200000210301_100009864263 [0,2,0,0,0,0|1,0,0]=3 6489 B12R1.48 Cc1cc(ccc1C#N)C(=O)[13CH3] 1458a_100012180287_200025704644 [0,2,0,0,0,0|0,0,0]=2 6490 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 34a_100000746439_200025704644 [0,2,0,0,0,0|1,0,0]=3 6491 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 7a_100000746439_200025704644 [0,2,0,0,0,0|1,0,0]=3 6492 B12R1.48 Cc1cc(ccc1N[13CH3])N(C)C 34a_100000246174_200025704644 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 2230a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 34a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 7a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 34a_200012180908_200025704644 [0,2,0,0,0,0|1,0,1]=4 6497 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 7a_200012180908_200025704644 [0,2,0,0,0,0|1,0,1]=4 6498 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 34a_100000744956_200025704644 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 7a_100000744956_200025704644 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_100011218126_200025704644 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_200025704644_100011218126 [0,2,0,0,0,0|1,0,0]=3 6502 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_100011934168_200025704644 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_200025704644_100011934168 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200025704644 [0,2,0,0,0,0|1,0,0]=3 6505 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200025704644 [0,2,0,0,0,0|1,0,0]=3 6506 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200025704644 [0,2,0,0,0,0|1,0,0]=3 6507 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200025704644 [0,2,0,0,0,0|1,0,0]=3 6508 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 34a_200000192832_200025704644 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 7a_200000192832_200025704644 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_100009814583_200025704644 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_200025704644_100009814583 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_100000686215_200025704644 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_200025704644_100000686215 [0,2,0,0,0,0|2,0,0]=4 6514 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_100012344895_200025704644 [0,2,0,0,0,0|2,0,0]=4 6515 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_200025704644_100012344895 [0,2,0,0,0,0|2,0,0]=4 6516 B12R1.56 C#Cc1cc(ccc1C)C(=O)C 1458a_200012278110_200000210301 [0,2,0,0,0,0|0,0,1]=3 6517 B12R1.56 C#Cc1cc(ccc1C)C(=O)[13CH3] 1458a_200012278110_200025704644 [0,2,0,0,0,0|0,0,1]=3 6518 B12R1.56 C=C(C)c1c[nH]c(=O)c(c1)OC 271570a_100000694244_100010125397 [0,2,0,0,0,0|2,0,0]=4 6519 B12R1.56 C=C(C)c1cc(c(cn1)C)OC 271570a_100000694244_100010067687 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.56 C=C(C)c1cc(c(cn1)F)CO 271570a_100000694244_100000081974 [0,2,0,0,0,0|2,0,0]=4 6521 B12R1.56 C=C(C)c1cc(c(cn1)F)OC 271570a_100000694244_200010136270 [0,2,0,0,0,0|2,0,0]=4 6522 B12R1.56 C=C(C)c1cc(c(cn1)N)OC 271570a_100000694244_100009887741 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.56 C=C(C)c1ccc(=O)n(c1)CC 271570a_100000694244_100000231005 [0,2,0,0,0,0|2,0,0]=4 6524 B12R1.56 C=C(C)c1ccc(c(c1)C#N)Br 271570a_100000694244_100012355174 [0,2,0,0,0,0|1,0,1]=4 6525 B12R1.56 C=C(C)c1ccc(c(c1)C#N)C 271570a_100000694244_100000698047 [0,2,0,0,0,0|1,0,1]=4 6526 B12R1.56 C=C(C)c1ccc(c(c1)C#N)Cl 271570a_100000694244_100011356831 [0,2,0,0,0,0|1,0,1]=4 6527 B12R1.56 C=C(C)c1ccc(c(c1)C#N)F 271570a_100000694244_100000037165 [0,2,0,0,0,0|1,0,1]=4 6528 B12R1.56 C=C(C)c1ccc(c(c1)C#N)N 271570a_100000694244_100000688460 [0,2,0,0,0,0|1,0,1]=4 6529 B12R1.56 C=C(C)c1ccc(c(c1)C#N)O 271570a_100000694244_100000687585 [0,2,0,0,0,0|1,0,1]=4 6530 B12R1.56 C=C(C)c1ccc(c(c1)C=O)Br 271570a_100000694244_100010185652 [0,2,0,0,0,0|1,0,1]=4 6531 B12R1.56 C=C(C)c1ccc(c(c1)C=O)C 271570a_100000694244_100011361606 [0,2,0,0,0,0|1,0,1]=4 6532 B12R1.56 C=C(C)c1ccc(c(c1)C=O)Cl 271570a_100000694244_100010254384 [0,2,0,0,0,0|1,0,1]=4 6533 B12R1.56 C=C(C)c1ccc(c(c1)C=O)F 271570a_100000694244_100000211465 [0,2,0,0,0,0|1,0,1]=4 6534 B12R1.56 C=C(C)c1ccc(c(c1)C=O)N 271570a_100000694244_100011935258 [0,2,0,0,0,0|1,0,1]=4 6535 B12R1.56 C=C(C)c1ccc(c(c1)C=O)O 271570a_100000694244_100000186750 [0,2,0,0,0,0|1,0,1]=4 6536 B12R1.56 C=C(C)c1ccc(c(c1)CC)Br 271570a_100000694244_100010244631 [0,2,0,0,0,0|1,0,0]=3 6537 B12R1.56 C=C(C)c1ccc(c(c1)CC)F 271570a_100000694244_100010244625 [0,2,0,0,0,0|1,0,0]=3 6538 B12R1.56 C=C(C)c1ccc(c(c1)CC)N 271570a_100000694244_100000686106 [0,2,0,0,0,0|1,0,0]=3 6539 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,2,0,0,0,0|1,0,0]=3 6540 B12R1.56 C=C(C)c1ccc(c(c1)CN)F 271570a_100000694244_100009815772 [0,2,0,0,0,0|1,0,0]=3 6541 B12R1.56 C=C(C)c1ccc(c(c1)CN)N 271570a_100000694244_100012349119 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.56 C=C(C)c1ccc(c(c1)CN)O 271570a_100000694244_100000730032 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.56 C=C(C)c1ccc(c(c1)CO)Br 271570a_100000694244_100012359683 [0,2,0,0,0,0|1,0,0]=3 6544 B12R1.56 C=C(C)c1ccc(c(c1)CO)C 271570a_100000694244_100000700630 [0,2,0,0,0,0|1,0,0]=3 6545 B12R1.56 C=C(C)c1ccc(c(c1)CO)Cl 271570a_100000694244_100010128486 [0,2,0,0,0,0|1,0,0]=3 6546 B12R1.56 C=C(C)c1ccc(c(c1)CO)F 271570a_100000694244_100000049604 [0,2,0,0,0,0|1,0,0]=3 6547 B12R1.56 C=C(C)c1ccc(c(c1)CO)N 271570a_100000694244_100012353972 [0,2,0,0,0,0|1,0,0]=3 6548 B12R1.56 C=C(C)c1ccc(c(c1)CO)O 271570a_100000694244_100000184703 [0,2,0,0,0,0|1,0,0]=3 6549 B12R1.56 C=C(C)c1ccc(c(c1)NC)C 271570a_100000694244_100020629602 [0,2,0,0,0,0|1,0,0]=3 6550 B12R1.56 C=C(C)c1ccc(c(c1)NC)F 271570a_100000694244_100011314990 [0,2,0,0,0,0|1,0,0]=3 6551 B12R1.56 C=C(C)c1ccc(c(c1)NC)N 271570a_100000694244_100000694363 [0,2,0,0,0,0|1,0,0]=3 6552 B12R1.56 C=C(C)c1ccc(c(c1)NN)F 271570a_100000694244_100020610843 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [0,2,0,0,0,0|1,0,0]=3 6554 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [0,2,0,0,0,0|1,0,0]=3 6555 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [0,2,0,0,0,0|1,0,0]=3 6556 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [0,2,0,0,0,0|1,0,0]=3 6557 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [0,2,0,0,0,0|1,0,0]=3 6558 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,2,0,0,0,0|1,0,0]=3 6559 B12R1.56 C=C(C)c1ccc(c(c1)SC)F 271570a_100000694244_100010341305 [0,2,0,0,0,0|1,0,0]=3 6560 B12R1.56 C=C(C)c1ccc(c(n1)CC)N 271570a_100000694244_100009871203 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.56 C=C(C)c1ccc(c(n1)CN)F 271570a_100000694244_100009887702 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.56 C=C(C)c1ccc(c(n1)OC)N 271570a_100000694244_100000687816 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.56 C=C(C)c1ccc(c(n1)OC)O 271570a_100000694244_100010893133 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.56 C=C(C)c1cnc(c(c1)CO)C 271570a_100000694244_100010894652 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.56 C=C(C)c1cnc(c(c1)CO)F 271570a_100000694244_100010202234 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.56 C=C(C)c1cnc(c(c1)CO)N 271570a_100000694244_100011934449 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.56 C=C(C)c1cnc(c(c1)CO)O 271570a_100000694244_100010065268 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.56 C=C(C)c1cnc(c(c1)NC)N 271570a_100000694244_100010506235 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.56 C=C(C)c1cnc(c(c1)OC)C 271570a_100000694244_100010254219 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.56 C=C(C)c1cnc(c(c1)OC)F 271570a_100000694244_100010214931 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.56 C=C(C)c1cnc(c(c1)OC)N 271570a_100000694244_106354213024 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.56 C=Cc1cc(ccc1Br)C(=O)C 271570a_100011290941_100010146556 [0,2,0,0,0,0|0,0,1]=3 6573 B12R1.56 C=Cc1cc(ccc1C)C(=O)C 271570a_100011290941_100011934287 [0,2,0,0,0,0|0,0,1]=3 6574 B12R1.56 C=Cc1cc(ccc1C)C(=O)N 271570a_100011290941_100000186401 [0,2,0,0,0,0|1,0,1]=4 6575 B12R1.56 C=Cc1cc(ccc1F)C(=O)C 271570a_100011290941_100000239719 [0,2,0,0,0,0|0,0,1]=3 6576 B12R1.56 C=Cc1cc(ccc1F)C(=O)N 271570a_100011290941_100011202321 [0,2,0,0,0,0|1,0,1]=4 6577 B12R1.56 C=Cc1cc(ccc1N)C(=O)C 271570a_100011290941_100012029215 [0,2,0,0,0,0|0,0,1]=3 6578 B12R1.56 C=Cc1cc(ccc1O)C(=O)C 271570a_100011290941_100011772453 [0,2,0,0,0,0|0,0,1]=3 6579 B12R1.56 C=Cc1cc(cnc1F)C(=O)C 271570a_100011290941_200010135287 [0,2,0,0,0,0|1,0,1]=4 6580 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200000210301 [0,2,0,0,0,0|0,0,1]=3 6581 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200000210301 [0,2,0,0,0,0|0,0,1]=3 6582 B12R1.56 CC(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200000210301 [0,2,0,0,0,0|0,0,1]=3 6583 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [0,2,0,0,0,0|0,0,1]=3 6584 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [0,2,0,0,0,0|0,0,1]=3 6585 B12R1.56 CC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200000210301 [0,2,0,0,0,0|0,0,0]=2 6586 B12R1.56 CC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200000210301 [0,2,0,0,0,0|0,0,0]=2 6587 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [0,2,0,0,0,0|0,0,0]=2 6588 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [0,2,0,0,0,0|0,0,0]=2 6589 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [0,2,0,0,0,0|0,0,0]=2 6591 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100010146556_200025704644 [0,2,0,0,0,0|0,0,0]=2 6592 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100010146556 [0,2,0,0,0,0|0,0,0]=2 6593 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [0,2,0,0,0,0|0,0,0]=2 6594 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [0,2,0,0,0,0|0,0,0]=2 6595 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000239719_200025704644 [0,2,0,0,0,0|0,0,0]=2 6596 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000239719 [0,2,0,0,0,0|0,0,0]=2 6597 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])N 62a_100012029215_200025704644 [0,2,0,0,0,0|0,0,0]=2 6598 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,2,0,0,0,0|0,0,0]=2 6599 B12R1.56 CC(=O)c1cnc(c(c1)S[13CH3])F 62a_200010135287_200025704644 [0,2,0,0,0,0|1,0,0]=3 6600 B12R1.56 CC(=O)c1cnc(c(c1)S[13CH3])F 62a_200025704644_200010135287 [0,2,0,0,0,0|1,0,0]=3 6601 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 34a_200000187366_200025704644 [0,2,0,0,0,0|1,0,1]=4 6602 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 7a_200000187366_200025704644 [0,2,0,0,0,0|1,0,1]=4 6603 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_100011218581_200025704644 [0,2,0,0,0,0|1,0,1]=4 6604 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100011218581 [0,2,0,0,0,0|1,0,1]=4 6605 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_100011191524_200025704644 [0,2,0,0,0,0|0,0,2]=4 6606 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011191524 [0,2,0,0,0,0|0,0,2]=4 6607 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [0,2,0,0,0,0|0,0,0]=2 6608 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [0,2,0,0,0,0|0,0,0]=2 6609 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [0,2,0,0,0,0|0,0,0]=2 6610 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [0,2,0,0,0,0|0,0,0]=2 6611 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [0,2,0,0,0,0|0,0,0]=2 6612 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [0,2,0,0,0,0|0,0,0]=2 6613 B12R1.56 CN(C)c1ccc(c(c1)S[13CH3])N 62a_200013039233_200025704644 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.56 CN(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_200013039233 [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.56 CNc1cc(ccc1C)C(=O)N 34a_100000188646_200000210301 [0,2,0,0,0,0|1,0,0]=3 6616 B12R1.56 CNc1cc(ccc1C)C(=O)N 7a_100000188646_200000210301 [0,2,0,0,0,0|1,0,0]=3 6617 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 6618 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 6619 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 6620 B12R1.56 CNc1cc(ccc1C)N(C)C 34a_100015186894_200000210301 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 34a_100000184112_200000210301 [0,2,0,0,0,0|2,0,0]=4 6622 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 7a_100000184112_200000210301 [0,2,0,0,0,0|2,0,0]=4 6623 B12R1.56 CNc1cc(ccc1Cl)C(=O)N 34a_100000736751_200000210301 [0,2,0,0,0,0|1,0,0]=3 6624 B12R1.56 CNc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000186089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6625 B12R1.56 CNc1cc(ccc1F)C(=O)N 34a_100000740466_200000210301 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.56 CNc1cc(ccc1F)[N+](=O)[O-] 34a_100000185768_200000210301 [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.56 CNc1cc(ccc1O)C(C)C 34a_200000187366_200000210301 [0,2,0,0,0,0|1,0,1]=4 6628 B12R1.56 CNc1cc(ccc1O)C(C)C 7a_200000187366_200000210301 [0,2,0,0,0,0|1,0,1]=4 6629 B12R1.56 CNc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200000210301 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.56 CNc1cc(cnc1F)C(=O)C 27a_100102657272_200010135287 [0,2,0,0,0,0|1,0,0]=3 6631 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [0,2,0,0,0,0|0,0,0]=2 6632 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,2,0,0,0,0|1,0,0]=3 6633 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,2,0,0,0,0|1,0,0]=3 6634 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [0,2,0,0,0,0|0,0,0]=2 6635 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200000210301 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200000210301 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [0,2,0,0,0,0|0,0,0]=2 6638 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [0,2,0,0,0,0|0,0,0]=2 6639 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [0,2,0,0,0,0|0,0,0]=2 6640 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [0,2,0,0,0,0|0,0,0]=2 6641 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [0,2,0,0,0,0|1,0,1]=4 6642 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [0,2,0,0,0,0|1,0,1]=4 6643 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 34a_100000740739_200000210301 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 7a_100000740739_200000210301 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [0,2,0,0,0,0|0,0,0]=2 6646 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [0,2,0,0,0,0|0,0,0]=2 6647 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200000210301 [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200000210301 [0,2,0,0,0,0|2,0,0]=4 6649 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [0,2,0,0,0,0|0,0,0]=2 6650 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [0,2,0,0,0,0|0,0,0]=2 6651 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [0,2,0,0,0,0|0,0,0]=2 6652 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [0,2,0,0,0,0|0,0,0]=2 6653 B12R1.56 COc1cc(ccc1F)N(C)C 2230a_200012002703_200000210301 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.56 COc1cc(ccc1F)N(C)C 269982a_200012002703_200000210301 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.56 COc1cc(ccc1F)N(C)C 34a_200012002703_200000210301 [0,2,0,0,0,0|2,0,0]=4 6656 B12R1.56 COc1cc(ccc1F)N(C)C 38a_200012002703_200000210301 [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 2230a_200012002703_200025704644 [0,2,0,0,0,0|2,0,0]=4 6658 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 269982a_200012002703_200025704644 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 34a_200012002703_200025704644 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 38a_200012002703_200025704644 [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200000210301 [0,2,0,0,0,0|2,0,0]=4 6662 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200000210301 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [0,2,0,0,0,0|0,0,0]=2 6664 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [0,2,0,0,0,0|0,0,0]=2 6665 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200000210301 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200000210301 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,2,0,0,0,0|1,0,0]=3 6668 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,2,0,0,0,0|1,0,0]=3 6669 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200000210301 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200000210301 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,2,0,0,0,0|0,0,0]=2 6672 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,2,0,0,0,0|0,0,0]=2 6673 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,2,0,0,0,0|1,0,0]=3 6674 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,2,0,0,0,0|0,0,0]=2 6675 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,2,0,0,0,0|1,0,1]=4 6676 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_100010146556_200000210301 [0,2,0,0,0,0|0,0,0]=2 6677 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_200000210301_100010146556 [0,2,0,0,0,0|0,0,0]=2 6678 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [0,2,0,0,0,0|0,0,0]=2 6679 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [0,2,0,0,0,0|0,0,0]=2 6680 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_100000186401_200000210301 [0,2,0,0,0,0|1,0,0]=3 6681 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_200000210301_100000186401 [0,2,0,0,0,0|1,0,0]=3 6682 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_100000239719_200000210301 [0,2,0,0,0,0|0,0,0]=2 6683 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_200000210301_100000239719 [0,2,0,0,0,0|0,0,0]=2 6684 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_100011202321_200000210301 [0,2,0,0,0,0|1,0,0]=3 6685 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_200000210301_100011202321 [0,2,0,0,0,0|1,0,0]=3 6686 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_100011191524_200000210301 [0,2,0,0,0,0|0,0,2]=4 6687 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_200000210301_100011191524 [0,2,0,0,0,0|0,0,2]=4 6688 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_100000753309_200000210301 [0,2,0,0,0,0|1,0,1]=4 6689 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_200000210301_100000753309 [0,2,0,0,0,0|1,0,1]=4 6690 B12R1.56 CSc1cc(ccc1N)C(=O)C 62a_100012029215_200000210301 [0,2,0,0,0,0|0,0,0]=2 6691 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_100011218581_200000210301 [0,2,0,0,0,0|1,0,1]=4 6692 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_200000210301_100011218581 [0,2,0,0,0,0|1,0,1]=4 6693 B12R1.56 CSc1cc(ccc1N)N(C)C 62a_200000210301_200013039233 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.56 CSc1cc(ccc1N)N(C)C 62a_200013039233_200000210301 [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,2,0,0,0,0|0,0,0]=2 6696 B12R1.56 CSc1cc(cnc1F)C(=O)C 62a_200000210301_200010135287 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.56 CSc1cc(cnc1F)C(=O)C 62a_200010135287_200000210301 [0,2,0,0,0,0|1,0,0]=3 6698 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_100000753309_200025704644 [0,2,0,0,0,0|1,0,1]=4 6699 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000753309 [0,2,0,0,0,0|1,0,1]=4 6700 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 34a_100000188646_200025704644 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 7a_100000188646_200025704644 [0,2,0,0,0,0|1,0,0]=3 6702 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 6703 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 6704 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 6705 B12R1.56 Cc1ccc(cc1N[13CH3])N(C)C 34a_100015186894_200025704644 [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 34a_100000184112_200025704644 [0,2,0,0,0,0|2,0,0]=4 6707 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 7a_100000184112_200025704644 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [0,2,0,0,0,0|1,0,1]=4 6709 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [0,2,0,0,0,0|1,0,1]=4 6710 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000740739_200025704644 [0,2,0,0,0,0|2,0,0]=4 6711 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000740739_200025704644 [0,2,0,0,0,0|2,0,0]=4 6712 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_100000186401_200025704644 [0,2,0,0,0,0|1,0,0]=3 6713 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_200025704644_100000186401 [0,2,0,0,0,0|1,0,0]=3 6714 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200025704644 [0,2,0,0,0,0|0,0,1]=3 6715 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200025704644 [0,2,0,0,0,0|0,0,1]=3 6716 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200025704644 [0,2,0,0,0,0|0,0,1]=3 6717 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [0,2,0,0,0,0|0,0,1]=3 6718 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200025704644 [0,2,0,0,0,0|0,0,0]=2 6719 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200025704644 [0,2,0,0,0,0|0,0,0]=2 6720 B12R1.56 [13CH3]Nc1cc(ccc1Cl)C(=O)N 34a_100000736751_200025704644 [0,2,0,0,0,0|1,0,0]=3 6721 B12R1.56 [13CH3]Nc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000186089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.56 [13CH3]Nc1cc(ccc1F)C(=O)N 34a_100000740466_200025704644 [0,2,0,0,0,0|1,0,0]=3 6723 B12R1.56 [13CH3]Nc1cc(ccc1F)[N+](=O)[O-] 34a_100000185768_200025704644 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.56 [13CH3]Nc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200025704644 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,2,0,0,0,0|1,0,0]=3 6726 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,2,0,0,0,0|1,0,0]=3 6727 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200025704644 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200025704644 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200025704644 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200025704644 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200025704644 [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200025704644 [0,2,0,0,0,0|2,0,0]=4 6733 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200025704644 [0,2,0,0,0,0|2,0,0]=4 6734 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200025704644 [0,2,0,0,0,0|2,0,0]=4 6735 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,2,0,0,0,0|1,0,0]=3 6737 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200025704644 [0,2,0,0,0,0|2,0,0]=4 6738 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200025704644 [0,2,0,0,0,0|2,0,0]=4 6739 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_100011202321_200025704644 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_200025704644_100011202321 [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.232 C=C(C)c1cc(c([nH]c1=O)C)C 271570a_100000694244_100010064231 [0,2,0,0,0,0|2,0,0]=4 6742 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)Br 271570a_100000694244_100010151546 [0,2,0,0,0,0|2,0,0]=4 6743 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)F 271570a_100000694244_200010212206 [0,2,0,0,0,0|2,0,0]=4 6744 B12R1.232 C=C(C)c1cc(c(cc1Br)C)Br 271570a_100000694244_100012929169 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.232 C=C(C)c1cc(c(cc1Br)C)F 271570a_100000694244_200009814774 [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)F 271570a_100000694244_100010254745 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)O 271570a_100000694244_100021297947 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.232 C=C(C)c1cc(c(cc1Br)F)C 271570a_100000694244_200009814773 [0,2,0,0,0,0|1,0,0]=3 6749 B12R1.232 C=C(C)c1cc(c(cc1Br)F)F 271570a_100000694244_100010259568 [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.232 C=C(C)c1cc(c(cc1C)Br)C 271570a_100000694244_100011356911 [0,2,0,0,0,0|1,0,0]=3 6751 B12R1.232 C=C(C)c1cc(c(cc1C)Br)Cl 271570a_100000694244_200009814780 [0,2,0,0,0,0|2,0,0]=4 6752 B12R1.232 C=C(C)c1cc(c(cc1C)Br)F 271570a_100000694244_100011356895 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.232 C=C(C)c1cc(c(cc1C)C)C 271570a_100000694244_100000759388 [0,2,0,0,0,0|1,0,0]=3 6754 B12R1.232 C=C(C)c1cc(c(cc1C)C)N 271570a_100000694244_100000703630 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.232 C=C(C)c1cc(c(cc1C)Cl)C 271570a_100000694244_100012357408 [0,2,0,0,0,0|1,0,0]=3 6756 B12R1.232 C=C(C)c1cc(c(cc1C)F)Br 271570a_100000694244_100011216669 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.232 C=C(C)c1cc(c(cc1C)F)C 271570a_100000694244_100010212296 [0,2,0,0,0,0|1,0,0]=3 6758 B12R1.232 C=C(C)c1cc(c(cc1C)F)F 271570a_100000694244_100009815990 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.232 C=C(C)c1cc(c(cc1C)F)N 271570a_100000694244_100011014115 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.232 C=C(C)c1cc(c(cc1C)F)O 271570a_100000694244_100010068922 [0,2,0,0,0,0|2,0,0]=4 6761 B12R1.232 C=C(C)c1cc(c(cc1C)N)C 271570a_100000694244_100011934712 [0,2,0,0,0,0|1,0,0]=3 6762 B12R1.232 C=C(C)c1cc(c(cc1C)N)F 271570a_100000694244_100000691575 [0,2,0,0,0,0|2,0,0]=4 6763 B12R1.232 C=C(C)c1cc(c(cc1C)N)N 271570a_100000694244_100010080480 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.232 C=C(C)c1cc(c(cc1C)N)O 271570a_100000694244_200010107346 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.232 C=C(C)c1cc(c(cc1C)O)C 271570a_100000694244_100000698207 [0,2,0,0,0,0|1,0,0]=3 6766 B12R1.232 C=C(C)c1cc(c(cc1C)O)F 271570a_100000694244_100012355673 [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.232 C=C(C)c1cc(c(cc1C)O)N 271570a_100000694244_200010235796 [0,2,0,0,0,0|2,0,0]=4 6768 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)C 271570a_100000694244_100010259621 [0,2,0,0,0,0|1,0,0]=3 6769 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)Cl 271570a_100000694244_200010244590 [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)F 271570a_100000694244_100010212230 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)Cl 271570a_100000694244_200011216203 [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)N 271570a_100000694244_100016224655 [0,2,0,0,0,0|2,0,0]=4 6773 B12R1.232 C=C(C)c1cc(c(cc1Cl)F)F 271570a_100000694244_100012349977 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.232 C=C(C)c1cc(c(cc1Cl)O)N 271570a_100000694244_100011011175 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.232 C=C(C)c1cc(c(cc1F)Br)Br 271570a_100000694244_200010212210 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.232 C=C(C)c1cc(c(cc1F)Br)C 271570a_100000694244_200009814772 [0,2,0,0,0,0|1,0,0]=3 6777 B12R1.232 C=C(C)c1cc(c(cc1F)Br)F 271570a_100000694244_100011356857 [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.232 C=C(C)c1cc(c(cc1F)C)Br 271570a_100000694244_100011068846 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.232 C=C(C)c1cc(c(cc1F)C)C 271570a_100000694244_100010197417 [0,2,0,0,0,0|1,0,0]=3 6780 B12R1.232 C=C(C)c1cc(c(cc1F)C)F 271570a_100000694244_100011219510 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.232 C=C(C)c1cc(c(cc1F)C)N 271570a_100000694244_100000717900 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.232 C=C(C)c1cc(c(cc1F)C)O 271570a_100000694244_100014242602 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)F 271570a_100000694244_100010142863 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)O 271570a_100000694244_100010735246 [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.232 C=C(C)c1cc(c(cc1F)F)Br 271570a_100000694244_100011356914 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.232 C=C(C)c1cc(c(cc1F)F)C 271570a_100000694244_100000692463 [0,2,0,0,0,0|1,0,0]=3 6787 B12R1.232 C=C(C)c1cc(c(cc1F)F)F 271570a_100000694244_100000686897 [0,2,0,0,0,0|2,0,0]=4 6788 B12R1.232 C=C(C)c1cc(c(cc1F)F)N 271570a_100000694244_100000700208 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.232 C=C(C)c1cc(c(cc1F)F)O 271570a_100000694244_100012457948 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.232 C=C(C)c1cc(c(cc1F)N)C 271570a_100000694244_100000695870 [0,2,0,0,0,0|1,0,0]=3 6791 B12R1.232 C=C(C)c1cc(c(cc1F)N)F 271570a_100000694244_100000690247 [0,2,0,0,0,0|2,0,0]=4 6792 B12R1.232 C=C(C)c1cc(c(cc1F)N)N 271570a_100000694244_100000766667 [0,2,0,0,0,0|2,0,0]=4 6793 B12R1.232 C=C(C)c1cc(c(cc1F)N)O 271570a_100000694244_100013038943 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.232 C=C(C)c1cc(c(cc1F)O)F 271570a_100000694244_100011830439 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.232 C=C(C)c1cc(c(cc1F)O)N 271570a_100000694244_100012359894 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.232 C=C(C)c1cc(c(cc1N)Br)C 271570a_100000694244_200015600912 [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.232 C=C(C)c1cc(c(cc1N)Br)F 271570a_100000694244_200021016574 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.232 C=C(C)c1cc(c(cc1N)C)C 271570a_100000694244_100012337760 [0,2,0,0,0,0|1,0,0]=3 6799 B12R1.232 C=C(C)c1cc(c(cc1N)C)F 271570a_100000694244_100010233353 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)Cl 271570a_100000694244_200011093942 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)F 271570a_100000694244_200010992381 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.232 C=C(C)c1cc(c(cc1N)F)Br 271570a_100000694244_100010888672 [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.232 C=C(C)c1cc(c(cc1N)F)C 271570a_100000694244_100011218008 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.232 C=C(C)c1cc(c(cc1N)F)Cl 271570a_100000694244_100010892166 [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.232 C=C(C)c1cc(c(cc1N)F)F 271570a_100000694244_100000765032 [0,2,0,0,0,0|2,0,0]=4 6806 B12R1.232 C=C(C)c1cc(c(cc1N)N)C 271570a_100000694244_200013038441 [0,2,0,0,0,0|1,0,0]=3 6807 B12R1.232 C=C(C)c1cc(c(cc1N)N)F 271570a_100000694244_200010115645 [0,2,0,0,0,0|2,0,0]=4 6808 B12R1.232 C=C(C)c1cc(c(cc1O)C)C 271570a_100000694244_100009814663 [0,2,0,0,0,0|1,0,0]=3 6809 B12R1.232 C=C(C)c1cc(c(cc1O)F)F 271570a_100000694244_100009813768 [0,2,0,0,0,0|2,0,0]=4 6810 B12R1.232 C=C(C)c1cc(c(nc1N)C)C 271570a_100000694244_100009990238 [0,2,0,0,0,0|2,0,0]=4 6811 B12R1.232 CC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_200000210301 [0,2,0,0,0,0|1,0,0]=3 6812 B12R1.232 CC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_200000210301 [0,2,0,0,0,0|0,0,0]=2 6813 B12R1.232 CC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200000210301 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.232 CC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200000210301 [0,2,0,0,0,0|1,0,0]=3 6815 B12R1.232 CC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_200000210301 [0,2,0,0,0,0|0,0,0]=2 6816 B12R1.232 CC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_200000210301 [0,2,0,0,0,0|1,0,0]=3 6817 B12R1.232 CC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_200000210301 [0,2,0,0,0,0|1,0,0]=3 6818 B12R1.232 CC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_200000210301 [0,2,0,0,0,0|0,0,0]=2 6819 B12R1.232 CC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_200000210301 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_200000210301 [0,2,0,0,0,0|1,0,0]=3 6821 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_200000210301 [0,2,0,0,0,0|1,0,0]=3 6822 B12R1.232 CC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_200000210301 [0,2,0,0,0,0|1,0,0]=3 6823 B12R1.232 CC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_200000210301 [0,2,0,0,0,0|1,0,0]=3 6824 B12R1.232 CC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_200000210301 [0,2,0,0,0,0|1,0,0]=3 6825 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200000210301 [0,2,0,0,0,0|1,0,0]=3 6826 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200000210301 [0,2,0,0,0,0|1,0,0]=3 6827 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_200000210301 [0,2,0,0,0,0|1,0,0]=3 6828 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_200000210301 [0,2,0,0,0,0|1,0,0]=3 6829 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200000210301 [0,2,0,0,0,0|1,0,0]=3 6830 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200000210301 [0,2,0,0,0,0|1,0,0]=3 6831 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_200000210301 [0,2,0,0,0,0|0,0,0]=2 6832 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200000210301 [0,2,0,0,0,0|1,0,0]=3 6833 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200000210301 [0,2,0,0,0,0|1,0,0]=3 6834 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200000210301 [0,2,0,0,0,0|1,0,0]=3 6835 B12R1.232 CC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_200000210301 [0,2,0,0,0,0|0,0,0]=2 6836 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200000210301 [0,2,0,0,0,0|1,0,0]=3 6837 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200000210301 [0,2,0,0,0,0|1,0,0]=3 6838 B12R1.232 CC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_200000210301 [0,2,0,0,0,0|1,0,0]=3 6839 B12R1.232 CC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_200000210301 [0,2,0,0,0,0|1,0,0]=3 6840 B12R1.232 CC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_200000210301 [0,2,0,0,0,0|1,0,0]=3 6841 B12R1.232 CC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_200000210301 [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200000210301 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200000210301 [0,2,0,0,0,0|1,0,0]=3 6844 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200000210301 [0,2,0,0,0,0|1,0,0]=3 6845 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [0,2,0,0,0,0|1,0,0]=3 6846 B12R1.232 CC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200000210301 [0,2,0,0,0,0|1,0,0]=3 6847 B12R1.232 CC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_200000210301 [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.232 CC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200000210301 [0,2,0,0,0,0|1,0,0]=3 6849 B12R1.232 CC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200000210301 [0,2,0,0,0,0|1,0,0]=3 6850 B12R1.232 CC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200000210301 [0,2,0,0,0,0|1,0,0]=3 6851 B12R1.232 CC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100009817148 [0,2,0,0,0,0|1,0,0]=3 6852 B12R1.232 CC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200000210301 [0,2,0,0,0,0|1,0,0]=3 6853 B12R1.232 CC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100012024335 [0,2,0,0,0,0|1,0,0]=3 6854 B12R1.232 CC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_200000210301 [0,2,0,0,0,0|0,0,0]=2 6855 B12R1.232 CC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200000210301 [0,2,0,0,0,0|1,0,0]=3 6856 B12R1.232 CC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200000210301 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.232 CC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_200000210301 [0,2,0,0,0,0|1,0,0]=3 6858 B12R1.232 CC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_200000210301 [0,2,0,0,0,0|0,0,0]=2 6859 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [0,2,0,0,0,0|1,0,0]=3 6860 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.232 CC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200000210301 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.232 CC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200000210301 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200000210301 [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100013243444 [0,2,0,0,0,0|1,0,0]=3 6865 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [0,2,0,0,0,0|1,0,0]=3 6866 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [0,2,0,0,0,0|1,0,0]=3 6867 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [0,2,0,0,0,0|0,0,0]=2 6868 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [0,2,0,0,0,0|1,0,0]=3 6869 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])C 1458a_100012920494_200025704644 [0,2,0,0,0,0|1,0,0]=3 6870 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])F 1458a_100012920545_200025704644 [0,2,0,0,0,0|1,0,0]=3 6871 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100010233826_200025704644 [0,2,0,0,0,0|1,0,0]=3 6872 B12R1.232 Cc1cc(c(cc1Br)C)C(=O)[13CH3] 1458a_100000695896_200025704644 [0,2,0,0,0,0|0,0,0]=2 6873 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)[13CH3] 1458a_100012354683_200025704644 [0,2,0,0,0,0|0,0,0]=2 6874 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Br)F 1458a_100000724332_200025704644 [0,2,0,0,0,0|1,0,0]=3 6875 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100010439669_200025704644 [0,2,0,0,0,0|1,0,0]=3 6876 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Br 1458a_100012344525_200025704644 [0,2,0,0,0,0|1,0,0]=3 6877 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Cl 1458a_200010768543_200025704644 [0,2,0,0,0,0|1,0,0]=3 6878 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)F 1458a_100000062099_200025704644 [0,2,0,0,0,0|1,0,0]=3 6879 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])I)F 1458a_100013328184_200025704644 [0,2,0,0,0,0|1,0,0]=3 6880 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])C 1458a_100011216168_200025704644 [0,2,0,0,0,0|0,0,0]=2 6881 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])I 1458a_100010184404_200025704644 [0,2,0,0,0,0|0,0,0]=2 6882 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])O 1458a_100009831561_200025704644 [0,2,0,0,0,0|0,0,0]=2 6883 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])Cl 1458a_100013033594_200025704644 [0,2,0,0,0,0|1,0,0]=3 6884 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])F 1458a_100012180961_200025704644 [0,2,0,0,0,0|1,0,0]=3 6885 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)[13CH3] 1458a_100010204433_200025704644 [0,2,0,0,0,0|0,0,0]=2 6886 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Br 1458a_200012355688_200025704644 [0,2,0,0,0,0|1,0,0]=3 6887 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Cl 1458a_100009857485_200025704644 [0,2,0,0,0,0|1,0,0]=3 6888 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])F 1458a_100000686409_200025704644 [0,2,0,0,0,0|1,0,0]=3 6889 B12R1.232 Cc1cc(c(cc1F)Cl)C(=O)[13CH3] 1458a_100000687843_200025704644 [0,2,0,0,0,0|0,0,0]=2 6890 B12R1.232 Cc1cc(c(cc1F)F)C(=O)[13CH3] 1458a_100000767126_200025704644 [0,2,0,0,0,0|0,0,0]=2 6891 B12R1.232 Cc1cc(c(cc1I)C(=O)[13CH3])C 1458a_100000723791_200025704644 [0,2,0,0,0,0|1,0,0]=3 6892 B12R1.232 Cc1cc(c(cc1O)C(=O)[13CH3])F 1458a_100009839767_200025704644 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.232 NC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100015235948 [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.232 NC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010244962 [0,2,0,0,0,0|2,0,0]=4 6895 B12R1.232 NC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100015444839 [0,2,0,0,0,0|2,0,0]=4 6896 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200025704644 [0,2,0,0,0,0|1,0,0]=3 6897 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200025704644 [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200025704644 [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200025704644 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200025704644 [0,2,0,0,0,0|1,0,0]=3 6901 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200025704644 [0,2,0,0,0,0|1,0,0]=3 6902 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200025704644 [0,2,0,0,0,0|1,0,0]=3 6903 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200025704644 [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200025704644 [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200025704644 [0,2,0,0,0,0|1,0,0]=3 6906 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200025704644 [0,2,0,0,0,0|1,0,0]=3 6907 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200025704644 [0,2,0,0,0,0|1,0,0]=3 6908 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200025704644 [0,2,0,0,0,0|1,0,0]=3 6909 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200025704644 [0,2,0,0,0,0|1,0,0]=3 6910 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [0,2,0,0,0,0|1,0,0]=3 6911 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200025704644 [0,2,0,0,0,0|1,0,0]=3 6912 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200025704644 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200025704644 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200025704644 [0,2,0,0,0,0|1,0,0]=3 6915 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200025704644 [0,2,0,0,0,0|1,0,0]=3 6916 B12R1.232 [13CH3]C(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200025704644 [0,2,0,0,0,0|1,0,0]=3 6917 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200025704644 [0,2,0,0,0,0|1,0,0]=3 6918 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [0,2,0,0,0,0|1,0,0]=3 6919 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200025704644 [0,2,0,0,0,0|1,0,0]=3 6920 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200025704644 [0,2,0,0,0,0|1,0,0]=3 6921 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200025704644 [0,2,0,0,0,0|1,0,0]=3 6922 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [0,2,0,0,0,0|1,0,0]=3 6923 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210202 [0,2,0,0,0,0|1,0,0]=3 6924 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [0,2,0,0,0,0|1,0,0]=3 6925 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [0,2,0,0,0,0|1,0,0]=3 6926 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210202 [0,2,0,0,0,0|1,0,0]=3 6927 B12R1.367 CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210202 [0,2,0,0,0,0|1,0,0]=3 6928 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,2,0,0,0,0|1,0,0]=3 6929 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [0,2,0,0,0,0|0,0,0]=2 6930 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [0,2,0,0,0,0|0,0,0]=2 6931 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [0,2,0,0,0,0|0,0,0]=2 6932 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [0,2,0,0,0,0|0,0,0]=2 6933 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [0,2,0,0,0,0|0,0,0]=2 6934 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,2,0,0,0,0|0,0,0]=2 6935 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,2,0,0,0,0|0,0,0]=2 6936 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210202 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [0,2,0,0,0,0|1,0,0]=3 6938 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [0,2,0,0,0,0|1,0,0]=3 6939 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210202 [0,2,0,0,0,0|1,0,0]=3 6940 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210202 [0,2,0,0,0,0|1,0,0]=3 6941 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,2,0,0,0,0|1,0,0]=3 6942 B12R1.367 CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210202 [0,2,0,0,0,0|1,0,0]=3 6943 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [0,2,0,0,0,0|1,0,0]=3 6944 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [0,2,0,0,0,0|1,0,0]=3 6945 B12R1.367 CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210202 [0,2,0,0,0,0|1,0,0]=3 6946 B12R1.367 CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210202 [0,2,0,0,0,0|1,0,0]=3 6947 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,2,0,0,0,0|1,0,0]=3 6948 B12R1.367 CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210202 [0,2,0,0,0,0|1,0,0]=3 6949 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [0,2,0,0,0,0|1,0,0]=3 6950 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [0,2,0,0,0,0|1,0,0]=3 6951 B12R1.367 CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210202 [0,2,0,0,0,0|1,0,0]=3 6952 B12R1.367 CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210202 [0,2,0,0,0,0|1,0,0]=3 6953 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,2,0,0,0,0|1,0,0]=3 6954 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,2,0,0,0,0|1,0,0]=3 6955 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,2,0,0,0,0|1,0,0]=3 6956 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,2,0,0,0,0|1,0,0]=3 6958 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,2,0,0,0,0|1,0,0]=3 6959 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,2,0,0,0,0|1,0,0]=3 6960 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,2,0,0,0,0|1,0,0]=3 6961 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100102888905_100000210202 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100102888905_100000204670 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100102888905_100000210202 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 7a_100015183089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.367 CCN(C)c1ccc(c(c1)C)C 2230a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.367 CCN(C)c1ccc(c(c1)C)C 269982a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.367 CCN(C)c1ccc(c(c1)C)C 34a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.367 CCN(C)c1ccc(c(c1)C)C 7a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 2230a_114849113799_100000210202 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 269982a_114849113799_100000204670 [0,2,0,0,0,0|2,0,0]=4 6974 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 34a_114849113799_100000210202 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.367 CCN(C)c1ccc(c(c1)C)F 2230a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.367 CCN(C)c1ccc(c(c1)C)F 269982a_100011756966_100000204670 [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.367 CCN(C)c1ccc(c(c1)C)F 34a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 6978 B12R1.367 CCN(C)c1ccc(c(c1)C)F 38a_100011756966_100000204670 [0,2,0,0,0,0|2,0,0]=4 6979 B12R1.367 CCN(C)c1ccc(c(c1)C)F 7a_100011756966_100000210202 [0,2,0,0,0,0|2,0,0]=4 6980 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 2230a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6981 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 269982a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6982 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 34a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6983 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 7a_100015183089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6984 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 2230a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6985 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 269982a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6986 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 34a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6987 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 7a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6988 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 11a_106832991635_100012339404 [0,2,0,0,0,0|1,0,0]=3 6989 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 1626a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6990 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 240690a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6991 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 527a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6992 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 11a_106832991635_100000186397 [0,2,0,0,0,0|1,0,0]=3 6993 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 1626a_100102657272_100000186397 [0,2,0,0,0,0|1,0,0]=3 6994 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 240690a_100102657272_100000186397 [0,2,0,0,0,0|1,0,0]=3 6995 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 527a_100102657272_100000186397 [0,2,0,0,0,0|1,0,0]=3 6996 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 11a_106832991635_100000691181 [0,2,0,0,0,0|1,0,0]=3 6997 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 6998 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 6999 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 527a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 7000 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 11a_106832991635_100000760357 [0,2,0,0,0,0|1,0,0]=3 7001 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 1626a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 7002 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 240690a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 7003 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 527a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 7004 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 11a_106832991635_100000739115 [0,2,0,0,0,0|1,0,0]=3 7005 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 1626a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 7006 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 240690a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 7007 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 527a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 7008 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,2,0,0,0,0|1,0,0]=3 7009 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 11a_106832991635_100000692631 [0,2,0,0,0,0|0,0,0]=2 7010 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 1626a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 7011 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 240690a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 7012 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 527a_100102657272_100000692631 [0,2,0,0,0,0|0,0,0]=2 7013 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [0,2,0,0,0,0|0,0,0]=2 7014 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 7015 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 7016 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 7017 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [0,2,0,0,0,0|0,0,0]=2 7018 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 7019 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 7020 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [0,2,0,0,0,0|0,0,0]=2 7021 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 11a_106832991635_100000751819 [0,2,0,0,0,0|0,0,0]=2 7022 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 1626a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 7023 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 240690a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 7024 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 527a_100102657272_100000751819 [0,2,0,0,0,0|0,0,0]=2 7025 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 11a_106832991635_100000751300 [0,2,0,0,0,0|0,0,0]=2 7026 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 1626a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 7027 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 240690a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 7028 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 527a_100102657272_100000751300 [0,2,0,0,0,0|0,0,0]=2 7029 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,2,0,0,0,0|0,0,0]=2 7030 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,2,0,0,0,0|0,0,0]=2 7031 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 11a_106832991635_100000687082 [0,2,0,0,0,0|1,0,0]=3 7032 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 7033 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 7034 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 527a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 11a_106832991635_100000751740 [0,2,0,0,0,0|1,0,0]=3 7036 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 1626a_100102657272_100000751740 [0,2,0,0,0,0|1,0,0]=3 7037 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 240690a_100102657272_100000751740 [0,2,0,0,0,0|1,0,0]=3 7038 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 527a_100102657272_100000751740 [0,2,0,0,0,0|1,0,0]=3 7039 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 11a_106832991635_100000210401 [0,2,0,0,0,0|1,0,0]=3 7040 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 7041 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 7042 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 7043 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 11a_106832991635_100000686462 [0,2,0,0,0,0|1,0,0]=3 7044 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 1626a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 7045 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 240690a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 7046 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 527a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 7047 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 11a_106832991635_100000684831 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 1626a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 240690a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 527a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 7051 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,2,0,0,0,0|1,0,0]=3 7052 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,2,0,0,0,0|1,0,0]=3 7053 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 11a_106832991635_100000743946 [0,2,0,0,0,0|1,0,0]=3 7054 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 1626a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 7055 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 240690a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 7056 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 527a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 7057 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 11a_106832991635_100000212313 [0,2,0,0,0,0|1,0,0]=3 7058 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 1626a_100102657272_100000212313 [0,2,0,0,0,0|1,0,0]=3 7059 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 240690a_100102657272_100000212313 [0,2,0,0,0,0|1,0,0]=3 7060 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 527a_100102657272_100000212313 [0,2,0,0,0,0|1,0,0]=3 7061 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 11a_106832991635_100000743183 [0,2,0,0,0,0|1,0,0]=3 7062 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 1626a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 7063 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 240690a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 7064 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 527a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 7065 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 11a_106832991635_100000209822 [0,2,0,0,0,0|1,0,0]=3 7066 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 1626a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 7067 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 240690a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 7068 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 527a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 7069 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 11a_106832991635_100000062624 [0,2,0,0,0,0|1,0,0]=3 7070 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 1626a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 7071 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 240690a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 527a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,2,0,0,0,0|1,0,0]=3 7074 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,2,0,0,0,0|1,0,0]=3 7075 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 11a_106832991635_100012343876 [0,2,0,0,0,0|1,0,0]=3 7076 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 1626a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 240690a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 527a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 7079 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 11a_106832991635_100000751299 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 1626a_100102657272_100000751299 [0,2,0,0,0,0|1,0,0]=3 7081 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 240690a_100102657272_100000751299 [0,2,0,0,0,0|1,0,0]=3 7082 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 527a_100102657272_100000751299 [0,2,0,0,0,0|1,0,0]=3 7083 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 11a_106832991635_100000739381 [0,2,0,0,0,0|1,0,0]=3 7084 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 1626a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 7085 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 240690a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 7086 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 527a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 7087 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 11a_106832991635_100000688015 [0,2,0,0,0,0|1,0,0]=3 7088 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 1626a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 7089 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 240690a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 7090 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 527a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 7091 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 11a_106832991635_100000725830 [0,2,0,0,0,0|1,0,0]=3 7092 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 1626a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 7093 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 240690a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 7094 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 527a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 7095 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,2,0,0,0,0|1,0,0]=3 7097 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [0,2,0,0,0,0|1,0,0]=3 7098 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [0,2,0,0,0,0|1,0,0]=3 7099 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [0,2,0,0,0,0|1,0,0]=3 7100 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [0,2,0,0,0,0|1,0,0]=3 7101 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [0,2,0,0,0,0|1,0,0]=3 7102 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [0,2,0,0,0,0|1,0,0]=3 7103 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [0,2,0,0,0,0|1,0,0]=3 7104 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [0,2,0,0,0,0|1,0,0]=3 7105 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 7106 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 7107 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 7108 B12R1.367 CNC(C)c1ccc(c(c1)C)Br 269862a_106832991636_100000697869 [0,2,0,0,0,0|1,0,1]=4 7109 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [0,2,0,0,0,0|1,0,1]=4 7110 B12R1.367 CNC(C)c1ccc(c(c1)C)Cl 269862a_106832991636_100011216000 [0,2,0,0,0,0|1,0,1]=4 7111 B12R1.367 CNC(C)c1ccc(c(c1)C)F 2230a_100000705826_200000210301 [0,2,0,0,0,0|1,0,1]=4 7112 B12R1.367 CNC(C)c1ccc(c(c1)C)F 269862a_106832991636_100000754758 [0,2,0,0,0,0|1,0,1]=4 7113 B12R1.367 CNC(C)c1ccc(c(c1)C)F 34a_100000705826_200000210301 [0,2,0,0,0,0|1,0,1]=4 7114 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [0,2,0,0,0,0|1,0,1]=4 7115 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 7116 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 7117 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [0,2,0,0,0,0|1,0,0]=3 7119 B12R1.367 COC(=O)c1cc(c(cn1)O)N 271570a_203496583355_100016001589 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.367 COC(=O)c1cc(c(nn1)O)C 271570a_203496583355_100102422153 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,2,0,0,0,0|1,0,0]=3 7122 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,2,0,0,0,0|0,0,0]=2 7123 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,2,0,0,0,0|1,0,0]=3 7124 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,2,0,0,0,0|1,0,0]=3 7125 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,2,0,0,0,0|1,0,0]=3 7126 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [0,2,0,0,0,0|1,0,0]=3 7127 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [0,2,0,0,0,0|1,0,0]=3 7128 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [0,2,0,0,0,0|1,0,0]=3 7129 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [0,2,0,0,0,0|1,0,0]=3 7130 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [0,2,0,0,0,0|1,0,0]=3 7131 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,2,0,0,0,0|1,0,0]=3 7132 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,2,0,0,0,0|1,0,0]=3 7133 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [0,2,0,0,0,0|1,0,0]=3 7134 B12R1.367 COC(=O)c1ccc(c(n1)F)O 271570a_203496583355_100010189630 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.367 COC(=O)c1ccc(c(n1)N)O 271570a_203496583355_100010187631 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.367 COC(=O)c1ccc(c(n1)O)F 271570a_203496583355_100010189626 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.367 COC(=O)c1cnc(c(c1)Br)O 271570a_203496583355_100010114297 [0,2,0,0,0,0|2,0,0]=4 7141 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [0,2,0,0,0,0|1,0,0]=3 7142 B12R1.367 COC(=O)c1cnc(c(c1)F)O 271570a_203496583355_100010189625 [0,2,0,0,0,0|2,0,0]=4 7143 B12R1.367 COC(=O)c1cnc(c(c1)N)O 271570a_203496583355_100000079130 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.367 COC(=O)c1cnc(c(c1)O)Cl 271570a_203496583355_100010188758 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.367 COC(=O)c1cnc(c(c1)O)F 271570a_203496583355_100000117919 [0,2,0,0,0,0|2,0,0]=4 7146 B12R1.367 COC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816800 [0,2,0,0,0,0|2,0,0]=4 7147 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [0,2,0,0,0,0|2,0,0]=4 7148 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.367 COC(=O)c1cnc(c(n1)C)O 271570a_203496583355_100000109192 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.367 COC(=O)c1coc(=O)c(c1)O 271570a_203496583355_100009812866 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.367 Cc1cc(ccc1Br)C(=O)CF 1458a_100000692631_100015361967 [0,2,0,0,0,0|0,0,0]=2 7152 B12R1.367 Cc1cc(ccc1Br)N(C)CF 269982a_100102888905_100015361967 [0,2,0,0,0,0|2,0,0]=4 7153 B12R1.367 Cc1cc(ccc1Br)N(C)CF 34a_100102888905_100015361967 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.367 Cc1cc(ccc1Cl)C(=O)CF 1458a_100000686306_100015361967 [0,2,0,0,0,0|0,0,0]=2 7155 B12R1.367 Cc1cc(ccc1Cl)N(C)CF 269982a_114849113799_100015361967 [0,2,0,0,0,0|2,0,0]=4 7156 B12R1.367 Cc1cc(ccc1Cl)N(C)CF 34a_114849113799_100015361967 [0,2,0,0,0,0|2,0,0]=4 7157 B12R1.367 Cc1cc(ccc1F)C(=O)CF 1458a_100000751819_100015361967 [0,2,0,0,0,0|0,0,0]=2 7158 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 2230a_100000705826_200025704644 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 34a_100000705826_200025704644 [0,2,0,0,0,0|1,0,1]=4 7160 B12R1.367 Cc1cc(ccc1F)N(C)CF 269982a_100011756966_100015361967 [0,2,0,0,0,0|2,0,0]=4 7161 B12R1.367 Cc1cc(ccc1F)N(C)CF 34a_100011756966_100015361967 [0,2,0,0,0,0|2,0,0]=4 7162 B12R1.367 Cc1cc(ccc1F)N(C)CF 38a_100011756966_100015361967 [0,2,0,0,0,0|2,0,0]=4 7163 B12R1.367 Cc1cc(ccc1F)N(C)CF 7a_100011756966_100015361967 [0,2,0,0,0,0|2,0,0]=4 7164 B12R1.367 Cc1cc(ccc1I)C(=O)CF 1458a_100000751300_100015361967 [0,2,0,0,0,0|0,0,0]=2 7165 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,2,0,0,0,0|0,0,0]=2 7166 B12R1.367 Cc1cc(ccc1O)C(=O)NN 271570a_203496583355_100012339724 [0,2,0,0,0,0|1,0,0]=3 7167 B12R1.367 Cc1ccc(cc1Br)C(=O)CF 1458a_100000186397_100015361967 [0,2,0,0,0,0|1,0,0]=3 7168 B12R1.367 Cc1ccc(cc1C)C(=O)CF 1458a_100000210898_100015361967 [0,2,0,0,0,0|0,0,0]=2 7169 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 7170 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 7171 B12R1.367 Cc1ccc(cc1Cl)C(=O)CF 1458a_100000751740_100015361967 [0,2,0,0,0,0|1,0,0]=3 7172 B12R1.367 Cc1ccc(cc1F)C(=O)CF 1458a_100000212313_100015361967 [0,2,0,0,0,0|1,0,0]=3 7173 B12R1.367 Cc1ccc(cc1I)C(=O)CF 1458a_100000751299_100015361967 [0,2,0,0,0,0|1,0,0]=3 7174 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [0,2,0,0,0,0|1,0,0]=3 7175 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [0,2,0,0,0,0|2,0,0]=4 7176 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,2,0,0,0,0|1,0,0]=3 7177 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Br 1458a_100012339404_100015361967 [0,2,0,0,0,0|1,0,0]=3 7179 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100015361967 [0,2,0,0,0,0|1,0,0]=3 7180 B12R1.367 O=C(CF)c1ccc(c(c1)Br)F 1458a_100000760357_100015361967 [0,2,0,0,0,0|1,0,0]=3 7181 B12R1.367 O=C(CF)c1ccc(c(c1)Br)I 1458a_100000739115_100015361967 [0,2,0,0,0,0|1,0,0]=3 7182 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,2,0,0,0,0|1,0,0]=3 7183 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100015361967 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100015361967 [0,2,0,0,0,0|1,0,0]=3 7185 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)F 1458a_100000686462_100015361967 [0,2,0,0,0,0|1,0,0]=3 7186 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)I 1458a_100000684831_100015361967 [0,2,0,0,0,0|1,0,0]=3 7187 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,2,0,0,0,0|1,0,0]=3 7188 B12R1.367 O=C(CF)c1ccc(c(c1)F)Br 1458a_100000743946_100015361967 [0,2,0,0,0,0|1,0,0]=3 7189 B12R1.367 O=C(CF)c1ccc(c(c1)F)Cl 1458a_100000743183_100015361967 [0,2,0,0,0,0|1,0,0]=3 7190 B12R1.367 O=C(CF)c1ccc(c(c1)F)F 1458a_100000209822_100015361967 [0,2,0,0,0,0|1,0,0]=3 7191 B12R1.367 O=C(CF)c1ccc(c(c1)F)I 1458a_100000062624_100015361967 [0,2,0,0,0,0|1,0,0]=3 7192 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,2,0,0,0,0|1,0,0]=3 7193 B12R1.367 O=C(CF)c1ccc(c(c1)I)Br 1458a_100012343876_100015361967 [0,2,0,0,0,0|1,0,0]=3 7194 B12R1.367 O=C(CF)c1ccc(c(c1)I)Cl 1458a_100000739381_100015361967 [0,2,0,0,0,0|1,0,0]=3 7195 B12R1.367 O=C(CF)c1ccc(c(c1)I)F 1458a_100000688015_100015361967 [0,2,0,0,0,0|1,0,0]=3 7196 B12R1.367 O=C(CF)c1ccc(c(c1)I)I 1458a_100000725830_100015361967 [0,2,0,0,0,0|1,0,0]=3 7197 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,2,0,0,0,0|1,0,0]=3 7198 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [0,2,0,0,0,0|1,0,0]=3 7199 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [0,2,0,0,0,0|1,0,0]=3 7200 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [0,2,0,0,0,0|1,0,0]=3 7201 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [0,2,0,0,0,0|1,0,0]=3 7202 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.893 C=C(C)c1cc[n+](c(c1C)C)[O-] 271570a_100000694244_100000083769 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.893 C=C(C)c1ccc(c(c1C)C)Br 271570a_100000694244_200010185626 [0,2,0,0,0,0|1,0,0]=3 7205 B12R1.893 C=C(C)c1ccc(c(c1C)C)F 271570a_100000694244_100009816033 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.893 C=C(C)c1ccc(c(c1C)C)N 271570a_100000694244_100009816967 [0,2,0,0,0,0|1,0,0]=3 7207 B12R1.893 C=C(C)c1ccc(c(c1C)C)O 271570a_100000694244_100012353674 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.893 C=C(C)c1ccc(c(c1C)Cl)Br 271570a_100000694244_200010212245 [0,2,0,0,0,0|2,0,0]=4 7209 B12R1.893 C=C(C)c1ccc(c(c1C)F)Br 271570a_100000694244_100010208201 [0,2,0,0,0,0|2,0,0]=4 7210 B12R1.893 C=C(C)c1ccc(c(c1C)F)F 271570a_100000694244_100009815991 [0,2,0,0,0,0|2,0,0]=4 7211 B12R1.893 C=C(C)c1ccc(c(c1C)F)N 271570a_100000694244_100000722916 [0,2,0,0,0,0|2,0,0]=4 7212 B12R1.893 C=C(C)c1ccc(c(c1C)N)C 271570a_100000694244_200010074581 [0,2,0,0,0,0|2,0,0]=4 7213 B12R1.893 C=C(C)c1ccc(c(c1C)N)F 271570a_100000694244_100010588651 [0,2,0,0,0,0|2,0,0]=4 7214 B12R1.893 C=C(C)c1ccc(c(c1C)N)N 271570a_100000694244_100010009725 [0,2,0,0,0,0|2,0,0]=4 7215 B12R1.893 C=C(C)c1ccc(c(c1C)N)O 271570a_100000694244_100013039247 [0,2,0,0,0,0|2,0,0]=4 7216 B12R1.893 C=C(C)c1ccc(c(c1Cl)C)Br 271570a_100000694244_100055076181 [0,2,0,0,0,0|1,0,0]=3 7217 B12R1.893 C=C(C)c1ccc(c(c1Cl)C)Cl 271570a_100000694244_100010730154 [0,2,0,0,0,0|1,0,0]=3 7218 B12R1.893 C=C(C)c1ccc(c(c1Cl)Cl)Br 271570a_100000694244_200012356690 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.893 C=C(C)c1ccc(c(c1F)Br)F 271570a_100000694244_100010167943 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.893 C=C(C)c1ccc(c(c1F)Br)N 271570a_100000694244_100015781493 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.893 C=C(C)c1ccc(c(c1F)C)C 271570a_100000694244_200015555822 [0,2,0,0,0,0|1,0,0]=3 7222 B12R1.893 C=C(C)c1ccc(c(c1F)C)F 271570a_100000694244_100009815987 [0,2,0,0,0,0|1,0,0]=3 7223 B12R1.893 C=C(C)c1ccc(c(c1F)C)N 271570a_100000694244_100010208198 [0,2,0,0,0,0|1,0,0]=3 7224 B12R1.893 C=C(C)c1ccc(c(c1F)C)O 271570a_100000694244_100010390934 [0,2,0,0,0,0|1,0,0]=3 7225 B12R1.893 C=C(C)c1ccc(c(c1F)Cl)Br 271570a_100000694244_100010212236 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.893 C=C(C)c1ccc(c(c1F)Cl)F 271570a_100000694244_200000038702 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.893 C=C(C)c1ccc(c(c1F)F)Br 271570a_100000694244_100010212264 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.893 C=C(C)c1ccc(c(c1F)F)C 271570a_100000694244_100012766498 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.893 C=C(C)c1ccc(c(c1F)F)F 271570a_100000694244_100000750562 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.893 C=C(C)c1ccc(c(c1F)F)N 271570a_100000694244_100010200256 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.893 C=C(C)c1ccc(c(c1F)F)O 271570a_100000694244_100011830415 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.893 C=C(C)c1ccc(c(c1F)N)F 271570a_100000694244_100025793129 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.893 C=C(C)c1ccc(c(c1F)N)N 271570a_100000694244_100009814308 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.893 C=C(C)c1ccc(c(c1F)O)Br 271570a_100000694244_200010782288 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.893 C=C(C)c1ccc(c(c1F)O)F 271570a_100000694244_100010167067 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.893 C=C(C)c1ccc(c(c1N)C)F 271570a_100000694244_100011009917 [0,2,0,0,0,0|1,0,0]=3 7237 B12R1.893 C=C(C)c1ccc(c(c1N)F)F 271570a_100000694244_100010008850 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.893 C=C(C)c1ccc(c(c1N)N)F 271570a_100000694244_100011102919 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.893 C=C(C)c1ccc(c(c1N)O)Br 271570a_100000694244_100020748643 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.893 C=C(C)c1ccc(c(c1O)C)F 271570a_100000694244_200010391124 [0,2,0,0,0,0|1,0,0]=3 7241 B12R1.893 C=C(C)c1ccc(c(c1O)F)C 271570a_100000694244_100000722096 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.893 C=C(C)c1ccc(c(c1O)F)F 271570a_100000694244_100010243909 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.893 C=C(C)c1cnc(c(c1C)C)N 271570a_100000694244_100009813837 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.893 C=C(C)c1cnc(c(c1C)C)O 271570a_100000694244_200011099879 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200000210301 [0,2,0,0,0,0|1,0,0]=3 7246 B12R1.893 CC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200000210301 [0,2,0,0,0,0|1,0,0]=3 7247 B12R1.893 CC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_200000210301 [0,2,0,0,0,0|1,0,0]=3 7248 B12R1.893 CC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200000210301 [0,2,0,0,0,0|1,0,0]=3 7249 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_200000210301 [0,2,0,0,0,0|0,0,0]=2 7250 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_200000210301 [0,2,0,0,0,0|0,0,0]=2 7251 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200000210301 [0,2,0,0,0,0|1,0,0]=3 7252 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200000210301 [0,2,0,0,0,0|1,0,0]=3 7253 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200000210301 [0,2,0,0,0,0|1,0,0]=3 7254 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200000210301 [0,2,0,0,0,0|1,0,0]=3 7255 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,2,0,0,0,0|1,0,0]=3 7256 B12R1.893 CC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200000210301 [0,2,0,0,0,0|1,0,0]=3 7257 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200000210301 [0,2,0,0,0,0|1,0,0]=3 7258 B12R1.893 CC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_200000210301 [0,2,0,0,0,0|0,0,0]=2 7259 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [0,2,0,0,0,0|0,0,0]=2 7260 B12R1.893 CC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_200000210301 [0,2,0,0,0,0|0,0,0]=2 7261 B12R1.893 CC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_200000210301 [0,2,0,0,0,0|0,0,0]=2 7262 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200000210301 [0,2,0,0,0,0|1,0,0]=3 7263 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_200000210301 [0,2,0,0,0,0|1,0,0]=3 7264 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200000210301 [0,2,0,0,0,0|1,0,0]=3 7265 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200000210301 [0,2,0,0,0,0|1,0,0]=3 7266 B12R1.893 CC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_200000210301 [0,2,0,0,0,0|1,0,0]=3 7267 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200000210301 [0,2,0,0,0,0|1,0,0]=3 7268 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200000210301 [0,2,0,0,0,0|1,0,0]=3 7269 B12R1.893 CC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200000210301 [0,2,0,0,0,0|1,0,0]=3 7270 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,2,0,0,0,0|1,0,0]=3 7271 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,2,0,0,0,0|1,0,0]=3 7272 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200000210301 [0,2,0,0,0,0|1,0,0]=3 7273 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100010179980 [0,2,0,0,0,0|1,0,0]=3 7274 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [0,2,0,0,0,0|0,0,0]=2 7275 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [0,2,0,0,0,0|0,0,0]=2 7276 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [0,2,0,0,0,0|1,0,0]=3 7277 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [0,2,0,0,0,0|1,0,0]=3 7278 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [0,2,0,0,0,0|1,0,0]=3 7279 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,2,0,0,0,0|1,0,0]=3 7280 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])Cl 1458a_100010074829_200025704644 [0,2,0,0,0,0|0,0,0]=2 7281 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])F 1458a_100000061447_200025704644 [0,2,0,0,0,0|0,0,0]=2 7282 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100000722919_200025704644 [0,2,0,0,0,0|0,0,0]=2 7283 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100012183103_200025704644 [0,2,0,0,0,0|0,0,0]=2 7284 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000067293_200025704644 [0,2,0,0,0,0|0,0,0]=2 7285 B12R1.893 Cc1c(ccc(c1F)F)C(=O)[13CH3] 1458a_100000061971_200025704644 [0,2,0,0,0,0|1,0,0]=3 7286 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [0,2,0,0,0,0|0,0,0]=2 7287 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [0,2,0,0,0,0|0,0,0]=2 7288 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [0,2,0,0,0,0|0,0,0]=2 7289 B12R1.893 Cc1ccc(c(c1Cl)F)C(=O)[13CH3] 1458a_100000722910_200025704644 [0,2,0,0,0,0|1,0,0]=3 7290 B12R1.893 Cc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100011219789_200025704644 [0,2,0,0,0,0|1,0,0]=3 7291 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200025704644 [0,2,0,0,0,0|1,0,0]=3 7292 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200025704644 [0,2,0,0,0,0|1,0,0]=3 7293 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200025704644 [0,2,0,0,0,0|1,0,0]=3 7294 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200025704644 [0,2,0,0,0,0|1,0,0]=3 7295 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200025704644 [0,2,0,0,0,0|1,0,0]=3 7296 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200025704644 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200025704644 [0,2,0,0,0,0|1,0,0]=3 7298 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200025704644 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200025704644 [0,2,0,0,0,0|1,0,0]=3 7301 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200025704644 [0,2,0,0,0,0|1,0,0]=3 7302 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200025704644 [0,2,0,0,0,0|1,0,0]=3 7303 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200025704644 [0,2,0,0,0,0|1,0,0]=3 7304 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200025704644 [0,2,0,0,0,0|1,0,0]=3 7305 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200025704644 [0,2,0,0,0,0|1,0,0]=3 7306 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200025704644 [0,2,0,0,0,0|1,0,0]=3 7307 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,2,0,0,0,0|1,0,0]=3 7308 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200025704644 [0,2,0,0,0,0|1,0,0]=3 7309 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [0,2,0,0,0,0|1,0,0]=3 7310 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [0,2,0,0,0,0|1,0,0]=3 7311 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,2,0,0,0,0|1,0,0]=3 7312 B12R1.1005 C=C(C)c1cc(c(=O)n(c1)C)C 271570a_100000694244_100011830242 [0,2,0,0,0,0|2,0,0]=4 7313 B12R1.1005 C=C(C)c1cc(c(=O)n(c1)C)F 271570a_100000694244_100010749421 [0,2,0,0,0,0|2,0,0]=4 7314 B12R1.1005 C=C(C)c1cc(c(=O)n(c1)C)N 271570a_100000694244_106446545582 [0,2,0,0,0,0|2,0,0]=4 7315 B12R1.1005 C=C(C)c1cc(c(c(c1)Br)C)Br 271570a_100000694244_100011099977 [0,2,0,0,0,0|2,0,0]=4 7316 B12R1.1005 C=C(C)c1cc(c(c(c1)Br)O)C 271570a_100000694244_100010982682 [0,2,0,0,0,0|1,0,0]=3 7317 B12R1.1005 C=C(C)c1cc(c(c(c1)C)C)C 271570a_100000694244_200011015895 [0,2,0,0,0,0|1,0,0]=3 7318 B12R1.1005 C=C(C)c1cc(c(c(c1)C)F)C 271570a_100000694244_100009814169 [0,2,0,0,0,0|1,0,0]=3 7319 B12R1.1005 C=C(C)c1cc(c(c(c1)C)N)C 271570a_100000694244_100000737279 [0,2,0,0,0,0|1,0,0]=3 7320 B12R1.1005 C=C(C)c1cc(c(c(c1)C)O)C 271570a_100000694244_100000187306 [0,2,0,0,0,0|1,0,0]=3 7321 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)Br)Cl 271570a_100000694244_200010212260 [0,2,0,0,0,0|2,0,0]=4 7322 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)F)Cl 271570a_100000694244_100012357505 [0,2,0,0,0,0|2,0,0]=4 7323 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)C 271570a_100000694244_200015900153 [0,2,0,0,0,0|1,0,0]=3 7324 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)Cl 271570a_100000694244_100012339652 [0,2,0,0,0,0|2,0,0]=4 7325 B12R1.1005 C=C(C)c1cc(c(c(c1)F)C)F 271570a_100000694244_100009814309 [0,2,0,0,0,0|2,0,0]=4 7326 B12R1.1005 C=C(C)c1cc(c(c(c1)F)C)N 271570a_100000694244_100009813729 [0,2,0,0,0,0|2,0,0]=4 7327 B12R1.1005 C=C(C)c1cc(c(c(c1)F)Cl)F 271570a_100000694244_100010154629 [0,2,0,0,0,0|2,0,0]=4 7328 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)C 271570a_100000694244_200011068660 [0,2,0,0,0,0|1,0,0]=3 7329 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)F 271570a_100000694244_100011215606 [0,2,0,0,0,0|2,0,0]=4 7330 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)O 271570a_100000694244_100000709865 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)C 271570a_100000694244_100000709789 [0,2,0,0,0,0|1,0,0]=3 7332 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)F 271570a_100000694244_100000758902 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)N 271570a_100000694244_100011218333 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)O 271570a_100000694244_100015475841 [0,2,0,0,0,0|2,0,0]=4 7335 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)F 271570a_100000694244_100011216917 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)N 271570a_100000694244_100011217383 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.1005 C=C(C)c1cc(c(c(c1)N)F)C 271570a_100000694244_100010381932 [0,2,0,0,0,0|1,0,0]=3 7338 B12R1.1005 C=C(C)c1cc(c(c(c1)N)N)C 271570a_100000694244_100000688557 [0,2,0,0,0,0|1,0,0]=3 7339 B12R1.1005 C=C(C)c1cc(c(c(c1)N)O)C 271570a_100000694244_100011825904 [0,2,0,0,0,0|1,0,0]=3 7340 B12R1.1005 C=C(C)c1cc(c(c(c1)O)N)C 271570a_100000694244_100010371313 [0,2,0,0,0,0|1,0,0]=3 7341 B12R1.1005 C=C(C)c1cc(c(c(n1)C)N)C 271570a_100000694244_100009817025 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_200000210301 [0,2,0,0,0,0|1,0,0]=3 7343 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_200000210301 [0,2,0,0,0,0|1,0,0]=3 7344 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200000210301 [0,2,0,0,0,0|1,0,0]=3 7345 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200000210301 [0,2,0,0,0,0|1,0,0]=3 7346 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_200000210301 [0,2,0,0,0,0|1,0,0]=3 7347 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200000210301 [0,2,0,0,0,0|1,0,0]=3 7348 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200000210301 [0,2,0,0,0,0|1,0,0]=3 7349 B12R1.1005 CC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_200000210301 [0,2,0,0,0,0|0,0,0]=2 7350 B12R1.1005 CC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_200000210301 [0,2,0,0,0,0|0,0,0]=2 7351 B12R1.1005 CC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_200000210301 [0,2,0,0,0,0|0,0,0]=2 7352 B12R1.1005 CC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_200000210301 [0,2,0,0,0,0|0,0,0]=2 7353 B12R1.1005 CC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_200000210301 [0,2,0,0,0,0|0,0,0]=2 7354 B12R1.1005 CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_200000210301 [0,2,0,0,0,0|0,0,0]=2 7355 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_200000210301 [0,2,0,0,0,0|1,0,0]=3 7356 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_200000210301 [0,2,0,0,0,0|1,0,0]=3 7357 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200000210301 [0,2,0,0,0,0|1,0,0]=3 7358 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200000210301 [0,2,0,0,0,0|1,0,0]=3 7359 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_200000210301 [0,2,0,0,0,0|1,0,0]=3 7360 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_200000210301 [0,2,0,0,0,0|1,0,0]=3 7361 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200000210301 [0,2,0,0,0,0|1,0,0]=3 7362 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200000210301 [0,2,0,0,0,0|1,0,0]=3 7363 B12R1.1005 CC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_200000210301 [0,2,0,0,0,0|1,0,0]=3 7364 B12R1.1005 CC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_200000210301 [0,2,0,0,0,0|1,0,0]=3 7365 B12R1.1005 CC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200000210301 [0,2,0,0,0,0|1,0,0]=3 7366 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_200000210301 [0,2,0,0,0,0|0,0,0]=2 7367 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_200000210301 [0,2,0,0,0,0|1,0,0]=3 7368 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200000210301 [0,2,0,0,0,0|1,0,0]=3 7369 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200000210301 [0,2,0,0,0,0|1,0,0]=3 7370 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_100010371124 [0,2,0,0,0,0|1,0,0]=3 7371 B12R1.1005 CC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_200000210301 [0,2,0,0,0,0|1,0,0]=3 7372 B12R1.1005 CC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200000210301 [0,2,0,0,0,0|1,0,0]=3 7373 B12R1.1005 CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200000210301 [0,2,0,0,0,0|1,0,0]=3 7374 B12R1.1005 CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_200000210301 [0,2,0,0,0,0|1,0,0]=3 7375 B12R1.1005 CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200000210301 [0,2,0,0,0,0|1,0,0]=3 7376 B12R1.1005 CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000210301 [0,2,0,0,0,0|1,0,0]=3 7377 B12R1.1005 Cc1c(cc(cc1Br)C(=O)[13CH3])Br 1458a_100000187602_200025704644 [0,2,0,0,0,0|1,0,0]=3 7378 B12R1.1005 Cc1c(cc(cc1Br)C(=O)[13CH3])F 1458a_200012347618_200025704644 [0,2,0,0,0,0|1,0,0]=3 7379 B12R1.1005 Cc1c(cc(cc1Cl)C(=O)[13CH3])Cl 1458a_100012356007_200025704644 [0,2,0,0,0,0|1,0,0]=3 7380 B12R1.1005 Cc1c(cc(cc1F)C(=O)[13CH3])F 1458a_100000055762_200025704644 [0,2,0,0,0,0|1,0,0]=3 7381 B12R1.1005 Cc1c(cc(cc1I)C(=O)[13CH3])F 1458a_100012344050_200025704644 [0,2,0,0,0,0|1,0,0]=3 7382 B12R1.1005 Cc1c(cc(cc1O)C(=O)[13CH3])O 1458a_100000031928_200025704644 [0,2,0,0,0,0|1,0,0]=3 7383 B12R1.1005 Cc1cc(cc(c1Br)C)C(=O)[13CH3] 1458a_100000700660_200025704644 [0,2,0,0,0,0|0,0,0]=2 7384 B12R1.1005 Cc1cc(cc(c1C)C)C(=O)[13CH3] 1458a_100000075298_200025704644 [0,2,0,0,0,0|0,0,0]=2 7385 B12R1.1005 Cc1cc(cc(c1Cl)C)C(=O)[13CH3] 1458a_100000102532_200025704644 [0,2,0,0,0,0|0,0,0]=2 7386 B12R1.1005 Cc1cc(cc(c1F)C)C(=O)[13CH3] 1458a_100000741972_200025704644 [0,2,0,0,0,0|0,0,0]=2 7387 B12R1.1005 Cc1cc(cc(c1F)F)C(=O)[13CH3] 1458a_100000061453_200025704644 [0,2,0,0,0,0|0,0,0]=2 7388 B12R1.1005 Cc1cc(cc(c1I)C)C(=O)[13CH3] 1458a_100010769667_200025704644 [0,2,0,0,0,0|0,0,0]=2 7389 B12R1.1005 Cc1cc(cc(c1O)C)C(=O)N 271570a_203496583355_200009816865 [0,2,0,0,0,0|1,0,0]=3 7390 B12R1.1005 Cc1cc(cc(c1O)C)C(=O)[13CH3] 1458a_100011219978_200025704644 [0,2,0,0,0,0|0,0,0]=2 7391 B12R1.1005 Cc1cc(cc(c1O)C)N(C)C 271570a_203496583355_100011935182 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.1005 NC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_200009814324 [0,2,0,0,0,0|2,0,0]=4 7393 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200025704644 [0,2,0,0,0,0|1,0,0]=3 7394 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200025704644 [0,2,0,0,0,0|1,0,0]=3 7395 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_200025704644 [0,2,0,0,0,0|1,0,0]=3 7396 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200025704644 [0,2,0,0,0,0|1,0,0]=3 7397 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200025704644 [0,2,0,0,0,0|1,0,0]=3 7398 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_200025704644 [0,2,0,0,0,0|1,0,0]=3 7399 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200025704644 [0,2,0,0,0,0|1,0,0]=3 7400 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200025704644 [0,2,0,0,0,0|1,0,0]=3 7401 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_200025704644 [0,2,0,0,0,0|1,0,0]=3 7402 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_200025704644 [0,2,0,0,0,0|1,0,0]=3 7403 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200025704644 [0,2,0,0,0,0|1,0,0]=3 7404 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200025704644 [0,2,0,0,0,0|1,0,0]=3 7405 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_200025704644 [0,2,0,0,0,0|1,0,0]=3 7406 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200025704644 [0,2,0,0,0,0|1,0,0]=3 7407 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_200025704644 [0,2,0,0,0,0|1,0,0]=3 7408 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200025704644 [0,2,0,0,0,0|1,0,0]=3 7409 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200025704644 [0,2,0,0,0,0|1,0,0]=3 7410 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200025704644 [0,2,0,0,0,0|1,0,0]=3 7411 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200025704644 [0,2,0,0,0,0|1,0,0]=3 7412 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200025704644 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200025704644 [0,2,0,0,0,0|1,0,0]=3 7414 B12R1.10 CCS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815775 [0,2,0,0,0,0|2,0,0]=4 7415 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 270084a_100102657272_100000184224 [0,2,0,0,0,0|2,0,0]=4 7416 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 274078a_100102657272_100000184224 [0,2,0,0,0,0|2,0,0]=4 7417 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 40a_100102657272_100010340488 [0,2,0,0,0,0|2,0,0]=4 7418 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 270084a_100102657272_100000182797 [0,2,0,0,0,0|1,0,0]=3 7419 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 274078a_100102657272_100000182797 [0,2,0,0,0,0|1,0,0]=3 7420 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 40a_100102657272_100010983817 [0,2,0,0,0,0|1,0,0]=3 7421 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 270084a_100102657272_100000182923 [0,2,0,0,0,0|2,0,0]=4 7422 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 274078a_100102657272_100000182923 [0,2,0,0,0,0|2,0,0]=4 7423 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 270084a_100102657272_100000184201 [0,2,0,0,0,0|2,0,0]=4 7424 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 274078a_100102657272_100000184201 [0,2,0,0,0,0|2,0,0]=4 7425 B12R1.10 CNS(=O)(=O)c1cccc(c1)N 40a_100102657272_100000034547 [0,2,0,0,0,0|2,0,0]=4 7426 B12R1.10 CNS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000165148 [0,2,0,0,0,0|2,0,0]=4 7427 B12R1.13 CCC(NC)c1cccc(c1)C 269862a_106832991636_100000730664 [0,2,0,0,0,0|1,0,1]=4 7428 B12R1.13 CCN(CC)c1cccc(c1)C 2230a_100000182157_100000210202 [0,2,0,0,0,0|2,0,0]=4 7429 B12R1.13 CCN(CC)c1cccc(c1)C 269982a_100000182157_100000204670 [0,2,0,0,0,0|2,0,0]=4 7430 B12R1.13 CCN(CC)c1cccc(c1)C 34a_100000182157_100000210202 [0,2,0,0,0,0|2,0,0]=4 7431 B12R1.13 CCN(CC)c1cccc(c1)C 7a_100000182157_100000210202 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.13 CCN(CF)c1cccc(c1)C 269982a_100000182157_100015361967 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.13 CCN(CF)c1cccc(c1)C 34a_100000182157_100015361967 [0,2,0,0,0,0|2,0,0]=4 7434 B12R1.13 CCN(CF)c1cccc(c1)C 7a_100000182157_100015361967 [0,2,0,0,0,0|2,0,0]=4 7435 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 2230a_200016991486_200000210301 [0,2,0,0,0,0|1,0,1]=4 7436 B12R1.13 CC[C@@H](NC)c1cccc(c1)C 34a_200016991486_200000210301 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 2230a_200016991486_200025704644 [0,2,0,0,0,0|1,0,1]=4 7438 B12R1.13 CC[C@@H](N[13CH3])c1cccc(c1)C 34a_200016991486_200025704644 [0,2,0,0,0,0|1,0,1]=4 7439 B12R1.13 CN[C@H](CO)c1cccc(c1)C 2230a_100009818812_200000210301 [0,2,0,0,0,0|0,0,2]=4 7440 B12R1.13 CN[C@H](CO)c1cccc(c1)C 34a_100009818812_200000210301 [0,2,0,0,0,0|0,0,2]=4 7441 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 2230a_100009818812_200025704644 [0,2,0,0,0,0|0,0,2]=4 7442 B12R1.13 Cc1cccc(c1)[C@@H](CO)N[13CH3] 34a_100009818812_200025704644 [0,2,0,0,0,0|0,0,2]=4 7443 B12R1.17 C#CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000184674 [0,2,0,0,0,0|1,0,0]=3 7444 B12R1.17 C#CCC(=O)c1cccc(c1)C 1458a_100000189346_100000184674 [0,2,0,0,0,0|0,0,0]=2 7445 B12R1.17 C#CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000184674 [0,2,0,0,0,0|1,0,0]=3 7446 B12R1.17 C#CCC(=O)c1cccc(c1)F 1458a_100000210950_100000184674 [0,2,0,0,0,0|1,0,0]=3 7447 B12R1.17 C#CCC(=O)c1cccc(c1)I 1458a_100000184098_100000184674 [0,2,0,0,0,0|1,0,0]=3 7448 B12R1.17 C#CCC(=O)c1cccc(c1)O 1458a_100000183914_100000184674 [0,2,0,0,0,0|1,0,0]=3 7449 B12R1.17 C#CCN(C)c1cccc(c1)C 2230a_100000219674_100000038162 [0,2,0,0,0,0|2,0,0]=4 7450 B12R1.17 C#CCN(C)c1cccc(c1)C 34a_100000219674_100000184674 [0,2,0,0,0,0|2,0,0]=4 7451 B12R1.17 C=CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210623 [0,2,0,0,0,0|1,0,0]=3 7452 B12R1.17 C=CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210623 [0,2,0,0,0,0|0,0,0]=2 7453 B12R1.17 C=CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210623 [0,2,0,0,0,0|1,0,0]=3 7454 B12R1.17 C=CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210623 [0,2,0,0,0,0|1,0,0]=3 7455 B12R1.17 C=CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210623 [0,2,0,0,0,0|1,0,0]=3 7456 B12R1.17 C=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210623 [0,2,0,0,0,0|1,0,0]=3 7457 B12R1.17 C=CCN(C)c1cccc(c1)C 2230a_100000219674_100000210623 [0,2,0,0,0,0|2,0,0]=4 7458 B12R1.17 C=CCN(C)c1cccc(c1)C 269982a_100000219674_100000210623 [0,2,0,0,0,0|2,0,0]=4 7459 B12R1.17 C=CCN(C)c1cccc(c1)C 34a_100000219674_100015514636 [0,2,0,0,0,0|2,0,0]=4 7460 B12R1.17 CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210303 [0,2,0,0,0,0|1,0,0]=3 7461 B12R1.17 CCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210303 [0,2,0,0,0,0|0,0,0]=2 7462 B12R1.17 CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210303 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.17 CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210303 [0,2,0,0,0,0|1,0,0]=3 7464 B12R1.17 CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210303 [0,2,0,0,0,0|1,0,0]=3 7465 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [0,2,0,0,0,0|1,0,0]=3 7466 B12R1.17 CCCN(C)c1cccc(c1)C 2230a_100000219674_100000210303 [0,2,0,0,0,0|2,0,0]=4 7467 B12R1.17 CCCN(C)c1cccc(c1)C 269982a_100000219674_100000210303 [0,2,0,0,0,0|2,0,0]=4 7468 B12R1.17 CCCN(C)c1cccc(c1)C 34a_100000219674_100000210303 [0,2,0,0,0,0|2,0,0]=4 7469 B12R1.17 CCNC(=O)c1cc(ccn1)O 271570a_203496583355_100000194128 [0,2,0,0,0,0|2,0,0]=4 7470 B12R1.17 CCNC(=O)c1cccc(c1)Br 11a_100015525214_100000210664 [0,2,0,0,0,0|1,0,0]=3 7471 B12R1.17 CCNC(=O)c1cccc(c1)Br 240690a_100015525214_100000210664 [0,2,0,0,0,0|1,0,0]=3 7472 B12R1.17 CCNC(=O)c1cccc(c1)Br 527a_100015525214_100000210664 [0,2,0,0,0,0|1,0,0]=3 7473 B12R1.17 CCNC(=O)c1cccc(c1)C 11a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 7474 B12R1.17 CCNC(=O)c1cccc(c1)C 240690a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 7475 B12R1.17 CCNC(=O)c1cccc(c1)C 527a_100015525214_100000189346 [0,2,0,0,0,0|0,0,0]=2 7476 B12R1.17 CCNC(=O)c1cccc(c1)Cl 11a_100015525214_100000210390 [0,2,0,0,0,0|1,0,0]=3 7477 B12R1.17 CCNC(=O)c1cccc(c1)Cl 240690a_100015525214_100000210390 [0,2,0,0,0,0|1,0,0]=3 7478 B12R1.17 CCNC(=O)c1cccc(c1)Cl 527a_100015525214_100000210390 [0,2,0,0,0,0|1,0,0]=3 7479 B12R1.17 CCNC(=O)c1cccc(c1)F 11a_100015525214_100000210950 [0,2,0,0,0,0|1,0,0]=3 7480 B12R1.17 CCNC(=O)c1cccc(c1)F 240690a_100015525214_100000210950 [0,2,0,0,0,0|1,0,0]=3 7481 B12R1.17 CCNC(=O)c1cccc(c1)F 527a_100015525214_100000210950 [0,2,0,0,0,0|1,0,0]=3 7482 B12R1.17 CCNC(=O)c1cccc(c1)I 11a_100015525214_100000184098 [0,2,0,0,0,0|1,0,0]=3 7483 B12R1.17 CCNC(=O)c1cccc(c1)I 240690a_100015525214_100000184098 [0,2,0,0,0,0|1,0,0]=3 7484 B12R1.17 CCNC(=O)c1cccc(c1)I 527a_100015525214_100000184098 [0,2,0,0,0,0|1,0,0]=3 7485 B12R1.17 CCNC(=O)c1cccc(c1)O 240690a_100015525214_100000183914 [0,2,0,0,0,0|1,0,0]=3 7486 B12R1.17 CCNC(=O)c1cccc(c1)O 271570a_203496583355_100000155180 [0,2,0,0,0,0|1,0,0]=3 7487 B12R1.17 CCNC(=O)c1cccc(c1)O 527a_100015525214_100000183914 [0,2,0,0,0,0|1,0,0]=3 7488 B12R1.17 CCNC(=O)c1ccnc(c1)O 271570a_203496583355_100000229823 [0,2,0,0,0,0|2,0,0]=4 7489 B12R1.17 CCNC(=O)c1cncc(c1)O 271570a_203496583355_200000155184 [0,2,0,0,0,0|2,0,0]=4 7490 B12R1.17 CCNC(C)c1cccc(c1)C 269862a_100015525214_100000211476 [0,2,0,0,0,0|1,0,1]=4 7491 B12R1.17 CCN[C@H](C)c1cccc(c1)C 2230a_100000698126_100000210202 [0,2,0,0,0,0|1,0,1]=4 7492 B12R1.17 CCN[C@H](C)c1cccc(c1)C 34a_100000698126_100000210202 [0,2,0,0,0,0|1,0,1]=4 7493 B12R1.17 CCOC(=O)c1cc(ccn1)O 271570a_203496583355_100010210110 [0,2,0,0,0,0|2,0,0]=4 7494 B12R1.17 CCOC(=O)c1cccc(c1)O 271570a_203496583355_100000170211 [0,2,0,0,0,0|1,0,0]=3 7495 B12R1.17 CCOC(=O)c1cccc(n1)O 271570a_203496583355_100000695914 [0,2,0,0,0,0|2,0,0]=4 7496 B12R1.17 CCOC(=O)c1ccnc(c1)O 271570a_203496583355_100011213083 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.17 CCOC(=O)c1cncc(c1)O 271570a_203496583355_100000170250 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.17 CCOC(C)c1cccc(c1)C 34a_100000757818_100000210202 [0,2,0,0,0,0|0,0,2]=4 7499 B12R1.17 CCOC(C)c1cccc(c1)C 7a_100000757818_100000210202 [0,2,0,0,0,0|0,0,2]=4 7500 B12R1.17 CN(CC=O)c1cccc(c1)Br 2230a_100000219648_200015260668 [0,2,0,0,0,0|2,0,0]=4 7501 B12R1.17 CN(CC=O)c1cccc(c1)Br 269982a_100000219648_200015260668 [0,2,0,0,0,0|2,0,0]=4 7502 B12R1.17 CN(CC=O)c1cccc(c1)Br 34a_100000219648_200009817547 [0,2,0,0,0,0|2,0,0]=4 7503 B12R1.17 CN(CC=O)c1cccc(c1)Cl 2230a_100000220044_200015260668 [0,2,0,0,0,0|2,0,0]=4 7504 B12R1.17 CN(CC=O)c1cccc(c1)Cl 269982a_100000220044_200015260668 [0,2,0,0,0,0|2,0,0]=4 7505 B12R1.17 CN(CC=O)c1cccc(c1)Cl 34a_100000220044_200009817547 [0,2,0,0,0,0|2,0,0]=4 7506 B12R1.17 CN(CC=O)c1cccc(c1)F 2230a_100020633736_200015260668 [0,2,0,0,0,0|2,0,0]=4 7507 B12R1.17 CN(CC=O)c1cccc(c1)F 269982a_100020633736_200015260668 [0,2,0,0,0,0|2,0,0]=4 7508 B12R1.17 CN(CC=O)c1cccc(c1)F 34a_100020633736_200009817547 [0,2,0,0,0,0|2,0,0]=4 7509 B12R1.17 CN(CC=O)c1cccc(c1)I 2230a_100000221217_200015260668 [0,2,0,0,0,0|2,0,0]=4 7510 B12R1.17 CN(CC=O)c1cccc(c1)I 269982a_100000221217_200015260668 [0,2,0,0,0,0|2,0,0]=4 7511 B12R1.17 CN(CC=O)c1cccc(c1)I 34a_100000221217_200009817547 [0,2,0,0,0,0|2,0,0]=4 7512 B12R1.17 CN(CC=O)c1cccc(c1)O 2230a_100000756613_200015260668 [0,2,0,0,0,0|2,0,0]=4 7513 B12R1.17 CN(CC=O)c1cccc(c1)O 269982a_100000756613_200015260668 [0,2,0,0,0,0|2,0,0]=4 7514 B12R1.17 CN(CC=O)c1cccc(c1)O 34a_100000756613_200009817547 [0,2,0,0,0,0|2,0,0]=4 7515 B12R1.17 CNCC(=O)c1cccc(c1)Br 2230a_106832991635_100000212080 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.17 CNCC(=O)c1cccc(c1)Br 34a_100102657272_100000212080 [0,2,0,0,0,0|1,0,0]=3 7517 B12R1.17 CNCC(=O)c1cccc(c1)Br 7a_106832991635_100000212080 [0,2,0,0,0,0|1,0,0]=3 7518 B12R1.17 CNCC(=O)c1cccc(c1)C 2230a_106832991635_100000739480 [0,2,0,0,0,0|0,0,0]=2 7519 B12R1.17 CNCC(=O)c1cccc(c1)C 34a_100102657272_100000739480 [0,2,0,0,0,0|0,0,0]=2 7520 B12R1.17 CNCC(=O)c1cccc(c1)C 7a_106832991635_100000739480 [0,2,0,0,0,0|0,0,0]=2 7521 B12R1.17 CNCC(=O)c1cccc(c1)Cl 2230a_106832991635_100000211444 [0,2,0,0,0,0|1,0,0]=3 7522 B12R1.17 CNCC(=O)c1cccc(c1)Cl 34a_100102657272_100000211444 [0,2,0,0,0,0|1,0,0]=3 7523 B12R1.17 CNCC(=O)c1cccc(c1)Cl 7a_106832991635_100000211444 [0,2,0,0,0,0|1,0,0]=3 7524 B12R1.17 CNCC(=O)c1cccc(c1)F 2230a_106832991635_100000215616 [0,2,0,0,0,0|1,0,0]=3 7525 B12R1.17 CNCC(=O)c1cccc(c1)F 34a_100102657272_100000215616 [0,2,0,0,0,0|1,0,0]=3 7526 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [0,2,0,0,0,0|1,0,0]=3 7527 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [0,2,0,0,0,0|1,0,0]=3 7528 B12R1.17 CNNC(=O)c1cccc(c1)Br 22a_100016993582_100000210664 [0,2,0,0,0,0|1,0,0]=3 7529 B12R1.17 CNNC(=O)c1cccc(c1)C 22a_100016993582_100000189346 [0,2,0,0,0,0|0,0,0]=2 7530 B12R1.17 CNNC(=O)c1cccc(c1)Cl 22a_100016993582_100000210390 [0,2,0,0,0,0|1,0,0]=3 7531 B12R1.17 CNNC(=O)c1cccc(c1)F 22a_100016993582_100000210950 [0,2,0,0,0,0|1,0,0]=3 7532 B12R1.17 CNNC(=O)c1cccc(c1)I 22a_100016993582_100000184098 [0,2,0,0,0,0|1,0,0]=3 7533 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [0,2,0,0,0,0|1,0,0]=3 7534 B12R1.17 COCC(=O)c1cccc(c1)Br 34a_100138415774_100000212080 [0,2,0,0,0,0|1,0,0]=3 7535 B12R1.17 COCC(=O)c1cccc(c1)C 34a_100138415774_100000739480 [0,2,0,0,0,0|0,0,0]=2 7536 B12R1.17 COCC(=O)c1cccc(c1)Cl 34a_100138415774_100000211444 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.17 COCC(=O)c1cccc(c1)Cl 7a_200011592804_200000210301 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100011592800_200000210301 [0,2,0,0,0,0|1,0,0]=3 7539 B12R1.17 COCC(=O)c1cccc(c1)F 34a_100138415774_100000215616 [0,2,0,0,0,0|1,0,0]=3 7540 B12R1.17 COCC(=O)c1cccc(c1)F 7a_100011592800_200000210301 [0,2,0,0,0,0|1,0,0]=3 7541 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [0,2,0,0,0,0|1,0,0]=3 7542 B12R1.17 COCN(C)c1cccc(c1)C 2230a_100000219674_100000766300 [0,2,0,0,0,0|1,0,1]=4 7543 B12R1.17 COCN(C)c1cccc(c1)C 269982a_100000219674_100000766300 [0,2,0,0,0,0|1,0,1]=4 7544 B12R1.17 COC[C@@H](N)c1cccc(c1)C 34a_100009818812_200000210301 [0,2,0,0,0,0|1,0,1]=4 7545 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_100000212080_200000210301 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.17 CSCC(=O)c1cccc(c1)Br 62a_200000210301_100000212080 [0,2,0,0,0,0|1,0,0]=3 7547 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_100000739480_200000210301 [0,2,0,0,0,0|0,0,0]=2 7548 B12R1.17 CSCC(=O)c1cccc(c1)C 62a_200000210301_100000739480 [0,2,0,0,0,0|0,0,0]=2 7549 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_100000211444_200000210301 [0,2,0,0,0,0|1,0,0]=3 7550 B12R1.17 CSCC(=O)c1cccc(c1)Cl 62a_200000210301_100000211444 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_100000215616_200000210301 [0,2,0,0,0,0|1,0,0]=3 7552 B12R1.17 CSCC(=O)c1cccc(c1)F 62a_200000210301_100000215616 [0,2,0,0,0,0|1,0,0]=3 7553 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [0,2,0,0,0,0|1,0,0]=3 7554 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [0,2,0,0,0,0|1,0,0]=3 7555 B12R1.17 CSCC(=O)c1ccnc(c1)Cl 62a_100009817076_200000210301 [0,2,0,0,0,0|2,0,0]=4 7556 B12R1.17 CSCC(=O)c1ccnc(c1)Cl 62a_200000210301_100009817076 [0,2,0,0,0,0|2,0,0]=4 7557 B12R1.17 CSCN(C)c1cccc(c1)C 2230a_100000219674_100011218213 [0,2,0,0,0,0|1,1,0]=4 7558 B12R1.17 CSCN(C)c1cccc(c1)C 269982a_100000219674_100011218213 [0,2,0,0,0,0|1,1,0]=4 7559 B12R1.17 CSCN(C)c1cccc(c1)C 34a_100000219674_100011218213 [0,2,0,0,0,0|1,1,0]=4 7560 B12R1.17 Cc1cccc(c1)C(=O)CC#N 1458a_100000189346_100011214920 [0,2,0,0,0,0|0,0,0]=2 7561 B12R1.17 Cc1cccc(c1)C(=O)CCF 1458a_100000189346_100011217306 [0,2,0,0,0,0|0,0,0]=2 7562 B12R1.17 Cc1cccc(c1)C(=O)CCO 1458a_100000189346_100000211926 [0,2,0,0,0,0|0,0,0]=2 7563 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_100000739480_200025704644 [0,2,0,0,0,0|0,0,0]=2 7564 B12R1.17 Cc1cccc(c1)C(=O)CS[13CH3] 62a_200025704644_100000739480 [0,2,0,0,0,0|0,0,0]=2 7565 B12R1.17 Cc1cccc(c1)C(C)OCF 34a_100000757818_100015361967 [0,2,0,0,0,0|0,0,2]=4 7566 B12R1.17 Cc1cccc(c1)C(C)OCF 7a_100000757818_100015361967 [0,2,0,0,0,0|0,0,2]=4 7567 B12R1.17 Cc1cccc(c1)N(C)CC#N 2230a_100000219674_100011215382 [0,2,0,0,0,0|2,0,0]=4 7568 B12R1.17 Cc1cccc(c1)N(C)CC#N 269982a_100000219674_100011214920 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.17 Cc1cccc(c1)N(C)CC=O 2230a_100000219674_200015260668 [0,2,0,0,0,0|1,0,0]=3 7570 B12R1.17 Cc1cccc(c1)N(C)CC=O 269982a_100000219674_200015260668 [0,2,0,0,0,0|1,0,0]=3 7571 B12R1.17 Cc1cccc(c1)N(C)CC=O 34a_100000219674_200009817547 [0,2,0,0,0,0|1,0,0]=3 7572 B12R1.17 Cc1cccc(c1)N(C)CCF 2230a_100000219674_100011217306 [0,2,0,0,0,0|2,0,0]=4 7573 B12R1.17 Cc1cccc(c1)N(C)CCF 269982a_100000219674_100011217306 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.17 Cc1cccc(c1)N(C)CCF 34a_100000219674_100011217306 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.17 Cc1cccc(c1)N(C)CCO 2230a_100000219674_100000211926 [0,2,0,0,0,0|1,0,1]=4 7576 B12R1.17 Cc1cccc(c1)N(C)CCO 269982a_100000219674_100000211926 [0,2,0,0,0,0|1,0,1]=4 7577 B12R1.17 Cc1cccc(c1)N(C)CCO 34a_100000219674_100000211926 [0,2,0,0,0,0|1,0,1]=4 7578 B12R1.17 Cc1cccc(c1)[C@@H](C)NCF 34a_100000698126_100015361967 [0,2,0,0,0,0|1,0,1]=4 7579 B12R1.17 Cc1cccc(c1)[C@H](N)CO[13CH3] 34a_100009818812_200025704644 [0,2,0,0,0,0|1,0,1]=4 7580 B12R1.17 N#CCC(=O)c1cccc(c1)Br 1458a_100000210664_100011214920 [0,2,0,0,0,0|1,0,0]=3 7581 B12R1.17 N#CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011214920 [0,2,0,0,0,0|1,0,0]=3 7582 B12R1.17 N#CCC(=O)c1cccc(c1)F 1458a_100000210950_100011214920 [0,2,0,0,0,0|1,0,0]=3 7583 B12R1.17 N#CCC(=O)c1cccc(c1)I 1458a_100000184098_100011214920 [0,2,0,0,0,0|1,0,0]=3 7584 B12R1.17 N#CCC(=O)c1cccc(c1)O 1458a_100000183914_100011214920 [0,2,0,0,0,0|1,0,0]=3 7585 B12R1.17 N#CCC(=O)c1cccc(c1)O 271570a_203496583355_100000740218 [0,2,0,0,0,0|1,0,0]=3 7586 B12R1.17 O=C(CCF)c1cccc(c1)Br 1458a_100000210664_100011217306 [0,2,0,0,0,0|1,0,0]=3 7587 B12R1.17 O=C(CCF)c1cccc(c1)Cl 1458a_100000210390_100011217306 [0,2,0,0,0,0|1,0,0]=3 7588 B12R1.17 O=C(CCF)c1cccc(c1)F 1458a_100000210950_100011217306 [0,2,0,0,0,0|1,0,0]=3 7589 B12R1.17 O=C(CCF)c1cccc(c1)I 1458a_100000184098_100011217306 [0,2,0,0,0,0|1,0,0]=3 7590 B12R1.17 O=C(CCF)c1cccc(c1)O 1458a_100000183914_100011217306 [0,2,0,0,0,0|1,0,0]=3 7591 B12R1.17 O=C(CCO)c1cccc(c1)Br 1458a_100000210664_100000211926 [0,2,0,0,0,0|1,0,0]=3 7592 B12R1.17 O=C(CCO)c1cccc(c1)Cl 1458a_100000210390_100000211926 [0,2,0,0,0,0|1,0,0]=3 7593 B12R1.17 O=C(CCO)c1cccc(c1)F 1458a_100000210950_100000211926 [0,2,0,0,0,0|1,0,0]=3 7594 B12R1.17 O=C(CCO)c1cccc(c1)I 1458a_100000184098_100000211926 [0,2,0,0,0,0|1,0,0]=3 7595 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [0,2,0,0,0,0|1,0,0]=3 7596 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)Cl 7a_200011592804_200025704644 [0,2,0,0,0,0|1,0,0]=3 7597 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 34a_100011592800_200025704644 [0,2,0,0,0,0|1,0,0]=3 7598 B12R1.17 [13CH3]OCC(=O)c1cccc(c1)F 7a_100011592800_200025704644 [0,2,0,0,0,0|1,0,0]=3 7599 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_100000212080_200025704644 [0,2,0,0,0,0|1,0,0]=3 7600 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Br 62a_200025704644_100000212080 [0,2,0,0,0,0|1,0,0]=3 7601 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_100000211444_200025704644 [0,2,0,0,0,0|1,0,0]=3 7602 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)Cl 62a_200025704644_100000211444 [0,2,0,0,0,0|1,0,0]=3 7603 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_100000215616_200025704644 [0,2,0,0,0,0|1,0,0]=3 7604 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)F 62a_200025704644_100000215616 [0,2,0,0,0,0|1,0,0]=3 7605 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [0,2,0,0,0,0|1,0,0]=3 7606 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [0,2,0,0,0,0|1,0,0]=3 7607 B12R1.17 [13CH3]SCC(=O)c1ccnc(c1)Cl 62a_100009817076_200025704644 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.17 [13CH3]SCC(=O)c1ccnc(c1)Cl 62a_200025704644_100009817076 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.24 CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210202 [0,2,0,0,0,0|1,0,0]=3 7610 B12R1.24 CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210202 [0,2,0,0,0,0|0,0,0]=2 7611 B12R1.24 CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210202 [0,2,0,0,0,0|1,0,0]=3 7612 B12R1.24 CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210202 [0,2,0,0,0,0|1,0,0]=3 7613 B12R1.24 CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210202 [0,2,0,0,0,0|1,0,0]=3 7614 B12R1.24 CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210202 [0,2,0,0,0,0|1,0,0]=3 7615 B12R1.24 CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210202 [0,2,0,0,0,0|1,0,0]=3 7616 B12R1.24 CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210202 [0,2,0,0,0,0|0,0,0]=2 7617 B12R1.24 CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210202 [0,2,0,0,0,0|1,0,0]=3 7618 B12R1.24 CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210202 [0,2,0,0,0,0|1,0,0]=3 7619 B12R1.24 CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210202 [0,2,0,0,0,0|1,0,0]=3 7620 B12R1.24 CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210202 [0,2,0,0,0,0|1,0,0]=3 7621 B12R1.24 CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210202 [0,2,0,0,0,0|1,0,0]=3 7622 B12R1.24 CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210202 [0,2,0,0,0,0|0,0,0]=2 7623 B12R1.24 CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210202 [0,2,0,0,0,0|1,0,0]=3 7624 B12R1.24 CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210202 [0,2,0,0,0,0|1,0,0]=3 7625 B12R1.24 CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210202 [0,2,0,0,0,0|1,0,0]=3 7626 B12R1.24 CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210202 [0,2,0,0,0,0|1,0,0]=3 7627 B12R1.24 CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210202 [0,2,0,0,0,0|1,0,0]=3 7628 B12R1.24 CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210202 [0,2,0,0,0,0|0,0,0]=2 7629 B12R1.24 CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210202 [0,2,0,0,0,0|1,0,0]=3 7630 B12R1.24 CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210202 [0,2,0,0,0,0|1,0,0]=3 7631 B12R1.24 CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210202 [0,2,0,0,0,0|1,0,0]=3 7632 B12R1.24 CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210202 [0,2,0,0,0,0|1,0,0]=3 7633 B12R1.24 CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210202 [0,2,0,0,0,0|1,0,0]=3 7634 B12R1.24 CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210202 [0,2,0,0,0,0|0,0,0]=2 7635 B12R1.24 CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210202 [0,2,0,0,0,0|1,0,0]=3 7636 B12R1.24 CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210202 [0,2,0,0,0,0|1,0,0]=3 7637 B12R1.24 CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210202 [0,2,0,0,0,0|1,0,0]=3 7638 B12R1.24 CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210202 [0,2,0,0,0,0|1,0,0]=3 7639 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [0,2,0,0,0,0|0,0,0]=2 7640 B12R1.24 CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210202 [0,2,0,0,0,0|1,0,0]=3 7641 B12R1.24 CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210202 [0,2,0,0,0,0|1,0,0]=3 7642 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [0,2,0,0,0,0|1,0,0]=3 7643 B12R1.24 CCN(C)c1cccc(c1C)C 2230a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 7644 B12R1.24 CCN(C)c1cccc(c1C)C 269982a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 7645 B12R1.24 CCN(C)c1cccc(c1C)C 34a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.24 CCN(C)c1cccc(c1C)C 7a_100000219776_200000210301 [0,2,0,0,0,0|2,0,0]=4 7647 B12R1.24 CCN([13CH3])c1cccc(c1C)C 2230a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 7648 B12R1.24 CCN([13CH3])c1cccc(c1C)C 269982a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 7649 B12R1.24 CCN([13CH3])c1cccc(c1C)C 34a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 7650 B12R1.24 CCN([13CH3])c1cccc(c1C)C 7a_100000219776_200025704644 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.24 CNC(=O)c1cccc(c1Br)Br 11a_106832991635_100012360534 [0,2,0,0,0,0|1,0,0]=3 7652 B12R1.24 CNC(=O)c1cccc(c1Br)Br 1626a_100102657272_100012360534 [0,2,0,0,0,0|1,0,0]=3 7653 B12R1.24 CNC(=O)c1cccc(c1Br)Br 240690a_100102657272_100012360534 [0,2,0,0,0,0|1,0,0]=3 7654 B12R1.24 CNC(=O)c1cccc(c1Br)Br 527a_100102657272_100012360534 [0,2,0,0,0,0|1,0,0]=3 7655 B12R1.24 CNC(=O)c1cccc(c1Br)C 11a_106832991635_100000692419 [0,2,0,0,0,0|0,0,0]=2 7656 B12R1.24 CNC(=O)c1cccc(c1Br)C 1626a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 7657 B12R1.24 CNC(=O)c1cccc(c1Br)C 240690a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 7658 B12R1.24 CNC(=O)c1cccc(c1Br)C 527a_100102657272_100000692419 [0,2,0,0,0,0|0,0,0]=2 7659 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 11a_106832991635_100012339722 [0,2,0,0,0,0|1,0,0]=3 7660 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 1626a_100102657272_100012339722 [0,2,0,0,0,0|1,0,0]=3 7661 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 240690a_100102657272_100012339722 [0,2,0,0,0,0|1,0,0]=3 7662 B12R1.24 CNC(=O)c1cccc(c1Br)Cl 527a_100102657272_100012339722 [0,2,0,0,0,0|1,0,0]=3 7663 B12R1.24 CNC(=O)c1cccc(c1Br)F 11a_106832991635_100011217547 [0,2,0,0,0,0|1,0,0]=3 7664 B12R1.24 CNC(=O)c1cccc(c1Br)F 1626a_100102657272_100011217547 [0,2,0,0,0,0|1,0,0]=3 7665 B12R1.24 CNC(=O)c1cccc(c1Br)F 240690a_100102657272_100011217547 [0,2,0,0,0,0|1,0,0]=3 7666 B12R1.24 CNC(=O)c1cccc(c1Br)F 527a_100102657272_100011217547 [0,2,0,0,0,0|1,0,0]=3 7667 B12R1.24 CNC(=O)c1cccc(c1Br)I 11a_106832991635_100010232522 [0,2,0,0,0,0|1,0,0]=3 7668 B12R1.24 CNC(=O)c1cccc(c1Br)I 1626a_100102657272_100010232522 [0,2,0,0,0,0|1,0,0]=3 7669 B12R1.24 CNC(=O)c1cccc(c1Br)I 240690a_100102657272_100010232522 [0,2,0,0,0,0|1,0,0]=3 7670 B12R1.24 CNC(=O)c1cccc(c1Br)I 527a_100102657272_100010232522 [0,2,0,0,0,0|1,0,0]=3 7671 B12R1.24 CNC(=O)c1cccc(c1Br)O 240690a_100102657272_100010230362 [0,2,0,0,0,0|1,0,0]=3 7672 B12R1.24 CNC(=O)c1cccc(c1Br)O 527a_100102657272_100010230362 [0,2,0,0,0,0|1,0,0]=3 7673 B12R1.24 CNC(=O)c1cccc(c1C)Br 11a_106832991635_100000760464 [0,2,0,0,0,0|1,0,0]=3 7674 B12R1.24 CNC(=O)c1cccc(c1C)Br 1626a_100102657272_100000760464 [0,2,0,0,0,0|1,0,0]=3 7675 B12R1.24 CNC(=O)c1cccc(c1C)Br 240690a_100102657272_100000760464 [0,2,0,0,0,0|1,0,0]=3 7676 B12R1.24 CNC(=O)c1cccc(c1C)Br 527a_100102657272_100000760464 [0,2,0,0,0,0|1,0,0]=3 7677 B12R1.24 CNC(=O)c1cccc(c1C)C 11a_106832991635_100000183679 [0,2,0,0,0,0|0,0,0]=2 7678 B12R1.24 CNC(=O)c1cccc(c1C)C 1626a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 7679 B12R1.24 CNC(=O)c1cccc(c1C)C 240690a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 7680 B12R1.24 CNC(=O)c1cccc(c1C)C 527a_100102657272_100000183679 [0,2,0,0,0,0|0,0,0]=2 7681 B12R1.24 CNC(=O)c1cccc(c1C)Cl 11a_106832991635_100000690184 [0,2,0,0,0,0|1,0,0]=3 7682 B12R1.24 CNC(=O)c1cccc(c1C)Cl 1626a_100102657272_100000690184 [0,2,0,0,0,0|1,0,0]=3 7683 B12R1.24 CNC(=O)c1cccc(c1C)Cl 240690a_100102657272_100000690184 [0,2,0,0,0,0|1,0,0]=3 7684 B12R1.24 CNC(=O)c1cccc(c1C)Cl 527a_100102657272_100000690184 [0,2,0,0,0,0|1,0,0]=3 7685 B12R1.24 CNC(=O)c1cccc(c1C)F 11a_106832991635_100011218272 [0,2,0,0,0,0|1,0,0]=3 7686 B12R1.24 CNC(=O)c1cccc(c1C)F 1626a_100102657272_100011218272 [0,2,0,0,0,0|1,0,0]=3 7687 B12R1.24 CNC(=O)c1cccc(c1C)F 240690a_100102657272_100011218272 [0,2,0,0,0,0|1,0,0]=3 7688 B12R1.24 CNC(=O)c1cccc(c1C)F 527a_100102657272_100011218272 [0,2,0,0,0,0|1,0,0]=3 7689 B12R1.24 CNC(=O)c1cccc(c1C)I 11a_106832991635_100000751865 [0,2,0,0,0,0|1,0,0]=3 7690 B12R1.24 CNC(=O)c1cccc(c1C)I 1626a_100102657272_100000751865 [0,2,0,0,0,0|1,0,0]=3 7691 B12R1.24 CNC(=O)c1cccc(c1C)I 240690a_100102657272_100000751865 [0,2,0,0,0,0|1,0,0]=3 7692 B12R1.24 CNC(=O)c1cccc(c1C)I 527a_100102657272_100000751865 [0,2,0,0,0,0|1,0,0]=3 7693 B12R1.24 CNC(=O)c1cccc(c1C)O 240690a_100102657272_100000766327 [0,2,0,0,0,0|1,0,0]=3 7694 B12R1.24 CNC(=O)c1cccc(c1C)O 527a_100102657272_100000766327 [0,2,0,0,0,0|1,0,0]=3 7695 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 11a_106832991635_100000760540 [0,2,0,0,0,0|1,0,0]=3 7696 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 1626a_100102657272_100000760540 [0,2,0,0,0,0|1,0,0]=3 7697 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 240690a_100102657272_100000760540 [0,2,0,0,0,0|1,0,0]=3 7698 B12R1.24 CNC(=O)c1cccc(c1Cl)Br 527a_100102657272_100000760540 [0,2,0,0,0,0|1,0,0]=3 7699 B12R1.24 CNC(=O)c1cccc(c1Cl)C 11a_106832991635_100000693142 [0,2,0,0,0,0|0,0,0]=2 7700 B12R1.24 CNC(=O)c1cccc(c1Cl)C 1626a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 7701 B12R1.24 CNC(=O)c1cccc(c1Cl)C 240690a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 7702 B12R1.24 CNC(=O)c1cccc(c1Cl)C 527a_100102657272_100000693142 [0,2,0,0,0,0|0,0,0]=2 7703 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 11a_106832991635_100000183631 [0,2,0,0,0,0|1,0,0]=3 7704 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 1626a_100102657272_100000183631 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 240690a_100102657272_100000183631 [0,2,0,0,0,0|1,0,0]=3 7706 B12R1.24 CNC(=O)c1cccc(c1Cl)Cl 527a_100102657272_100000183631 [0,2,0,0,0,0|1,0,0]=3 7707 B12R1.24 CNC(=O)c1cccc(c1Cl)F 11a_106832991635_100000759904 [0,2,0,0,0,0|1,0,0]=3 7708 B12R1.24 CNC(=O)c1cccc(c1Cl)F 1626a_100102657272_100000759904 [0,2,0,0,0,0|1,0,0]=3 7709 B12R1.24 CNC(=O)c1cccc(c1Cl)F 240690a_100102657272_100000759904 [0,2,0,0,0,0|1,0,0]=3 7710 B12R1.24 CNC(=O)c1cccc(c1Cl)F 527a_100102657272_100000759904 [0,2,0,0,0,0|1,0,0]=3 7711 B12R1.24 CNC(=O)c1cccc(c1Cl)I 11a_106832991635_100010176783 [0,2,0,0,0,0|1,0,0]=3 7712 B12R1.24 CNC(=O)c1cccc(c1Cl)I 1626a_100102657272_100010176783 [0,2,0,0,0,0|1,0,0]=3 7713 B12R1.24 CNC(=O)c1cccc(c1Cl)I 240690a_100102657272_100010176783 [0,2,0,0,0,0|1,0,0]=3 7714 B12R1.24 CNC(=O)c1cccc(c1Cl)I 527a_100102657272_100010176783 [0,2,0,0,0,0|1,0,0]=3 7715 B12R1.24 CNC(=O)c1cccc(c1Cl)O 240690a_100102657272_100000092362 [0,2,0,0,0,0|1,0,0]=3 7716 B12R1.24 CNC(=O)c1cccc(c1Cl)O 527a_100102657272_100000092362 [0,2,0,0,0,0|1,0,0]=3 7717 B12R1.24 CNC(=O)c1cccc(c1F)Br 11a_106832991635_100000756403 [0,2,0,0,0,0|1,0,0]=3 7718 B12R1.24 CNC(=O)c1cccc(c1F)Br 1626a_100102657272_100000756403 [0,2,0,0,0,0|1,0,0]=3 7719 B12R1.24 CNC(=O)c1cccc(c1F)Br 240690a_100102657272_100000756403 [0,2,0,0,0,0|1,0,0]=3 7720 B12R1.24 CNC(=O)c1cccc(c1F)Br 527a_100102657272_100000756403 [0,2,0,0,0,0|1,0,0]=3 7721 B12R1.24 CNC(=O)c1cccc(c1F)C 11a_106832991635_100000766181 [0,2,0,0,0,0|0,0,0]=2 7722 B12R1.24 CNC(=O)c1cccc(c1F)C 1626a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 7723 B12R1.24 CNC(=O)c1cccc(c1F)C 240690a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 7724 B12R1.24 CNC(=O)c1cccc(c1F)C 527a_100102657272_100000766181 [0,2,0,0,0,0|0,0,0]=2 7725 B12R1.24 CNC(=O)c1cccc(c1F)Cl 11a_106832991635_100000688816 [0,2,0,0,0,0|1,0,0]=3 7726 B12R1.24 CNC(=O)c1cccc(c1F)Cl 1626a_100102657272_100000688816 [0,2,0,0,0,0|1,0,0]=3 7727 B12R1.24 CNC(=O)c1cccc(c1F)Cl 240690a_100102657272_100000688816 [0,2,0,0,0,0|1,0,0]=3 7728 B12R1.24 CNC(=O)c1cccc(c1F)Cl 527a_100102657272_100000688816 [0,2,0,0,0,0|1,0,0]=3 7729 B12R1.24 CNC(=O)c1cccc(c1F)F 11a_106832991635_100000748134 [0,2,0,0,0,0|1,0,0]=3 7730 B12R1.24 CNC(=O)c1cccc(c1F)F 1626a_100102657272_100000748134 [0,2,0,0,0,0|1,0,0]=3 7731 B12R1.24 CNC(=O)c1cccc(c1F)F 240690a_100102657272_100000748134 [0,2,0,0,0,0|1,0,0]=3 7732 B12R1.24 CNC(=O)c1cccc(c1F)F 527a_100102657272_100000748134 [0,2,0,0,0,0|1,0,0]=3 7733 B12R1.24 CNC(=O)c1cccc(c1F)I 11a_106832991635_100010185205 [0,2,0,0,0,0|1,0,0]=3 7734 B12R1.24 CNC(=O)c1cccc(c1F)I 1626a_100102657272_100010185205 [0,2,0,0,0,0|1,0,0]=3 7735 B12R1.24 CNC(=O)c1cccc(c1F)I 240690a_100102657272_100010185205 [0,2,0,0,0,0|1,0,0]=3 7736 B12R1.24 CNC(=O)c1cccc(c1F)I 527a_100102657272_100010185205 [0,2,0,0,0,0|1,0,0]=3 7737 B12R1.24 CNC(=O)c1cccc(c1F)O 240690a_100102657272_100000037433 [0,2,0,0,0,0|1,0,0]=3 7738 B12R1.24 CNC(=O)c1cccc(c1F)O 527a_100102657272_100000037433 [0,2,0,0,0,0|1,0,0]=3 7739 B12R1.24 CNC(=O)c1cccc(c1I)Br 11a_106832991635_100000688019 [0,2,0,0,0,0|1,0,0]=3 7740 B12R1.24 CNC(=O)c1cccc(c1I)Br 1626a_100102657272_100000688019 [0,2,0,0,0,0|1,0,0]=3 7741 B12R1.24 CNC(=O)c1cccc(c1I)Br 240690a_100102657272_100000688019 [0,2,0,0,0,0|1,0,0]=3 7742 B12R1.24 CNC(=O)c1cccc(c1I)Br 527a_100102657272_100000688019 [0,2,0,0,0,0|1,0,0]=3 7743 B12R1.24 CNC(=O)c1cccc(c1I)C 11a_106832991635_100000739377 [0,2,0,0,0,0|0,0,0]=2 7744 B12R1.24 CNC(=O)c1cccc(c1I)C 1626a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 7745 B12R1.24 CNC(=O)c1cccc(c1I)C 240690a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 7746 B12R1.24 CNC(=O)c1cccc(c1I)C 527a_100102657272_100000739377 [0,2,0,0,0,0|0,0,0]=2 7747 B12R1.24 CNC(=O)c1cccc(c1I)Cl 11a_106832991635_100010176784 [0,2,0,0,0,0|1,0,0]=3 7748 B12R1.24 CNC(=O)c1cccc(c1I)Cl 1626a_100102657272_100010176784 [0,2,0,0,0,0|1,0,0]=3 7749 B12R1.24 CNC(=O)c1cccc(c1I)Cl 240690a_100102657272_100010176784 [0,2,0,0,0,0|1,0,0]=3 7750 B12R1.24 CNC(=O)c1cccc(c1I)Cl 527a_100102657272_100010176784 [0,2,0,0,0,0|1,0,0]=3 7751 B12R1.24 CNC(=O)c1cccc(c1I)F 11a_106832991635_100000690930 [0,2,0,0,0,0|1,0,0]=3 7752 B12R1.24 CNC(=O)c1cccc(c1I)F 1626a_100102657272_100000690930 [0,2,0,0,0,0|1,0,0]=3 7753 B12R1.24 CNC(=O)c1cccc(c1I)F 240690a_100102657272_100000690930 [0,2,0,0,0,0|1,0,0]=3 7754 B12R1.24 CNC(=O)c1cccc(c1I)F 527a_100102657272_100000690930 [0,2,0,0,0,0|1,0,0]=3 7755 B12R1.24 CNC(=O)c1cccc(c1I)O 527a_100102657272_100010084636 [0,2,0,0,0,0|1,0,0]=3 7756 B12R1.24 CNC(=O)c1cccc(c1O)Br 240690a_100102657272_100000752940 [0,2,0,0,0,0|1,0,0]=3 7757 B12R1.24 CNC(=O)c1cccc(c1O)Br 527a_100102657272_100000752940 [0,2,0,0,0,0|1,0,0]=3 7758 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [0,2,0,0,0,0|0,0,0]=2 7759 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [0,2,0,0,0,0|0,0,0]=2 7760 B12R1.24 CNC(=O)c1cccc(c1O)Cl 240690a_100102657272_100000742801 [0,2,0,0,0,0|1,0,0]=3 7761 B12R1.24 CNC(=O)c1cccc(c1O)Cl 527a_100102657272_100000742801 [0,2,0,0,0,0|1,0,0]=3 7762 B12R1.24 CNC(=O)c1cccc(c1O)F 240690a_100102657272_100011217230 [0,2,0,0,0,0|1,0,0]=3 7763 B12R1.24 CNC(=O)c1cccc(c1O)F 527a_100102657272_100011217230 [0,2,0,0,0,0|1,0,0]=3 7764 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [0,2,0,0,0,0|1,0,0]=3 7765 B12R1.24 CNC(C)c1cccc(c1C)C 2230a_106832991635_100012183177 [0,2,0,0,0,0|1,0,1]=4 7766 B12R1.24 CNC(C)c1cccc(c1C)C 269862a_106832991636_100000756305 [0,2,0,0,0,0|1,0,1]=4 7767 B12R1.24 CNC(C)c1cccc(c1C)C 34a_100102657272_100012183177 [0,2,0,0,0,0|1,0,1]=4 7768 B12R1.24 CNC(C)c1cccc(c1C)C 7a_106832991635_100012183177 [0,2,0,0,0,0|1,0,1]=4 7769 B12R1.24 CNC(C)c1cccc(c1F)C 269862a_106832991636_100012182731 [0,2,0,0,0,0|1,0,1]=4 7770 B12R1.24 CNC(C)c1cccc(c1O)C 269862a_106832991636_100009847209 [0,2,0,0,0,0|1,0,1]=4 7771 B12R1.24 COC(=O)c1c[nH]cc(c1=O)O 271570a_203496583355_100010873956 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [0,2,0,0,0,0|1,0,0]=3 7773 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [0,2,0,0,0,0|1,0,0]=3 7774 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [0,2,0,0,0,0|1,0,0]=3 7775 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [0,2,0,0,0,0|1,0,0]=3 7776 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [0,2,0,0,0,0|1,0,0]=3 7777 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [0,2,0,0,0,0|0,0,0]=2 7778 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [0,2,0,0,0,0|1,0,0]=3 7779 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [0,2,0,0,0,0|1,0,0]=3 7780 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [0,2,0,0,0,0|1,0,0]=3 7781 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [0,2,0,0,0,0|1,0,0]=3 7782 B12R1.24 COC(=O)c1ccnc(c1C)O 271570a_203496583355_100000087782 [0,2,0,0,0,0|2,0,0]=4 7783 B12R1.24 COC(=O)c1ccnc(c1F)O 271570a_203496583355_100000081818 [0,2,0,0,0,0|2,0,0]=4 7784 B12R1.24 COC(=O)c1ccnc(c1N)O 271570a_203496583355_100000067308 [0,2,0,0,0,0|2,0,0]=4 7785 B12R1.24 COC(=O)c1cncc(c1C)O 271570a_203496583355_100010713144 [0,2,0,0,0,0|2,0,0]=4 7786 B12R1.24 COC(=O)c1nccc(c1C)O 271570a_203496583355_100000094583 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.24 COC(=O)c1nccc(c1F)O 271570a_203496583355_100000687924 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.24 COC(C)c1cccc(c1C)C 34a_100138415774_100012183177 [0,2,0,0,0,0|0,0,2]=4 7789 B12R1.24 CSC(C)c1cccc(c1C)C 62a_100012183177_200000210301 [0,2,0,0,0,0|0,1,1]=4 7790 B12R1.24 CSC(C)c1cccc(c1C)C 62a_200000210301_100012183177 [0,2,0,0,0,0|0,1,1]=4 7791 B12R1.24 Cc1c(cccc1C(=O)CF)Br 1458a_100000760464_100015361967 [0,2,0,0,0,0|1,0,0]=3 7792 B12R1.24 Cc1c(cccc1C(=O)CF)Cl 1458a_100000690184_100015361967 [0,2,0,0,0,0|1,0,0]=3 7793 B12R1.24 Cc1c(cccc1C(=O)CF)F 1458a_100011218272_100015361967 [0,2,0,0,0,0|1,0,0]=3 7794 B12R1.24 Cc1c(cccc1C(=O)CF)I 1458a_100000751865_100015361967 [0,2,0,0,0,0|1,0,0]=3 7795 B12R1.24 Cc1c(cccc1C(=O)CF)O 1458a_100000766327_100015361967 [0,2,0,0,0,0|1,0,0]=3 7796 B12R1.24 Cc1c(cccc1C(=O)NN)O 271570a_203496583355_200012298103 [0,2,0,0,0,0|2,0,0]=4 7797 B12R1.24 Cc1cccc(c1Br)C(=O)CF 1458a_100000692419_100015361967 [0,2,0,0,0,0|0,0,0]=2 7798 B12R1.24 Cc1cccc(c1C)C(=O)CF 1458a_100000183679_100015361967 [0,2,0,0,0,0|0,0,0]=2 7799 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_100012183177_200025704644 [0,2,0,0,0,0|0,1,1]=4 7800 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_200025704644_100012183177 [0,2,0,0,0,0|0,1,1]=4 7801 B12R1.24 Cc1cccc(c1Cl)C(=O)CF 1458a_100000693142_100015361967 [0,2,0,0,0,0|0,0,0]=2 7802 B12R1.24 Cc1cccc(c1F)C(=O)CF 1458a_100000766181_100015361967 [0,2,0,0,0,0|0,0,0]=2 7803 B12R1.24 Cc1cccc(c1I)C(=O)CF 1458a_100000739377_100015361967 [0,2,0,0,0,0|0,0,0]=2 7804 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [0,2,0,0,0,0|0,0,0]=2 7805 B12R1.24 O=C(CF)c1cccc(c1Br)Br 1458a_100012360534_100015361967 [0,2,0,0,0,0|1,0,0]=3 7806 B12R1.24 O=C(CF)c1cccc(c1Br)Cl 1458a_100012339722_100015361967 [0,2,0,0,0,0|1,0,0]=3 7807 B12R1.24 O=C(CF)c1cccc(c1Br)F 1458a_100011217547_100015361967 [0,2,0,0,0,0|1,0,0]=3 7808 B12R1.24 O=C(CF)c1cccc(c1Br)I 1458a_100010232522_100015361967 [0,2,0,0,0,0|1,0,0]=3 7809 B12R1.24 O=C(CF)c1cccc(c1Br)O 1458a_100010230362_100015361967 [0,2,0,0,0,0|1,0,0]=3 7810 B12R1.24 O=C(CF)c1cccc(c1Cl)Br 1458a_100000760540_100015361967 [0,2,0,0,0,0|1,0,0]=3 7811 B12R1.24 O=C(CF)c1cccc(c1Cl)Cl 1458a_100000183631_100015361967 [0,2,0,0,0,0|1,0,0]=3 7812 B12R1.24 O=C(CF)c1cccc(c1Cl)F 1458a_100000759904_100015361967 [0,2,0,0,0,0|1,0,0]=3 7813 B12R1.24 O=C(CF)c1cccc(c1Cl)I 1458a_100010176783_100015361967 [0,2,0,0,0,0|1,0,0]=3 7814 B12R1.24 O=C(CF)c1cccc(c1Cl)O 1458a_100000092362_100015361967 [0,2,0,0,0,0|1,0,0]=3 7815 B12R1.24 O=C(CF)c1cccc(c1F)Br 1458a_100000756403_100015361967 [0,2,0,0,0,0|1,0,0]=3 7816 B12R1.24 O=C(CF)c1cccc(c1F)Cl 1458a_100000688816_100015361967 [0,2,0,0,0,0|1,0,0]=3 7817 B12R1.24 O=C(CF)c1cccc(c1F)F 1458a_100000748134_100015361967 [0,2,0,0,0,0|1,0,0]=3 7818 B12R1.24 O=C(CF)c1cccc(c1F)I 1458a_100010185205_100015361967 [0,2,0,0,0,0|1,0,0]=3 7819 B12R1.24 O=C(CF)c1cccc(c1F)O 1458a_100000037433_100015361967 [0,2,0,0,0,0|1,0,0]=3 7820 B12R1.24 O=C(CF)c1cccc(c1I)Br 1458a_100000688019_100015361967 [0,2,0,0,0,0|1,0,0]=3 7821 B12R1.24 O=C(CF)c1cccc(c1I)Cl 1458a_100010176784_100015361967 [0,2,0,0,0,0|1,0,0]=3 7822 B12R1.24 O=C(CF)c1cccc(c1I)F 1458a_100000690930_100015361967 [0,2,0,0,0,0|1,0,0]=3 7823 B12R1.24 O=C(CF)c1cccc(c1I)O 1458a_100010084636_100015361967 [0,2,0,0,0,0|1,0,0]=3 7824 B12R1.24 O=C(CF)c1cccc(c1O)Br 1458a_100000752940_100015361967 [0,2,0,0,0,0|1,0,0]=3 7825 B12R1.24 O=C(CF)c1cccc(c1O)Cl 1458a_100000742801_100015361967 [0,2,0,0,0,0|1,0,0]=3 7826 B12R1.24 O=C(CF)c1cccc(c1O)F 1458a_100011217230_100015361967 [0,2,0,0,0,0|1,0,0]=3 7827 B12R1.24 O=C(CF)c1cccc(c1O)O 1458a_100000690420_100015361967 [0,2,0,0,0,0|1,0,0]=3 7828 B12R1.354 CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210202 [0,2,0,0,0,0|1,0,0]=3 7829 B12R1.354 CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210202 [0,2,0,0,0,0|0,0,0]=2 7830 B12R1.354 CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210202 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.354 CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210202 [0,2,0,0,0,0|1,0,0]=3 7832 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [0,2,0,0,0,0|1,0,0]=3 7834 B12R1.354 CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210202 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.354 CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210202 [0,2,0,0,0,0|0,0,0]=2 7836 B12R1.354 CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210202 [0,2,0,0,0,0|1,0,0]=3 7837 B12R1.354 CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210202 [0,2,0,0,0,0|1,0,0]=3 7838 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [0,2,0,0,0,0|1,0,0]=3 7840 B12R1.354 CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210202 [0,2,0,0,0,0|1,0,0]=3 7841 B12R1.354 CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210202 [0,2,0,0,0,0|0,0,0]=2 7842 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210202 [0,2,0,0,0,0|1,0,0]=3 7843 B12R1.354 CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210202 [0,2,0,0,0,0|1,0,0]=3 7844 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [0,2,0,0,0,0|1,0,0]=3 7845 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [0,2,0,0,0,0|1,0,0]=3 7846 B12R1.354 CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210202 [0,2,0,0,0,0|1,0,0]=3 7847 B12R1.354 CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210202 [0,2,0,0,0,0|0,0,0]=2 7848 B12R1.354 CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210202 [0,2,0,0,0,0|1,0,0]=3 7849 B12R1.354 CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210202 [0,2,0,0,0,0|1,0,0]=3 7850 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [0,2,0,0,0,0|1,0,0]=3 7851 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [0,2,0,0,0,0|1,0,0]=3 7852 B12R1.354 CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210202 [0,2,0,0,0,0|1,0,0]=3 7853 B12R1.354 CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210202 [0,2,0,0,0,0|0,0,0]=2 7854 B12R1.354 CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210202 [0,2,0,0,0,0|1,0,0]=3 7855 B12R1.354 CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210202 [0,2,0,0,0,0|1,0,0]=3 7856 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [0,2,0,0,0,0|1,0,0]=3 7857 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [0,2,0,0,0,0|1,0,0]=3 7858 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [0,2,0,0,0,0|1,0,0]=3 7859 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [0,2,0,0,0,0|0,0,0]=2 7860 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [0,2,0,0,0,0|1,0,0]=3 7861 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [0,2,0,0,0,0|1,0,0]=3 7862 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [0,2,0,0,0,0|1,0,0]=3 7863 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [0,2,0,0,0,0|1,0,0]=3 7864 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [0,2,0,0,0,0|1,0,0]=3 7865 B12R1.354 CCN(C)c1cc(ccc1C)C 2230a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 7866 B12R1.354 CCN(C)c1cc(ccc1C)C 269982a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 7867 B12R1.354 CCN(C)c1cc(ccc1C)C 34a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 7868 B12R1.354 CCN(C)c1cc(ccc1C)C 7a_100000743043_200000210301 [0,2,0,0,0,0|2,0,0]=4 7869 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 2230a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 7870 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 269982a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 7871 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 34a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 7a_100000743043_200025704644 [0,2,0,0,0,0|2,0,0]=4 7873 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 11a_106832991635_100000690610 [0,2,0,0,0,0|1,0,0]=3 7874 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 1626a_100102657272_100000690610 [0,2,0,0,0,0|1,0,0]=3 7875 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 240690a_100102657272_100000690610 [0,2,0,0,0,0|1,0,0]=3 7876 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 527a_100102657272_100000690610 [0,2,0,0,0,0|1,0,0]=3 7877 B12R1.354 CNC(=O)c1cc(ccc1Br)C 11a_106832991635_100000689033 [0,2,0,0,0,0|0,0,0]=2 7878 B12R1.354 CNC(=O)c1cc(ccc1Br)C 1626a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 7879 B12R1.354 CNC(=O)c1cc(ccc1Br)C 240690a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 7880 B12R1.354 CNC(=O)c1cc(ccc1Br)C 527a_100102657272_100000689033 [0,2,0,0,0,0|0,0,0]=2 7881 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 11a_106832991635_100000736951 [0,2,0,0,0,0|1,0,0]=3 7882 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 1626a_100102657272_100000736951 [0,2,0,0,0,0|1,0,0]=3 7883 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 240690a_100102657272_100000736951 [0,2,0,0,0,0|1,0,0]=3 7884 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 527a_100102657272_100000736951 [0,2,0,0,0,0|1,0,0]=3 7885 B12R1.354 CNC(=O)c1cc(ccc1Br)F 11a_106832991635_100000212315 [0,2,0,0,0,0|1,0,0]=3 7886 B12R1.354 CNC(=O)c1cc(ccc1Br)F 1626a_100102657272_100000212315 [0,2,0,0,0,0|1,0,0]=3 7887 B12R1.354 CNC(=O)c1cc(ccc1Br)F 240690a_100102657272_100000212315 [0,2,0,0,0,0|1,0,0]=3 7888 B12R1.354 CNC(=O)c1cc(ccc1Br)F 527a_100102657272_100000212315 [0,2,0,0,0,0|1,0,0]=3 7889 B12R1.354 CNC(=O)c1cc(ccc1Br)I 11a_106832991635_100000698340 [0,2,0,0,0,0|1,0,0]=3 7890 B12R1.354 CNC(=O)c1cc(ccc1Br)I 1626a_100102657272_100000698340 [0,2,0,0,0,0|1,0,0]=3 7891 B12R1.354 CNC(=O)c1cc(ccc1Br)I 240690a_100102657272_100000698340 [0,2,0,0,0,0|1,0,0]=3 7892 B12R1.354 CNC(=O)c1cc(ccc1Br)I 527a_100102657272_100000698340 [0,2,0,0,0,0|1,0,0]=3 7893 B12R1.354 CNC(=O)c1cc(ccc1Br)O 240690a_100102657272_100012352043 [0,2,0,0,0,0|1,0,0]=3 7894 B12R1.354 CNC(=O)c1cc(ccc1Br)O 527a_100102657272_100012352043 [0,2,0,0,0,0|1,0,0]=3 7895 B12R1.354 CNC(=O)c1cc(ccc1C)Br 11a_106832991635_100000759961 [0,2,0,0,0,0|1,0,0]=3 7896 B12R1.354 CNC(=O)c1cc(ccc1C)Br 1626a_100102657272_100000759961 [0,2,0,0,0,0|1,0,0]=3 7897 B12R1.354 CNC(=O)c1cc(ccc1C)Br 240690a_100102657272_100000759961 [0,2,0,0,0,0|1,0,0]=3 7898 B12R1.354 CNC(=O)c1cc(ccc1C)Br 527a_100102657272_100000759961 [0,2,0,0,0,0|1,0,0]=3 7899 B12R1.354 CNC(=O)c1cc(ccc1C)C 11a_106832991635_100000195421 [0,2,0,0,0,0|0,0,0]=2 7900 B12R1.354 CNC(=O)c1cc(ccc1C)C 1626a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 7901 B12R1.354 CNC(=O)c1cc(ccc1C)C 240690a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 7902 B12R1.354 CNC(=O)c1cc(ccc1C)C 527a_100102657272_100000195421 [0,2,0,0,0,0|0,0,0]=2 7903 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 11a_106832991635_100000692595 [0,2,0,0,0,0|1,0,0]=3 7904 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 1626a_100102657272_100000692595 [0,2,0,0,0,0|1,0,0]=3 7905 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 240690a_100102657272_100000692595 [0,2,0,0,0,0|1,0,0]=3 7906 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 527a_100102657272_100000692595 [0,2,0,0,0,0|1,0,0]=3 7907 B12R1.354 CNC(=O)c1cc(ccc1C)F 11a_106832991635_100000240043 [0,2,0,0,0,0|1,0,0]=3 7908 B12R1.354 CNC(=O)c1cc(ccc1C)F 1626a_100102657272_100000240043 [0,2,0,0,0,0|1,0,0]=3 7909 B12R1.354 CNC(=O)c1cc(ccc1C)F 240690a_100102657272_100000240043 [0,2,0,0,0,0|1,0,0]=3 7910 B12R1.354 CNC(=O)c1cc(ccc1C)F 527a_100102657272_100000240043 [0,2,0,0,0,0|1,0,0]=3 7911 B12R1.354 CNC(=O)c1cc(ccc1C)I 11a_106832991635_100000688012 [0,2,0,0,0,0|1,0,0]=3 7912 B12R1.354 CNC(=O)c1cc(ccc1C)I 1626a_100102657272_100000688012 [0,2,0,0,0,0|1,0,0]=3 7913 B12R1.354 CNC(=O)c1cc(ccc1C)I 240690a_100102657272_100000688012 [0,2,0,0,0,0|1,0,0]=3 7914 B12R1.354 CNC(=O)c1cc(ccc1C)I 527a_100102657272_100000688012 [0,2,0,0,0,0|1,0,0]=3 7915 B12R1.354 CNC(=O)c1cc(ccc1C)O 240690a_100102657272_100000687834 [0,2,0,0,0,0|1,0,0]=3 7916 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 11a_106832991635_100000211212 [0,2,0,0,0,0|1,0,0]=3 7917 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 1626a_100102657272_100000211212 [0,2,0,0,0,0|1,0,0]=3 7918 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 240690a_100102657272_100000211212 [0,2,0,0,0,0|1,0,0]=3 7919 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 527a_100102657272_100000211212 [0,2,0,0,0,0|1,0,0]=3 7920 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 11a_106832991635_100011290873 [0,2,0,0,0,0|0,0,0]=2 7921 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 1626a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 7922 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 240690a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 7923 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 527a_100102657272_100011290873 [0,2,0,0,0,0|0,0,0]=2 7924 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 11a_106832991635_100000210642 [0,2,0,0,0,0|1,0,0]=3 7925 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 1626a_100102657272_100000210642 [0,2,0,0,0,0|1,0,0]=3 7926 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 240690a_100102657272_100000210642 [0,2,0,0,0,0|1,0,0]=3 7927 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 527a_100102657272_100000210642 [0,2,0,0,0,0|1,0,0]=3 7928 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 11a_106832991635_100011219680 [0,2,0,0,0,0|1,0,0]=3 7929 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 1626a_100102657272_100011219680 [0,2,0,0,0,0|1,0,0]=3 7930 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 240690a_100102657272_100011219680 [0,2,0,0,0,0|1,0,0]=3 7931 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 527a_100102657272_100011219680 [0,2,0,0,0,0|1,0,0]=3 7932 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 11a_106832991635_100000688013 [0,2,0,0,0,0|1,0,0]=3 7933 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 1626a_100102657272_100000688013 [0,2,0,0,0,0|1,0,0]=3 7934 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 240690a_100102657272_100000688013 [0,2,0,0,0,0|1,0,0]=3 7935 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 527a_100102657272_100000688013 [0,2,0,0,0,0|1,0,0]=3 7936 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 240690a_100102657272_100000719527 [0,2,0,0,0,0|1,0,0]=3 7937 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 527a_100102657272_100000719527 [0,2,0,0,0,0|1,0,0]=3 7938 B12R1.354 CNC(=O)c1cc(ccc1F)Br 11a_106832991635_100000212322 [0,2,0,0,0,0|1,0,0]=3 7939 B12R1.354 CNC(=O)c1cc(ccc1F)Br 1626a_100102657272_100000212322 [0,2,0,0,0,0|1,0,0]=3 7940 B12R1.354 CNC(=O)c1cc(ccc1F)Br 240690a_100102657272_100000212322 [0,2,0,0,0,0|1,0,0]=3 7941 B12R1.354 CNC(=O)c1cc(ccc1F)Br 527a_100102657272_100000212322 [0,2,0,0,0,0|1,0,0]=3 7942 B12R1.354 CNC(=O)c1cc(ccc1F)C 11a_106832991635_100000749327 [0,2,0,0,0,0|0,0,0]=2 7943 B12R1.354 CNC(=O)c1cc(ccc1F)C 1626a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 7944 B12R1.354 CNC(=O)c1cc(ccc1F)C 240690a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 7945 B12R1.354 CNC(=O)c1cc(ccc1F)C 527a_100102657272_100000749327 [0,2,0,0,0,0|0,0,0]=2 7946 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 11a_106832991635_100000214954 [0,2,0,0,0,0|1,0,0]=3 7947 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 1626a_100102657272_100000214954 [0,2,0,0,0,0|1,0,0]=3 7948 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 240690a_100102657272_100000214954 [0,2,0,0,0,0|1,0,0]=3 7949 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 527a_100102657272_100000214954 [0,2,0,0,0,0|1,0,0]=3 7950 B12R1.354 CNC(=O)c1cc(ccc1F)F 11a_106832991635_100000198512 [0,2,0,0,0,0|1,0,0]=3 7951 B12R1.354 CNC(=O)c1cc(ccc1F)F 1626a_100102657272_100000198512 [0,2,0,0,0,0|1,0,0]=3 7952 B12R1.354 CNC(=O)c1cc(ccc1F)F 240690a_100102657272_100000198512 [0,2,0,0,0,0|1,0,0]=3 7953 B12R1.354 CNC(=O)c1cc(ccc1F)F 527a_100102657272_100000198512 [0,2,0,0,0,0|1,0,0]=3 7954 B12R1.354 CNC(=O)c1cc(ccc1F)I 11a_106832991635_100000688014 [0,2,0,0,0,0|1,0,0]=3 7955 B12R1.354 CNC(=O)c1cc(ccc1F)I 1626a_100102657272_100000688014 [0,2,0,0,0,0|1,0,0]=3 7956 B12R1.354 CNC(=O)c1cc(ccc1F)I 240690a_100102657272_100000688014 [0,2,0,0,0,0|1,0,0]=3 7957 B12R1.354 CNC(=O)c1cc(ccc1F)I 527a_100102657272_100000688014 [0,2,0,0,0,0|1,0,0]=3 7958 B12R1.354 CNC(=O)c1cc(ccc1F)O 240690a_100102657272_100000037260 [0,2,0,0,0,0|1,0,0]=3 7959 B12R1.354 CNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155058 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.354 CNC(=O)c1cc(ccc1F)O 527a_100102657272_100000037260 [0,2,0,0,0,0|1,0,0]=3 7961 B12R1.354 CNC(=O)c1cc(ccc1I)Br 11a_106832991635_100000183945 [0,2,0,0,0,0|1,0,0]=3 7962 B12R1.354 CNC(=O)c1cc(ccc1I)Br 1626a_100102657272_100000183945 [0,2,0,0,0,0|1,0,0]=3 7963 B12R1.354 CNC(=O)c1cc(ccc1I)Br 240690a_100102657272_100000183945 [0,2,0,0,0,0|1,0,0]=3 7964 B12R1.354 CNC(=O)c1cc(ccc1I)C 11a_106832991635_100000057929 [0,2,0,0,0,0|0,0,0]=2 7965 B12R1.354 CNC(=O)c1cc(ccc1I)C 1626a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 7966 B12R1.354 CNC(=O)c1cc(ccc1I)C 240690a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 7967 B12R1.354 CNC(=O)c1cc(ccc1I)C 527a_100102657272_100000057929 [0,2,0,0,0,0|0,0,0]=2 7968 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 11a_106832991635_100000739379 [0,2,0,0,0,0|1,0,0]=3 7969 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 1626a_100102657272_100000739379 [0,2,0,0,0,0|1,0,0]=3 7970 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 240690a_100102657272_100000739379 [0,2,0,0,0,0|1,0,0]=3 7971 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 527a_100102657272_100000739379 [0,2,0,0,0,0|1,0,0]=3 7972 B12R1.354 CNC(=O)c1cc(ccc1I)F 11a_106832991635_100000748905 [0,2,0,0,0,0|1,0,0]=3 7973 B12R1.354 CNC(=O)c1cc(ccc1I)F 1626a_100102657272_100000748905 [0,2,0,0,0,0|1,0,0]=3 7974 B12R1.354 CNC(=O)c1cc(ccc1I)F 240690a_100102657272_100000748905 [0,2,0,0,0,0|1,0,0]=3 7975 B12R1.354 CNC(=O)c1cc(ccc1I)F 527a_100102657272_100000748905 [0,2,0,0,0,0|1,0,0]=3 7976 B12R1.354 CNC(=O)c1cc(ccc1I)I 11a_106832991635_100000750460 [0,2,0,0,0,0|1,0,0]=3 7977 B12R1.354 CNC(=O)c1cc(ccc1I)I 1626a_100102657272_100000750460 [0,2,0,0,0,0|1,0,0]=3 7978 B12R1.354 CNC(=O)c1cc(ccc1I)I 240690a_100102657272_100000750460 [0,2,0,0,0,0|1,0,0]=3 7979 B12R1.354 CNC(=O)c1cc(ccc1I)I 527a_100102657272_100000750460 [0,2,0,0,0,0|1,0,0]=3 7980 B12R1.354 CNC(=O)c1cc(ccc1I)O 1626a_100102657272_200009995701 [0,2,0,0,0,0|1,0,0]=3 7981 B12R1.354 CNC(=O)c1cc(ccc1I)O 240690a_100102657272_200009995701 [0,2,0,0,0,0|1,0,0]=3 7982 B12R1.354 CNC(=O)c1cc(ccc1I)O 527a_100102657272_200009995701 [0,2,0,0,0,0|1,0,0]=3 7983 B12R1.354 CNC(=O)c1cc(ccc1N)O 271570a_203496583355_100000690504 [0,2,0,0,0,0|1,0,0]=3 7984 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [0,2,0,0,0,0|1,0,0]=3 7985 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [0,2,0,0,0,0|1,0,0]=3 7986 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [0,2,0,0,0,0|1,0,0]=3 7987 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [0,2,0,0,0,0|0,0,0]=2 7988 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [0,2,0,0,0,0|0,0,0]=2 7989 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [0,2,0,0,0,0|1,0,0]=3 7990 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [0,2,0,0,0,0|1,0,0]=3 7991 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [0,2,0,0,0,0|1,0,0]=3 7992 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [0,2,0,0,0,0|1,0,0]=3 7993 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [0,2,0,0,0,0|1,0,0]=3 7994 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [0,2,0,0,0,0|1,0,0]=3 7995 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [0,2,0,0,0,0|1,0,0]=3 7996 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [0,2,0,0,0,0|1,0,0]=3 7997 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [0,2,0,0,0,0|1,0,0]=3 7998 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [0,2,0,0,0,0|1,0,0]=3 7999 B12R1.354 CNC(C)c1cc(ccc1Br)C 269862a_106832991636_100012361225 [0,2,0,0,0,0|1,0,1]=4 8000 B12R1.354 CNC(C)c1cc(ccc1C)C 269862a_106832991636_100000211711 [0,2,0,0,0,0|1,0,1]=4 8001 B12R1.354 CNC(C)c1cc(ccc1F)C 269862a_106832991636_100000760338 [0,2,0,0,0,0|1,0,1]=4 8002 B12R1.354 CNC(C)c1cc(ccc1O)C 269862a_106832991636_100000195442 [0,2,0,0,0,0|1,0,1]=4 8003 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_200000210301 [0,2,0,0,0,0|1,0,1]=4 8004 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_200000210301 [0,2,0,0,0,0|1,0,1]=4 8005 B12R1.354 COC(=O)c1cc(c[nH]c1=O)O 271570a_203496583355_100009816710 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.354 COC(=O)c1cc(ccc1Br)O 271570a_203496583355_100012340073 [0,2,0,0,0,0|1,0,0]=3 8007 B12R1.354 COC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360116 [0,2,0,0,0,0|1,0,0]=3 8008 B12R1.354 COC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100012353682 [0,2,0,0,0,0|1,0,0]=3 8009 B12R1.354 COC(=O)c1cc(ccc1F)O 271570a_203496583355_100000154357 [0,2,0,0,0,0|1,0,0]=3 8010 B12R1.354 COC(=O)c1cc(ccc1N)O 271570a_203496583355_100000212070 [0,2,0,0,0,0|1,0,0]=3 8011 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [0,2,0,0,0,0|1,0,0]=3 8012 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [0,2,0,0,0,0|0,0,0]=2 8013 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [0,2,0,0,0,0|1,0,0]=3 8014 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [0,2,0,0,0,0|1,0,0]=3 8015 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [0,2,0,0,0,0|1,0,0]=3 8016 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [0,2,0,0,0,0|1,0,0]=3 8017 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [0,2,0,0,0,0|1,0,0]=3 8018 B12R1.354 COC(=O)c1cc(cnc1C)O 271570a_203496583355_100010180201 [0,2,0,0,0,0|2,0,0]=4 8019 B12R1.354 COC(=O)c1cc(cnc1F)O 271570a_203496583355_100010243567 [0,2,0,0,0,0|2,0,0]=4 8020 B12R1.354 COC(=O)c1cc(cnc1N)O 271570a_203496583355_100009816750 [0,2,0,0,0,0|2,0,0]=4 8021 B12R1.354 COC(=O)c1cc(cnc1O)C 271570a_203496583355_100000085774 [0,2,0,0,0,0|1,0,0]=3 8022 B12R1.354 COC(=O)c1cc(cnc1O)F 271570a_203496583355_100012000215 [0,2,0,0,0,0|2,0,0]=4 8023 B12R1.354 COC(=O)c1cc(cnc1O)N 271570a_203496583355_200012182668 [0,2,0,0,0,0|2,0,0]=4 8024 B12R1.354 COC(=O)c1cc(ncc1C)O 271570a_203496583355_100009858526 [0,2,0,0,0,0|2,0,0]=4 8025 B12R1.354 COC(=O)c1cc(ncc1F)O 271570a_203496583355_100010218257 [0,2,0,0,0,0|2,0,0]=4 8026 B12R1.354 COC(=O)c1cc(ncc1N)O 271570a_203496583355_100012180746 [0,2,0,0,0,0|2,0,0]=4 8027 B12R1.354 COC(=O)c1cc(ncc1O)N 271570a_203496583355_100011934820 [0,2,0,0,0,0|2,0,0]=4 8028 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100009816900 [0,2,0,0,0,0|2,0,0]=4 8029 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100010136202 [0,2,0,0,0,0|2,0,0]=4 8030 B12R1.354 COC(=O)c1nc(ccc1C)O 271570a_203496583355_100000117997 [0,2,0,0,0,0|2,0,0]=4 8031 B12R1.354 COC(=O)c1nc(ccc1F)O 271570a_203496583355_100000697719 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.354 COC(=O)c1nc(ccc1N)O 271570a_203496583355_100009860768 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.354 COC(=O)c1nc(ccc1O)N 271570a_203496583355_100009816986 [0,2,0,0,0,0|2,0,0]=4 8034 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100000697862 [0,2,0,0,0,0|2,0,0]=4 8035 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100010189638 [0,2,0,0,0,0|2,0,0]=4 8036 B12R1.354 COC(C)c1cc(ccc1C)C 34a_200000246511_200000210301 [0,2,0,0,0,0|0,0,2]=4 8037 B12R1.354 COC(C)c1cc(ccc1C)C 7a_200000246511_200000210301 [0,2,0,0,0,0|0,0,2]=4 8038 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Br 1458a_100000689033_100015361967 [0,2,0,0,0,0|0,0,0]=2 8039 B12R1.354 Cc1ccc(c(c1)C(=O)CF)C 1458a_100000195421_100015361967 [0,2,0,0,0,0|0,0,0]=2 8040 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Cl 1458a_100011290873_100015361967 [0,2,0,0,0,0|0,0,0]=2 8041 B12R1.354 Cc1ccc(c(c1)C(=O)CF)F 1458a_100000749327_100015361967 [0,2,0,0,0,0|0,0,0]=2 8042 B12R1.354 Cc1ccc(c(c1)C(=O)CF)I 1458a_100000057929_100015361967 [0,2,0,0,0,0|0,0,0]=2 8043 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [0,2,0,0,0,0|0,0,0]=2 8044 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 34a_200000246511_200025704644 [0,2,0,0,0,0|0,0,2]=4 8045 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 7a_200000246511_200025704644 [0,2,0,0,0,0|0,0,2]=4 8046 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 2230a_100000695983_200025704644 [0,2,0,0,0,0|1,0,1]=4 8047 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 34a_100000695983_200025704644 [0,2,0,0,0,0|1,0,1]=4 8048 B12R1.354 Cc1ccc(cc1C(=O)CF)Br 1458a_100000759961_100015361967 [0,2,0,0,0,0|1,0,0]=3 8049 B12R1.354 Cc1ccc(cc1C(=O)CF)Cl 1458a_100000692595_100015361967 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.354 Cc1ccc(cc1C(=O)CF)F 1458a_100000240043_100015361967 [0,2,0,0,0,0|1,0,0]=3 8051 B12R1.354 Cc1ccc(cc1C(=O)CF)I 1458a_100000688012_100015361967 [0,2,0,0,0,0|1,0,0]=3 8052 B12R1.354 Cc1ccc(cc1C(=O)CF)O 1458a_100000687834_100015361967 [0,2,0,0,0,0|1,0,0]=3 8053 B12R1.354 NNC(=O)c1cc(ccc1Br)O 271570a_203496583355_200011356971 [0,2,0,0,0,0|2,0,0]=4 8054 B12R1.354 NNC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200000049959 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.354 NNC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205862 [0,2,0,0,0,0|2,0,0]=4 8056 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [0,2,0,0,0,0|2,0,0]=4 8057 B12R1.354 O=C(CF)c1cc(ccc1Br)Br 1458a_100000690610_100015361967 [0,2,0,0,0,0|1,0,0]=3 8058 B12R1.354 O=C(CF)c1cc(ccc1Br)Cl 1458a_100000736951_100015361967 [0,2,0,0,0,0|1,0,0]=3 8059 B12R1.354 O=C(CF)c1cc(ccc1Br)F 1458a_100000212315_100015361967 [0,2,0,0,0,0|1,0,0]=3 8060 B12R1.354 O=C(CF)c1cc(ccc1Br)I 1458a_100000698340_100015361967 [0,2,0,0,0,0|1,0,0]=3 8061 B12R1.354 O=C(CF)c1cc(ccc1Br)O 1458a_100012352043_100015361967 [0,2,0,0,0,0|1,0,0]=3 8062 B12R1.354 O=C(CF)c1cc(ccc1Cl)Br 1458a_100000211212_100015361967 [0,2,0,0,0,0|1,0,0]=3 8063 B12R1.354 O=C(CF)c1cc(ccc1Cl)Cl 1458a_100000210642_100015361967 [0,2,0,0,0,0|1,0,0]=3 8064 B12R1.354 O=C(CF)c1cc(ccc1Cl)F 1458a_100011219680_100015361967 [0,2,0,0,0,0|1,0,0]=3 8065 B12R1.354 O=C(CF)c1cc(ccc1Cl)I 1458a_100000688013_100015361967 [0,2,0,0,0,0|1,0,0]=3 8066 B12R1.354 O=C(CF)c1cc(ccc1Cl)O 1458a_100000719527_100015361967 [0,2,0,0,0,0|1,0,0]=3 8067 B12R1.354 O=C(CF)c1cc(ccc1F)Br 1458a_100000212322_100015361967 [0,2,0,0,0,0|1,0,0]=3 8068 B12R1.354 O=C(CF)c1cc(ccc1F)Cl 1458a_100000214954_100015361967 [0,2,0,0,0,0|1,0,0]=3 8069 B12R1.354 O=C(CF)c1cc(ccc1F)F 1458a_100000198512_100015361967 [0,2,0,0,0,0|1,0,0]=3 8070 B12R1.354 O=C(CF)c1cc(ccc1F)I 1458a_100000688014_100015361967 [0,2,0,0,0,0|1,0,0]=3 8071 B12R1.354 O=C(CF)c1cc(ccc1F)O 1458a_100000037260_100015361967 [0,2,0,0,0,0|1,0,0]=3 8072 B12R1.354 O=C(CF)c1cc(ccc1I)Br 1458a_100000183945_100015361967 [0,2,0,0,0,0|1,0,0]=3 8073 B12R1.354 O=C(CF)c1cc(ccc1I)Cl 1458a_100000739379_100015361967 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.354 O=C(CF)c1cc(ccc1I)F 1458a_100000748905_100015361967 [0,2,0,0,0,0|1,0,0]=3 8075 B12R1.354 O=C(CF)c1cc(ccc1I)I 1458a_100000750460_100015361967 [0,2,0,0,0,0|1,0,0]=3 8076 B12R1.354 O=C(CF)c1cc(ccc1I)O 1458a_200009995701_100015361967 [0,2,0,0,0,0|1,0,0]=3 8077 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [0,2,0,0,0,0|1,0,0]=3 8078 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [0,2,0,0,0,0|1,0,0]=3 8079 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [0,2,0,0,0,0|1,0,0]=3 8080 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [0,2,0,0,0,0|1,0,0]=3 8081 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [0,2,0,0,0,0|1,0,0]=3 8082 B12R1.358 CCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210202 [0,2,0,0,0,0|1,0,0]=3 8083 B12R1.358 CCC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_100000210202 [0,2,0,0,0,0|0,0,0]=2 8084 B12R1.358 CCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210202 [0,2,0,0,0,0|1,0,0]=3 8085 B12R1.358 CCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210202 [0,2,0,0,0,0|1,0,0]=3 8086 B12R1.358 CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210202 [0,2,0,0,0,0|1,0,0]=3 8087 B12R1.358 CCC(=O)c1cc(cc(c1)C)C 1458a_100000210874_100000210202 [0,2,0,0,0,0|0,0,0]=2 8088 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_100000210202 [0,2,0,0,0,0|0,0,0]=2 8089 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210202 [0,2,0,0,0,0|1,0,0]=3 8090 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210202 [0,2,0,0,0,0|1,0,0]=3 8091 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210202 [0,2,0,0,0,0|1,0,0]=3 8092 B12R1.358 CCC(=O)c1cc(cc(c1)F)C 1458a_100000763163_100000210202 [0,2,0,0,0,0|0,0,0]=2 8093 B12R1.358 CCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210202 [0,2,0,0,0,0|1,0,0]=3 8094 B12R1.358 CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210202 [0,2,0,0,0,0|1,0,0]=3 8095 B12R1.358 CCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210202 [0,2,0,0,0,0|1,0,0]=3 8096 B12R1.358 CCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210202 [0,2,0,0,0,0|0,0,0]=2 8097 B12R1.358 CCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210202 [0,2,0,0,0,0|1,0,0]=3 8098 B12R1.358 CCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210202 [0,2,0,0,0,0|1,0,0]=3 8099 B12R1.358 CCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210202 [0,2,0,0,0,0|1,0,0]=3 8100 B12R1.358 CCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210202 [0,2,0,0,0,0|0,0,0]=2 8101 B12R1.358 CCN(C)c1cc(cc(c1)C)C 2230a_100000743038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.358 CCN(C)c1cc(cc(c1)C)C 269982a_100000743038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.358 CCN(C)c1cc(cc(c1)C)C 34a_100000743038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8104 B12R1.358 CCN(C)c1cc(cc(c1)C)C 7a_100000743038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8105 B12R1.358 CCN(C)c1cc(cc(c1)F)C 2230a_103496528823_100000210202 [0,2,0,0,0,0|2,0,0]=4 8106 B12R1.358 CCN(C)c1cc(cc(c1)F)C 269982a_103496528823_100000204670 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.358 CCN(C)c1cc(cc(c1)F)C 34a_103496528823_100000210202 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.358 CCN(C)c1cc(cc(c1)F)C 38a_103496528823_100000204670 [0,2,0,0,0,0|2,0,0]=4 8109 B12R1.358 CCN(C)c1cc(cc(c1)F)C 7a_103496528823_100000210202 [0,2,0,0,0,0|2,0,0]=4 8110 B12R1.358 CCN([13CH3])c1cc(cc(c1)C)C 2230a_100000743038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.358 CCN([13CH3])c1cc(cc(c1)C)C 269982a_100000743038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8112 B12R1.358 CCN([13CH3])c1cc(cc(c1)C)C 34a_100000743038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8113 B12R1.358 CCN([13CH3])c1cc(cc(c1)C)C 7a_100000743038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8114 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 11a_106832991635_100000687083 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 1626a_100102657272_100000687083 [0,2,0,0,0,0|1,0,0]=3 8116 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 240690a_100102657272_100000687083 [0,2,0,0,0,0|1,0,0]=3 8117 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Br 527a_100102657272_100000687083 [0,2,0,0,0,0|1,0,0]=3 8118 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 11a_106832991635_100000760426 [0,2,0,0,0,0|0,0,0]=2 8119 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 1626a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 8120 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 240690a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 8121 B12R1.358 CNC(=O)c1cc(cc(c1)Br)C 527a_100102657272_100000760426 [0,2,0,0,0,0|0,0,0]=2 8122 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 11a_106832991635_100000687899 [0,2,0,0,0,0|1,0,0]=3 8123 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 1626a_100102657272_100000687899 [0,2,0,0,0,0|1,0,0]=3 8124 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 240690a_100102657272_100000687899 [0,2,0,0,0,0|1,0,0]=3 8125 B12R1.358 CNC(=O)c1cc(cc(c1)Br)Cl 527a_100102657272_100000687899 [0,2,0,0,0,0|1,0,0]=3 8126 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 11a_106832991635_100000739618 [0,2,0,0,0,0|1,0,0]=3 8127 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 1626a_100102657272_100000739618 [0,2,0,0,0,0|1,0,0]=3 8128 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 240690a_100102657272_100000739618 [0,2,0,0,0,0|1,0,0]=3 8129 B12R1.358 CNC(=O)c1cc(cc(c1)Br)F 527a_100102657272_100000739618 [0,2,0,0,0,0|1,0,0]=3 8130 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O 240690a_100102657272_100011934545 [0,2,0,0,0,0|1,0,0]=3 8131 B12R1.358 CNC(=O)c1cc(cc(c1)Br)O 527a_100102657272_100011934545 [0,2,0,0,0,0|1,0,0]=3 8132 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 11a_106832991635_100000210874 [0,2,0,0,0,0|0,0,0]=2 8133 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 1626a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 8134 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 240690a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 8135 B12R1.358 CNC(=O)c1cc(cc(c1)C)C 527a_100102657272_100000210874 [0,2,0,0,0,0|0,0,0]=2 8136 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 11a_106832991635_100000684526 [0,2,0,0,0,0|0,0,0]=2 8137 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 1626a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 8138 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 240690a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 8139 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)C 527a_100102657272_100000684526 [0,2,0,0,0,0|0,0,0]=2 8140 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 11a_106832991635_100000210701 [0,2,0,0,0,0|1,0,0]=3 8141 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 1626a_100102657272_100000210701 [0,2,0,0,0,0|1,0,0]=3 8142 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100102657272_100000210701 [0,2,0,0,0,0|1,0,0]=3 8143 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl 527a_100102657272_100000210701 [0,2,0,0,0,0|1,0,0]=3 8144 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 11a_106832991635_100000685768 [0,2,0,0,0,0|1,0,0]=3 8145 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 1626a_100102657272_100000685768 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 240690a_100102657272_100000685768 [0,2,0,0,0,0|1,0,0]=3 8147 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)F 527a_100102657272_100000685768 [0,2,0,0,0,0|1,0,0]=3 8148 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O 240690a_100102657272_100011997059 [0,2,0,0,0,0|1,0,0]=3 8149 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)O 527a_100102657272_100011997059 [0,2,0,0,0,0|1,0,0]=3 8150 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 11a_106832991635_100000763163 [0,2,0,0,0,0|0,0,0]=2 8151 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 1626a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 8152 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 240690a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 8153 B12R1.358 CNC(=O)c1cc(cc(c1)F)C 527a_100102657272_100000763163 [0,2,0,0,0,0|0,0,0]=2 8154 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 11a_106832991635_100000211655 [0,2,0,0,0,0|1,0,0]=3 8155 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 1626a_100102657272_100000211655 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 240690a_100102657272_100000211655 [0,2,0,0,0,0|1,0,0]=3 8157 B12R1.358 CNC(=O)c1cc(cc(c1)F)F 527a_100102657272_100000211655 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 11a_106832991635_100012017291 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 240690a_100102657272_100012017291 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011295653 [0,2,0,0,0,0|1,0,0]=3 8161 B12R1.358 CNC(=O)c1cc(cc(c1)F)O 527a_100102657272_100012017291 [0,2,0,0,0,0|1,0,0]=3 8162 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 11a_106832991635_100000689235 [0,2,0,0,0,0|1,0,0]=3 8163 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 1626a_100102657272_100000689235 [0,2,0,0,0,0|1,0,0]=3 8164 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 240690a_100102657272_100000689235 [0,2,0,0,0,0|1,0,0]=3 8165 B12R1.358 CNC(=O)c1cc(cc(c1)I)Br 527a_100102657272_100000689235 [0,2,0,0,0,0|1,0,0]=3 8166 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 11a_106832991635_100000729426 [0,2,0,0,0,0|0,0,0]=2 8167 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 1626a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 8168 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 240690a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 8169 B12R1.358 CNC(=O)c1cc(cc(c1)I)C 527a_100102657272_100000729426 [0,2,0,0,0,0|0,0,0]=2 8170 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 11a_106832991635_100012047205 [0,2,0,0,0,0|1,0,0]=3 8171 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 1626a_100102657272_100012047205 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 240690a_100102657272_100012047205 [0,2,0,0,0,0|1,0,0]=3 8173 B12R1.358 CNC(=O)c1cc(cc(c1)I)Cl 527a_100102657272_100012047205 [0,2,0,0,0,0|1,0,0]=3 8174 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 11a_106832991635_100012047268 [0,2,0,0,0,0|1,0,0]=3 8175 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 1626a_100102657272_100012047268 [0,2,0,0,0,0|1,0,0]=3 8176 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 240690a_100102657272_100012047268 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.358 CNC(=O)c1cc(cc(c1)I)F 527a_100102657272_100012047268 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 11a_106832991635_100011204819 [0,2,0,0,0,0|1,0,0]=3 8179 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 1626a_100102657272_100011204819 [0,2,0,0,0,0|1,0,0]=3 8180 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 240690a_100102657272_100011204819 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.358 CNC(=O)c1cc(cc(c1)I)I 527a_100102657272_100011204819 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.358 CNC(=O)c1cc(cc(c1)O)C 240690a_100102657272_100000094094 [0,2,0,0,0,0|0,0,0]=2 8183 B12R1.358 CNC(=O)c1cc(cc(c1)O)C 527a_100102657272_100000094094 [0,2,0,0,0,0|0,0,0]=2 8184 B12R1.358 CNC(=O)c1cc(cc(c1)O)O 240690a_100102657272_100000690292 [0,2,0,0,0,0|1,0,0]=3 8185 B12R1.358 CNC(=O)c1cc(cc(c1)O)O 527a_100102657272_100000690292 [0,2,0,0,0,0|1,0,0]=3 8186 B12R1.358 CNC(C)c1cc(cc(c1)Br)C 269862a_106832991636_100000694479 [0,2,0,0,0,0|1,0,1]=4 8187 B12R1.358 CNC(C)c1cc(cc(c1)C)C 2230a_100000753145_200000210301 [0,2,0,0,0,0|1,0,1]=4 8188 B12R1.358 CNC(C)c1cc(cc(c1)C)C 269862a_106832991636_100000753124 [0,2,0,0,0,0|1,0,1]=4 8189 B12R1.358 CNC(C)c1cc(cc(c1)C)C 34a_100000753145_200000210301 [0,2,0,0,0,0|1,0,1]=4 8190 B12R1.358 CNC(C)c1cc(cc(c1)F)C 269862a_106832991636_100011830400 [0,2,0,0,0,0|1,0,1]=4 8191 B12R1.358 CNC(C)c1cc(cc(c1)O)C 269862a_106832991636_100009855872 [0,2,0,0,0,0|1,0,1]=4 8192 B12R1.358 COC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100012339729 [0,2,0,0,0,0|1,0,0]=3 8193 B12R1.358 COC(=O)c1cc(cc(c1)Cl)O 271570a_203496583355_100000695173 [0,2,0,0,0,0|1,0,0]=3 8194 B12R1.358 COC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100000698578 [0,2,0,0,0,0|1,0,0]=3 8195 B12R1.358 COC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100012359405 [0,2,0,0,0,0|0,0,0]=2 8196 B12R1.358 COC(=O)c1cc(cc(c1)O)N 271570a_203496583355_100138415615 [0,2,0,0,0,0|1,0,0]=3 8197 B12R1.358 COC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100000696291 [0,2,0,0,0,0|1,0,0]=3 8198 B12R1.358 COC(=O)c1cc(cc(n1)O)C 271570a_203496583355_100009865194 [0,2,0,0,0,0|1,0,0]=3 8199 B12R1.358 COC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100000695393 [0,2,0,0,0,0|1,0,0]=3 8200 B12R1.358 COC(=O)c1cc(nc(c1)O)N 271570a_203496583355_100000062536 [0,2,0,0,0,0|2,0,0]=4 8201 B12R1.358 COC(=O)c1cc(nc(n1)O)C 271570a_203496583355_100000724386 [0,2,0,0,0,0|2,0,0]=4 8202 B12R1.358 Cc1cc(cc(c1)C(=O)CF)Br 1458a_100000760426_100015361967 [0,2,0,0,0,0|0,0,0]=2 8203 B12R1.358 Cc1cc(cc(c1)C(=O)CF)C 1458a_100000210874_100015361967 [0,2,0,0,0,0|0,0,0]=2 8204 B12R1.358 Cc1cc(cc(c1)C(=O)CF)Cl 1458a_100000684526_100015361967 [0,2,0,0,0,0|0,0,0]=2 8205 B12R1.358 Cc1cc(cc(c1)C(=O)CF)F 1458a_100000763163_100015361967 [0,2,0,0,0,0|0,0,0]=2 8206 B12R1.358 Cc1cc(cc(c1)C(=O)CF)I 1458a_100000729426_100015361967 [0,2,0,0,0,0|0,0,0]=2 8207 B12R1.358 Cc1cc(cc(c1)C(=O)CF)O 1458a_100000094094_100015361967 [0,2,0,0,0,0|0,0,0]=2 8208 B12R1.358 Cc1cc(cc(c1)C(C)N[13CH3])C 2230a_100000753145_200025704644 [0,2,0,0,0,0|1,0,1]=4 8209 B12R1.358 Cc1cc(cc(c1)C(C)N[13CH3])C 34a_100000753145_200025704644 [0,2,0,0,0,0|1,0,1]=4 8210 B12R1.358 Cc1cc(cc(c1)N(C)CF)F 269982a_103496528823_100015361967 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.358 Cc1cc(cc(c1)N(C)CF)F 34a_103496528823_100015361967 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.358 Cc1cc(cc(c1)N(C)CF)F 38a_103496528823_100015361967 [0,2,0,0,0,0|2,0,0]=4 8213 B12R1.358 Cc1cc(cc(c1)N(C)CF)F 7a_103496528823_100015361967 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.358 NNC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100011279999 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.358 O=C(CF)c1cc(cc(c1)Br)Br 1458a_100000687083_100015361967 [0,2,0,0,0,0|1,0,0]=3 8216 B12R1.358 O=C(CF)c1cc(cc(c1)Br)Cl 1458a_100000687899_100015361967 [0,2,0,0,0,0|1,0,0]=3 8217 B12R1.358 O=C(CF)c1cc(cc(c1)Br)F 1458a_100000739618_100015361967 [0,2,0,0,0,0|1,0,0]=3 8218 B12R1.358 O=C(CF)c1cc(cc(c1)Br)O 1458a_100011934545_100015361967 [0,2,0,0,0,0|1,0,0]=3 8219 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100015361967 [0,2,0,0,0,0|1,0,0]=3 8220 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)F 1458a_100000685768_100015361967 [0,2,0,0,0,0|1,0,0]=3 8221 B12R1.358 O=C(CF)c1cc(cc(c1)Cl)O 1458a_100011997059_100015361967 [0,2,0,0,0,0|1,0,0]=3 8222 B12R1.358 O=C(CF)c1cc(cc(c1)F)F 1458a_100000211655_100015361967 [0,2,0,0,0,0|1,0,0]=3 8223 B12R1.358 O=C(CF)c1cc(cc(c1)F)O 1458a_100012017291_100015361967 [0,2,0,0,0,0|1,0,0]=3 8224 B12R1.358 O=C(CF)c1cc(cc(c1)I)Br 1458a_100000689235_100015361967 [0,2,0,0,0,0|1,0,0]=3 8225 B12R1.358 O=C(CF)c1cc(cc(c1)I)Cl 1458a_100012047205_100015361967 [0,2,0,0,0,0|1,0,0]=3 8226 B12R1.358 O=C(CF)c1cc(cc(c1)I)F 1458a_100012047268_100015361967 [0,2,0,0,0,0|1,0,0]=3 8227 B12R1.358 O=C(CF)c1cc(cc(c1)I)I 1458a_100011204819_100015361967 [0,2,0,0,0,0|1,0,0]=3 8228 B12R1.435 C#Cc1cccc(c1)C(=O)CC 1458a_100011997762_100000210202 [0,2,0,0,0,0|0,0,1]=3 8229 B12R1.435 C#Cc1cccc(c1)C(=O)CF 1458a_100011997762_100015361967 [0,2,0,0,0,0|0,0,1]=3 8230 B12R1.435 C#Cc1cccc(c1)C(=O)NC 11a_106832991635_100011997762 [0,2,0,0,0,0|0,0,1]=3 8231 B12R1.435 C#Cc1cccc(c1)C(=O)NC 1626a_100102657272_100011997762 [0,2,0,0,0,0|0,0,1]=3 8232 B12R1.435 C#Cc1cccc(c1)C(=O)NC 240690a_100102657272_100011997762 [0,2,0,0,0,0|0,0,1]=3 8233 B12R1.435 C#Cc1cccc(c1)C(=O)NC 527a_100102657272_100011997762 [0,2,0,0,0,0|0,0,1]=3 8234 B12R1.435 C=Cc1cc(ccn1)C(=O)NC 271570a_100011290941_100011196506 [0,2,0,0,0,0|1,0,1]=4 8235 B12R1.435 C=Cc1cc(ccn1)C(=O)OC 271570a_100011290941_100011934382 [0,2,0,0,0,0|1,0,1]=4 8236 B12R1.435 C=Cc1cccc(c1)C(=O)C#N 271570a_100011290941_100010169886 [0,2,0,0,0,0|0,0,2]=4 8237 B12R1.435 C=Cc1cccc(c1)C(=O)C=O 271570a_100011290941_100000726164 [0,2,0,0,0,0|0,0,2]=4 8238 B12R1.435 C=Cc1cccc(c1)C(=O)CC 1458a_100011215009_100000210202 [0,2,0,0,0,0|0,0,1]=3 8239 B12R1.435 C=Cc1cccc(c1)C(=O)CC 271570a_100011290941_100000211677 [0,2,0,0,0,0|0,0,1]=3 8240 B12R1.435 C=Cc1cccc(c1)C(=O)CF 1458a_100011215009_100015361967 [0,2,0,0,0,0|0,0,1]=3 8241 B12R1.435 C=Cc1cccc(c1)C(=O)CN 271570a_100011290941_100020587001 [0,2,0,0,0,0|0,0,1]=3 8242 B12R1.435 C=Cc1cccc(c1)C(=O)NC 11a_106832991635_100011215009 [0,2,0,0,0,0|0,0,1]=3 8243 B12R1.435 C=Cc1cccc(c1)C(=O)NC 1626a_100102657272_100011215009 [0,2,0,0,0,0|0,0,1]=3 8244 B12R1.435 C=Cc1cccc(c1)C(=O)NC 240690a_100102657272_100011215009 [0,2,0,0,0,0|0,0,1]=3 8245 B12R1.435 C=Cc1cccc(c1)C(=O)NC 271570a_100011290941_100000155082 [0,2,0,0,0,0|0,0,1]=3 8246 B12R1.435 C=Cc1cccc(c1)C(=O)NC 527a_100102657272_100011215009 [0,2,0,0,0,0|0,0,1]=3 8247 B12R1.435 C=Cc1cccc(c1)C(=O)NN 271570a_100011290941_100000189783 [0,2,0,0,0,0|1,0,1]=4 8248 B12R1.435 C=Cc1cccc(c1)C(=O)OC 271570a_100011290941_100000148679 [0,2,0,0,0,0|0,0,1]=3 8249 B12R1.435 C=Cc1cccc(n1)C(=O)CC 271570a_100011290941_100011004013 [0,2,0,0,0,0|1,0,1]=4 8250 B12R1.435 C=Cc1cccc(n1)C(=O)NC 271570a_100011290941_100000755456 [0,2,0,0,0,0|1,0,1]=4 8251 B12R1.435 C=Cc1cccc(n1)C(=O)OC 271570a_100011290941_100000708286 [0,2,0,0,0,0|1,0,1]=4 8252 B12R1.435 C=Cc1ccnc(c1)C(=O)CC 271570a_100011290941_200000094848 [0,2,0,0,0,0|1,0,1]=4 8253 B12R1.435 C=Cc1ccnc(c1)C(=O)NC 271570a_100011290941_100000204654 [0,2,0,0,0,0|1,0,1]=4 8254 B12R1.435 C=Cc1ccnc(c1)C(=O)OC 271570a_100011290941_100000693414 [0,2,0,0,0,0|1,0,1]=4 8255 B12R1.435 C=Cc1cncc(c1)C(=O)NC 271570a_100011290941_200000155086 [0,2,0,0,0,0|1,0,1]=4 8256 B12R1.435 C=Cc1cncc(c1)C(=O)OC 271570a_100011290941_100000148912 [0,2,0,0,0,0|1,0,1]=4 8257 B12R1.435 CC(=NN)c1cccc(c1)O[13CH3] 34a_100000689795_200025704644 [0,2,0,0,0,0|1,0,0]=3 8258 B12R1.435 CCC(=O)c1cc(ccn1)SC 62a_200000094848_200000210301 [0,2,0,0,0,0|1,0,0]=3 8259 B12R1.435 CCC(=O)c1cc(ccn1)SC 62a_200000210301_200000094848 [0,2,0,0,0,0|1,0,0]=3 8260 B12R1.435 CCC(=O)c1cc(ccn1)S[13CH3] 62a_200000094848_200025704644 [0,2,0,0,0,0|1,0,0]=3 8261 B12R1.435 CCC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_200000094848 [0,2,0,0,0,0|1,0,0]=3 8262 B12R1.435 CCC(=O)c1cccc(c1)C#N 1458a_100000183950_100000210202 [0,2,0,0,0,0|0,0,1]=3 8263 B12R1.435 CCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210202 [0,2,0,0,0,0|0,0,0]=2 8264 B12R1.435 CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210202 [0,2,0,0,0,0|0,0,0]=2 8265 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [0,2,0,0,0,0|0,0,0]=2 8266 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [0,2,0,0,0,0|0,0,0]=2 8267 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [0,2,0,0,0,0|0,0,0]=2 8268 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [0,2,0,0,0,0|0,0,0]=2 8269 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [0,2,0,0,0,0|0,0,0]=2 8270 B12R1.435 CCC(=O)c1cccc(c1)SC 1458a_100011217804_100000210202 [0,2,0,0,0,0|0,0,0]=2 8271 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_100000211677_200000210301 [0,2,0,0,0,0|0,0,0]=2 8272 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_200000210301_100000211677 [0,2,0,0,0,0|0,0,0]=2 8273 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_100000211677_200025704644 [0,2,0,0,0,0|0,0,0]=2 8274 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000211677 [0,2,0,0,0,0|0,0,0]=2 8275 B12R1.435 CCC(=O)c1cccc(n1)SC 62a_100011004013_200000210301 [0,2,0,0,0,0|1,0,0]=3 8276 B12R1.435 CCC(=O)c1cccc(n1)SC 62a_200000210301_100011004013 [0,2,0,0,0,0|1,0,0]=3 8277 B12R1.435 CCC(=O)c1cccc(n1)S[13CH3] 62a_100011004013_200025704644 [0,2,0,0,0,0|1,0,0]=3 8278 B12R1.435 CCC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100011004013 [0,2,0,0,0,0|1,0,0]=3 8279 B12R1.435 CCC(N)c1cccc(c1)OC 34a_100159312145_200000210301 [0,2,0,0,0,0|1,0,1]=4 8280 B12R1.435 CCC(N)c1cccc(c1)O[13CH3] 34a_100159312145_200025704644 [0,2,0,0,0,0|1,0,1]=4 8281 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200000210301_200013212081 [0,2,0,0,0,0|0,0,2]=4 8282 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200013212081_200000210301 [0,2,0,0,0,0|0,0,2]=4 8283 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200013212081_200025704644 [0,2,0,0,0,0|0,0,2]=4 8284 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200025704644_200013212081 [0,2,0,0,0,0|0,0,2]=4 8285 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219725_100000210202 [0,2,0,0,0,0|2,0,0]=4 8286 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219733_200000210301 [0,2,0,0,0,0|2,0,0]=4 8287 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219725_100000204670 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219733_200000210301 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219725_100000210202 [0,2,0,0,0,0|2,0,0]=4 8290 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219733_200000210301 [0,2,0,0,0,0|2,0,0]=4 8291 B12R1.435 CCN(C)c1cccc(c1)SC 2230a_100020672454_100000210202 [0,2,0,0,0,0|2,0,0]=4 8292 B12R1.435 CCN(C)c1cccc(c1)SC 269982a_100020672454_100000204670 [0,2,0,0,0,0|2,0,0]=4 8293 B12R1.435 CCN(C)c1cccc(c1)SC 34a_100020672454_100000210202 [0,2,0,0,0,0|2,0,0]=4 8294 B12R1.435 CCN([13CH3])c1cccc(c1)OC 2230a_100000219733_200025704644 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.435 CCN([13CH3])c1cccc(c1)OC 269982a_100000219733_200025704644 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.435 CCN([13CH3])c1cccc(c1)OC 34a_100000219733_200025704644 [0,2,0,0,0,0|2,0,0]=4 8297 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_100102422761_200000210301 [0,2,0,0,0,0|1,0,1]=4 8298 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_200000210301_100102422761 [0,2,0,0,0,0|1,0,1]=4 8299 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_100102422761_200025704644 [0,2,0,0,0,0|1,0,1]=4 8300 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_200025704644_100102422761 [0,2,0,0,0,0|1,0,1]=4 8301 B12R1.435 CCc1cccc(c1)C(=O)CF 1458a_100011933908_100015361967 [0,2,0,0,0,0|0,0,0]=2 8302 B12R1.435 CCc1cccc(c1)C(=O)NC 11a_106832991635_100011933908 [0,2,0,0,0,0|0,0,0]=2 8303 B12R1.435 CCc1cccc(c1)C(=O)NC 1626a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 8304 B12R1.435 CCc1cccc(c1)C(=O)NC 240690a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 8305 B12R1.435 CCc1cccc(c1)C(=O)NC 527a_100102657272_100011933908 [0,2,0,0,0,0|0,0,0]=2 8306 B12R1.435 CCc1cccc(c1)C(C)NC 269862a_106832991636_100011220055 [0,2,0,0,0,0|1,0,1]=4 8307 B12R1.435 CNC(=O)c1cc(ccn1)NC 27a_100102657272_100000204654 [0,2,0,0,0,0|1,0,0]=3 8308 B12R1.435 CNC(=O)c1cc(ccn1)SC 62a_100000204654_200000210301 [0,2,0,0,0,0|1,0,0]=3 8309 B12R1.435 CNC(=O)c1cc(ccn1)SC 62a_200000210301_100000204654 [0,2,0,0,0,0|1,0,0]=3 8310 B12R1.435 CNC(=O)c1cc(ccn1)S[13CH3] 62a_100000204654_200025704644 [0,2,0,0,0,0|1,0,0]=3 8311 B12R1.435 CNC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000204654 [0,2,0,0,0,0|1,0,0]=3 8312 B12R1.435 CNC(=O)c1cccc(c1)C#N 11a_106832991635_100000183950 [0,2,0,0,0,0|0,0,1]=3 8313 B12R1.435 CNC(=O)c1cccc(c1)C#N 1626a_100102657272_100000183950 [0,2,0,0,0,0|0,0,1]=3 8314 B12R1.435 CNC(=O)c1cccc(c1)C#N 240690a_100102657272_100000183950 [0,2,0,0,0,0|0,0,1]=3 8315 B12R1.435 CNC(=O)c1cccc(c1)C#N 527a_100102657272_100000183950 [0,2,0,0,0,0|0,0,1]=3 8316 B12R1.435 CNC(=O)c1cccc(c1)CO 240690a_100102657272_100000746274 [0,2,0,0,0,0|0,0,0]=2 8317 B12R1.435 CNC(=O)c1cccc(c1)NC 34a_100000185133_200000210301 [0,2,0,0,0,0|0,0,0]=2 8318 B12R1.435 CNC(=O)c1cccc(c1)N[13CH3] 34a_100000185133_200025704644 [0,2,0,0,0,0|0,0,0]=2 8319 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [0,2,0,0,0,0|0,0,0]=2 8320 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 8321 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 8322 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [0,2,0,0,0,0|0,0,0]=2 8323 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [0,2,0,0,0,0|0,0,0]=2 8324 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [0,2,0,0,0,0|0,0,0]=2 8325 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [0,2,0,0,0,0|0,0,0]=2 8326 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [0,2,0,0,0,0|0,0,0]=2 8327 B12R1.435 CNC(=O)c1cccc(c1)SC 11a_106832991635_100011217804 [0,2,0,0,0,0|0,0,0]=2 8328 B12R1.435 CNC(=O)c1cccc(c1)SC 1626a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 8329 B12R1.435 CNC(=O)c1cccc(c1)SC 240690a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 8330 B12R1.435 CNC(=O)c1cccc(c1)SC 527a_100102657272_100011217804 [0,2,0,0,0,0|0,0,0]=2 8331 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_100000155082_200000210301 [0,2,0,0,0,0|0,0,0]=2 8332 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_200000210301_100000155082 [0,2,0,0,0,0|0,0,0]=2 8333 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_100000155082_200025704644 [0,2,0,0,0,0|0,0,0]=2 8334 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000155082 [0,2,0,0,0,0|0,0,0]=2 8335 B12R1.435 CNC(=O)c1cccc(n1)NC 27a_100102657272_100000755456 [0,2,0,0,0,0|1,0,0]=3 8336 B12R1.435 CNC(=O)c1cccc(n1)SC 62a_100000755456_200000210301 [0,2,0,0,0,0|1,0,0]=3 8337 B12R1.435 CNC(=O)c1cccc(n1)SC 62a_200000210301_100000755456 [0,2,0,0,0,0|1,0,0]=3 8338 B12R1.435 CNC(=O)c1cccc(n1)S[13CH3] 62a_100000755456_200025704644 [0,2,0,0,0,0|1,0,0]=3 8339 B12R1.435 CNC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100000755456 [0,2,0,0,0,0|1,0,0]=3 8340 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_100011196506_200000210301 [0,2,0,0,0,0|1,0,0]=3 8341 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_200000210301_100011196506 [0,2,0,0,0,0|1,0,0]=3 8342 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_100011196506_200025704644 [0,2,0,0,0,0|1,0,0]=3 8343 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011196506 [0,2,0,0,0,0|1,0,0]=3 8344 B12R1.435 CNC(=O)c1cncc(c1)NC 27a_100102657272_200000155086 [0,2,0,0,0,0|1,0,0]=3 8345 B12R1.435 CNC(=O)c1cncc(c1)SC 62a_200000155086_200000210301 [0,2,0,0,0,0|1,0,0]=3 8346 B12R1.435 CNC(=O)c1cncc(c1)SC 62a_200000210301_200000155086 [0,2,0,0,0,0|1,0,0]=3 8347 B12R1.435 CNC(=O)c1cncc(c1)S[13CH3] 62a_200000155086_200025704644 [0,2,0,0,0,0|1,0,0]=3 8348 B12R1.435 CNC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_200000155086 [0,2,0,0,0,0|1,0,0]=3 8349 B12R1.435 CNC(C)c1cccc(c1)OC 2230a_100000737859_200000210301 [0,2,0,0,0,0|1,0,1]=4 8350 B12R1.435 CNC(C)c1cccc(c1)OC 269862a_106832991636_100000171656 [0,2,0,0,0,0|1,0,1]=4 8351 B12R1.435 CNC(C)c1cccc(c1)SC 62a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 8352 B12R1.435 CNC(C)c1cccc(c1)SC 62a_200000210301_100025717457 [0,2,0,0,0,0|1,0,1]=4 8353 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 8354 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100025717457 [0,2,0,0,0,0|1,0,1]=4 8355 B12R1.435 CNc1cc(cnn1)C(=O)OC 27a_100102657272_100009862058 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.435 CNc1cc(ncn1)C(=O)OC 27a_100102657272_100000051410 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.435 CNc1cccc(n1)C(=O)OC 27a_100102657272_100000708286 [0,2,0,0,0,0|1,0,0]=3 8358 B12R1.435 CNc1cncc(n1)C(=O)OC 27a_100102657272_100000765340 [0,2,0,0,0,0|2,0,0]=4 8359 B12R1.435 CNc1nccc(n1)C(=O)OC 27a_100102657272_100000070389 [0,2,0,0,0,0|2,0,0]=4 8360 B12R1.435 COC(=O)c1cc(ccn1)OC 34a_200020638413_200000210301 [0,2,0,0,0,0|1,0,0]=3 8361 B12R1.435 COC(=O)c1cc(ccn1)O[13CH3] 34a_200020638413_200025704644 [0,2,0,0,0,0|1,0,0]=3 8362 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_100000693414_200000210301 [0,2,0,0,0,0|1,0,0]=3 8363 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_200000210301_100000693414 [0,2,0,0,0,0|1,0,0]=3 8364 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_100000693414_200025704644 [0,2,0,0,0,0|1,0,0]=3 8365 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000693414 [0,2,0,0,0,0|1,0,0]=3 8366 B12R1.435 COC(=O)c1cc(ncn1)SC 62a_100000051410_200000210301 [0,2,0,0,0,0|2,0,0]=4 8367 B12R1.435 COC(=O)c1cc(ncn1)SC 62a_200000210301_100000051410 [0,2,0,0,0,0|2,0,0]=4 8368 B12R1.435 COC(=O)c1cc(ncn1)S[13CH3] 62a_100000051410_200025704644 [0,2,0,0,0,0|2,0,0]=4 8369 B12R1.435 COC(=O)c1cc(ncn1)S[13CH3] 62a_200025704644_100000051410 [0,2,0,0,0,0|2,0,0]=4 8370 B12R1.435 COC(=O)c1cccc(c1)OC 34a_100000150331_200000210301 [0,2,0,0,0,0|0,0,0]=2 8371 B12R1.435 COC(=O)c1cccc(c1)OC 7a_100000150331_200000210301 [0,2,0,0,0,0|0,0,0]=2 8372 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 34a_100000150331_200025704644 [0,2,0,0,0,0|0,0,0]=2 8373 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 7a_100000150331_200025704644 [0,2,0,0,0,0|0,0,0]=2 8374 B12R1.435 COC(=O)c1cccc(c1)SC 62a_100000148848_200000210301 [0,2,0,0,0,0|0,0,0]=2 8375 B12R1.435 COC(=O)c1cccc(c1)SC 62a_200000210301_100000148848 [0,2,0,0,0,0|0,0,0]=2 8376 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_100000148848_200025704644 [0,2,0,0,0,0|0,0,0]=2 8377 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000148848 [0,2,0,0,0,0|0,0,0]=2 8378 B12R1.435 COC(=O)c1cccc(n1)SC 62a_100000708286_200000210301 [0,2,0,0,0,0|1,0,0]=3 8379 B12R1.435 COC(=O)c1cccc(n1)SC 62a_200000210301_100000708286 [0,2,0,0,0,0|1,0,0]=3 8380 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_100000708286_200025704644 [0,2,0,0,0,0|1,0,0]=3 8381 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100000708286 [0,2,0,0,0,0|1,0,0]=3 8382 B12R1.435 COC(=O)c1ccnc(c1)OC 34a_100138552365_200000210301 [0,2,0,0,0,0|1,0,0]=3 8383 B12R1.435 COC(=O)c1ccnc(c1)O[13CH3] 34a_100138552365_200025704644 [0,2,0,0,0,0|1,0,0]=3 8384 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_100011934382_200000210301 [0,2,0,0,0,0|1,0,0]=3 8385 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_200000210301_100011934382 [0,2,0,0,0,0|1,0,0]=3 8386 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_100011934382_200025704644 [0,2,0,0,0,0|1,0,0]=3 8387 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011934382 [0,2,0,0,0,0|1,0,0]=3 8388 B12R1.435 COC(=O)c1ccnc(n1)SC 62a_100000070389_200000210301 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.435 COC(=O)c1ccnc(n1)SC 62a_200000210301_100000070389 [0,2,0,0,0,0|2,0,0]=4 8390 B12R1.435 COC(=O)c1ccnc(n1)S[13CH3] 62a_100000070389_200025704644 [0,2,0,0,0,0|2,0,0]=4 8391 B12R1.435 COC(=O)c1ccnc(n1)S[13CH3] 62a_200025704644_100000070389 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.435 COC(=O)c1cncc(c1)OC 34a_100000687108_200000210301 [0,2,0,0,0,0|1,0,0]=3 8393 B12R1.435 COC(=O)c1cncc(c1)OC 7a_100000687108_200000210301 [0,2,0,0,0,0|1,0,0]=3 8394 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 34a_100000687108_200025704644 [0,2,0,0,0,0|1,0,0]=3 8395 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 7a_100000687108_200025704644 [0,2,0,0,0,0|1,0,0]=3 8396 B12R1.435 COC(=O)c1cncc(c1)SC 62a_100000148912_200000210301 [0,2,0,0,0,0|1,0,0]=3 8397 B12R1.435 COC(=O)c1cncc(c1)SC 62a_200000210301_100000148912 [0,2,0,0,0,0|1,0,0]=3 8398 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_100000148912_200025704644 [0,2,0,0,0,0|1,0,0]=3 8399 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100000148912 [0,2,0,0,0,0|1,0,0]=3 8400 B12R1.435 COC(=O)c1cncc(n1)SC 62a_100000765340_200000210301 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.435 COC(=O)c1cncc(n1)SC 62a_200000210301_100000765340 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.435 COC(=O)c1cncc(n1)S[13CH3] 62a_100000765340_200025704644 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.435 COC(=O)c1cncc(n1)S[13CH3] 62a_200025704644_100000765340 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.435 COC(=O)c1cnnc(c1)SC 62a_100009862058_200000210301 [0,2,0,0,0,0|2,0,0]=4 8405 B12R1.435 COC(=O)c1cnnc(c1)SC 62a_200000210301_100009862058 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.435 COC(=O)c1cnnc(c1)S[13CH3] 62a_100009862058_200025704644 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.435 COC(=O)c1cnnc(c1)S[13CH3] 62a_200025704644_100009862058 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.435 COc1cccc(c1)C(=NN)C 34a_100000689795_200000210301 [0,2,0,0,0,0|1,0,0]=3 8409 B12R1.435 COc1cccc(c1)C(=NO)N 34a_100000738085_200000210301 [0,2,0,0,0,0|1,0,1]=4 8410 B12R1.435 COc1cccc(c1)C(=O)CBr 7a_100009813753_200000210301 [0,2,0,0,0,0|0,0,0]=2 8411 B12R1.435 COc1cccc(c1)C(=O)CF 1458a_100000188888_100015361967 [0,2,0,0,0,0|0,0,0]=2 8412 B12R1.435 COc1cccc(c1)C(=O)NN 34a_100000184184_200000210301 [0,2,0,0,0,0|1,0,0]=3 8413 B12R1.435 COc1cccc(c1)C(C)N[13CH3] 2230a_100000737859_200025704644 [0,2,0,0,0,0|1,0,1]=4 8414 B12R1.435 COc1cccc(c1)C(C)OC 34a_100000246466_200000210301 [0,2,0,0,0,0|0,0,2]=4 8415 B12R1.435 COc1cccc(c1)C(C)OC 7a_100000246466_200000210301 [0,2,0,0,0,0|0,0,2]=4 8416 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 34a_100000246466_200025704644 [0,2,0,0,0,0|0,0,2]=4 8417 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 7a_100000246466_200025704644 [0,2,0,0,0,0|0,0,2]=4 8418 B12R1.435 COc1cccc(c1)C(N)CO 34a_100025717460_200000210301 [0,2,0,0,0,0|1,0,1]=4 8419 B12R1.435 COc1cccc(c1)C(O)CN 34a_100020657549_200000210301 [0,2,0,0,0,0|0,0,2]=4 8420 B12R1.435 COc1cccc(c1)N(C)CF 269982a_100000219725_100015361967 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.435 COc1cccc(c1)N(C)CF 34a_100000219725_100015361967 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_100000021280_200000210301 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_200000210301_100000021280 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.435 CSc1cccc(c1)C(=O)C#N 62a_200000210301_100010169886 [0,2,0,0,0,0|0,0,1]=3 8425 B12R1.435 CSc1cccc(c1)C(=O)C=O 62a_100000726164_200000210301 [0,2,0,0,0,0|0,0,1]=3 8426 B12R1.435 CSc1cccc(c1)C(=O)C=O 62a_200000210301_100000726164 [0,2,0,0,0,0|0,0,1]=3 8427 B12R1.435 CSc1cccc(c1)C(=O)CF 1458a_100011217804_100015361967 [0,2,0,0,0,0|0,0,0]=2 8428 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_100020587001_200000210301 [0,2,0,0,0,0|0,0,0]=2 8429 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_200000210301_100020587001 [0,2,0,0,0,0|0,0,0]=2 8430 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_100000189783_200000210301 [0,2,0,0,0,0|1,0,0]=3 8431 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_200000210301_100000189783 [0,2,0,0,0,0|1,0,0]=3 8432 B12R1.435 CSc1cccc(c1)C(N)CO 62a_100000690078_200000210301 [0,2,0,0,0,0|1,0,1]=4 8433 B12R1.435 CSc1cccc(c1)C(N)CO 62a_200000210301_100000690078 [0,2,0,0,0,0|1,0,1]=4 8434 B12R1.435 CSc1cccc(c1)N(C)CF 269982a_100020672454_100015361967 [0,2,0,0,0,0|2,0,0]=4 8435 B12R1.435 CSc1cccc(c1)N(C)CF 34a_100020672454_100015361967 [0,2,0,0,0,0|2,0,0]=4 8436 B12R1.435 CSc1cccc(n1)C(=O)NN 62a_100011631096_200000210301 [0,2,0,0,0,0|2,0,0]=4 8437 B12R1.435 CSc1cccc(n1)C(=O)NN 62a_200000210301_100011631096 [0,2,0,0,0,0|2,0,0]=4 8438 B12R1.435 CSc1ccnc(c1)C(=O)NN 62a_100000017052_200000210301 [0,2,0,0,0,0|2,0,0]=4 8439 B12R1.435 CSc1ccnc(c1)C(=O)NN 62a_200000210301_100000017052 [0,2,0,0,0,0|2,0,0]=4 8440 B12R1.435 CSc1cncc(c1)C(=O)NN 62a_100000189809_200000210301 [0,2,0,0,0,0|2,0,0]=4 8441 B12R1.435 CSc1cncc(c1)C(=O)NN 62a_200000210301_100000189809 [0,2,0,0,0,0|2,0,0]=4 8442 B12R1.435 N#Cc1cccc(c1)C(=O)CF 1458a_100000183950_100015361967 [0,2,0,0,0,0|0,0,1]=3 8443 B12R1.435 O=C(CF)c1cccc(c1)CO 1458a_100000746274_100015361967 [0,2,0,0,0,0|0,0,0]=2 8444 B12R1.435 [13CH3]Oc1cccc(c1)C(=NO)N 34a_100000738085_200025704644 [0,2,0,0,0,0|1,0,1]=4 8445 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)CBr 7a_100009813753_200025704644 [0,2,0,0,0,0|0,0,0]=2 8446 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)NN 34a_100000184184_200025704644 [0,2,0,0,0,0|1,0,0]=3 8447 B12R1.435 [13CH3]Oc1cccc(c1)C(N)CO 34a_100025717460_200025704644 [0,2,0,0,0,0|1,0,1]=4 8448 B12R1.435 [13CH3]Oc1cccc(c1)C(O)CN 34a_100020657549_200025704644 [0,2,0,0,0,0|0,0,2]=4 8449 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_100000021280_200025704644 [0,2,0,0,0,0|2,0,0]=4 8450 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_200025704644_100000021280 [0,2,0,0,0,0|2,0,0]=4 8451 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C#N 62a_200025704644_100010169886 [0,2,0,0,0,0|0,0,1]=3 8452 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C=O 62a_100000726164_200025704644 [0,2,0,0,0,0|0,0,1]=3 8453 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)C=O 62a_200025704644_100000726164 [0,2,0,0,0,0|0,0,1]=3 8454 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_100020587001_200025704644 [0,2,0,0,0,0|0,0,0]=2 8455 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_200025704644_100020587001 [0,2,0,0,0,0|0,0,0]=2 8456 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_100000189783_200025704644 [0,2,0,0,0,0|1,0,0]=3 8457 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_200025704644_100000189783 [0,2,0,0,0,0|1,0,0]=3 8458 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_100000690078_200025704644 [0,2,0,0,0,0|1,0,1]=4 8459 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_200025704644_100000690078 [0,2,0,0,0,0|1,0,1]=4 8460 B12R1.435 [13CH3]Sc1cccc(n1)C(=O)NN 62a_100011631096_200025704644 [0,2,0,0,0,0|2,0,0]=4 8461 B12R1.435 [13CH3]Sc1cccc(n1)C(=O)NN 62a_200025704644_100011631096 [0,2,0,0,0,0|2,0,0]=4 8462 B12R1.435 [13CH3]Sc1ccnc(c1)C(=O)NN 62a_100000017052_200025704644 [0,2,0,0,0,0|2,0,0]=4 8463 B12R1.435 [13CH3]Sc1ccnc(c1)C(=O)NN 62a_200025704644_100000017052 [0,2,0,0,0,0|2,0,0]=4 8464 B12R1.435 [13CH3]Sc1cncc(c1)C(=O)NN 62a_100000189809_200025704644 [0,2,0,0,0,0|2,0,0]=4 8465 B12R1.435 [13CH3]Sc1cncc(c1)C(=O)NN 62a_200025704644_100000189809 [0,2,0,0,0,0|2,0,0]=4 8466 B12R1.11 C=C(C)c1cc(cc(c1)C#N)Br 271570a_100000694244_100009997436 [0,2,0,0,0,0|1,0,1]=4 8467 B12R1.11 C=C(C)c1cc(cc(c1)C#N)C 271570a_100000694244_100011998626 [0,2,0,0,0,0|1,0,0]=3 8468 B12R1.11 C=C(C)c1cc(cc(c1)C#N)Cl 271570a_100000694244_100009827952 [0,2,0,0,0,0|1,0,1]=4 8469 B12R1.11 C=C(C)c1cc(cc(c1)C#N)F 271570a_100000694244_100000756176 [0,2,0,0,0,0|1,0,1]=4 8470 B12R1.11 C=C(C)c1cc(cc(c1)C#N)N 271570a_100000694244_100012002331 [0,2,0,0,0,0|1,0,1]=4 8471 B12R1.11 C=C(C)c1cc(cc(c1)C#N)O 271570a_100000694244_100012180112 [0,2,0,0,0,0|1,0,1]=4 8472 B12R1.11 C=C(C)c1cc(cc(c1)C=O)Br 271570a_100000694244_100010185649 [0,2,0,0,0,0|1,0,1]=4 8473 B12R1.11 C=C(C)c1cc(cc(c1)C=O)C 271570a_100000694244_100000686105 [0,2,0,0,0,0|1,0,0]=3 8474 B12R1.11 C=C(C)c1cc(cc(c1)C=O)F 271570a_100000694244_100011794424 [0,2,0,0,0,0|1,0,1]=4 8475 B12R1.11 C=C(C)c1cc(cc(c1)C=O)O 271570a_100000694244_100010176088 [0,2,0,0,0,0|1,0,1]=4 8476 B12R1.11 C=C(C)c1cc(cc(c1)CC)N 271570a_100000694244_100010074814 [0,2,0,0,0,0|1,0,0]=3 8477 B12R1.11 C=C(C)c1cc(cc(c1)CN)F 271570a_100000694244_100020611034 [0,2,0,0,0,0|1,0,0]=3 8478 B12R1.11 C=C(C)c1cc(cc(c1)CO)Br 271570a_100000694244_100009814756 [0,2,0,0,0,0|1,0,0]=3 8479 B12R1.11 C=C(C)c1cc(cc(c1)CO)C 271570a_100000694244_100000720511 [0,2,0,0,0,0|1,0,0]=3 8480 B12R1.11 C=C(C)c1cc(cc(c1)CO)F 271570a_100000694244_100000766897 [0,2,0,0,0,0|1,0,0]=3 8481 B12R1.11 C=C(C)c1cc(cc(c1)NC)F 271570a_100000694244_106741647397 [0,2,0,0,0,0|1,0,0]=3 8482 B12R1.11 C=C(C)c1cc(cc(c1)OC)Br 271570a_100000694244_100010141301 [0,2,0,0,0,0|1,0,0]=3 8483 B12R1.11 C=C(C)c1cc(cc(c1)OC)C 271570a_100000694244_100010187550 [0,2,0,0,0,0|1,0,0]=3 8484 B12R1.11 C=C(C)c1cc(cc(c1)OC)Cl 271570a_100000694244_100010147680 [0,2,0,0,0,0|1,0,0]=3 8485 B12R1.11 C=C(C)c1cc(cc(c1)OC)F 271570a_100000694244_100011934182 [0,2,0,0,0,0|1,0,0]=3 8486 B12R1.11 C=C(C)c1cc(cc(c1)OC)N 271570a_100000694244_100000750983 [0,2,0,0,0,0|1,0,0]=3 8487 B12R1.11 C=C(C)c1cc(cc(c1)OC)O 271570a_100000694244_100010068927 [0,2,0,0,0,0|1,0,0]=3 8488 B12R1.11 C=C(C)c1cc(cc(c1)SC)C 271570a_100000694244_200010709730 [0,2,0,0,0,0|1,0,0]=3 8489 B12R1.11 C=C(C)c1cc(cc(c1)SC)F 271570a_100000694244_200010245467 [0,2,0,0,0,0|1,0,0]=3 8490 B12R1.11 C=C(C)c1cc(cc(n1)C)C#N 271570a_100000694244_100000692097 [0,2,0,0,0,0|2,0,0]=4 8491 B12R1.11 C=C(C)c1cc(cc(n1)C)OC 271570a_100000694244_200009849800 [0,2,0,0,0,0|2,0,0]=4 8492 B12R1.11 C=C(C)c1cc(cc(n1)CO)C 271570a_100000694244_100000725198 [0,2,0,0,0,0|2,0,0]=4 8493 B12R1.11 C=C(C)c1cc(cc(n1)N)OC 271570a_100000694244_100010257270 [0,2,0,0,0,0|2,0,0]=4 8494 B12R1.11 C=C(C)c1cc(cc(n1)OC)C 271570a_100000694244_100009856763 [0,2,0,0,0,0|2,0,0]=4 8495 B12R1.11 C=C(C)c1cc(cc(n1)OC)N 271570a_100000694244_100012187057 [0,2,0,0,0,0|2,0,0]=4 8496 B12R1.11 C=C(C)c1cc(nc(c1)C#N)C 271570a_100000694244_100000730222 [0,2,0,0,0,0|2,0,0]=4 8497 B12R1.11 C=C(C)c1cc(nc(c1)C=O)C 271570a_100000694244_100009814795 [0,2,0,0,0,0|2,0,0]=4 8498 B12R1.11 C=C(C)c1cc(nc(c1)CN)C 271570a_100000694244_100010178683 [0,2,0,0,0,0|2,0,0]=4 8499 B12R1.11 C=C(C)c1cc(nc(c1)CO)C 271570a_100000694244_100010178681 [0,2,0,0,0,0|2,0,0]=4 8500 B12R1.11 C=C(C)c1cc(nc(c1)OC)C 271570a_100000694244_100010067692 [0,2,0,0,0,0|2,0,0]=4 8501 B12R1.11 C=C(C)c1cc(nc(c1)OC)N 271570a_100000694244_100010136845 [0,2,0,0,0,0|2,0,0]=4 8502 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)Br 271570a_100011290941_100010005435 [0,2,0,0,0,0|0,0,1]=3 8503 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)C 271570a_100011290941_100000694479 [0,2,0,0,0,0|0,0,0]=2 8504 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)F 271570a_100011290941_100012361402 [0,2,0,0,0,0|0,0,1]=3 8505 B12R1.11 C=Cc1cc(cc(c1)C(=O)N)C 271570a_100011290941_200012348365 [0,2,0,0,0,0|1,0,0]=3 8506 B12R1.11 C=Cc1cc(cc(c1)C(=O)N)F 271570a_100011290941_200011280034 [0,2,0,0,0,0|1,0,1]=4 8507 B12R1.11 C=Cc1cc(cc(c1)C(=O)N)O 271570a_100011290941_100010084318 [0,2,0,0,0,0|1,0,1]=4 8508 B12R1.11 C=Cc1cc(cc(n1)C)C(=O)C 271570a_100011290941_100009884196 [0,2,0,0,0,0|1,0,0]=3 8509 B12R1.11 CC(=O)c1cc(cc(c1)C#N)Br 1458a_100011935128_200000210301 [0,2,0,0,0,0|0,0,1]=3 8510 B12R1.11 CC(=O)c1cc(cc(c1)C#N)C 1458a_100012001805_200000210301 [0,2,0,0,0,0|0,0,0]=2 8511 B12R1.11 CC(=O)c1cc(cc(c1)C#N)Cl 1458a_100011997934_200000210301 [0,2,0,0,0,0|0,0,1]=3 8512 B12R1.11 CC(=O)c1cc(cc(c1)C#N)F 1458a_100011356446_200000210301 [0,2,0,0,0,0|0,0,1]=3 8513 B12R1.11 CC(=O)c1cc(cc(c1)CO)Cl 1458a_100009925505_200000210301 [0,2,0,0,0,0|0,0,0]=2 8514 B12R1.11 CC(=O)c1cc(cc(c1)CO)F 1458a_100012278920_200000210301 [0,2,0,0,0,0|0,0,0]=2 8515 B12R1.11 CC(=O)c1cc(cc(c1)O[13CH3])C 34a_100009855872_200025704644 [0,2,0,0,0,0|0,0,0]=2 8516 B12R1.11 CC(=O)c1cc(cc(c1)O[13CH3])C 7a_100009855872_200025704644 [0,2,0,0,0,0|0,0,0]=2 8517 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])Br 62a_100010005435_200025704644 [0,2,0,0,0,0|0,0,0]=2 8518 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])Br 62a_200025704644_100010005435 [0,2,0,0,0,0|0,0,0]=2 8519 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])C 62a_100000694479_200025704644 [0,2,0,0,0,0|0,0,0]=2 8520 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])C 62a_200025704644_100000694479 [0,2,0,0,0,0|0,0,0]=2 8521 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])F 62a_100012361402_200025704644 [0,2,0,0,0,0|0,0,0]=2 8522 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])F 62a_200025704644_100012361402 [0,2,0,0,0,0|0,0,0]=2 8523 B12R1.11 CC(=O)c1cc(nc(c1)S[13CH3])C 62a_100009884196_200025704644 [0,2,0,0,0,0|1,0,0]=3 8524 B12R1.11 CC(=O)c1cc(nc(c1)S[13CH3])C 62a_200025704644_100009884196 [0,2,0,0,0,0|1,0,0]=3 8525 B12R1.11 CC(C)c1cc(cc(c1)N[13CH3])Br 2230a_100010369243_200025704644 [0,2,0,0,0,0|1,0,1]=4 8526 B12R1.11 CC(C)c1cc(cc(c1)N[13CH3])Br 34a_100010369243_200025704644 [0,2,0,0,0,0|1,0,1]=4 8527 B12R1.11 CC(C)c1cc(cc(c1)N[13CH3])Br 7a_100010369243_200025704644 [0,2,0,0,0,0|1,0,1]=4 8528 B12R1.11 CC(C)c1cc(cc(c1)S[13CH3])Br 62a_200015473176_200025704644 [0,2,0,0,0,0|1,0,1]=4 8529 B12R1.11 CC(C)c1cc(cc(c1)S[13CH3])Br 62a_200025704644_200015473176 [0,2,0,0,0,0|1,0,1]=4 8530 B12R1.11 CC(C)c1cc(cc(c1)S[13CH3])N 62a_100010369243_200025704644 [0,2,0,0,0,0|1,0,1]=4 8531 B12R1.11 CC(C)c1cc(cc(c1)S[13CH3])N 62a_200025704644_100010369243 [0,2,0,0,0,0|1,0,1]=4 8532 B12R1.11 CNc1cc(cc(c1)C(=O)N)F 34a_200011998915_200000210301 [0,2,0,0,0,0|1,0,0]=3 8533 B12R1.11 CNc1cc(cc(c1)C(=O)N)F 7a_200011998915_200000210301 [0,2,0,0,0,0|1,0,0]=3 8534 B12R1.11 CNc1cc(cc(c1)C(C)C)Br 2230a_100010369243_200000210301 [0,2,0,0,0,0|1,0,1]=4 8535 B12R1.11 CNc1cc(cc(c1)C(C)C)Br 34a_100010369243_200000210301 [0,2,0,0,0,0|1,0,1]=4 8536 B12R1.11 CNc1cc(cc(c1)C(C)C)Br 7a_100010369243_200000210301 [0,2,0,0,0,0|1,0,1]=4 8537 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Br 34a_100000728782_200000210301 [0,2,0,0,0,0|2,0,0]=4 8538 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Br 7a_100000728782_200000210301 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 2230a_100011707342_200000210301 [0,2,0,0,0,0|2,0,0]=4 8540 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 34a_100011707342_200000210301 [0,2,0,0,0,0|2,0,0]=4 8541 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 7a_100011707342_200000210301 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100012181248_200000210301 [0,2,0,0,0,0|2,0,0]=4 8543 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100012181248_200000210301 [0,2,0,0,0,0|2,0,0]=4 8544 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])F 34a_100000756922_200000210301 [0,2,0,0,0,0|2,0,0]=4 8545 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])F 7a_100000756922_200000210301 [0,2,0,0,0,0|2,0,0]=4 8546 B12R1.11 COc1cc(cc(c1)C(=O)C)Br 1458a_100011934030_200000210301 [0,2,0,0,0,0|0,0,0]=2 8547 B12R1.11 COc1cc(cc(c1)C(=O)C)C 1458a_100000117910_200000210301 [0,2,0,0,0,0|0,0,0]=2 8548 B12R1.11 COc1cc(cc(c1)C(=O)C)C 34a_100009855872_200000210301 [0,2,0,0,0,0|0,0,0]=2 8549 B12R1.11 COc1cc(cc(c1)C(=O)C)C 7a_100009855872_200000210301 [0,2,0,0,0,0|0,0,0]=2 8550 B12R1.11 COc1cc(cc(c1)C(=O)C)Cl 1458a_100000066651_200000210301 [0,2,0,0,0,0|0,0,0]=2 8551 B12R1.11 COc1cc(cc(c1)C(=O)C)F 1458a_100011934639_200000210301 [0,2,0,0,0,0|0,0,0]=2 8552 B12R1.11 COc1cc(cc(c1)C(=O)C)I 1458a_200010292657_200000210301 [0,2,0,0,0,0|0,0,0]=2 8553 B12R1.11 COc1cc(cc(c1)C(=O)C)O 1458a_100000083963_200000210301 [0,2,0,0,0,0|0,0,0]=2 8554 B12R1.11 COc1cc(cc(c1)C(=O)C)O 271570a_203496583355_100010713257 [0,2,0,0,0,0|0,0,0]=2 8555 B12R1.11 COc1cc(cc(c1)C(=O)N)Br 34a_100010084318_200000210301 [0,2,0,0,0,0|1,0,0]=3 8556 B12R1.11 COc1cc(cc(c1)C(=O)N)Br 7a_100010084318_200000210301 [0,2,0,0,0,0|1,0,0]=3 8557 B12R1.11 COc1cc(cc(c1)C(=O)N)O 271570a_203496583355_100010146780 [0,2,0,0,0,0|1,0,0]=3 8558 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100011934030_200025704644 [0,2,0,0,0,0|0,0,0]=2 8559 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000117910_200025704644 [0,2,0,0,0,0|0,0,0]=2 8560 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000066651_200025704644 [0,2,0,0,0,0|0,0,0]=2 8561 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])F 1458a_100011934639_200025704644 [0,2,0,0,0,0|0,0,0]=2 8562 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])I 1458a_200010292657_200025704644 [0,2,0,0,0,0|0,0,0]=2 8563 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000083963_200025704644 [0,2,0,0,0,0|0,0,0]=2 8564 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Br 34a_100010219246_200000210301 [0,2,0,0,0,0|2,0,0]=4 8565 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Br 7a_100010219246_200000210301 [0,2,0,0,0,0|2,0,0]=4 8566 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 34a_200000091708_200000210301 [0,2,0,0,0,0|2,0,0]=4 8567 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 7a_200000091708_200000210301 [0,2,0,0,0,0|2,0,0]=4 8568 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100000118981_200000210301 [0,2,0,0,0,0|2,0,0]=4 8569 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100000118981_200000210301 [0,2,0,0,0,0|2,0,0]=4 8570 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])F 34a_100000690918_200000210301 [0,2,0,0,0,0|2,0,0]=4 8571 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])F 7a_100000690918_200000210301 [0,2,0,0,0,0|2,0,0]=4 8572 B12R1.11 CSc1cc(cc(c1)C(=O)C)Br 62a_100010005435_200000210301 [0,2,0,0,0,0|0,0,0]=2 8573 B12R1.11 CSc1cc(cc(c1)C(=O)C)Br 62a_200000210301_100010005435 [0,2,0,0,0,0|0,0,0]=2 8574 B12R1.11 CSc1cc(cc(c1)C(=O)C)C 62a_100000694479_200000210301 [0,2,0,0,0,0|0,0,0]=2 8575 B12R1.11 CSc1cc(cc(c1)C(=O)C)C 62a_200000210301_100000694479 [0,2,0,0,0,0|0,0,0]=2 8576 B12R1.11 CSc1cc(cc(c1)C(=O)C)F 62a_100012361402_200000210301 [0,2,0,0,0,0|0,0,0]=2 8577 B12R1.11 CSc1cc(cc(c1)C(=O)C)F 62a_200000210301_100012361402 [0,2,0,0,0,0|0,0,0]=2 8578 B12R1.11 CSc1cc(cc(c1)C(=O)N)C 62a_200000210301_200012348365 [0,2,0,0,0,0|1,0,0]=3 8579 B12R1.11 CSc1cc(cc(c1)C(=O)N)C 62a_200012348365_200000210301 [0,2,0,0,0,0|1,0,0]=3 8580 B12R1.11 CSc1cc(cc(c1)C(=O)N)F 62a_200000210301_200011280034 [0,2,0,0,0,0|1,0,0]=3 8581 B12R1.11 CSc1cc(cc(c1)C(=O)N)F 62a_200011280034_200000210301 [0,2,0,0,0,0|1,0,0]=3 8582 B12R1.11 CSc1cc(cc(c1)C(=O)N)O 62a_100010084318_200000210301 [0,2,0,0,0,0|1,0,0]=3 8583 B12R1.11 CSc1cc(cc(c1)C(=O)N)O 62a_200000210301_100010084318 [0,2,0,0,0,0|1,0,0]=3 8584 B12R1.11 CSc1cc(cc(c1)C(C)C)Br 62a_200000210301_200015473176 [0,2,0,0,0,0|1,0,1]=4 8585 B12R1.11 CSc1cc(cc(c1)C(C)C)Br 62a_200015473176_200000210301 [0,2,0,0,0,0|1,0,1]=4 8586 B12R1.11 CSc1cc(cc(c1)C(C)C)N 62a_100010369243_200000210301 [0,2,0,0,0,0|1,0,1]=4 8587 B12R1.11 CSc1cc(cc(c1)C(C)C)N 62a_200000210301_100010369243 [0,2,0,0,0,0|1,0,1]=4 8588 B12R1.11 CSc1cc(cc(n1)C)C(=O)C 62a_100009884196_200000210301 [0,2,0,0,0,0|1,0,0]=3 8589 B12R1.11 CSc1cc(cc(n1)C)C(=O)C 62a_200000210301_100009884196 [0,2,0,0,0,0|1,0,0]=3 8590 B12R1.11 Cc1cc(cc(c1)C(=O)N)S[13CH3] 62a_200012348365_200025704644 [0,2,0,0,0,0|1,0,0]=3 8591 B12R1.11 Cc1cc(cc(c1)C(=O)N)S[13CH3] 62a_200025704644_200012348365 [0,2,0,0,0,0|1,0,0]=3 8592 B12R1.11 Cc1cc(cc(c1)C(=O)[13CH3])C#N 1458a_100012001805_200025704644 [0,2,0,0,0,0|0,0,0]=2 8593 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 2230a_100011707342_200025704644 [0,2,0,0,0,0|2,0,0]=4 8594 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 34a_100011707342_200025704644 [0,2,0,0,0,0|2,0,0]=4 8595 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 7a_100011707342_200025704644 [0,2,0,0,0,0|2,0,0]=4 8596 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 34a_200000091708_200025704644 [0,2,0,0,0,0|2,0,0]=4 8597 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 7a_200000091708_200025704644 [0,2,0,0,0,0|2,0,0]=4 8598 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)Br 1458a_100011935128_200025704644 [0,2,0,0,0,0|0,0,1]=3 8599 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)Cl 1458a_100011997934_200025704644 [0,2,0,0,0,0|0,0,1]=3 8600 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)F 1458a_100011356446_200025704644 [0,2,0,0,0,0|0,0,1]=3 8601 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)CO)Cl 1458a_100009925505_200025704644 [0,2,0,0,0,0|0,0,0]=2 8602 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)CO)F 1458a_100012278920_200025704644 [0,2,0,0,0,0|0,0,0]=2 8603 B12R1.11 [13CH3]Nc1cc(cc(c1)C(=O)N)F 34a_200011998915_200025704644 [0,2,0,0,0,0|1,0,0]=3 8604 B12R1.11 [13CH3]Nc1cc(cc(c1)C(=O)N)F 7a_200011998915_200025704644 [0,2,0,0,0,0|1,0,0]=3 8605 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Br 34a_100000728782_200025704644 [0,2,0,0,0,0|2,0,0]=4 8606 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Br 7a_100000728782_200025704644 [0,2,0,0,0,0|2,0,0]=4 8607 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100012181248_200025704644 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100012181248_200025704644 [0,2,0,0,0,0|2,0,0]=4 8609 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])F 34a_100000756922_200025704644 [0,2,0,0,0,0|2,0,0]=4 8610 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])F 7a_100000756922_200025704644 [0,2,0,0,0,0|2,0,0]=4 8611 B12R1.11 [13CH3]Oc1cc(cc(c1)C(=O)N)Br 34a_100010084318_200025704644 [0,2,0,0,0,0|1,0,0]=3 8612 B12R1.11 [13CH3]Oc1cc(cc(c1)C(=O)N)Br 7a_100010084318_200025704644 [0,2,0,0,0,0|1,0,0]=3 8613 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Br 34a_100010219246_200025704644 [0,2,0,0,0,0|2,0,0]=4 8614 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Br 7a_100010219246_200025704644 [0,2,0,0,0,0|2,0,0]=4 8615 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100000118981_200025704644 [0,2,0,0,0,0|2,0,0]=4 8616 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100000118981_200025704644 [0,2,0,0,0,0|2,0,0]=4 8617 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])F 34a_100000690918_200025704644 [0,2,0,0,0,0|2,0,0]=4 8618 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])F 7a_100000690918_200025704644 [0,2,0,0,0,0|2,0,0]=4 8619 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)F 62a_200011280034_200025704644 [0,2,0,0,0,0|1,0,0]=3 8620 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)F 62a_200025704644_200011280034 [0,2,0,0,0,0|1,0,0]=3 8621 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)O 62a_100010084318_200025704644 [0,2,0,0,0,0|1,0,0]=3 8622 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)O 62a_200025704644_100010084318 [0,2,0,0,0,0|1,0,0]=3 8623 B12R1.102 CS(=O)(=O)c1cc(cc(c1)F)O 271570a_203496583355_200010884439 [0,2,0,0,0,0|2,0,0]=4 8624 B12R1.102 CS(=O)(=O)c1cc(cc(c1)O)N 271570a_203496583355_200010115582 [0,2,0,0,0,0|2,0,0]=4 8625 B12R1.102 Cc1cc(cc(c1)C(C)(C)C)O 271570a_203496583355_200009817001 [0,2,0,0,0,0|1,0,1]=4 8626 B12R1.511 C=C(C)c1cc(cc(c1Br)F)F 271570a_100000694244_100010256416 [0,2,0,0,0,0|2,0,0]=4 8627 B12R1.511 C=C(C)c1cc(cc(c1C)C)N 271570a_100000694244_100010368239 [0,2,0,0,0,0|1,0,0]=3 8628 B12R1.511 C=C(C)c1cc(cc(c1C)C)O 271570a_100000694244_100010068915 [0,2,0,0,0,0|1,0,0]=3 8629 B12R1.511 C=C(C)c1cc(cc(c1C)F)C 271570a_100000694244_100015473476 [0,2,0,0,0,0|1,0,0]=3 8630 B12R1.511 C=C(C)c1cc(cc(c1C)F)F 271570a_100000694244_100015579730 [0,2,0,0,0,0|2,0,0]=4 8631 B12R1.511 C=C(C)c1cc(cc(c1C)F)N 271570a_100000694244_100010254531 [0,2,0,0,0,0|2,0,0]=4 8632 B12R1.511 C=C(C)c1cc(cc(c1C)N)C 271570a_100000694244_102495365385 [0,2,0,0,0,0|1,0,0]=3 8633 B12R1.511 C=C(C)c1cc(cc(c1C)N)Cl 271570a_100000694244_200000050010 [0,2,0,0,0,0|2,0,0]=4 8634 B12R1.511 C=C(C)c1cc(cc(c1C)N)F 271570a_100000694244_100009814351 [0,2,0,0,0,0|2,0,0]=4 8635 B12R1.511 C=C(C)c1cc(cc(c1Cl)Cl)Cl 271570a_100000694244_200000042848 [0,2,0,0,0,0|2,0,0]=4 8636 B12R1.511 C=C(C)c1cc(cc(c1F)C)C 271570a_100000694244_200010204574 [0,2,0,0,0,0|1,0,0]=3 8637 B12R1.511 C=C(C)c1cc(cc(c1F)C)F 271570a_100000694244_100010291795 [0,2,0,0,0,0|1,0,0]=3 8638 B12R1.511 C=C(C)c1cc(cc(c1F)Cl)Br 271570a_100000694244_100010270166 [0,2,0,0,0,0|2,0,0]=4 8639 B12R1.511 C=C(C)c1cc(cc(c1F)F)C 271570a_100000694244_100010141297 [0,2,0,0,0,0|1,0,0]=3 8640 B12R1.511 C=C(C)c1cc(cc(c1F)F)F 271570a_100000694244_100000724850 [0,2,0,0,0,0|2,0,0]=4 8641 B12R1.511 C=C(C)c1cc(cc(c1F)F)N 271570a_100000694244_100009816004 [0,2,0,0,0,0|2,0,0]=4 8642 B12R1.511 C=C(C)c1cc(cc(c1F)N)C 271570a_100000694244_100010589139 [0,2,0,0,0,0|1,0,0]=3 8643 B12R1.511 C=C(C)c1cc(cc(c1F)N)F 271570a_100000694244_100000722353 [0,2,0,0,0,0|2,0,0]=4 8644 B12R1.511 C=C(C)c1cc(cc(c1N)Br)Cl 271570a_100000694244_200012970264 [0,2,0,0,0,0|2,0,0]=4 8645 B12R1.511 C=C(C)c1cc(cc(c1N)C)Br 271570a_100000694244_200000690823 [0,2,0,0,0,0|1,0,0]=3 8646 B12R1.511 C=C(C)c1cc(cc(c1N)C)C 271570a_100000694244_100000688863 [0,2,0,0,0,0|1,0,0]=3 8647 B12R1.511 C=C(C)c1cc(cc(c1N)C)Cl 271570a_100000694244_100012344046 [0,2,0,0,0,0|1,0,0]=3 8648 B12R1.511 C=C(C)c1cc(cc(c1N)C)F 271570a_100000694244_100011216670 [0,2,0,0,0,0|1,0,0]=3 8649 B12R1.511 C=C(C)c1cc(cc(c1N)Cl)Cl 271570a_100000694244_100011216899 [0,2,0,0,0,0|2,0,0]=4 8650 B12R1.511 C=C(C)c1cc(cc(c1N)F)Br 271570a_100000694244_100012970276 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.511 C=C(C)c1cc(cc(c1N)F)C 271570a_100000694244_100012353694 [0,2,0,0,0,0|1,0,0]=3 8652 B12R1.511 C=C(C)c1cc(cc(c1N)F)Cl 271570a_100000694244_100011214900 [0,2,0,0,0,0|2,0,0]=4 8653 B12R1.511 C=C(C)c1cc(cc(c1N)F)F 271570a_100000694244_100000211602 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.511 C=C(C)c1cc(cc(c1N)N)C 271570a_100000694244_100012348275 [0,2,0,0,0,0|1,0,0]=3 8655 B12R1.511 C=C(C)c1cc(cc(c1N)N)F 271570a_100000694244_100011934818 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.511 C=C(C)c1cc(cc(c1O)Br)F 271570a_100000694244_200013085147 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.511 C=C(C)c1cc(cc(c1O)C)C 271570a_100000694244_100011934984 [0,2,0,0,0,0|1,0,0]=3 8658 B12R1.511 C=C(C)c1cc(cc(c1O)C)Cl 271570a_100000694244_100012343667 [0,2,0,0,0,0|1,0,0]=3 8659 B12R1.511 C=C(C)c1cc(cc(c1O)C)N 271570a_100000694244_100010064301 [0,2,0,0,0,0|1,0,0]=3 8660 B12R1.511 C=C(C)c1cc(cc(c1O)Cl)Cl 271570a_100000694244_200012339341 [0,2,0,0,0,0|2,0,0]=4 8661 B12R1.511 C=C(C)c1cc(cc(c1O)F)Br 271570a_100000694244_100013354677 [0,2,0,0,0,0|2,0,0]=4 8662 B12R1.511 C=C(C)c1cc(cc(c1O)F)C 271570a_100000694244_200135191068 [0,2,0,0,0,0|1,0,0]=3 8663 B12R1.511 C=C(C)c1cc(cc(c1O)F)F 271570a_100000694244_100000688693 [0,2,0,0,0,0|2,0,0]=4 8664 B12R1.511 C=C(C)c1cc(cc(c1O)N)F 271570a_100000694244_200011217456 [0,2,0,0,0,0|2,0,0]=4 8665 B12R1.511 C=C(C)c1cc(cn(c1=O)C)C 271570a_100000694244_100011068373 [0,2,0,0,0,0|2,0,0]=4 8666 B12R1.511 C=C(C)c1nc(cc(c1N)C)C 271570a_100000694244_100009816701 [0,2,0,0,0,0|2,0,0]=4 8667 B12R1.511 C=C(C)c1nc(cc(c1N)C)Cl 271570a_100000694244_100021194808 [0,2,0,0,0,0|2,0,0]=4 8668 B12R1.511 CC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_200000210301 [0,2,0,0,0,0|0,0,0]=2 8669 B12R1.511 CC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_200000210301 [0,2,0,0,0,0|0,0,0]=2 8670 B12R1.511 CC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200000210301 [0,2,0,0,0,0|1,0,0]=3 8671 B12R1.511 CC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_200000210301 [0,2,0,0,0,0|1,0,0]=3 8672 B12R1.511 CC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_200000210301 [0,2,0,0,0,0|1,0,0]=3 8673 B12R1.511 CC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_200000210301 [0,2,0,0,0,0|0,0,0]=2 8674 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_200000210301 [0,2,0,0,0,0|1,0,0]=3 8675 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_200000210301 [0,2,0,0,0,0|1,0,0]=3 8676 B12R1.511 CC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_200000210301 [0,2,0,0,0,0|1,0,0]=3 8677 B12R1.511 CC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_200000210301 [0,2,0,0,0,0|1,0,0]=3 8678 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200000210301 [0,2,0,0,0,0|1,0,0]=3 8679 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200000210301 [0,2,0,0,0,0|1,0,0]=3 8680 B12R1.511 CC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_200000210301 [0,2,0,0,0,0|0,0,0]=2 8681 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200000210301 [0,2,0,0,0,0|1,0,0]=3 8682 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200000210301 [0,2,0,0,0,0|1,0,0]=3 8683 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200000210301 [0,2,0,0,0,0|1,0,0]=3 8684 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200000210301 [0,2,0,0,0,0|1,0,0]=3 8685 B12R1.511 CC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_200000210301 [0,2,0,0,0,0|0,0,0]=2 8686 B12R1.511 CC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200000210301 [0,2,0,0,0,0|1,0,0]=3 8687 B12R1.511 CC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200000210301 [0,2,0,0,0,0|1,0,0]=3 8688 B12R1.511 CC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_200000210301 [0,2,0,0,0,0|0,0,0]=2 8689 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200000210301 [0,2,0,0,0,0|1,0,0]=3 8690 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200000210301 [0,2,0,0,0,0|1,0,0]=3 8691 B12R1.511 CC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200000210301 [0,2,0,0,0,0|1,0,0]=3 8692 B12R1.511 CC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_200000210301 [0,2,0,0,0,0|0,0,0]=2 8693 B12R1.511 CC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200000210301 [0,2,0,0,0,0|1,0,0]=3 8694 B12R1.511 CC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200000210301 [0,2,0,0,0,0|1,0,0]=3 8695 B12R1.511 CC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200000210301 [0,2,0,0,0,0|1,0,0]=3 8696 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200000210301 [0,2,0,0,0,0|1,0,0]=3 8697 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200000210301 [0,2,0,0,0,0|1,0,0]=3 8698 B12R1.511 CC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_200000210301 [0,2,0,0,0,0|0,0,0]=2 8699 B12R1.511 CC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_200000210301 [0,2,0,0,0,0|0,0,0]=2 8700 B12R1.511 CC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200000210301 [0,2,0,0,0,0|1,0,0]=3 8701 B12R1.511 CC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200000210301 [0,2,0,0,0,0|1,0,0]=3 8702 B12R1.511 CC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200000210301 [0,2,0,0,0,0|1,0,0]=3 8703 B12R1.511 CC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200000210301 [0,2,0,0,0,0|1,0,0]=3 8704 B12R1.511 CC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200000210301 [0,2,0,0,0,0|1,0,0]=3 8705 B12R1.511 CC(=O)c1cc(cc(c1O)O)C 271570a_203496583355_100011659362 [0,2,0,0,0,0|0,0,0]=2 8706 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100012356187_200025704644 [0,2,0,0,0,0|1,0,0]=3 8707 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Cl 1458a_100012921640_200025704644 [0,2,0,0,0,0|1,0,0]=3 8708 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)F 1458a_100010768523_200025704644 [0,2,0,0,0,0|1,0,0]=3 8709 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)O 1458a_100011101721_200025704644 [0,2,0,0,0,0|1,0,0]=3 8710 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Br 1458a_100012347597_200025704644 [0,2,0,0,0,0|1,0,0]=3 8711 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Cl 1458a_100012177191_200025704644 [0,2,0,0,0,0|1,0,0]=3 8712 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)Br 1458a_200012920551_200025704644 [0,2,0,0,0,0|0,0,0]=2 8713 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)C 1458a_200000701928_200025704644 [0,2,0,0,0,0|0,0,0]=2 8714 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)Br 1458a_100009996753_200025704644 [0,2,0,0,0,0|0,0,0]=2 8715 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)F 1458a_100000094381_200025704644 [0,2,0,0,0,0|0,0,0]=2 8716 B12R1.511 Cc1cc(cc(c1C)C(=O)[13CH3])Br 1458a_100012920495_200025704644 [0,2,0,0,0,0|0,0,0]=2 8717 B12R1.511 Cc1cc(cc(c1Cl)C(=O)[13CH3])F 1458a_200010768536_200025704644 [0,2,0,0,0,0|0,0,0]=2 8718 B12R1.511 Cc1cc(cc(c1F)C(=O)[13CH3])Br 1458a_100012928937_200025704644 [0,2,0,0,0,0|0,0,0]=2 8719 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100011825902_200025704644 [0,2,0,0,0,0|0,0,0]=2 8720 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Cl 1458a_100011255218_200025704644 [0,2,0,0,0,0|0,0,0]=2 8721 B12R1.511 NC(=O)c1cc(cc(c1O)O)F 271570a_203496583355_200135271384 [0,2,0,0,0,0|2,0,0]=4 8722 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200025704644 [0,2,0,0,0,0|1,0,0]=3 8723 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200025704644 [0,2,0,0,0,0|1,0,0]=3 8724 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200025704644 [0,2,0,0,0,0|1,0,0]=3 8725 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200025704644 [0,2,0,0,0,0|1,0,0]=3 8726 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200025704644 [0,2,0,0,0,0|1,0,0]=3 8727 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200025704644 [0,2,0,0,0,0|1,0,0]=3 8728 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200025704644 [0,2,0,0,0,0|1,0,0]=3 8729 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200025704644 [0,2,0,0,0,0|1,0,0]=3 8730 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200025704644 [0,2,0,0,0,0|1,0,0]=3 8731 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200025704644 [0,2,0,0,0,0|1,0,0]=3 8732 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200025704644 [0,2,0,0,0,0|1,0,0]=3 8733 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200025704644 [0,2,0,0,0,0|1,0,0]=3 8734 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200025704644 [0,2,0,0,0,0|1,0,0]=3 8735 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200025704644 [0,2,0,0,0,0|1,0,0]=3 8736 B12R1.511 [13CH3]C(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200025704644 [0,2,0,0,0,0|1,0,0]=3 8737 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200025704644 [0,2,0,0,0,0|1,0,0]=3 8738 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200025704644 [0,2,0,0,0,0|1,0,0]=3 8739 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200025704644 [0,2,0,0,0,0|1,0,0]=3 8740 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200025704644 [0,2,0,0,0,0|1,0,0]=3 8741 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200025704644 [0,2,0,0,0,0|1,0,0]=3 8742 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200025704644 [0,2,0,0,0,0|1,0,0]=3 8743 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200025704644 [0,2,0,0,0,0|1,0,0]=3 8744 B12R1.128 CS(=O)(=O)c1cc(ccc1Br)O 271570a_203496583355_100011102953 [0,2,0,0,0,0|2,0,0]=4 8745 B12R1.128 CS(=O)(=O)c1cc(ccc1F)O 271570a_203496583355_100010195686 [0,2,0,0,0,0|2,0,0]=4 8746 B12R1.128 CS(=O)(=O)c1cc(ccc1N)O 271570a_203496583355_100000692581 [0,2,0,0,0,0|2,0,0]=4 8747 B12R1.128 CS(=O)(=O)c1cc(ccc1O)O 271570a_203496583355_200015712519 [0,2,0,0,0,0|2,0,0]=4 8748 B12R1.128 Cc1ccc(cc1S(=O)(=O)C)O 271570a_203496583355_100009814363 [0,2,0,0,0,0|2,0,0]=4 8749 B12R1.228 Cc1cccc(c1O)S(=O)(=O)N 271570a_203496583355_200012348303 [0,2,0,0,0,0|2,0,0]=4 8750 B12R1.436 C=Cc1cccc(c1)S(=O)(=O)C 271570a_100011290941_100009815773 [0,2,0,0,0,0|1,0,1]=4 8751 B12R1.436 CC(C)(C)c1cccc(c1)N[13CH3] 2230a_100000035496_200025704644 [0,2,0,0,0,0|1,0,1]=4 8752 B12R1.436 CC(C)(C)c1cccc(c1)N[13CH3] 34a_100000035496_200025704644 [0,2,0,0,0,0|1,0,1]=4 8753 B12R1.436 CC(C)(C)c1cccc(c1)N[13CH3] 7a_100000035496_200025704644 [0,2,0,0,0,0|1,0,1]=4 8754 B12R1.436 CC(C)(C)c1cccc(c1)O[13CH3] 34a_100000211624_200025704644 [0,2,0,0,0,0|1,0,1]=4 8755 B12R1.436 CC(C)(C)c1cccc(c1)O[13CH3] 7a_100000211624_200025704644 [0,2,0,0,0,0|1,0,1]=4 8756 B12R1.436 CC(C)(C)c1cccc(c1)S[13CH3] 62a_100009816526_200025704644 [0,2,0,0,0,0|1,0,1]=4 8757 B12R1.436 CC(C)(C)c1cccc(c1)S[13CH3] 62a_200025704644_100009816526 [0,2,0,0,0,0|1,0,1]=4 8758 B12R1.436 CC(C)(N)c1cccc(c1)S[13CH3] 62a_100016995529_200025704644 [0,2,0,0,0,0|1,0,1]=4 8759 B12R1.436 CC(C)(N)c1cccc(c1)S[13CH3] 62a_200025704644_100016995529 [0,2,0,0,0,0|1,0,1]=4 8760 B12R1.436 CC(C)(O)c1cccc(c1)O[13CH3] 34a_200000085863_200025704644 [0,2,0,0,0,0|0,0,2]=4 8761 B12R1.436 CC(C)(O)c1cccc(c1)O[13CH3] 7a_200000085863_200025704644 [0,2,0,0,0,0|0,0,2]=4 8762 B12R1.436 CC(C)(O)c1cccc(c1)S[13CH3] 62a_100011346009_200025704644 [0,2,0,0,0,0|0,0,2]=4 8763 B12R1.436 CC(C)(O)c1cccc(c1)S[13CH3] 62a_200025704644_100011346009 [0,2,0,0,0,0|0,0,2]=4 8764 B12R1.436 CC(F)(F)c1cccc(c1)N[13CH3] 34a_100000709193_200025704644 [0,2,0,0,0,0|1,0,1]=4 8765 B12R1.436 CC(F)(F)c1cccc(c1)N[13CH3] 7a_100000709193_200025704644 [0,2,0,0,0,0|1,0,1]=4 8766 B12R1.436 CC(F)(F)c1cccc(c1)S[13CH3] 62a_100010232180_200025704644 [0,2,0,0,0,0|1,0,1]=4 8767 B12R1.436 CC(F)(F)c1cccc(c1)S[13CH3] 62a_200025704644_100010232180 [0,2,0,0,0,0|1,0,1]=4 8768 B12R1.436 CNc1cccc(c1)C(C)(C)C 2230a_100000035496_200000210301 [0,2,0,0,0,0|1,0,1]=4 8769 B12R1.436 CNc1cccc(c1)C(C)(C)C 34a_100000035496_200000210301 [0,2,0,0,0,0|1,0,1]=4 8770 B12R1.436 CNc1cccc(c1)C(C)(C)C 7a_100000035496_200000210301 [0,2,0,0,0,0|1,0,1]=4 8771 B12R1.436 CNc1cccc(c1)C(C)(F)F 34a_100000709193_200000210301 [0,2,0,0,0,0|1,0,1]=4 8772 B12R1.436 CNc1cccc(c1)C(C)(F)F 7a_100000709193_200000210301 [0,2,0,0,0,0|1,0,1]=4 8773 B12R1.436 CNc1cccc(c1)S(=O)(=O)C 34a_100000209861_200000210301 [0,2,0,0,0,0|1,0,0]=3 8774 B12R1.436 CNc1cccc(c1)S(=O)(=O)C 7a_100000209861_200000210301 [0,2,0,0,0,0|1,0,0]=3 8775 B12R1.436 CNc1cccc(c1)S(=O)(=O)N 34a_100000182236_200000210301 [0,2,0,0,0,0|2,0,0]=4 8776 B12R1.436 CNc1cccc(n1)S(=O)(=O)C 27a_100102657272_100010191205 [0,2,0,0,0,0|2,0,0]=4 8777 B12R1.436 CNc1cncc(c1)S(=O)(=O)C 27a_100102657272_100000702611 [0,2,0,0,0,0|2,0,0]=4 8778 B12R1.436 COc1cccc(c1)C(C)(C)C 34a_100000211624_200000210301 [0,2,0,0,0,0|1,0,1]=4 8779 B12R1.436 COc1cccc(c1)C(C)(C)C 7a_100000211624_200000210301 [0,2,0,0,0,0|1,0,1]=4 8780 B12R1.436 COc1cccc(c1)C(C)(C)O 34a_200000085863_200000210301 [0,2,0,0,0,0|0,0,2]=4 8781 B12R1.436 COc1cccc(c1)C(C)(C)O 7a_200000085863_200000210301 [0,2,0,0,0,0|0,0,2]=4 8782 B12R1.436 COc1cccc(c1)S(=O)(=O)[O-] 7a_100000116945_200000210301 [0,2,0,0,0,0|2,0,0]=4 8783 B12R1.436 CS(=O)(=O)c1cccc(c1)N[13CH3] 34a_100000209861_200025704644 [0,2,0,0,0,0|1,0,0]=3 8784 B12R1.436 CS(=O)(=O)c1cccc(c1)N[13CH3] 7a_100000209861_200025704644 [0,2,0,0,0,0|1,0,0]=3 8785 B12R1.436 CS(=O)(=O)c1cccc(c1)S[13CH3] 62a_100009815773_200025704644 [0,2,0,0,0,0|1,0,0]=3 8786 B12R1.436 CS(=O)(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009815773 [0,2,0,0,0,0|1,0,0]=3 8787 B12R1.436 CS(=O)(=O)c1cccc(n1)S[13CH3] 62a_100010191205_200025704644 [0,2,0,0,0,0|2,0,0]=4 8788 B12R1.436 CS(=O)(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100010191205 [0,2,0,0,0,0|2,0,0]=4 8789 B12R1.436 CS(=O)(=O)c1ccnc(c1)S[13CH3] 62a_100016215246_200025704644 [0,2,0,0,0,0|2,0,0]=4 8790 B12R1.436 CS(=O)(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100016215246 [0,2,0,0,0,0|2,0,0]=4 8791 B12R1.436 CS(=O)(=O)c1cncc(c1)S[13CH3] 62a_100000702611_200025704644 [0,2,0,0,0,0|2,0,0]=4 8792 B12R1.436 CS(=O)(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100000702611 [0,2,0,0,0,0|2,0,0]=4 8793 B12R1.436 CSc1cc(ccn1)S(=O)(=O)C 62a_100016215246_200000210301 [0,2,0,0,0,0|2,0,0]=4 8794 B12R1.436 CSc1cc(ccn1)S(=O)(=O)C 62a_200000210301_100016215246 [0,2,0,0,0,0|2,0,0]=4 8795 B12R1.436 CSc1cccc(c1)C(C)(C)C 62a_100009816526_200000210301 [0,2,0,0,0,0|1,0,1]=4 8796 B12R1.436 CSc1cccc(c1)C(C)(C)C 62a_200000210301_100009816526 [0,2,0,0,0,0|1,0,1]=4 8797 B12R1.436 CSc1cccc(c1)C(C)(C)N 62a_100016995529_200000210301 [0,2,0,0,0,0|1,0,1]=4 8798 B12R1.436 CSc1cccc(c1)C(C)(C)N 62a_200000210301_100016995529 [0,2,0,0,0,0|1,0,1]=4 8799 B12R1.436 CSc1cccc(c1)C(C)(C)O 62a_100011346009_200000210301 [0,2,0,0,0,0|0,0,2]=4 8800 B12R1.436 CSc1cccc(c1)C(C)(C)O 62a_200000210301_100011346009 [0,2,0,0,0,0|0,0,2]=4 8801 B12R1.436 CSc1cccc(c1)C(C)(F)F 62a_100010232180_200000210301 [0,2,0,0,0,0|1,0,1]=4 8802 B12R1.436 CSc1cccc(c1)C(C)(F)F 62a_200000210301_100010232180 [0,2,0,0,0,0|1,0,1]=4 8803 B12R1.436 CSc1cccc(c1)S(=O)(=O)C 62a_100009815773_200000210301 [0,2,0,0,0,0|1,0,0]=3 8804 B12R1.436 CSc1cccc(c1)S(=O)(=O)C 62a_200000210301_100009815773 [0,2,0,0,0,0|1,0,0]=3 8805 B12R1.436 CSc1cccc(c1)S(=O)(=O)N 62a_100000164563_200000210301 [0,2,0,0,0,0|2,0,0]=4 8806 B12R1.436 CSc1cccc(c1)S(=O)(=O)N 62a_200000210301_100000164563 [0,2,0,0,0,0|2,0,0]=4 8807 B12R1.436 CSc1cccc(c1)[Si](C)(C)C 62a_100009816414_200000210301 [0,2,0,0,0,0|1,1,0]=4 8808 B12R1.436 CSc1cccc(c1)[Si](C)(C)C 62a_200000210301_100009816414 [0,2,0,0,0,0|1,1,0]=4 8809 B12R1.436 CSc1cccc(n1)S(=O)(=O)C 62a_100010191205_200000210301 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.436 CSc1cccc(n1)S(=O)(=O)C 62a_200000210301_100010191205 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.436 CSc1cncc(c1)S(=O)(=O)C 62a_100000702611_200000210301 [0,2,0,0,0,0|2,0,0]=4 8812 B12R1.436 CSc1cncc(c1)S(=O)(=O)C 62a_200000210301_100000702611 [0,2,0,0,0,0|2,0,0]=4 8813 B12R1.436 C[Si](C)(C)c1cccc(c1)S[13CH3] 62a_100009816414_200025704644 [0,2,0,0,0,0|1,1,0]=4 8814 B12R1.436 C[Si](C)(C)c1cccc(c1)S[13CH3] 62a_200025704644_100009816414 [0,2,0,0,0,0|1,1,0]=4 8815 B12R1.436 [13CH3]Nc1cccc(c1)S(=O)(=O)N 34a_100000182236_200025704644 [0,2,0,0,0,0|2,0,0]=4 8816 B12R1.436 [13CH3]Oc1cccc(c1)S(=O)(=O)[O-] 7a_100000116945_200025704644 [0,2,0,0,0,0|2,0,0]=4 8817 B12R1.436 [13CH3]Sc1cccc(c1)S(=O)(=O)N 62a_100000164563_200025704644 [0,2,0,0,0,0|2,0,0]=4 8818 B12R1.436 [13CH3]Sc1cccc(c1)S(=O)(=O)N 62a_200025704644_100000164563 [0,2,0,0,0,0|2,0,0]=4 8819 B12R1.87 C=C(C)c1cccc(c1C#N)Br 271570a_100000694244_100010071968 [0,2,0,0,0,0|2,0,0]=4 8820 B12R1.87 C=C(C)c1cccc(c1C#N)C 271570a_100000694244_100009819585 [0,2,0,0,0,0|1,0,0]=3 8821 B12R1.87 C=C(C)c1cccc(c1C#N)Cl 271570a_100000694244_200000049503 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.87 C=C(C)c1cccc(c1C#N)F 271570a_100000694244_100000699744 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.87 C=C(C)c1cccc(c1C#N)N 271570a_100000694244_100011935054 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.87 C=C(C)c1cccc(c1C#N)O 271570a_100000694244_100012180507 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.87 C=C(C)c1cccc(c1C=O)C 271570a_100000694244_100000041122 [0,2,0,0,0,0|1,0,0]=3 8826 B12R1.87 C=C(C)c1cccc(c1C=O)Cl 271570a_100000694244_100010147682 [0,2,0,0,0,0|2,0,0]=4 8827 B12R1.87 C=C(C)c1cccc(c1C=O)F 271570a_100000694244_100000210083 [0,2,0,0,0,0|2,0,0]=4 8828 B12R1.87 C=C(C)c1cccc(c1C=O)N 271570a_100000694244_100010232536 [0,2,0,0,0,0|2,0,0]=4 8829 B12R1.87 C=C(C)c1cccc(c1C=O)O 271570a_100000694244_100009814793 [0,2,0,0,0,0|2,0,0]=4 8830 B12R1.87 C=C(C)c1cccc(c1CN)F 271570a_100000694244_100012349121 [0,2,0,0,0,0|2,0,0]=4 8831 B12R1.87 C=C(C)c1cccc(c1CO)F 271570a_100000694244_100012355691 [0,2,0,0,0,0|2,0,0]=4 8832 B12R1.87 C=C(C)c1cccc(c1CO)N 271570a_100000694244_100000747656 [0,2,0,0,0,0|2,0,0]=4 8833 B12R1.87 C=C(C)c1cccc(c1NC)N 271570a_100000694244_100010510394 [0,2,0,0,0,0|2,0,0]=4 8834 B12R1.87 C=C(C)c1cccc(c1NN)F 271570a_100000694244_100016994982 [0,2,0,0,0,0|2,0,0]=4 8835 B12R1.87 C=C(C)c1cccc(c1OC)Br 271570a_100000694244_100010146560 [0,2,0,0,0,0|2,0,0]=4 8836 B12R1.87 C=C(C)c1cccc(c1OC)C 271570a_100000694244_100010141385 [0,2,0,0,0,0|1,0,0]=3 8837 B12R1.87 C=C(C)c1cccc(c1OC)Cl 271570a_100000694244_100010147678 [0,2,0,0,0,0|2,0,0]=4 8838 B12R1.87 C=C(C)c1cccc(c1OC)F 271570a_100000694244_100009816759 [0,2,0,0,0,0|2,0,0]=4 8839 B12R1.87 C=C(C)c1cccc(c1OC)N 271570a_100000694244_100011935253 [0,2,0,0,0,0|2,0,0]=4 8840 B12R1.87 C=C(C)c1cccc(c1OC)O 271570a_100000694244_100010234590 [0,2,0,0,0,0|2,0,0]=4 8841 B12R1.87 C=C(C)c1cccc(c1SC)F 271570a_100000694244_200010709249 [0,2,0,0,0,0|2,0,0]=4 8842 B12R1.87 C=C(C)c1ccnc(c1OC)C 271570a_100000694244_100000685116 [0,2,0,0,0,0|2,0,0]=4 8843 B12R1.87 C=C(C)c1cncc(c1C#N)C 271570a_100000694244_200009887794 [0,2,0,0,0,0|2,0,0]=4 8844 B12R1.87 C=C(C)c1nccc(c1C#N)C 271570a_100000694244_100000691447 [0,2,0,0,0,0|2,0,0]=4 8845 B12R1.87 C=Cc1c(cccc1C(=O)C)F 271570a_100011290941_100012362612 [0,2,0,0,0,0|1,0,0]=3 8846 B12R1.87 C=Cc1c(cccc1C(=O)N)C 271570a_100011290941_200011409216 [0,2,0,0,0,0|1,0,0]=3 8847 B12R1.87 C=Cc1c(cccc1C(=O)N)F 271570a_100011290941_200012351544 [0,2,0,0,0,0|2,0,0]=4 8848 B12R1.87 CC(=O)c1cccc(c1C#N)F 1458a_100000702252_200000210301 [0,2,0,0,0,0|1,0,0]=3 8849 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 34a_100009847209_200025704644 [0,2,0,0,0,0|0,0,0]=2 8850 B12R1.87 CC(=O)c1cccc(c1O[13CH3])C 7a_100009847209_200025704644 [0,2,0,0,0,0|0,0,0]=2 8851 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 34a_100000043392_200025704644 [0,2,0,0,0,0|1,0,0]=3 8852 B12R1.87 CC(=O)c1cccc(c1O[13CH3])Cl 7a_100000043392_200025704644 [0,2,0,0,0,0|1,0,0]=3 8853 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 34a_100011246037_200025704644 [0,2,0,0,0,0|1,0,0]=3 8854 B12R1.87 CC(=O)c1cccc(c1O[13CH3])F 7a_100011246037_200025704644 [0,2,0,0,0,0|1,0,0]=3 8855 B12R1.87 CC(=O)c1cccc(c1S[13CH3])F 62a_100012362612_200025704644 [0,2,0,0,0,0|1,0,0]=3 8856 B12R1.87 CC(=O)c1cccc(c1S[13CH3])F 62a_200025704644_100012362612 [0,2,0,0,0,0|1,0,0]=3 8857 B12R1.87 CCc1c(cccc1C(=O)C)Br 1458a_100010125490_200000210301 [0,2,0,0,0,0|1,0,0]=3 8858 B12R1.87 CCc1c(cccc1C(=O)[13CH3])Br 1458a_100010125490_200025704644 [0,2,0,0,0,0|1,0,0]=3 8859 B12R1.87 CNc1c(cccc1C(=O)N)C 34a_100000223273_200000210301 [0,2,0,0,0,0|1,0,0]=3 8860 B12R1.87 CNc1c(cccc1C(=O)N)Cl 34a_200011997947_200000210301 [0,2,0,0,0,0|2,0,0]=4 8861 B12R1.87 CNc1c(cccc1C(=O)N)F 34a_100011722151_200000210301 [0,2,0,0,0,0|2,0,0]=4 8862 B12R1.87 CNc1c(cccc1C(C)C)C 2230a_100138557336_200000210301 [0,2,0,0,0,0|1,0,1]=4 8863 B12R1.87 CNc1c(cccc1C(C)C)C 34a_100138557336_200000210301 [0,2,0,0,0,0|1,0,1]=4 8864 B12R1.87 CNc1c(cccc1C(C)C)C 7a_100138557336_200000210301 [0,2,0,0,0,0|1,0,1]=4 8865 B12R1.87 COc1c(cccc1C(=O)C)Br 1458a_100000689802_200000210301 [0,2,0,0,0,0|1,0,0]=3 8866 B12R1.87 COc1c(cccc1C(=O)C)C 1458a_100000187929_200000210301 [0,2,0,0,0,0|0,0,0]=2 8867 B12R1.87 COc1c(cccc1C(=O)C)C 34a_100009847209_200000210301 [0,2,0,0,0,0|0,0,0]=2 8868 B12R1.87 COc1c(cccc1C(=O)C)C 7a_100009847209_200000210301 [0,2,0,0,0,0|0,0,0]=2 8869 B12R1.87 COc1c(cccc1C(=O)C)Cl 1458a_100011934004_200000210301 [0,2,0,0,0,0|1,0,0]=3 8870 B12R1.87 COc1c(cccc1C(=O)C)Cl 34a_100000043392_200000210301 [0,2,0,0,0,0|1,0,0]=3 8871 B12R1.87 COc1c(cccc1C(=O)C)Cl 7a_100000043392_200000210301 [0,2,0,0,0,0|1,0,0]=3 8872 B12R1.87 COc1c(cccc1C(=O)C)F 1458a_100011218433_200000210301 [0,2,0,0,0,0|1,0,0]=3 8873 B12R1.87 COc1c(cccc1C(=O)C)F 34a_100011246037_200000210301 [0,2,0,0,0,0|1,0,0]=3 8874 B12R1.87 COc1c(cccc1C(=O)C)F 7a_100011246037_200000210301 [0,2,0,0,0,0|1,0,0]=3 8875 B12R1.87 COc1c(cccc1C(=O)C)O 1458a_100000080799_200000210301 [0,2,0,0,0,0|1,0,0]=3 8876 B12R1.87 COc1c(cccc1C(=O)C)O 271570a_203496583355_100010725610 [0,2,0,0,0,0|1,0,0]=3 8877 B12R1.87 COc1c(cccc1C(=O)N)Cl 34a_100009868166_200000210301 [0,2,0,0,0,0|2,0,0]=4 8878 B12R1.87 COc1c(cccc1C(=O)N)Cl 7a_100009868166_200000210301 [0,2,0,0,0,0|2,0,0]=4 8879 B12R1.87 COc1c(cccc1C(=O)N)F 34a_100009886295_200000210301 [0,2,0,0,0,0|2,0,0]=4 8880 B12R1.87 COc1c(cccc1C(=O)N)F 7a_100009886295_200000210301 [0,2,0,0,0,0|2,0,0]=4 8881 B12R1.87 COc1c(cccc1C(=O)N)O 271570a_203496583355_100010146779 [0,2,0,0,0,0|2,0,0]=4 8882 B12R1.87 COc1c(cccc1C(=O)[13CH3])Br 1458a_100000689802_200025704644 [0,2,0,0,0,0|1,0,0]=3 8883 B12R1.87 COc1c(cccc1C(=O)[13CH3])C 1458a_100000187929_200025704644 [0,2,0,0,0,0|0,0,0]=2 8884 B12R1.87 COc1c(cccc1C(=O)[13CH3])Cl 1458a_100011934004_200025704644 [0,2,0,0,0,0|1,0,0]=3 8885 B12R1.87 COc1c(cccc1C(=O)[13CH3])F 1458a_100011218433_200025704644 [0,2,0,0,0,0|1,0,0]=3 8886 B12R1.87 COc1c(cccc1C(=O)[13CH3])O 1458a_100000080799_200025704644 [0,2,0,0,0,0|1,0,0]=3 8887 B12R1.87 COc1c(cccc1[N+](=O)[O-])C 34a_100000763257_200000210301 [0,2,0,0,0,0|2,0,0]=4 8888 B12R1.87 COc1c(cccc1[N+](=O)[O-])C 7a_100000763257_200000210301 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.87 CSc1c(cccc1C(=O)C)F 62a_100012362612_200000210301 [0,2,0,0,0,0|1,0,0]=3 8890 B12R1.87 CSc1c(cccc1C(=O)C)F 62a_200000210301_100012362612 [0,2,0,0,0,0|1,0,0]=3 8891 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200000210301_200011409216 [0,2,0,0,0,0|1,0,0]=3 8892 B12R1.87 CSc1c(cccc1C(=O)N)C 62a_200011409216_200000210301 [0,2,0,0,0,0|1,0,0]=3 8893 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200000210301_200012351544 [0,2,0,0,0,0|2,0,0]=4 8894 B12R1.87 CSc1c(cccc1C(=O)N)F 62a_200012351544_200000210301 [0,2,0,0,0,0|2,0,0]=4 8895 B12R1.87 Cc1cccc(c1N[13CH3])C(=O)N 34a_100000223273_200025704644 [0,2,0,0,0,0|1,0,0]=3 8896 B12R1.87 Cc1cccc(c1N[13CH3])C(C)C 2230a_100138557336_200025704644 [0,2,0,0,0,0|1,0,1]=4 8897 B12R1.87 Cc1cccc(c1N[13CH3])C(C)C 34a_100138557336_200025704644 [0,2,0,0,0,0|1,0,1]=4 8898 B12R1.87 Cc1cccc(c1N[13CH3])C(C)C 7a_100138557336_200025704644 [0,2,0,0,0,0|1,0,1]=4 8899 B12R1.87 Cc1cccc(c1O[13CH3])[N+](=O)[O-] 34a_100000763257_200025704644 [0,2,0,0,0,0|2,0,0]=4 8900 B12R1.87 Cc1cccc(c1O[13CH3])[N+](=O)[O-] 7a_100000763257_200025704644 [0,2,0,0,0,0|2,0,0]=4 8901 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200011409216_200025704644 [0,2,0,0,0,0|1,0,0]=3 8902 B12R1.87 Cc1cccc(c1S[13CH3])C(=O)N 62a_200025704644_200011409216 [0,2,0,0,0,0|1,0,0]=3 8903 B12R1.87 [13CH3]C(=O)c1cccc(c1C#N)F 1458a_100000702252_200025704644 [0,2,0,0,0,0|1,0,0]=3 8904 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)Cl 34a_200011997947_200025704644 [0,2,0,0,0,0|2,0,0]=4 8905 B12R1.87 [13CH3]Nc1c(cccc1C(=O)N)F 34a_100011722151_200025704644 [0,2,0,0,0,0|2,0,0]=4 8906 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 34a_100009868166_200025704644 [0,2,0,0,0,0|2,0,0]=4 8907 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)Cl 7a_100009868166_200025704644 [0,2,0,0,0,0|2,0,0]=4 8908 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 34a_100009886295_200025704644 [0,2,0,0,0,0|2,0,0]=4 8909 B12R1.87 [13CH3]Oc1c(cccc1C(=O)N)F 7a_100009886295_200025704644 [0,2,0,0,0,0|2,0,0]=4 8910 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200012351544_200025704644 [0,2,0,0,0,0|2,0,0]=4 8911 B12R1.87 [13CH3]Sc1c(cccc1C(=O)N)F 62a_200025704644_200012351544 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.440 C=C(C)c1cccc(c1Br)CO 271570a_100000694244_100010240205 [0,2,0,0,0,0|1,0,0]=3 8913 B12R1.440 C=C(C)c1cccc(c1C)C#N 271570a_100000694244_100000721996 [0,2,0,0,0,0|1,0,1]=4 8914 B12R1.440 C=C(C)c1cccc(c1C)C=O 271570a_100000694244_100012179384 [0,2,0,0,0,0|1,0,1]=4 8915 B12R1.440 C=C(C)c1cccc(c1C)CN 271570a_100000694244_100000724210 [0,2,0,0,0,0|1,0,0]=3 8916 B12R1.440 C=C(C)c1cccc(c1C)CO 271570a_100000694244_100000694458 [0,2,0,0,0,0|1,0,0]=3 8917 B12R1.440 C=C(C)c1cccc(c1C)OC 271570a_100000694244_100010002647 [0,2,0,0,0,0|1,0,0]=3 8918 B12R1.440 C=C(C)c1cccc(c1Cl)OC 271570a_100000694244_100010147677 [0,2,0,0,0,0|1,0,0]=3 8919 B12R1.440 C=C(C)c1cccc(c1F)C#N 271570a_100000694244_100011934600 [0,2,0,0,0,0|1,0,1]=4 8920 B12R1.440 C=C(C)c1cccc(c1F)C=O 271570a_100000694244_100000766533 [0,2,0,0,0,0|1,0,1]=4 8921 B12R1.440 C=C(C)c1cccc(c1F)CN 271570a_100000694244_100015189953 [0,2,0,0,0,0|1,0,0]=3 8922 B12R1.440 C=C(C)c1cccc(c1F)CO 271570a_100000694244_100011935076 [0,2,0,0,0,0|1,0,0]=3 8923 B12R1.440 C=C(C)c1cccc(c1F)OC 271570a_100000694244_100010185846 [0,2,0,0,0,0|1,0,0]=3 8924 B12R1.440 C=C(C)c1cccc(c1N)C#N 271570a_100000694244_100000690598 [0,2,0,0,0,0|1,0,1]=4 8925 B12R1.440 C=C(C)c1cccc(c1N)C=O 271570a_100000694244_100010144990 [0,2,0,0,0,0|1,0,1]=4 8926 B12R1.440 C=C(C)c1cccc(c1N)CO 271570a_100000694244_100012349457 [0,2,0,0,0,0|1,0,0]=3 8927 B12R1.440 C=C(C)c1cccc(c1N)NC 271570a_100000694244_100000695761 [0,2,0,0,0,0|1,0,0]=3 8928 B12R1.440 C=C(C)c1cccc(c1N)OC 271570a_100000694244_100000708083 [0,2,0,0,0,0|1,0,0]=3 8929 B12R1.440 C=C(C)c1cccc(c1O)C#N 271570a_100000694244_100009817103 [0,2,0,0,0,0|1,0,1]=4 8930 B12R1.440 C=C(C)c1cccc(c1O)C=O 271570a_100000694244_100000737635 [0,2,0,0,0,0|1,0,1]=4 8931 B12R1.440 C=C(C)c1cccc(c1O)CC 271570a_100000694244_200010001580 [0,2,0,0,0,0|1,0,0]=3 8932 B12R1.440 C=C(C)c1cccc(c1O)OC 271570a_100000694244_100000686866 [0,2,0,0,0,0|1,0,0]=3 8933 B12R1.440 C=C(C)c1ccnc(c1C)OC 271570a_100000694244_100010068544 [0,2,0,0,0,0|2,0,0]=4 8934 B12R1.440 C=C(C)c1ccnc(c1F)OC 271570a_100000694244_100009885657 [0,2,0,0,0,0|2,0,0]=4 8935 B12R1.440 C=C(C)c1cncc(c1C)OC 271570a_100000694244_100010136163 [0,2,0,0,0,0|2,0,0]=4 8936 B12R1.440 C=C(C)c1cncc(c1N)CO 271570a_100000694244_200010988789 [0,2,0,0,0,0|2,0,0]=4 8937 B12R1.440 C=C(C)c1nccc(c1C)OC 271570a_100000694244_100010067686 [0,2,0,0,0,0|2,0,0]=4 8938 B12R1.440 C=C(C)c1nccc(c1F)CO 271570a_100000694244_100000101314 [0,2,0,0,0,0|2,0,0]=4 8939 B12R1.440 C=C(C)c1nccc(c1F)OC 271570a_100000694244_200010136267 [0,2,0,0,0,0|2,0,0]=4 8940 B12R1.440 C=C(C)c1nccc(c1F)SC 271570a_100000694244_200021123860 [0,2,0,0,0,0|2,0,0]=4 8941 B12R1.440 C=C(C)c1nccc(c1N)NC 271570a_100000694244_200000076579 [0,2,0,0,0,0|2,0,0]=4 8942 B12R1.440 C=C(C)c1nccc(c1N)OC 271570a_100000694244_100000100113 [0,2,0,0,0,0|2,0,0]=4 8943 B12R1.440 C=Cc1cccc(c1C)C(=O)C 271570a_100011290941_100012706834 [0,2,0,0,0,0|0,0,1]=3 8944 B12R1.440 C=Cc1cccc(c1C)C(=O)N 271570a_100011290941_200012298201 [0,2,0,0,0,0|1,0,1]=4 8945 B12R1.440 C=Cc1cccc(c1F)C(=O)C 271570a_100011290941_100012355707 [0,2,0,0,0,0|0,0,1]=3 8946 B12R1.440 C=Cc1cccc(c1F)C(=O)N 271570a_100011290941_100012351131 [0,2,0,0,0,0|1,0,1]=4 8947 B12R1.440 C=Cc1cccc(c1N)C(=O)N 271570a_100011290941_100010144993 [0,2,0,0,0,0|1,0,1]=4 8948 B12R1.440 C=Cc1cccc(c1O)C(=O)C 271570a_100011290941_100009815558 [0,2,0,0,0,0|0,0,1]=3 8949 B12R1.440 C=Cc1ccnc(c1F)C(=O)C 271570a_100011290941_100010729024 [0,2,0,0,0,0|1,0,1]=4 8950 B12R1.440 C=Cc1nccc(c1N)C(=O)C 271570a_100011290941_200000063496 [0,2,0,0,0,0|1,0,1]=4 8951 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [0,2,0,0,0,0|0,0,0]=2 8952 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [0,2,0,0,0,0|0,0,0]=2 8953 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_100012706834_200025704644 [0,2,0,0,0,0|0,0,0]=2 8954 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012706834 [0,2,0,0,0,0|0,0,0]=2 8955 B12R1.440 CC(=O)c1cccc(c1Cl)C#N 1458a_100009860865_200000210301 [0,2,0,0,0,0|0,0,1]=3 8956 B12R1.440 CC(=O)c1cccc(c1F)C#N 1458a_100011999812_200000210301 [0,2,0,0,0,0|0,0,1]=3 8957 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [0,2,0,0,0,0|0,0,0]=2 8958 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [0,2,0,0,0,0|0,0,0]=2 8959 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_100012355707_200025704644 [0,2,0,0,0,0|0,0,0]=2 8960 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355707 [0,2,0,0,0,0|0,0,0]=2 8961 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [0,2,0,0,0,0|0,0,0]=2 8962 B12R1.440 CC(=O)c1cccc(c1O)C#N 1458a_100009886288_200000210301 [0,2,0,0,0,0|0,0,1]=3 8963 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200000063496_200025704644 [0,2,0,0,0,0|1,0,0]=3 8964 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200025704644_200000063496 [0,2,0,0,0,0|1,0,0]=3 8965 B12R1.440 CC(=O)c1nccc(c1F)S[13CH3] 62a_100010729024_200025704644 [0,2,0,0,0,0|1,0,0]=3 8966 B12R1.440 CC(=O)c1nccc(c1F)S[13CH3] 62a_200025704644_100010729024 [0,2,0,0,0,0|1,0,0]=3 8967 B12R1.440 CC(C)c1cccc(c1F)N[13CH3] 34a_100021981578_200025704644 [0,2,0,0,0,0|1,0,1]=4 8968 B12R1.440 CC(C)c1cccc(c1F)N[13CH3] 7a_100021981578_200025704644 [0,2,0,0,0,0|1,0,1]=4 8969 B12R1.440 CC(C)c1cccc(c1N)S[13CH3] 62a_100010571509_200025704644 [0,2,0,0,0,0|1,0,1]=4 8970 B12R1.440 CC(C)c1cccc(c1N)S[13CH3] 62a_200025704644_100010571509 [0,2,0,0,0,0|1,0,1]=4 8971 B12R1.440 CC(O)c1cccc(c1F)S[13CH3] 62a_200012356376_200025704644 [0,2,0,0,0,0|0,0,2]=4 8972 B12R1.440 CC(O)c1cccc(c1F)S[13CH3] 62a_200025704644_200012356376 [0,2,0,0,0,0|0,0,2]=4 8973 B12R1.440 CNc1cccc(c1C)C(=O)N 34a_100000738810_200000210301 [0,2,0,0,0,0|1,0,0]=3 8974 B12R1.440 CNc1cccc(c1C)C(=O)N 7a_100000738810_200000210301 [0,2,0,0,0,0|1,0,0]=3 8975 B12R1.440 CNc1cccc(c1F)C(=O)N 34a_100014075672_200000210301 [0,2,0,0,0,0|1,0,0]=3 8976 B12R1.440 CNc1cccc(c1F)C(C)C 34a_100021981578_200000210301 [0,2,0,0,0,0|1,0,1]=4 8977 B12R1.440 CNc1cccc(c1F)C(C)C 7a_100021981578_200000210301 [0,2,0,0,0,0|1,0,1]=4 8978 B12R1.440 CNc1cccc(c1F)[N+](=O)[O-] 34a_100000055607_200000210301 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [0,2,0,0,0,0|0,0,0]=2 8980 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [0,2,0,0,0,0|0,0,0]=2 8981 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200000210301 [0,2,0,0,0,0|2,0,0]=4 8982 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200000210301 [0,2,0,0,0,0|2,0,0]=4 8983 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [0,2,0,0,0,0|0,0,0]=2 8984 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [0,2,0,0,0,0|0,0,0]=2 8985 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [0,2,0,0,0,0|0,0,0]=2 8986 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [0,2,0,0,0,0|0,0,0]=2 8987 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 34a_100000740326_200000210301 [0,2,0,0,0,0|2,0,0]=4 8988 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 7a_100000740326_200000210301 [0,2,0,0,0,0|2,0,0]=4 8989 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [0,2,0,0,0,0|0,0,0]=2 8990 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [0,2,0,0,0,0|0,0,0]=2 8991 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200000210301 [0,2,0,0,0,0|2,0,0]=4 8992 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200000210301 [0,2,0,0,0,0|2,0,0]=4 8993 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [0,2,0,0,0,0|0,0,0]=2 8994 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [0,2,0,0,0,0|0,0,0]=2 8995 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [0,2,0,0,0,0|0,0,0]=2 8996 B12R1.440 COc1cccc(c1F)C(=O)N 34a_100009841371_200000210301 [0,2,0,0,0,0|1,0,0]=3 8997 B12R1.440 COc1cccc(c1F)C(=O)N 7a_100009841371_200000210301 [0,2,0,0,0,0|1,0,0]=3 8998 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [0,2,0,0,0,0|0,0,0]=2 8999 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200000210301 [0,2,0,0,0,0|2,0,0]=4 9000 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200000210301 [0,2,0,0,0,0|2,0,0]=4 9001 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [0,2,0,0,0,0|0,0,0]=2 9002 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [0,2,0,0,0,0|0,0,0]=2 9003 B12R1.440 COc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200000210301 [0,2,0,0,0,0|2,0,0]=4 9004 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [0,2,0,0,0,0|0,0,0]=2 9005 B12R1.440 COc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200000210301 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [0,2,0,0,0,0|0,0,0]=2 9007 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [0,2,0,0,0,0|0,0,0]=2 9008 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_100012706834_200000210301 [0,2,0,0,0,0|0,0,0]=2 9009 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_200000210301_100012706834 [0,2,0,0,0,0|0,0,0]=2 9010 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200000210301_200012298201 [0,2,0,0,0,0|1,0,0]=3 9011 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200012298201_200000210301 [0,2,0,0,0,0|1,0,0]=3 9012 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_100012355707_200000210301 [0,2,0,0,0,0|0,0,0]=2 9013 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_200000210301_100012355707 [0,2,0,0,0,0|0,0,0]=2 9014 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_100012351131_200000210301 [0,2,0,0,0,0|1,0,0]=3 9015 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_200000210301_100012351131 [0,2,0,0,0,0|1,0,0]=3 9016 B12R1.440 CSc1cccc(c1F)C(C)O 62a_200000210301_200012356376 [0,2,0,0,0,0|0,0,2]=4 9017 B12R1.440 CSc1cccc(c1F)C(C)O 62a_200012356376_200000210301 [0,2,0,0,0,0|0,0,2]=4 9018 B12R1.440 CSc1cccc(c1N)C(=O)N 62a_100010144993_200000210301 [0,2,0,0,0,0|1,0,0]=3 9019 B12R1.440 CSc1cccc(c1N)C(C)C 62a_100010571509_200000210301 [0,2,0,0,0,0|1,0,1]=4 9020 B12R1.440 CSc1cccc(c1N)C(C)C 62a_200000210301_100010571509 [0,2,0,0,0,0|1,0,1]=4 9021 B12R1.440 CSc1ccnc(c1F)C(=O)C 62a_100010729024_200000210301 [0,2,0,0,0,0|1,0,0]=3 9022 B12R1.440 CSc1ccnc(c1F)C(=O)C 62a_200000210301_100010729024 [0,2,0,0,0,0|1,0,0]=3 9023 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000063496_200000210301 [0,2,0,0,0,0|1,0,0]=3 9024 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000210301_200000063496 [0,2,0,0,0,0|1,0,0]=3 9025 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_100000080204_200000210301 [0,2,0,0,0,0|2,0,0]=4 9026 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_200000210301_100000080204 [0,2,0,0,0,0|2,0,0]=4 9027 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 34a_100000738810_200025704644 [0,2,0,0,0,0|1,0,0]=3 9028 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 7a_100000738810_200025704644 [0,2,0,0,0,0|1,0,0]=3 9029 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200012298201_200025704644 [0,2,0,0,0,0|1,0,0]=3 9030 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200025704644_200012298201 [0,2,0,0,0,0|1,0,0]=3 9031 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 34a_100000740326_200025704644 [0,2,0,0,0,0|2,0,0]=4 9032 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 7a_100000740326_200025704644 [0,2,0,0,0,0|2,0,0]=4 9033 B12R1.440 [13CH3]C(=O)c1cccc(c1Cl)C#N 1458a_100009860865_200025704644 [0,2,0,0,0,0|0,0,1]=3 9034 B12R1.440 [13CH3]C(=O)c1cccc(c1F)C#N 1458a_100011999812_200025704644 [0,2,0,0,0,0|0,0,1]=3 9035 B12R1.440 [13CH3]C(=O)c1cccc(c1O)C#N 1458a_100009886288_200025704644 [0,2,0,0,0,0|0,0,1]=3 9036 B12R1.440 [13CH3]Nc1cccc(c1F)C(=O)N 34a_100014075672_200025704644 [0,2,0,0,0,0|1,0,0]=3 9037 B12R1.440 [13CH3]Nc1cccc(c1F)[N+](=O)[O-] 34a_100000055607_200025704644 [0,2,0,0,0,0|2,0,0]=4 9038 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200025704644 [0,2,0,0,0,0|2,0,0]=4 9039 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200025704644 [0,2,0,0,0,0|2,0,0]=4 9040 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200025704644 [0,2,0,0,0,0|2,0,0]=4 9041 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200025704644 [0,2,0,0,0,0|2,0,0]=4 9042 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 34a_100009841371_200025704644 [0,2,0,0,0,0|1,0,0]=3 9043 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 7a_100009841371_200025704644 [0,2,0,0,0,0|1,0,0]=3 9044 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200025704644 [0,2,0,0,0,0|2,0,0]=4 9045 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200025704644 [0,2,0,0,0,0|2,0,0]=4 9046 B12R1.440 [13CH3]Oc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200025704644 [0,2,0,0,0,0|2,0,0]=4 9047 B12R1.440 [13CH3]Oc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200025704644 [0,2,0,0,0,0|2,0,0]=4 9048 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_100012351131_200025704644 [0,2,0,0,0,0|1,0,0]=3 9049 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_200025704644_100012351131 [0,2,0,0,0,0|1,0,0]=3 9050 B12R1.440 [13CH3]Sc1cccc(c1N)C(=O)N 62a_100010144993_200025704644 [0,2,0,0,0,0|1,0,0]=3 9051 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_100000080204_200025704644 [0,2,0,0,0,0|2,0,0]=4 9052 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_200025704644_100000080204 [0,2,0,0,0,0|2,0,0]=4 9053 B12R1.894 C=C(C)c1c(ccc(c1C)F)C 271570a_100000694244_100011068659 [0,2,0,0,0,0|2,0,0]=4 9054 B12R1.894 C=C(C)c1c(ccc(c1C)F)F 271570a_100000694244_100010167959 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.894 C=C(C)c1c(ccc(c1C)N)C 271570a_100000694244_106354213274 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.894 C=C(C)c1c(ccc(c1C)O)C 271570a_100000694244_100010659238 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.894 C=C(C)c1c(ccc(c1Cl)Br)N 271570a_100000694244_200010779962 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)Cl 271570a_100000694244_200010170825 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)F 271570a_100000694244_200015697950 [0,2,0,0,0,0|2,0,0]=4 9060 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)N 271570a_100000694244_200011093878 [0,2,0,0,0,0|2,0,0]=4 9061 B12R1.894 C=C(C)c1c(ccc(c1Cl)F)Br 271570a_100000694244_200037249116 [0,2,0,0,0,0|2,0,0]=4 9062 B12R1.894 C=C(C)c1c(ccc(c1Cl)F)F 271570a_100000694244_100010167948 [0,2,0,0,0,0|2,0,0]=4 9063 B12R1.894 C=C(C)c1c(ccc(c1F)Br)Cl 271570a_100000694244_100011092007 [0,2,0,0,0,0|2,0,0]=4 9064 B12R1.894 C=C(C)c1c(ccc(c1F)Br)F 271570a_100000694244_100000722365 [0,2,0,0,0,0|2,0,0]=4 9065 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)Br 271570a_100000694244_100011084128 [0,2,0,0,0,0|2,0,0]=4 9066 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)F 271570a_100000694244_200010167938 [0,2,0,0,0,0|2,0,0]=4 9067 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)N 271570a_100000694244_100010134325 [0,2,0,0,0,0|2,0,0]=4 9068 B12R1.894 C=C(C)c1c(ccc(c1F)F)F 271570a_100000694244_100009814005 [0,2,0,0,0,0|2,0,0]=4 9069 B12R1.894 C=C(C)c1c(ccc(c1F)F)N 271570a_100000694244_100010232473 [0,2,0,0,0,0|2,0,0]=4 9070 B12R1.894 C=C(C)c1c(ccc(c1F)N)F 271570a_100000694244_100010070858 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.894 C=C(C)c1c(ccc(c1N)F)F 271570a_100000694244_100014094178 [0,2,0,0,0,0|2,0,0]=4 9072 B12R1.894 C=C(C)c1c(ccc(c1N)N)F 271570a_100000694244_100010128261 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.894 C=C(C)c1c(ccc(c1O)F)C 271570a_100000694244_200010223207 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.894 C=C(C)c1c(ccc(c1O)F)F 271570a_100000694244_100010170822 [0,2,0,0,0,0|2,0,0]=4 9075 B12R1.894 CC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_200000210301 [0,2,0,0,0,0|0,0,0]=2 9076 B12R1.894 CC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200000210301 [0,2,0,0,0,0|1,0,0]=3 9077 B12R1.894 CC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_200000210301 [0,2,0,0,0,0|1,0,0]=3 9078 B12R1.894 CC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_200000210301 [0,2,0,0,0,0|1,0,0]=3 9079 B12R1.894 CC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_200000210301 [0,2,0,0,0,0|1,0,0]=3 9080 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200000210301 [0,2,0,0,0,0|1,0,0]=3 9081 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200000210301 [0,2,0,0,0,0|1,0,0]=3 9082 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_200000210301 [0,2,0,0,0,0|0,0,0]=2 9083 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_200000210301 [0,2,0,0,0,0|0,0,0]=2 9084 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200000210301 [0,2,0,0,0,0|1,0,0]=3 9085 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200000210301 [0,2,0,0,0,0|1,0,0]=3 9086 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200000210301 [0,2,0,0,0,0|1,0,0]=3 9087 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200000210301 [0,2,0,0,0,0|1,0,0]=3 9088 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200000210301 [0,2,0,0,0,0|1,0,0]=3 9089 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200000210301 [0,2,0,0,0,0|1,0,0]=3 9090 B12R1.894 CC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200000210301 [0,2,0,0,0,0|1,0,0]=3 9091 B12R1.894 CC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_200000210301 [0,2,0,0,0,0|0,0,0]=2 9092 B12R1.894 CC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_200000210301 [0,2,0,0,0,0|0,0,0]=2 9093 B12R1.894 CC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_200000210301 [0,2,0,0,0,0|0,0,0]=2 9094 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200000210301 [0,2,0,0,0,0|1,0,0]=3 9095 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200000210301 [0,2,0,0,0,0|1,0,0]=3 9096 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200000210301 [0,2,0,0,0,0|1,0,0]=3 9097 B12R1.894 CC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200000210301 [0,2,0,0,0,0|1,0,0]=3 9098 B12R1.894 CC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200000210301 [0,2,0,0,0,0|1,0,0]=3 9099 B12R1.894 CC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200000210301 [0,2,0,0,0,0|1,0,0]=3 9100 B12R1.894 CC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200000210301 [0,2,0,0,0,0|1,0,0]=3 9101 B12R1.894 CC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200000210301 [0,2,0,0,0,0|1,0,0]=3 9102 B12R1.894 CC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200000210301 [0,2,0,0,0,0|1,0,0]=3 9103 B12R1.894 CC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200000210301 [0,2,0,0,0,0|1,0,0]=3 9104 B12R1.894 CC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200000210301 [0,2,0,0,0,0|1,0,0]=3 9105 B12R1.894 CC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200000210301 [0,2,0,0,0,0|1,0,0]=3 9106 B12R1.894 CC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200000210301 [0,2,0,0,0,0|1,0,0]=3 9107 B12R1.894 CC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_200000210301 [0,2,0,0,0,0|0,0,0]=2 9108 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200000210301 [0,2,0,0,0,0|1,0,0]=3 9109 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200000210301 [0,2,0,0,0,0|1,0,0]=3 9110 B12R1.894 CC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200000210301 [0,2,0,0,0,0|1,0,0]=3 9111 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])Br)F 1458a_100010768524_200025704644 [0,2,0,0,0,0|1,0,0]=3 9112 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])F)Br 1458a_100010768519_200025704644 [0,2,0,0,0,0|1,0,0]=3 9113 B12R1.894 Cc1ccc(c(c1Br)C(=O)[13CH3])F 1458a_100000720849_200025704644 [0,2,0,0,0,0|0,0,0]=2 9114 B12R1.894 Cc1ccc(c(c1C(=O)[13CH3])C)Br 1458a_100012355652_200025704644 [0,2,0,0,0,0|1,0,0]=3 9115 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])Br 1458a_200010769262_200025704644 [0,2,0,0,0,0|0,0,0]=2 9116 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000036856_200025704644 [0,2,0,0,0,0|0,0,0]=2 9117 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010271678_200025704644 [0,2,0,0,0,0|0,0,0]=2 9118 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000039063_200025704644 [0,2,0,0,0,0|0,0,0]=2 9119 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000692215_200025704644 [0,2,0,0,0,0|0,0,0]=2 9120 B12R1.894 Cc1ccc(c(c1O)C(=O)[13CH3])C 1458a_100011255215_200025704644 [0,2,0,0,0,0|0,0,0]=2 9121 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200025704644 [0,2,0,0,0,0|1,0,0]=3 9122 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200025704644 [0,2,0,0,0,0|1,0,0]=3 9123 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200025704644 [0,2,0,0,0,0|1,0,0]=3 9124 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200025704644 [0,2,0,0,0,0|1,0,0]=3 9125 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200025704644 [0,2,0,0,0,0|1,0,0]=3 9126 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200025704644 [0,2,0,0,0,0|1,0,0]=3 9127 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200025704644 [0,2,0,0,0,0|1,0,0]=3 9128 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200025704644 [0,2,0,0,0,0|1,0,0]=3 9129 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200025704644 [0,2,0,0,0,0|1,0,0]=3 9130 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200025704644 [0,2,0,0,0,0|1,0,0]=3 9131 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200025704644 [0,2,0,0,0,0|1,0,0]=3 9132 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200025704644 [0,2,0,0,0,0|1,0,0]=3 9133 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200025704644 [0,2,0,0,0,0|1,0,0]=3 9134 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200025704644 [0,2,0,0,0,0|1,0,0]=3 9135 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200025704644 [0,2,0,0,0,0|1,0,0]=3 9136 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200025704644 [0,2,0,0,0,0|1,0,0]=3 9137 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200025704644 [0,2,0,0,0,0|1,0,0]=3 9138 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200025704644 [0,2,0,0,0,0|1,0,0]=3 9139 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200025704644 [0,2,0,0,0,0|1,0,0]=3 9140 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200025704644 [0,2,0,0,0,0|1,0,0]=3 9141 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200025704644 [0,2,0,0,0,0|1,0,0]=3 9142 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200025704644 [0,2,0,0,0,0|1,0,0]=3 9143 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200025704644 [0,2,0,0,0,0|1,0,0]=3 9144 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200025704644 [0,2,0,0,0,0|1,0,0]=3 9145 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200025704644 [0,2,0,0,0,0|1,0,0]=3 9146 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200025704644 [0,2,0,0,0,0|1,0,0]=3 9147 B12R1.46 C=C(C)c1cc(ccc1C#N)Br 271570a_100000694244_100010214477 [0,2,0,0,0,0|2,0,0]=4 9148 B12R1.46 C=C(C)c1cc(ccc1C#N)C 271570a_100000694244_100000693804 [0,2,0,0,0,0|1,0,0]=3 9149 B12R1.46 C=C(C)c1cc(ccc1C#N)Cl 271570a_100000694244_100012355178 [0,2,0,0,0,0|2,0,0]=4 9150 B12R1.46 C=C(C)c1cc(ccc1C#N)F 271570a_100000694244_100000747196 [0,2,0,0,0,0|2,0,0]=4 9151 B12R1.46 C=C(C)c1cc(ccc1C#N)N 271570a_100000694244_100000689153 [0,2,0,0,0,0|2,0,0]=4 9152 B12R1.46 C=C(C)c1cc(ccc1C#N)O 271570a_100000694244_100012184851 [0,2,0,0,0,0|2,0,0]=4 9153 B12R1.46 C=C(C)c1cc(ccc1C=O)Br 271570a_100000694244_100010146562 [0,2,0,0,0,0|2,0,0]=4 9154 B12R1.46 C=C(C)c1cc(ccc1C=O)C 271570a_100000694244_100000692596 [0,2,0,0,0,0|1,0,0]=3 9155 B12R1.46 C=C(C)c1cc(ccc1C=O)F 271570a_100000694244_100000752949 [0,2,0,0,0,0|2,0,0]=4 9156 B12R1.46 C=C(C)c1cc(ccc1C=O)O 271570a_100000694244_100011236494 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.46 C=C(C)c1cc(ccc1CN)F 271570a_100000694244_100000708791 [0,2,0,0,0,0|2,0,0]=4 9158 B12R1.46 C=C(C)c1cc(ccc1CO)Br 271570a_100000694244_100010146605 [0,2,0,0,0,0|2,0,0]=4 9159 B12R1.46 C=C(C)c1cc(ccc1CO)Cl 271570a_100000694244_100000722340 [0,2,0,0,0,0|2,0,0]=4 9160 B12R1.46 C=C(C)c1cc(ccc1CO)F 271570a_100000694244_100000744086 [0,2,0,0,0,0|2,0,0]=4 9161 B12R1.46 C=C(C)c1cc(ccc1CO)O 271570a_100000694244_100010146404 [0,2,0,0,0,0|2,0,0]=4 9162 B12R1.46 C=C(C)c1cc(ccc1NC)C 271570a_100000694244_100000221369 [0,2,0,0,0,0|1,0,0]=3 9163 B12R1.46 C=C(C)c1cc(ccc1NC)F 271570a_100000694244_100011246292 [0,2,0,0,0,0|2,0,0]=4 9164 B12R1.46 C=C(C)c1cc(ccc1NC)F 34a_100009961556_200000210301 [0,2,0,0,0,0|2,0,0]=4 9165 B12R1.46 C=C(C)c1cc(ccc1NN)C 271570a_100000694244_100016996181 [0,2,0,0,0,0|1,0,0]=3 9166 B12R1.46 C=C(C)c1cc(ccc1N[13CH3])F 34a_100009961556_200025704644 [0,2,0,0,0,0|2,0,0]=4 9167 B12R1.46 C=C(C)c1cc(ccc1OC)Br 271570a_100000694244_100012351588 [0,2,0,0,0,0|2,0,0]=4 9168 B12R1.46 C=C(C)c1cc(ccc1OC)C 271570a_100000694244_100000186399 [0,2,0,0,0,0|1,0,0]=3 9169 B12R1.46 C=C(C)c1cc(ccc1OC)Cl 271570a_100000694244_100011215930 [0,2,0,0,0,0|2,0,0]=4 9170 B12R1.46 C=C(C)c1cc(ccc1OC)F 271570a_100000694244_100000171694 [0,2,0,0,0,0|2,0,0]=4 9171 B12R1.46 C=C(C)c1cc(ccc1OC)N 271570a_100000694244_100000187427 [0,2,0,0,0,0|2,0,0]=4 9172 B12R1.46 C=C(C)c1cc(ccc1OC)O 271570a_100000694244_100010084122 [0,2,0,0,0,0|2,0,0]=4 9173 B12R1.46 C=C(C)c1cc(ccc1SC)C 271570a_100000694244_200010201864 [0,2,0,0,0,0|1,0,0]=3 9174 B12R1.46 C=C(C)c1cc(ccc1SC)F 271570a_100000694244_100009817003 [0,2,0,0,0,0|2,0,0]=4 9175 B12R1.46 C=C(C)c1cc(cnc1C#N)C 271570a_100000694244_100009874213 [0,2,0,0,0,0|2,0,0]=4 9176 B12R1.46 C=C(C)c1cc(cnc1NN)C 271570a_100000694244_100012357580 [0,2,0,0,0,0|2,0,0]=4 9177 B12R1.46 C=C(C)c1cc(cnc1OC)C 271570a_100000694244_100012353929 [0,2,0,0,0,0|2,0,0]=4 9178 B12R1.46 C=C(C)c1cc(ncc1CC)C 271570a_100000694244_100010291839 [0,2,0,0,0,0|2,0,0]=4 9179 B12R1.46 C=C(C)c1cc(ncc1OC)C 271570a_100000694244_100010109759 [0,2,0,0,0,0|2,0,0]=4 9180 B12R1.46 C=C(C)c1nc(ccc1C#N)C 271570a_100000694244_100000741175 [0,2,0,0,0,0|2,0,0]=4 9181 B12R1.46 C=C(C)c1nc(ccc1C=O)C 271570a_100000694244_100000085379 [0,2,0,0,0,0|2,0,0]=4 9182 B12R1.46 C=C(C)c1nc(ccc1CO)C 271570a_100000694244_102495338573 [0,2,0,0,0,0|2,0,0]=4 9183 B12R1.46 C=C(C)c1nc(ccc1OC)C 271570a_100000694244_100009820875 [0,2,0,0,0,0|2,0,0]=4 9184 B12R1.46 C=Cc1ccc(cc1C(=O)C)Br 271570a_100011290941_100012349576 [0,2,0,0,0,0|1,0,0]=3 9185 B12R1.46 C=Cc1ccc(cc1C(=O)C)C 271570a_100011290941_100012361225 [0,2,0,0,0,0|0,0,0]=2 9186 B12R1.46 C=Cc1ccc(cc1C(=O)C)F 271570a_100011290941_100012353695 [0,2,0,0,0,0|1,0,0]=3 9187 B12R1.46 C=Cc1ccc(cc1C(=O)C)N 271570a_100011290941_100012349454 [0,2,0,0,0,0|1,0,0]=3 9188 B12R1.46 C=Cc1ccc(cc1C(=O)N)Br 271570a_100011290941_200000162314 [0,2,0,0,0,0|2,0,0]=4 9189 B12R1.46 C=Cc1ccc(cc1C(=O)N)C 271570a_100011290941_200012349609 [0,2,0,0,0,0|1,0,0]=3 9190 B12R1.46 C=Cc1ccc(cc1C(=O)N)F 271570a_100011290941_100000206434 [0,2,0,0,0,0|2,0,0]=4 9191 B12R1.46 C=Cc1ccc(cc1C(=O)N)N 271570a_100011290941_100015186447 [0,2,0,0,0,0|2,0,0]=4 9192 B12R1.46 C=Cc1ncc(cc1C(=O)C)F 271570a_100011290941_100000118324 [0,2,0,0,0,0|2,0,0]=4 9193 B12R1.46 CC(=O)c1cc(ccc1C#N)F 1458a_100011217471_200000210301 [0,2,0,0,0,0|1,0,0]=3 9194 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 34a_100000212127_200025704644 [0,2,0,0,0,0|1,0,0]=3 9195 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 7a_100000212127_200025704644 [0,2,0,0,0,0|1,0,0]=3 9196 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 34a_100000195442_200025704644 [0,2,0,0,0,0|0,0,0]=2 9197 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 7a_100000195442_200025704644 [0,2,0,0,0,0|0,0,0]=2 9198 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 34a_100000185566_200025704644 [0,2,0,0,0,0|1,0,0]=3 9199 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000185566_200025704644 [0,2,0,0,0,0|1,0,0]=3 9200 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])F 7a_100000182812_200025704644 [0,2,0,0,0,0|1,0,0]=3 9201 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])I 7a_100010712555_200025704644 [0,2,0,0,0,0|1,0,0]=3 9202 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])N 34a_100011218865_200025704644 [0,2,0,0,0,0|1,0,0]=3 9203 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])Br 62a_100012349576_200025704644 [0,2,0,0,0,0|1,0,0]=3 9204 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])C 62a_100012361225_200025704644 [0,2,0,0,0,0|0,0,0]=2 9205 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])C 62a_200025704644_100012361225 [0,2,0,0,0,0|0,0,0]=2 9206 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])F 62a_100012353695_200025704644 [0,2,0,0,0,0|1,0,0]=3 9207 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_100010200798 [0,2,0,0,0,0|1,0,0]=3 9208 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])N 62a_100012349454_200025704644 [0,2,0,0,0,0|1,0,0]=3 9209 B12R1.46 CC(=O)c1cc(cnc1S[13CH3])F 62a_100000118324_200025704644 [0,2,0,0,0,0|2,0,0]=4 9210 B12R1.46 CC(=O)c1cc(cnc1S[13CH3])F 62a_200025704644_100000118324 [0,2,0,0,0,0|2,0,0]=4 9211 B12R1.46 CCc1ccc(cc1C(=O)C)Br 1458a_100012343961_200000210301 [0,2,0,0,0,0|1,0,0]=3 9212 B12R1.46 CCc1ccc(cc1C(=O)[13CH3])Br 1458a_100012343961_200025704644 [0,2,0,0,0,0|1,0,0]=3 9213 B12R1.46 CNc1ccc(cc1C(=O)N)Br 27a_100102657272_200000162314 [0,2,0,0,0,0|2,0,0]=4 9214 B12R1.46 CNc1ccc(cc1C(=O)N)Br 34a_100000740421_200000210301 [0,2,0,0,0,0|2,0,0]=4 9215 B12R1.46 CNc1ccc(cc1C(=O)N)Br 7a_100000740421_200000210301 [0,2,0,0,0,0|2,0,0]=4 9216 B12R1.46 CNc1ccc(cc1C(=O)N)C 34a_100011692829_200000210301 [0,2,0,0,0,0|1,0,0]=3 9217 B12R1.46 CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_200000210301 [0,2,0,0,0,0|2,0,0]=4 9218 B12R1.46 CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_200000210301 [0,2,0,0,0,0|2,0,0]=4 9219 B12R1.46 CNc1ccc(cc1C(=O)N)F 34a_100000741173_200000210301 [0,2,0,0,0,0|2,0,0]=4 9220 B12R1.46 CNc1ccc(cc1C(=O)N)F 7a_100000741173_200000210301 [0,2,0,0,0,0|2,0,0]=4 9221 B12R1.46 CNc1ccc(cc1C(=O)N)O 271570a_203496583355_200010114593 [0,2,0,0,0,0|2,0,0]=4 9222 B12R1.46 COc1ccc(cc1C(=O)C)Br 1458a_100000188853_200000210301 [0,2,0,0,0,0|1,0,0]=3 9223 B12R1.46 COc1ccc(cc1C(=O)C)Br 34a_100000212127_200000210301 [0,2,0,0,0,0|1,0,0]=3 9224 B12R1.46 COc1ccc(cc1C(=O)C)Br 7a_100000212127_200000210301 [0,2,0,0,0,0|1,0,0]=3 9225 B12R1.46 COc1ccc(cc1C(=O)C)C 1458a_100000204667_200000210301 [0,2,0,0,0,0|0,0,0]=2 9226 B12R1.46 COc1ccc(cc1C(=O)C)C 34a_100000195442_200000210301 [0,2,0,0,0,0|0,0,0]=2 9227 B12R1.46 COc1ccc(cc1C(=O)C)C 7a_100000195442_200000210301 [0,2,0,0,0,0|0,0,0]=2 9228 B12R1.46 COc1ccc(cc1C(=O)C)Cl 1458a_100000211409_200000210301 [0,2,0,0,0,0|1,0,0]=3 9229 B12R1.46 COc1ccc(cc1C(=O)C)Cl 34a_100000185566_200000210301 [0,2,0,0,0,0|1,0,0]=3 9230 B12R1.46 COc1ccc(cc1C(=O)C)Cl 7a_100000185566_200000210301 [0,2,0,0,0,0|1,0,0]=3 9231 B12R1.46 COc1ccc(cc1C(=O)C)F 1458a_100000735445_200000210301 [0,2,0,0,0,0|1,0,0]=3 9232 B12R1.46 COc1ccc(cc1C(=O)C)F 7a_100000182812_200000210301 [0,2,0,0,0,0|1,0,0]=3 9233 B12R1.46 COc1ccc(cc1C(=O)C)I 1458a_100000230898_200000210301 [0,2,0,0,0,0|1,0,0]=3 9234 B12R1.46 COc1ccc(cc1C(=O)C)I 7a_100010712555_200000210301 [0,2,0,0,0,0|1,0,0]=3 9235 B12R1.46 COc1ccc(cc1C(=O)C)N 34a_100011218865_200000210301 [0,2,0,0,0,0|1,0,0]=3 9236 B12R1.46 COc1ccc(cc1C(=O)C)O 1458a_200000100057_200000210301 [0,2,0,0,0,0|1,0,0]=3 9237 B12R1.46 COc1ccc(cc1C(=O)C)O 271570a_203496583355_100000173343 [0,2,0,0,0,0|1,0,0]=3 9238 B12R1.46 COc1ccc(cc1C(=O)N)Br 34a_100000192807_200000210301 [0,2,0,0,0,0|2,0,0]=4 9239 B12R1.46 COc1ccc(cc1C(=O)N)Br 7a_100000192807_200000210301 [0,2,0,0,0,0|2,0,0]=4 9240 B12R1.46 COc1ccc(cc1C(=O)N)C 34a_200000192840_200000210301 [0,2,0,0,0,0|1,0,0]=3 9241 B12R1.46 COc1ccc(cc1C(=O)N)C 7a_200000192840_200000210301 [0,2,0,0,0,0|1,0,0]=3 9242 B12R1.46 COc1ccc(cc1C(=O)N)Cl 34a_100000185026_200000210301 [0,2,0,0,0,0|2,0,0]=4 9243 B12R1.46 COc1ccc(cc1C(=O)N)Cl 7a_100000185026_200000210301 [0,2,0,0,0,0|2,0,0]=4 9244 B12R1.46 COc1ccc(cc1C(=O)N)F 34a_100012186459_200000210301 [0,2,0,0,0,0|2,0,0]=4 9245 B12R1.46 COc1ccc(cc1C(=O)N)F 7a_100012186459_200000210301 [0,2,0,0,0,0|2,0,0]=4 9246 B12R1.46 COc1ccc(cc1C(=O)N)I 34a_100000192813_200000210301 [0,2,0,0,0,0|2,0,0]=4 9247 B12R1.46 COc1ccc(cc1C(=O)N)I 7a_100000192813_200000210301 [0,2,0,0,0,0|2,0,0]=4 9248 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Br 1458a_100000188853_200025704644 [0,2,0,0,0,0|1,0,0]=3 9249 B12R1.46 COc1ccc(cc1C(=O)[13CH3])C 1458a_100000204667_200025704644 [0,2,0,0,0,0|0,0,0]=2 9250 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000211409_200025704644 [0,2,0,0,0,0|1,0,0]=3 9251 B12R1.46 COc1ccc(cc1C(=O)[13CH3])F 1458a_100000735445_200025704644 [0,2,0,0,0,0|1,0,0]=3 9252 B12R1.46 COc1ccc(cc1C(=O)[13CH3])I 1458a_100000230898_200025704644 [0,2,0,0,0,0|1,0,0]=3 9253 B12R1.46 COc1ccc(cc1C(=O)[13CH3])O 1458a_200000100057_200025704644 [0,2,0,0,0,0|1,0,0]=3 9254 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_200000210301 [0,2,0,0,0,0|2,0,0]=4 9255 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_200000210301 [0,2,0,0,0,0|2,0,0]=4 9256 B12R1.46 COc1ncc(cc1C(=O)C)O 271570a_203496583355_100010135678 [0,2,0,0,0,0|2,0,0]=4 9257 B12R1.46 CSc1ccc(cc1C(=O)C)Br 62a_100012349576_200000210301 [0,2,0,0,0,0|1,0,0]=3 9258 B12R1.46 CSc1ccc(cc1C(=O)C)C 62a_100012361225_200000210301 [0,2,0,0,0,0|0,0,0]=2 9259 B12R1.46 CSc1ccc(cc1C(=O)C)C 62a_200000210301_100012361225 [0,2,0,0,0,0|0,0,0]=2 9260 B12R1.46 CSc1ccc(cc1C(=O)C)F 62a_100012353695_200000210301 [0,2,0,0,0,0|1,0,0]=3 9261 B12R1.46 CSc1ccc(cc1C(=O)C)F 62a_200000210301_100010200798 [0,2,0,0,0,0|1,0,0]=3 9262 B12R1.46 CSc1ccc(cc1C(=O)C)N 62a_100012349454_200000210301 [0,2,0,0,0,0|1,0,0]=3 9263 B12R1.46 CSc1ccc(cc1C(=O)N)Br 62a_200000162314_200000210301 [0,2,0,0,0,0|2,0,0]=4 9264 B12R1.46 CSc1ccc(cc1C(=O)N)C 62a_200000210301_200012349609 [0,2,0,0,0,0|1,0,0]=3 9265 B12R1.46 CSc1ccc(cc1C(=O)N)C 62a_200012349609_200000210301 [0,2,0,0,0,0|1,0,0]=3 9266 B12R1.46 CSc1ccc(cc1C(=O)N)F 62a_100000206434_200000210301 [0,2,0,0,0,0|2,0,0]=4 9267 B12R1.46 CSc1ccc(cc1C(=O)N)F 62a_200000210301_100000206434 [0,2,0,0,0,0|2,0,0]=4 9268 B12R1.46 CSc1ccc(cc1C(=O)N)N 62a_100015186447_200000210301 [0,2,0,0,0,0|2,0,0]=4 9269 B12R1.46 CSc1ccc(cc1C(=O)O)Br 62a_100011072988_200000210301 [0,2,0,0,0,0|2,0,0]=4 9270 B12R1.46 CSc1ncc(cc1C(=O)C)F 62a_100000118324_200000210301 [0,2,0,0,0,0|2,0,0]=4 9271 B12R1.46 CSc1ncc(cc1C(=O)C)F 62a_200000210301_100000118324 [0,2,0,0,0,0|2,0,0]=4 9272 B12R1.46 Cc1ccc(c(c1)C(=O)N)N[13CH3] 34a_100011692829_200025704644 [0,2,0,0,0,0|1,0,0]=3 9273 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 34a_200000192840_200025704644 [0,2,0,0,0,0|1,0,0]=3 9274 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 7a_200000192840_200025704644 [0,2,0,0,0,0|1,0,0]=3 9275 B12R1.46 Cc1ccc(c(c1)C(=O)N)S[13CH3] 62a_200012349609_200025704644 [0,2,0,0,0,0|1,0,0]=3 9276 B12R1.46 Cc1ccc(c(c1)C(=O)N)S[13CH3] 62a_200025704644_200012349609 [0,2,0,0,0,0|1,0,0]=3 9277 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 34a_100000195567_200025704644 [0,2,0,0,0,0|2,0,0]=4 9278 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 7a_100000195567_200025704644 [0,2,0,0,0,0|2,0,0]=4 9279 B12R1.46 [13CH3]C(=O)c1cc(ccc1C#N)F 1458a_100011217471_200025704644 [0,2,0,0,0,0|1,0,0]=3 9280 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Br 34a_100000740421_200025704644 [0,2,0,0,0,0|2,0,0]=4 9281 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Br 7a_100000740421_200025704644 [0,2,0,0,0,0|2,0,0]=4 9282 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Cl 34a_100000743835_200025704644 [0,2,0,0,0,0|2,0,0]=4 9283 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Cl 7a_100000743835_200025704644 [0,2,0,0,0,0|2,0,0]=4 9284 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)F 34a_100000741173_200025704644 [0,2,0,0,0,0|2,0,0]=4 9285 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)F 7a_100000741173_200025704644 [0,2,0,0,0,0|2,0,0]=4 9286 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 34a_100000192807_200025704644 [0,2,0,0,0,0|2,0,0]=4 9287 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 7a_100000192807_200025704644 [0,2,0,0,0,0|2,0,0]=4 9288 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 34a_100000185026_200025704644 [0,2,0,0,0,0|2,0,0]=4 9289 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 7a_100000185026_200025704644 [0,2,0,0,0,0|2,0,0]=4 9290 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 34a_100012186459_200025704644 [0,2,0,0,0,0|2,0,0]=4 9291 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 7a_100012186459_200025704644 [0,2,0,0,0,0|2,0,0]=4 9292 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 34a_100000192813_200025704644 [0,2,0,0,0,0|2,0,0]=4 9293 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 7a_100000192813_200025704644 [0,2,0,0,0,0|2,0,0]=4 9294 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)Br 62a_200000162314_200025704644 [0,2,0,0,0,0|2,0,0]=4 9295 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)F 62a_100000206434_200025704644 [0,2,0,0,0,0|2,0,0]=4 9296 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)F 62a_200025704644_100000206434 [0,2,0,0,0,0|2,0,0]=4 9297 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)N 62a_100015186447_200025704644 [0,2,0,0,0,0|2,0,0]=4 9298 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)O)Br 62a_100011072988_200025704644 [0,2,0,0,0,0|2,0,0]=4 9299 B12R1.453 C=C(C)c1cc(ccc1Br)C#N 271570a_100000694244_100012349583 [0,2,0,0,0,0|1,0,1]=4 9300 B12R1.453 C=C(C)c1cc(ccc1Br)C=O 271570a_100000694244_100010146563 [0,2,0,0,0,0|1,0,1]=4 9301 B12R1.453 C=C(C)c1cc(ccc1Br)OC 271570a_100000694244_100009992028 [0,2,0,0,0,0|1,0,0]=3 9302 B12R1.453 C=C(C)c1cc(ccc1C)C#N 271570a_100000694244_100000690169 [0,2,0,0,0,0|1,0,1]=4 9303 B12R1.453 C=C(C)c1cc(ccc1C)C=O 271570a_100000694244_100000695567 [0,2,0,0,0,0|1,0,1]=4 9304 B12R1.453 C=C(C)c1cc(ccc1C)CO 271570a_100000694244_100000050133 [0,2,0,0,0,0|1,0,0]=3 9305 B12R1.453 C=C(C)c1cc(ccc1C)NC 271570a_100000694244_100000707694 [0,2,0,0,0,0|1,0,0]=3 9306 B12R1.453 C=C(C)c1cc(ccc1C)NN 271570a_100000694244_100016991967 [0,2,0,0,0,0|2,0,0]=4 9307 B12R1.453 C=C(C)c1cc(ccc1C)OC 271570a_100000694244_100012349166 [0,2,0,0,0,0|1,0,0]=3 9308 B12R1.453 C=C(C)c1cc(ccc1Cl)C#N 271570a_100000694244_100010199462 [0,2,0,0,0,0|1,0,1]=4 9309 B12R1.453 C=C(C)c1cc(ccc1Cl)C=O 271570a_100000694244_100010209939 [0,2,0,0,0,0|1,0,1]=4 9310 B12R1.453 C=C(C)c1cc(ccc1Cl)OC 271570a_100000694244_100011356938 [0,2,0,0,0,0|1,0,0]=3 9311 B12R1.453 C=C(C)c1cc(ccc1F)C#N 271570a_100000694244_100000188605 [0,2,0,0,0,0|1,0,1]=4 9312 B12R1.453 C=C(C)c1cc(ccc1F)C=O 271570a_100000694244_100000211747 [0,2,0,0,0,0|1,0,1]=4 9313 B12R1.453 C=C(C)c1cc(ccc1F)CC 271570a_100000694244_200010244628 [0,2,0,0,0,0|1,0,0]=3 9314 B12R1.453 C=C(C)c1cc(ccc1F)CN 271570a_100000694244_100015193890 [0,2,0,0,0,0|1,0,0]=3 9315 B12R1.453 C=C(C)c1cc(ccc1F)CO 271570a_100000694244_100000246287 [0,2,0,0,0,0|1,0,0]=3 9316 B12R1.453 C=C(C)c1cc(ccc1F)NN 271570a_100000694244_200025705588 [0,2,0,0,0,0|2,0,0]=4 9317 B12R1.453 C=C(C)c1cc(ccc1F)OC 271570a_100000694244_100000699733 [0,2,0,0,0,0|1,0,0]=3 9318 B12R1.453 C=C(C)c1cc(ccc1F)SC 271570a_100000694244_200010708804 [0,2,0,0,0,0|1,0,0]=3 9319 B12R1.453 C=C(C)c1cc(ccc1N)C#N 271570a_100000694244_100000736769 [0,2,0,0,0,0|1,0,1]=4 9320 B12R1.453 C=C(C)c1cc(ccc1N)CC 271570a_100000694244_100012339725 [0,2,0,0,0,0|1,0,0]=3 9321 B12R1.453 C=C(C)c1cc(ccc1N)OC 271570a_100000694244_100015195136 [0,2,0,0,0,0|1,0,0]=3 9322 B12R1.453 C=C(C)c1cc(ccc1O)C#N 271570a_100000694244_100000725478 [0,2,0,0,0,0|1,0,1]=4 9323 B12R1.453 C=C(C)c1cc(ccc1O)C=O 271570a_100000694244_100000184552 [0,2,0,0,0,0|1,0,1]=4 9324 B12R1.453 C=C(C)c1cc(ccc1O)CC 271570a_100000694244_100012339963 [0,2,0,0,0,0|1,0,0]=3 9325 B12R1.453 C=C(C)c1cc(ccc1O)CO 271570a_100000694244_100011191544 [0,2,0,0,0,0|1,0,0]=3 9326 B12R1.453 C=C(C)c1cc(ccc1O)OC 271570a_100000694244_100000685887 [0,2,0,0,0,0|1,0,0]=3 9327 B12R1.453 C=C(C)c1cc(cnc1Cl)CO 271570a_100000694244_200015217190 [0,2,0,0,0,0|2,0,0]=4 9328 B12R1.453 C=C(C)c1cc(cnc1F)OC 271570a_100000694244_100010068374 [0,2,0,0,0,0|2,0,0]=4 9329 B12R1.453 C=C(C)c1cc(cnc1N)CO 271570a_100000694244_100012343677 [0,2,0,0,0,0|2,0,0]=4 9330 B12R1.453 C=C(C)c1cc(ncc1C)CO 271570a_100000694244_100010113723 [0,2,0,0,0,0|2,0,0]=4 9331 B12R1.453 C=C(C)c1cc(ncc1C)OC 271570a_100000694244_100010068546 [0,2,0,0,0,0|2,0,0]=4 9332 B12R1.453 C=C(C)c1cc(ncc1Cl)OC 271570a_100000694244_100010068019 [0,2,0,0,0,0|2,0,0]=4 9333 B12R1.453 C=C(C)c1cc(ncc1F)OC 271570a_100000694244_100010160775 [0,2,0,0,0,0|2,0,0]=4 9334 B12R1.453 C=C(C)c1nc(ccc1N)OC 271570a_100000694244_100000069805 [0,2,0,0,0,0|2,0,0]=4 9335 B12R1.453 C=C(C)c1nc(ccc1O)CO 271570a_100000694244_200000118097 [0,2,0,0,0,0|2,0,0]=4 9336 B12R1.453 C=Cc1cc(c(cn1)F)C(=O)C 271570a_100011290941_100000697832 [0,2,0,0,0,0|1,0,1]=4 9337 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)C 271570a_100011290941_100012706819 [0,2,0,0,0,0|0,0,1]=3 9338 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)Cl 271570a_100011290941_100010712560 [0,2,0,0,0,0|0,0,1]=3 9339 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)F 271570a_100011290941_100000689017 [0,2,0,0,0,0|0,0,1]=3 9340 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)N 271570a_100011290941_100000695420 [0,2,0,0,0,0|0,0,1]=3 9341 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)O 271570a_100011290941_100000212127 [0,2,0,0,0,0|0,0,1]=3 9342 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)C 271570a_100011290941_100012257281 [0,2,0,0,0,0|1,0,1]=4 9343 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)F 271570a_100011290941_100000162119 [0,2,0,0,0,0|1,0,1]=4 9344 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)N 271570a_100011290941_100000740421 [0,2,0,0,0,0|1,0,1]=4 9345 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)O 271570a_100011290941_100000192807 [0,2,0,0,0,0|1,0,1]=4 9346 B12R1.453 C=Cc1ccc(c(n1)C(=O)C)F 271570a_100011290941_100009887703 [0,2,0,0,0,0|1,0,1]=4 9347 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)C 271570a_100011290941_100138557192 [0,2,0,0,0,0|1,0,1]=4 9348 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)F 271570a_100011290941_100010254234 [0,2,0,0,0,0|1,0,1]=4 9349 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)N 271570a_100011290941_100010173950 [0,2,0,0,0,0|1,0,1]=4 9350 B12R1.453 CC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_200000210301 [0,2,0,0,0,0|0,0,1]=3 9351 B12R1.453 CC(=O)c1cc(ccc1Br)CO 1458a_100010259715_200000210301 [0,2,0,0,0,0|0,0,0]=2 9352 B12R1.453 CC(=O)c1cc(ccc1C)C#N 1458a_200012187059_200000210301 [0,2,0,0,0,0|0,0,1]=3 9353 B12R1.453 CC(=O)c1cc(ccc1C)S[13CH3] 62a_100012706819_200025704644 [0,2,0,0,0,0|0,0,0]=2 9354 B12R1.453 CC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_200000210301 [0,2,0,0,0,0|0,0,1]=3 9355 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100009867868_200025704644 [0,2,0,0,0,0|0,0,0]=2 9356 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100009867868_200025704644 [0,2,0,0,0,0|0,0,0]=2 9357 B12R1.453 CC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100010712560_200025704644 [0,2,0,0,0,0|0,0,0]=2 9358 B12R1.453 CC(=O)c1cc(ccc1F)C#N 1458a_100011218479_200000210301 [0,2,0,0,0,0|0,0,1]=3 9359 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 34a_100000091700_200025704644 [0,2,0,0,0,0|0,0,0]=2 9360 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 7a_100000091700_200025704644 [0,2,0,0,0,0|0,0,0]=2 9361 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_100000689017_200025704644 [0,2,0,0,0,0|0,0,0]=2 9362 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010254839 [0,2,0,0,0,0|0,0,0]=2 9363 B12R1.453 CC(=O)c1cc(ccc1I)C#N 1458a_200010191847_200000210301 [0,2,0,0,0,0|0,0,1]=3 9364 B12R1.453 CC(=O)c1cc(ccc1N)S[13CH3] 62a_100000695420_200025704644 [0,2,0,0,0,0|0,0,0]=2 9365 B12R1.453 CC(=O)c1cc(ccc1O)C#N 1458a_100000719980_200000210301 [0,2,0,0,0,0|0,0,1]=3 9366 B12R1.453 CC(=O)c1cc(ccc1O)CO 1458a_200000045694_200000210301 [0,2,0,0,0,0|0,0,0]=2 9367 B12R1.453 CC(=O)c1cc(cnc1C)S[13CH3] 62a_100138557192_200025704644 [0,2,0,0,0,0|1,0,0]=3 9368 B12R1.453 CC(=O)c1cc(cnc1C)S[13CH3] 62a_200025704644_100138557192 [0,2,0,0,0,0|1,0,0]=3 9369 B12R1.453 CC(=O)c1cc(cnc1F)S[13CH3] 62a_100010254234_200025704644 [0,2,0,0,0,0|1,0,0]=3 9370 B12R1.453 CC(=O)c1cc(cnc1F)S[13CH3] 62a_200025704644_100010254234 [0,2,0,0,0,0|1,0,0]=3 9371 B12R1.453 CC(=O)c1cc(cnc1N)S[13CH3] 62a_100010173950_200025704644 [0,2,0,0,0,0|1,0,0]=3 9372 B12R1.453 CC(=O)c1cc(cnc1N)S[13CH3] 62a_200025704644_100010173950 [0,2,0,0,0,0|1,0,0]=3 9373 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_100000697832_200025704644 [0,2,0,0,0,0|1,0,0]=3 9374 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_200025704644_100000697832 [0,2,0,0,0,0|1,0,0]=3 9375 B12R1.453 CC(=O)c1nc(ccc1F)S[13CH3] 62a_100009887703_200025704644 [0,2,0,0,0,0|1,0,0]=3 9376 B12R1.453 CC(=O)c1nc(ccc1F)S[13CH3] 62a_200025704644_100009887703 [0,2,0,0,0,0|1,0,0]=3 9377 B12R1.453 CC(=O)c1nc(ncc1C)S[13CH3] 62a_100010687370_200025704644 [0,2,0,0,0,0|2,0,0]=4 9378 B12R1.453 CC(=O)c1nc(ncc1C)S[13CH3] 62a_200025704644_100010687370 [0,2,0,0,0,0|2,0,0]=4 9379 B12R1.453 CC(C)c1cc(ccc1F)S[13CH3] 62a_200025704644_200053017515 [0,2,0,0,0,0|1,0,1]=4 9380 B12R1.453 CC(C)c1cc(ccc1F)S[13CH3] 62a_200053017515_200025704644 [0,2,0,0,0,0|1,0,1]=4 9381 B12R1.453 CC(C)c1cc(ccc1N)S[13CH3] 62a_100000694223_200025704644 [0,2,0,0,0,0|1,0,1]=4 9382 B12R1.453 CC(C)c1cc(ccc1N)S[13CH3] 62a_200025704644_100000694223 [0,2,0,0,0,0|1,0,1]=4 9383 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_100000691460_200025704644 [0,2,0,0,0,0|1,0,1]=4 9384 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000691460 [0,2,0,0,0,0|1,0,1]=4 9385 B12R1.453 CC(O)c1cc(ccc1F)S[13CH3] 62a_100011943926_200025704644 [0,2,0,0,0,0|0,0,2]=4 9386 B12R1.453 CC(O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100011943926 [0,2,0,0,0,0|0,0,2]=4 9387 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [0,2,0,0,0,0|0,0,0]=2 9388 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [0,2,0,0,0,0|0,0,0]=2 9389 B12R1.453 CN(C)c1cc(ccc1F)S[13CH3] 62a_100010288836_200025704644 [0,2,0,0,0,0|2,0,0]=4 9390 B12R1.453 CN(C)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010288836 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.453 CN(C)c1cc(ccc1I)O[13CH3] 34a_200010083878_200025704644 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200000210301 [0,2,0,0,0,0|1,0,0]=3 9393 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200000210301 [0,2,0,0,0,0|1,0,0]=3 9394 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 34a_100000750465_200000210301 [0,2,0,0,0,0|1,0,0]=3 9395 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 7a_100000750465_200000210301 [0,2,0,0,0,0|1,0,0]=3 9396 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200000210301 [0,2,0,0,0,0|1,0,0]=3 9397 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200000210301 [0,2,0,0,0,0|1,0,0]=3 9398 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 34a_100000738046_200000210301 [0,2,0,0,0,0|1,0,0]=3 9399 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 7a_100000738046_200000210301 [0,2,0,0,0,0|1,0,0]=3 9400 B12R1.453 CNc1ccc(c(c1)N(C)C)C 34a_100011708272_200000210301 [0,2,0,0,0,0|2,0,0]=4 9401 B12R1.453 CNc1ccc(c(c1)[N+](=O)[O-])C 34a_100000210030_200000210301 [0,2,0,0,0,0|2,0,0]=4 9402 B12R1.453 CNc1ccc(c(c1)[N+](=O)[O-])F 34a_100000185763_200000210301 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.453 CNc1ncc(c(n1)C(=O)C)C 27a_100102657272_100010687370 [0,2,0,0,0,0|2,0,0]=4 9404 B12R1.453 COc1ccc(c(c1)C(=O)C)Br 1458a_100000211723_200000210301 [0,2,0,0,0,0|0,0,0]=2 9405 B12R1.453 COc1ccc(c(c1)C(=O)C)C 1458a_100011399813_200000210301 [0,2,0,0,0,0|0,0,0]=2 9406 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 1458a_100000763818_200000210301 [0,2,0,0,0,0|0,0,0]=2 9407 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_200000210301 [0,2,0,0,0,0|0,0,0]=2 9408 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_200000210301 [0,2,0,0,0,0|0,0,0]=2 9409 B12R1.453 COc1ccc(c(c1)C(=O)C)F 1458a_100011217016_200000210301 [0,2,0,0,0,0|0,0,0]=2 9410 B12R1.453 COc1ccc(c(c1)C(=O)C)F 34a_100000091700_200000210301 [0,2,0,0,0,0|0,0,0]=2 9411 B12R1.453 COc1ccc(c(c1)C(=O)C)F 7a_100000091700_200000210301 [0,2,0,0,0,0|0,0,0]=2 9412 B12R1.453 COc1ccc(c(c1)C(=O)C)I 1458a_100012339533_200000210301 [0,2,0,0,0,0|0,0,0]=2 9413 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [0,2,0,0,0,0|0,0,0]=2 9414 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [0,2,0,0,0,0|0,0,0]=2 9415 B12R1.453 COc1ccc(c(c1)C(=O)N)O 271570a_203496583355_100000162014 [0,2,0,0,0,0|1,0,0]=3 9416 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000211723_200025704644 [0,2,0,0,0,0|0,0,0]=2 9417 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])C 1458a_100011399813_200025704644 [0,2,0,0,0,0|0,0,0]=2 9418 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000763818_200025704644 [0,2,0,0,0,0|0,0,0]=2 9419 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])F 1458a_100011217016_200025704644 [0,2,0,0,0,0|0,0,0]=2 9420 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])I 1458a_100012339533_200025704644 [0,2,0,0,0,0|0,0,0]=2 9421 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [0,2,0,0,0,0|0,0,0]=2 9422 B12R1.453 COc1ccc(c(c1)N(C)C)C 34a_200000087912_200000210301 [0,2,0,0,0,0|2,0,0]=4 9423 B12R1.453 COc1ccc(c(c1)N(C)C)I 34a_200010083878_200000210301 [0,2,0,0,0,0|2,0,0]=4 9424 B12R1.453 COc1ccc(c(c1)[C@H](C)N)O 271570a_203496583355_200015425320 [0,2,0,0,0,0|1,0,1]=4 9425 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Br 34a_100012232398_200000210301 [0,2,0,0,0,0|2,0,0]=4 9426 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Br 7a_100012232398_200000210301 [0,2,0,0,0,0|2,0,0]=4 9427 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])C 34a_100000742313_200000210301 [0,2,0,0,0,0|2,0,0]=4 9428 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])C 7a_100000742313_200000210301 [0,2,0,0,0,0|2,0,0]=4 9429 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Cl 34a_100000718020_200000210301 [0,2,0,0,0,0|2,0,0]=4 9430 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000718020_200000210301 [0,2,0,0,0,0|2,0,0]=4 9431 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])F 34a_100011294462_200000210301 [0,2,0,0,0,0|2,0,0]=4 9432 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])F 7a_100011294462_200000210301 [0,2,0,0,0,0|2,0,0]=4 9433 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])I 7a_100000031453_200000210301 [0,2,0,0,0,0|2,0,0]=4 9434 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])N 34a_100000740891_200000210301 [0,2,0,0,0,0|2,0,0]=4 9435 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])N 7a_100000740891_200000210301 [0,2,0,0,0,0|2,0,0]=4 9436 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_100000697832_200000210301 [0,2,0,0,0,0|1,0,0]=3 9437 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_200000210301_100000697832 [0,2,0,0,0,0|1,0,0]=3 9438 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_100015943597_200000210301 [0,2,0,0,0,0|2,0,0]=4 9439 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_200000210301_100015943597 [0,2,0,0,0,0|2,0,0]=4 9440 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_100012003536_200000210301 [0,2,0,0,0,0|2,0,0]=4 9441 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_200000210301_100012003536 [0,2,0,0,0,0|2,0,0]=4 9442 B12R1.453 CSc1ccc(c(c1)C(=O)C)C 62a_100012706819_200000210301 [0,2,0,0,0,0|0,0,0]=2 9443 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 1458a_100000212015_200000210301 [0,2,0,0,0,0|0,0,0]=2 9444 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_200000210301 [0,2,0,0,0,0|0,0,0]=2 9445 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 1458a_200012183283_200000210301 [0,2,0,0,0,0|0,0,0]=2 9446 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_100000689017_200000210301 [0,2,0,0,0,0|0,0,0]=2 9447 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_200000210301_100010254839 [0,2,0,0,0,0|0,0,0]=2 9448 B12R1.453 CSc1ccc(c(c1)C(=O)C)N 62a_100000695420_200000210301 [0,2,0,0,0,0|0,0,0]=2 9449 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_100012257281_200000210301 [0,2,0,0,0,0|1,0,0]=3 9450 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_200000210301_100012257281 [0,2,0,0,0,0|1,0,0]=3 9451 B12R1.453 CSc1ccc(c(c1)C(=O)N)F 62a_100000162119_200000210301 [0,2,0,0,0,0|1,0,0]=3 9452 B12R1.453 CSc1ccc(c(c1)C(=O)N)N 62a_100000740421_200000210301 [0,2,0,0,0,0|1,0,0]=3 9453 B12R1.453 CSc1ccc(c(c1)C(=O)N)O 62a_100000192807_200000210301 [0,2,0,0,0,0|1,0,0]=3 9454 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000212015_200025704644 [0,2,0,0,0,0|0,0,0]=2 9455 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])F 1458a_200012183283_200025704644 [0,2,0,0,0,0|0,0,0]=2 9456 B12R1.453 CSc1ccc(c(c1)C(C)C)F 62a_200000210301_200053017515 [0,2,0,0,0,0|1,0,1]=4 9457 B12R1.453 CSc1ccc(c(c1)C(C)C)F 62a_200053017515_200000210301 [0,2,0,0,0,0|1,0,1]=4 9458 B12R1.453 CSc1ccc(c(c1)C(C)C)N 62a_100000694223_200000210301 [0,2,0,0,0,0|1,0,1]=4 9459 B12R1.453 CSc1ccc(c(c1)C(C)C)N 62a_200000210301_100000694223 [0,2,0,0,0,0|1,0,1]=4 9460 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_100000691460_200000210301 [0,2,0,0,0,0|1,0,1]=4 9461 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_200000210301_100000691460 [0,2,0,0,0,0|1,0,1]=4 9462 B12R1.453 CSc1ccc(c(c1)C(C)O)F 62a_100011943926_200000210301 [0,2,0,0,0,0|0,0,2]=4 9463 B12R1.453 CSc1ccc(c(c1)C(C)O)F 62a_200000210301_100011943926 [0,2,0,0,0,0|0,0,2]=4 9464 B12R1.453 CSc1ccc(c(c1)N(C)C)F 62a_100010288836_200000210301 [0,2,0,0,0,0|2,0,0]=4 9465 B12R1.453 CSc1ccc(c(c1)N(C)C)F 62a_200000210301_100010288836 [0,2,0,0,0,0|2,0,0]=4 9466 B12R1.453 CSc1ccc(c(n1)C(=O)C)F 62a_100009887703_200000210301 [0,2,0,0,0,0|1,0,0]=3 9467 B12R1.453 CSc1ccc(c(n1)C(=O)C)F 62a_200000210301_100009887703 [0,2,0,0,0,0|1,0,0]=3 9468 B12R1.453 CSc1ccc(c(n1)C(=O)N)N 62a_100000093116_200000210301 [0,2,0,0,0,0|2,0,0]=4 9469 B12R1.453 CSc1cnc(c(c1)C(=O)C)C 62a_100138557192_200000210301 [0,2,0,0,0,0|1,0,0]=3 9470 B12R1.453 CSc1cnc(c(c1)C(=O)C)C 62a_200000210301_100138557192 [0,2,0,0,0,0|1,0,0]=3 9471 B12R1.453 CSc1cnc(c(c1)C(=O)C)F 62a_100010254234_200000210301 [0,2,0,0,0,0|1,0,0]=3 9472 B12R1.453 CSc1cnc(c(c1)C(=O)C)F 62a_200000210301_100010254234 [0,2,0,0,0,0|1,0,0]=3 9473 B12R1.453 CSc1cnc(c(c1)C(=O)C)N 62a_100010173950_200000210301 [0,2,0,0,0,0|1,0,0]=3 9474 B12R1.453 CSc1cnc(c(c1)C(=O)C)N 62a_200000210301_100010173950 [0,2,0,0,0,0|1,0,0]=3 9475 B12R1.453 CSc1cnc(c(c1)C(=O)N)N 62a_100000701294_200000210301 [0,2,0,0,0,0|2,0,0]=4 9476 B12R1.453 CSc1cnc(c(c1)C(=O)N)N 62a_200000210301_100000701294 [0,2,0,0,0,0|2,0,0]=4 9477 B12R1.453 CSc1ncc(c(n1)C(=O)C)C 62a_100010687370_200000210301 [0,2,0,0,0,0|2,0,0]=4 9478 B12R1.453 CSc1ncc(c(n1)C(=O)C)C 62a_200000210301_100010687370 [0,2,0,0,0,0|2,0,0]=4 9479 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 34a_100000750465_200025704644 [0,2,0,0,0,0|1,0,0]=3 9480 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 7a_100000750465_200025704644 [0,2,0,0,0,0|1,0,0]=3 9481 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_100012257281_200025704644 [0,2,0,0,0,0|1,0,0]=3 9482 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_200025704644_100012257281 [0,2,0,0,0,0|1,0,0]=3 9483 B12R1.453 Cc1ccc(cc1C(=O)[13CH3])C#N 1458a_200012187059_200025704644 [0,2,0,0,0,0|0,0,1]=3 9484 B12R1.453 Cc1ccc(cc1N(C)C)N[13CH3] 34a_100011708272_200025704644 [0,2,0,0,0,0|2,0,0]=4 9485 B12R1.453 Cc1ccc(cc1N(C)C)O[13CH3] 34a_200000087912_200025704644 [0,2,0,0,0,0|2,0,0]=4 9486 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])N[13CH3] 34a_100000210030_200025704644 [0,2,0,0,0,0|2,0,0]=4 9487 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])O[13CH3] 34a_100000742313_200025704644 [0,2,0,0,0,0|2,0,0]=4 9488 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])O[13CH3] 7a_100000742313_200025704644 [0,2,0,0,0,0|2,0,0]=4 9489 B12R1.453 [13CH3]C(=O)c1cc(ccc1Br)C#N 1458a_100012361338_200025704644 [0,2,0,0,0,0|0,0,1]=3 9490 B12R1.453 [13CH3]C(=O)c1cc(ccc1Br)CO 1458a_100010259715_200025704644 [0,2,0,0,0,0|0,0,0]=2 9491 B12R1.453 [13CH3]C(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_200025704644 [0,2,0,0,0,0|0,0,1]=3 9492 B12R1.453 [13CH3]C(=O)c1cc(ccc1F)C#N 1458a_100011218479_200025704644 [0,2,0,0,0,0|0,0,1]=3 9493 B12R1.453 [13CH3]C(=O)c1cc(ccc1I)C#N 1458a_200010191847_200025704644 [0,2,0,0,0,0|0,0,1]=3 9494 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)C#N 1458a_100000719980_200025704644 [0,2,0,0,0,0|0,0,1]=3 9495 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)CO 1458a_200000045694_200025704644 [0,2,0,0,0,0|0,0,0]=2 9496 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200025704644 [0,2,0,0,0,0|1,0,0]=3 9497 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200025704644 [0,2,0,0,0,0|1,0,0]=3 9498 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200025704644 [0,2,0,0,0,0|1,0,0]=3 9499 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200025704644 [0,2,0,0,0,0|1,0,0]=3 9500 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 34a_100000738046_200025704644 [0,2,0,0,0,0|1,0,0]=3 9501 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 7a_100000738046_200025704644 [0,2,0,0,0,0|1,0,0]=3 9502 B12R1.453 [13CH3]Nc1ccc(c(c1)[N+](=O)[O-])F 34a_100000185763_200025704644 [0,2,0,0,0,0|2,0,0]=4 9503 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Br 34a_100012232398_200025704644 [0,2,0,0,0,0|2,0,0]=4 9504 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Br 7a_100012232398_200025704644 [0,2,0,0,0,0|2,0,0]=4 9505 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Cl 34a_100000718020_200025704644 [0,2,0,0,0,0|2,0,0]=4 9506 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000718020_200025704644 [0,2,0,0,0,0|2,0,0]=4 9507 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])F 34a_100011294462_200025704644 [0,2,0,0,0,0|2,0,0]=4 9508 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])F 7a_100011294462_200025704644 [0,2,0,0,0,0|2,0,0]=4 9509 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])I 7a_100000031453_200025704644 [0,2,0,0,0,0|2,0,0]=4 9510 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])N 34a_100000740891_200025704644 [0,2,0,0,0,0|2,0,0]=4 9511 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])N 7a_100000740891_200025704644 [0,2,0,0,0,0|2,0,0]=4 9512 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_100015943597_200025704644 [0,2,0,0,0,0|2,0,0]=4 9513 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_200025704644_100015943597 [0,2,0,0,0,0|2,0,0]=4 9514 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_100012003536_200025704644 [0,2,0,0,0,0|2,0,0]=4 9515 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_200025704644_100012003536 [0,2,0,0,0,0|2,0,0]=4 9516 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)F 62a_100000162119_200025704644 [0,2,0,0,0,0|1,0,0]=3 9517 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)N 62a_100000740421_200025704644 [0,2,0,0,0,0|1,0,0]=3 9518 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)O 62a_100000192807_200025704644 [0,2,0,0,0,0|1,0,0]=3 9519 B12R1.453 [13CH3]Sc1ccc(c(n1)C(=O)N)N 62a_100000093116_200025704644 [0,2,0,0,0,0|2,0,0]=4 9520 B12R1.453 [13CH3]Sc1cnc(c(c1)C(=O)N)N 62a_100000701294_200025704644 [0,2,0,0,0,0|2,0,0]=4 9521 B12R1.453 [13CH3]Sc1cnc(c(c1)C(=O)N)N 62a_200025704644_100000701294 [0,2,0,0,0,0|2,0,0]=4 9522 B12R1.258 C=C(C)c1cc(ccn1)C(=O)C 271570a_100000694244_100000685609 [0,2,0,0,0,0|1,0,0]=3 9523 B12R1.258 C=C(C)c1cc(ccn1)C(=O)N 271570a_100000694244_100000229836 [0,2,0,0,0,0|2,0,0]=4 9524 B12R1.258 C=C(C)c1cc(ccn1)C(C)C 271570a_100000694244_100010237925 [0,2,0,0,0,0|2,0,0]=4 9525 B12R1.258 C=C(C)c1cc(ccn1)C(F)F 271570a_100000694244_100010180920 [0,2,0,0,0,0|2,0,0]=4 9526 B12R1.258 C=C(C)c1cc(ccn1)N(C)C 271570a_100000694244_100000766659 [0,2,0,0,0,0|2,0,0]=4 9527 B12R1.258 C=C(C)c1cccc(c1)B(O)O 271570a_100000694244_100000687717 [0,2,0,0,0,0|2,0,0]=4 9528 B12R1.258 C=C(C)c1cccc(c1)C(=C)C 271570a_100000694244_100012123953 [0,2,0,0,0,0|1,0,0]=3 9529 B12R1.258 C=C(C)c1cccc(c1)C(=O)C 271570a_100000694244_100000210093 [0,2,0,0,0,0|0,0,0]=2 9530 B12R1.258 C=C(C)c1cccc(c1)C(=O)N 271570a_100000694244_100000162208 [0,2,0,0,0,0|1,0,0]=3 9531 B12R1.258 C=C(C)c1cccc(c1)C(C)C 271570a_100000694244_100011214899 [0,2,0,0,0,0|1,0,0]=3 9532 B12R1.258 C=C(C)c1cccc(c1)C(C)N 271570a_100000694244_100020642005 [0,2,0,0,0,0|1,0,0]=3 9533 B12R1.258 C=C(C)c1cccc(c1)C(C)O 271570a_100000694244_100000246457 [0,2,0,0,0,0|1,0,0]=3 9534 B12R1.258 C=C(C)c1cccc(c1)C(F)F 271570a_100000694244_100009892619 [0,2,0,0,0,0|1,0,0]=3 9535 B12R1.258 C=C(C)c1cccc(c1)N(C)C 271570a_100000694244_100011215952 [0,2,0,0,0,0|1,0,0]=3 9536 B12R1.258 C=C(C)c1cccc(c1)S(=O)C 271570a_100000694244_100009816267 [0,2,0,0,0,0|1,0,0]=3 9537 B12R1.258 C=C(C)c1cccc(n1)C(=O)C 271570a_100000694244_100009816502 [0,2,0,0,0,0|1,0,0]=3 9538 B12R1.258 C=C(C)c1cccc(n1)C(=O)N 271570a_100000694244_100011834053 [0,2,0,0,0,0|2,0,0]=4 9539 B12R1.258 C=C(C)c1cccc(n1)C(C)C 271570a_100000694244_100012318657 [0,2,0,0,0,0|2,0,0]=4 9540 B12R1.258 C=C(C)c1cccc(n1)C(C)N 271570a_100000694244_200010173468 [0,2,0,0,0,0|2,0,0]=4 9541 B12R1.258 C=C(C)c1cccc(n1)C(C)O 271570a_100000694244_100009820884 [0,2,0,0,0,0|2,0,0]=4 9542 B12R1.258 C=C(C)c1cccc(n1)C(F)F 271570a_100000694244_100010208565 [0,2,0,0,0,0|2,0,0]=4 9543 B12R1.258 C=C(C)c1cccc(n1)N(C)C 271570a_100000694244_100011960435 [0,2,0,0,0,0|2,0,0]=4 9544 B12R1.258 C=C(C)c1ccnc(c1)C(=O)C 271570a_100000694244_100000709912 [0,2,0,0,0,0|1,0,0]=3 9545 B12R1.258 C=C(C)c1ccnc(c1)C(=O)N 271570a_100000694244_100000229564 [0,2,0,0,0,0|2,0,0]=4 9546 B12R1.258 C=C(C)c1ccnc(c1)C(C)C 271570a_100000694244_100010237922 [0,2,0,0,0,0|2,0,0]=4 9547 B12R1.258 C=C(C)c1ccnc(c1)C(C)O 271570a_100000694244_100000144657 [0,2,0,0,0,0|2,0,0]=4 9548 B12R1.258 C=C(C)c1ccnc(c1)C(F)F 271570a_100000694244_100010136062 [0,2,0,0,0,0|2,0,0]=4 9549 B12R1.258 C=C(C)c1ccnc(c1)N(C)C 271570a_100000694244_100012361627 [0,2,0,0,0,0|2,0,0]=4 9550 B12R1.258 C=C(C)c1cncc(c1)C(=C)C 271570a_100000694244_200009889500 [0,2,0,0,0,0|2,0,0]=4 9551 B12R1.258 C=C(C)c1cncc(c1)C(=O)C 271570a_100000694244_100011216243 [0,2,0,0,0,0|1,0,0]=3 9552 B12R1.258 C=C(C)c1cncc(c1)C(=O)N 271570a_100000694244_100000162242 [0,2,0,0,0,0|2,0,0]=4 9553 B12R1.258 C=C(C)c1cncc(c1)C(C)C 271570a_100000694244_200010191214 [0,2,0,0,0,0|2,0,0]=4 9554 B12R1.258 C=C(C)c1cncc(c1)C(C)O 271570a_100000694244_100012351597 [0,2,0,0,0,0|2,0,0]=4 9555 B12R1.258 C=C(C)c1cncc(c1)C(F)F 271570a_100000694244_100000694488 [0,2,0,0,0,0|2,0,0]=4 9556 B12R1.258 C=C(C)c1cncc(c1)N(C)C 271570a_100000694244_100012350714 [0,2,0,0,0,0|2,0,0]=4 9557 B12R1.258 C=C(C)c1cncc(c1)[C@@H](C)N 271570a_100000694244_100012350620 [0,2,0,0,0,0|2,0,0]=4 9558 B12R1.258 C=C(C)c1nccc(n1)C(=O)C 271570a_100000694244_100010643186 [0,2,0,0,0,0|2,0,0]=4 9559 B12R1.258 CC(=O)c1cc(ccn1)C(F)F 1458a_100009881524_200000210301 [0,2,0,0,0,0|1,0,0]=3 9560 B12R1.258 CC(=O)c1cccc(c1)C(=O)N 1458a_100000736676_200000210301 [0,2,0,0,0,0|0,0,1]=3 9561 B12R1.258 CC(=O)c1cccc(c1)C(C)C 1458a_100011934808_200000210301 [0,2,0,0,0,0|0,0,0]=2 9562 B12R1.258 CC(=O)c1cccc(c1)C(C)O 1458a_100000090953_200000210301 [0,2,0,0,0,0|0,0,0]=2 9563 B12R1.258 CC(=O)c1cccc(c1)C(F)F 1458a_100000752119_200000210301 [0,2,0,0,0,0|0,0,0]=2 9564 B12R1.258 CC(=O)c1cccc(c1)N(C)C 1458a_100000210872_200000210301 [0,2,0,0,0,0|0,0,0]=2 9565 B12R1.258 CC(=O)c1cccc(c1)[N+](=O)[O-] 1458a_100000185806_200000210301 [0,2,0,0,0,0|1,0,0]=3 9566 B12R1.258 CC(=O)c1cccc(n1)N(C)C 27a_100102631434_100000085735 [0,2,0,0,0,0|1,0,0]=3 9567 B12R1.258 CC(=O)c1ccnc(n1)N(C)C 27a_100102631434_100010643186 [0,2,0,0,0,0|2,0,0]=4 9568 B12R1.258 CC(C)c1cccc(c1)C(=O)[13CH3] 1458a_100011934808_200025704644 [0,2,0,0,0,0|0,0,0]=2 9569 B12R1.258 CC(O)c1cccc(c1)C(=O)[13CH3] 1458a_100000090953_200025704644 [0,2,0,0,0,0|0,0,0]=2 9570 B12R1.258 CN(C)c1cccc(c1)C(=O)[13CH3] 1458a_100000210872_200025704644 [0,2,0,0,0,0|0,0,0]=2 9571 B12R1.258 CN(C)c1cccc(c1)C(F)F 2230a_200016126983_200000210301 [0,2,0,0,0,0|2,0,0]=4 9572 B12R1.258 CN(C)c1cccc(c1)C(F)F 269982a_200016126983_200000210301 [0,2,0,0,0,0|2,0,0]=4 9573 B12R1.258 CN(C)c1cccc(c1)C(F)F 34a_200016126983_200000210301 [0,2,0,0,0,0|2,0,0]=4 9574 B12R1.258 CN(C)c1cccc(c1)C(F)F 7a_200016126983_200000210301 [0,2,0,0,0,0|2,0,0]=4 9575 B12R1.258 CN(C)c1cccc(c1)[N+](=O)[O-] 269982a_102515432896_200000210301 [0,2,0,0,0,0|2,0,0]=4 9576 B12R1.258 CN(C)c1cccc(c1)[N+](=O)[O-] 34a_102515432896_200000210301 [0,2,0,0,0,0|2,0,0]=4 9577 B12R1.258 CN(C)c1cccc(n1)C(=O)N 27a_100102631434_100011834053 [0,2,0,0,0,0|2,0,0]=4 9578 B12R1.258 CN(C)c1ccnc(c1)C(=O)N 27a_100102631434_100000229564 [0,2,0,0,0,0|2,0,0]=4 9579 B12R1.258 CN([13CH3])c1cccc(c1)C(F)F 2230a_200016126983_200025704644 [0,2,0,0,0,0|2,0,0]=4 9580 B12R1.258 CN([13CH3])c1cccc(c1)C(F)F 269982a_200016126983_200025704644 [0,2,0,0,0,0|2,0,0]=4 9581 B12R1.258 CN([13CH3])c1cccc(c1)C(F)F 34a_200016126983_200025704644 [0,2,0,0,0,0|2,0,0]=4 9582 B12R1.258 CN([13CH3])c1cccc(c1)C(F)F 7a_200016126983_200025704644 [0,2,0,0,0,0|2,0,0]=4 9583 B12R1.258 CN([13CH3])c1cccc(c1)[N+](=O)[O-] 269982a_102515432896_200025704644 [0,2,0,0,0,0|2,0,0]=4 9584 B12R1.258 CN([13CH3])c1cccc(c1)[N+](=O)[O-] 34a_102515432896_200025704644 [0,2,0,0,0,0|2,0,0]=4 9585 B12R1.258 [13CH3]C(=O)c1cc(ccn1)C(F)F 1458a_100009881524_200025704644 [0,2,0,0,0,0|1,0,0]=3 9586 B12R1.258 [13CH3]C(=O)c1cccc(c1)C(=O)N 1458a_100000736676_200025704644 [0,2,0,0,0,0|0,0,1]=3 9587 B12R1.258 [13CH3]C(=O)c1cccc(c1)C(F)F 1458a_100000752119_200025704644 [0,2,0,0,0,0|0,0,0]=2 9588 B12R1.258 [13CH3]C(=O)c1cccc(c1)[N+](=O)[O-] 1458a_100000185806_200025704644 [0,2,0,0,0,0|1,0,0]=3 9589 B12R1.279 C=C(C)c1cc(ccn1)CC#N 271570a_100000694244_100009819943 [0,2,0,0,0,0|2,0,0]=4 9590 B12R1.279 C=C(C)c1cc(ccn1)OCC 271570a_100000694244_100011922638 [0,2,0,0,0,0|2,0,0]=4 9591 B12R1.279 C=C(C)c1cccc(c1)C#CC 271570a_100000694244_200009843338 [0,2,0,0,0,0|1,0,0]=3 9592 B12R1.279 C=C(C)c1cccc(c1)C=CC 271570a_100016259895_100012123953 [0,2,0,0,0,0|1,0,0]=3 9593 B12R1.279 C=C(C)c1cccc(c1)CC#N 271570a_100000694244_100000034040 [0,2,0,0,0,0|1,0,0]=3 9594 B12R1.279 C=C(C)c1cccc(c1)CC=O 271570a_100000694244_200000698211 [0,2,0,0,0,0|1,0,0]=3 9595 B12R1.279 C=C(C)c1cccc(c1)CCC 271570a_100000694244_100000694964 [0,2,0,0,0,0|1,0,0]=3 9596 B12R1.279 C=C(C)c1cccc(c1)CCN 271570a_100000694244_100011207229 [0,2,0,0,0,0|1,0,0]=3 9597 B12R1.279 C=C(C)c1cccc(c1)CCO 271570a_100000694244_100011217444 [0,2,0,0,0,0|1,0,0]=3 9598 B12R1.279 C=C(C)c1cccc(c1)CNC 271570a_100000694244_100000187585 [0,2,0,0,0,0|1,0,0]=3 9599 B12R1.279 C=C(C)c1cccc(c1)CNN 271570a_100000694244_100000686200 [0,2,0,0,0,0|1,0,0]=3 9600 B12R1.279 C=C(C)c1cccc(c1)COC 271570a_100000694244_100011493687 [0,2,0,0,0,0|1,0,0]=3 9601 B12R1.279 C=C(C)c1cccc(c1)N=[N+]=[N-] 271570a_100000694244_100000735707 [0,2,0,0,0,0|2,0,0]=4 9602 B12R1.279 C=C(C)c1cccc(c1)NCC 271570a_100000694244_100000738899 [0,2,0,0,0,0|1,0,0]=3 9603 B12R1.279 C=C(C)c1cccc(c1)OCC 271570a_100000694244_100000170002 [0,2,0,0,0,0|1,0,0]=3 9604 B12R1.279 C=C(C)c1cccc(c1)SCC 271570a_100000694244_100000703699 [0,2,0,0,0,0|1,0,0]=3 9605 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100000210202_100012123953 [0,2,0,0,0,0|1,0,0]=3 9606 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100012123953_100000210202 [0,2,0,0,0,0|1,0,0]=3 9607 B12R1.279 C=C(C)c1cccc(c1)SCF 62a_100012123953_100015361967 [0,2,0,0,0,0|1,0,0]=3 9608 B12R1.279 C=C(C)c1cccc(c1)SCF 62a_100015361967_100012123953 [0,2,0,0,0,0|1,0,0]=3 9609 B12R1.279 C=C(C)c1cccc(n1)CC#N 271570a_100000694244_100000727631 [0,2,0,0,0,0|2,0,0]=4 9610 B12R1.279 C=C(C)c1cccc(n1)CCO 271570a_100000694244_100010221043 [0,2,0,0,0,0|2,0,0]=4 9611 B12R1.279 C=C(C)c1cccc(n1)CNC 271570a_100000694244_106354212997 [0,2,0,0,0,0|2,0,0]=4 9612 B12R1.279 C=C(C)c1cccc(n1)NCC 271570a_100000694244_200020678610 [0,2,0,0,0,0|2,0,0]=4 9613 B12R1.279 C=C(C)c1cccc(n1)OCC 271570a_100000694244_100000752924 [0,2,0,0,0,0|2,0,0]=4 9614 B12R1.279 C=C(C)c1ccnc(c1)CC#N 271570a_100000694244_100009875060 [0,2,0,0,0,0|2,0,0]=4 9615 B12R1.279 C=C(C)c1ccnc(c1)CNC 271570a_100000694244_100102954512 [0,2,0,0,0,0|2,0,0]=4 9616 B12R1.279 C=C(C)c1ccnc(c1)OCC 271570a_100000694244_100009995528 [0,2,0,0,0,0|2,0,0]=4 9617 B12R1.279 C=C(C)c1cncc(c1)C=CC 271570a_100016259895_200009889500 [0,2,0,0,0,0|2,0,0]=4 9618 B12R1.279 C=C(C)c1cncc(c1)CC#N 271570a_100000694244_100015508350 [0,2,0,0,0,0|2,0,0]=4 9619 B12R1.279 C=C(C)c1cncc(c1)CNC 271570a_100000694244_103549770560 [0,2,0,0,0,0|2,0,0]=4 9620 B12R1.279 C=C(C)c1cncc(c1)OCC 271570a_100000694244_100012029586 [0,2,0,0,0,0|2,0,0]=4 9621 B12R1.279 C=C(C)c1cncc(c1)SCC 62a_100000210202_200009889500 [0,2,0,0,0,0|2,0,0]=4 9622 B12R1.279 C=C(C)c1cncc(c1)SCC 62a_200009889500_100000210202 [0,2,0,0,0,0|2,0,0]=4 9623 B12R1.279 C=C(C)c1cncc(c1)SCF 62a_100015361967_200009889500 [0,2,0,0,0,0|2,0,0]=4 9624 B12R1.279 C=C(C)c1cncc(c1)SCF 62a_200009889500_100015361967 [0,2,0,0,0,0|2,0,0]=4 9625 B12R1.279 C=C=Cc1cc(ccn1)C(=O)C 271570a_100015277604_100000685609 [0,2,0,0,0,0|1,0,1]=4 9626 B12R1.279 C=C=Cc1cccc(c1)C(=C)C 271570a_100015277604_100012123953 [0,2,0,0,0,0|1,0,1]=4 9627 B12R1.279 C=C=Cc1cccc(c1)C(=O)C 271570a_100015277604_100000210093 [0,2,0,0,0,0|0,0,1]=3 9628 B12R1.279 C=C=Cc1cccc(c1)C(=O)N 271570a_100015277604_100000162208 [0,2,0,0,0,0|1,0,1]=4 9629 B12R1.279 C=C=Cc1cccc(c1)S(=O)C 271570a_100015277604_100009816267 [0,2,0,0,0,0|1,0,1]=4 9630 B12R1.279 C=C=Cc1cccc(n1)C(=O)C 271570a_100015277604_100009816502 [0,2,0,0,0,0|1,0,1]=4 9631 B12R1.279 C=C=Cc1ccnc(c1)C(=O)C 271570a_100015277604_100000709912 [0,2,0,0,0,0|1,0,1]=4 9632 B12R1.279 C=C=Cc1cncc(c1)C(=O)C 271570a_100015277604_100011216243 [0,2,0,0,0,0|1,0,1]=4 9633 B12R1.279 C=CCc1cccc(c1)C(=C)C 271570a_100000694244_100009816576 [0,2,0,0,0,0|1,0,0]=3 9634 B12R1.279 CC(=O)c1cc(ccn1)SCF 62a_100000709912_100015361967 [0,2,0,0,0,0|1,0,0]=3 9635 B12R1.279 CC(=O)c1cc(ccn1)SCF 62a_100015361967_100000709912 [0,2,0,0,0,0|1,0,0]=3 9636 B12R1.279 CC(=O)c1cccc(c1)CC#N 1458a_100000027370_200000210301 [0,2,0,0,0,0|0,0,0]=2 9637 B12R1.279 CC(=O)c1cccc(c1)CCO 1458a_100009869812_200000210301 [0,2,0,0,0,0|0,0,0]=2 9638 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_100000084091_200025704644 [0,2,0,0,0,0|0,0,0]=2 9639 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000084091 [0,2,0,0,0,0|0,0,0]=2 9640 B12R1.279 CC(=O)c1cccc(c1)OCF 34a_100000211620_100015361967 [0,2,0,0,0,0|0,0,0]=2 9641 B12R1.279 CC(=O)c1cccc(c1)OCF 7a_100000211620_100015361967 [0,2,0,0,0,0|0,0,0]=2 9642 B12R1.279 CC(=O)c1cccc(c1)SCF 62a_100000210093_100015361967 [0,2,0,0,0,0|0,0,0]=2 9643 B12R1.279 CC(=O)c1cccc(c1)SCF 62a_100015361967_100000210093 [0,2,0,0,0,0|0,0,0]=2 9644 B12R1.279 CC(=O)c1cccc(n1)SCF 62a_100009816502_100015361967 [0,2,0,0,0,0|1,0,0]=3 9645 B12R1.279 CC(=O)c1cccc(n1)SCF 62a_100015361967_100009816502 [0,2,0,0,0,0|1,0,0]=3 9646 B12R1.279 CC(=O)c1ccnc(c1)SCF 62a_100000685609_100015361967 [0,2,0,0,0,0|1,0,0]=3 9647 B12R1.279 CC(=O)c1ccnc(c1)SCF 62a_100015361967_100000685609 [0,2,0,0,0,0|1,0,0]=3 9648 B12R1.279 CC(=O)c1ccnc(n1)SCF 62a_100010643186_100015361967 [0,2,0,0,0,0|2,0,0]=4 9649 B12R1.279 CC(=O)c1ccnc(n1)SCF 62a_100015361967_100010643186 [0,2,0,0,0,0|2,0,0]=4 9650 B12R1.279 CC(=O)c1cncc(c1)SCF 62a_100011216243_100015361967 [0,2,0,0,0,0|1,0,0]=3 9651 B12R1.279 CC(=O)c1cncc(c1)SCF 62a_100015361967_100011216243 [0,2,0,0,0,0|1,0,0]=3 9652 B12R1.279 CC(C)c1cccc(c1)NCF 34a_100000211879_100015361967 [0,2,0,0,0,0|1,0,1]=4 9653 B12R1.279 CC(C)c1cccc(c1)NCF 7a_100000211879_100015361967 [0,2,0,0,0,0|1,0,1]=4 9654 B12R1.279 CC(C)c1cccc(c1)OCF 34a_100000211816_100015361967 [0,2,0,0,0,0|1,0,1]=4 9655 B12R1.279 CC(C)c1cccc(c1)OCF 7a_100000211816_100015361967 [0,2,0,0,0,0|1,0,1]=4 9656 B12R1.279 CC(C)c1cccc(c1)SCF 62a_100011214899_100015361967 [0,2,0,0,0,0|1,0,1]=4 9657 B12R1.279 CC(C)c1cccc(c1)SCF 62a_100015361967_100011214899 [0,2,0,0,0,0|1,0,1]=4 9658 B12R1.279 CC(N)c1cccc(c1)OCF 34a_100000740644_100015361967 [0,2,0,0,0,0|1,0,1]=4 9659 B12R1.279 CC(N)c1cccc(c1)OCF 7a_100000740644_100015361967 [0,2,0,0,0,0|1,0,1]=4 9660 B12R1.279 CC(N)c1cccc(c1)SCF 62a_100015361967_100020642005 [0,2,0,0,0,0|1,0,1]=4 9661 B12R1.279 CC(N)c1cccc(c1)SCF 62a_100020642005_100015361967 [0,2,0,0,0,0|1,0,1]=4 9662 B12R1.279 CC(O)c1cccc(c1)NCF 34a_100011217120_100015361967 [0,2,0,0,0,0|0,0,2]=4 9663 B12R1.279 CC(O)c1cccc(c1)OCF 34a_100000748013_100015361967 [0,2,0,0,0,0|0,0,2]=4 9664 B12R1.279 CC(O)c1cccc(c1)OCF 7a_100000748013_100015361967 [0,2,0,0,0,0|0,0,2]=4 9665 B12R1.279 CC(O)c1cccc(c1)SCF 62a_100000246457_100015361967 [0,2,0,0,0,0|0,0,2]=4 9666 B12R1.279 CC(O)c1cccc(c1)SCF 62a_100015361967_100000246457 [0,2,0,0,0,0|0,0,2]=4 9667 B12R1.279 CC=Cc1cc(ccn1)C(=O)C 271570a_100016259895_100000685609 [0,2,0,0,0,0|1,0,0]=3 9668 B12R1.279 CC=Cc1cc(ccn1)C(=O)N 271570a_100016259895_100000229836 [0,2,0,0,0,0|2,0,0]=4 9669 B12R1.279 CC=Cc1cccc(c1)C(=O)C 271570a_100016259895_100000210093 [0,2,0,0,0,0|0,0,0]=2 9670 B12R1.279 CC=Cc1cccc(c1)C(=O)N 271570a_100016259895_100000162208 [0,2,0,0,0,0|1,0,0]=3 9671 B12R1.279 CC=Cc1cccc(c1)C(C)C 271570a_100016259895_100011214899 [0,2,0,0,0,0|1,0,1]=4 9672 B12R1.279 CC=Cc1cccc(c1)C(C)N 271570a_100016259895_100020642005 [0,2,0,0,0,0|1,0,1]=4 9673 B12R1.279 CC=Cc1cccc(c1)C(C)O 271570a_100016259895_100000246457 [0,2,0,0,0,0|0,0,2]=4 9674 B12R1.279 CC=Cc1cccc(c1)N(C)C 271570a_100016259895_100011215952 [0,2,0,0,0,0|2,0,0]=4 9675 B12R1.279 CC=Cc1cccc(c1)S(=O)C 271570a_100016259895_100009816267 [0,2,0,0,0,0|1,0,0]=3 9676 B12R1.279 CC=Cc1cccc(n1)C(=O)C 271570a_100016259895_100009816502 [0,2,0,0,0,0|1,0,0]=3 9677 B12R1.279 CC=Cc1cccc(n1)C(=O)N 271570a_100016259895_100011834053 [0,2,0,0,0,0|2,0,0]=4 9678 B12R1.279 CC=Cc1ccnc(c1)C(=O)C 271570a_100016259895_100000709912 [0,2,0,0,0,0|1,0,0]=3 9679 B12R1.279 CC=Cc1ccnc(c1)C(=O)N 271570a_100016259895_100000229564 [0,2,0,0,0,0|2,0,0]=4 9680 B12R1.279 CC=Cc1cncc(c1)C(=O)C 271570a_100016259895_100011216243 [0,2,0,0,0,0|1,0,0]=3 9681 B12R1.279 CC=Cc1cncc(c1)C(=O)N 271570a_100016259895_100000162242 [0,2,0,0,0,0|2,0,0]=4 9682 B12R1.279 CC=Cc1nccc(n1)C(=O)C 271570a_100016259895_100010643186 [0,2,0,0,0,0|2,0,0]=4 9683 B12R1.279 CCNc1cccc(c1)C(=O)N 34a_100000217337_100000210202 [0,2,0,0,0,0|1,0,0]=3 9684 B12R1.279 CCNc1cccc(c1)C(C)C 2230a_100000211879_100000210202 [0,2,0,0,0,0|1,0,1]=4 9685 B12R1.279 CCNc1cccc(c1)C(C)C 34a_100000211879_100000210202 [0,2,0,0,0,0|1,0,1]=4 9686 B12R1.279 CCNc1cccc(c1)C(C)C 7a_100000211879_100000210202 [0,2,0,0,0,0|1,0,1]=4 9687 B12R1.279 CCNc1cccc(c1)C(C)O 2230a_100011217120_100000210202 [0,2,0,0,0,0|0,0,2]=4 9688 B12R1.279 CCNc1cccc(c1)C(C)O 34a_100011217120_100000210202 [0,2,0,0,0,0|0,0,2]=4 9689 B12R1.279 CCNc1cccc(c1)N(C)C 34a_100000209982_100000210202 [0,2,0,0,0,0|2,0,0]=4 9690 B12R1.279 CCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000210202 [0,2,0,0,0,0|2,0,0]=4 9691 B12R1.279 CCNc1cccc(n1)C(=O)C 27a_100015525214_100000085735 [0,2,0,0,0,0|1,0,0]=3 9692 B12R1.279 CCNc1cccc(n1)C(=O)N 27a_100015525214_100011834053 [0,2,0,0,0,0|2,0,0]=4 9693 B12R1.279 CCNc1ccnc(c1)C(=O)N 27a_100015525214_100000229564 [0,2,0,0,0,0|2,0,0]=4 9694 B12R1.279 CCNc1nccc(n1)C(=O)C 27a_100015525214_100010643186 [0,2,0,0,0,0|2,0,0]=4 9695 B12R1.279 CCOc1cccc(c1)C(=O)C 1458a_100000216331_200000210301 [0,2,0,0,0,0|0,0,0]=2 9696 B12R1.279 CCOc1cccc(c1)C(=O)C 34a_100000211620_100000210202 [0,2,0,0,0,0|0,0,0]=2 9697 B12R1.279 CCOc1cccc(c1)C(=O)C 7a_100000211620_100000210202 [0,2,0,0,0,0|0,0,0]=2 9698 B12R1.279 CCOc1cccc(c1)C(=O)N 34a_100000162170_100000210202 [0,2,0,0,0,0|1,0,0]=3 9699 B12R1.279 CCOc1cccc(c1)C(=O)N 7a_100000162170_100000210202 [0,2,0,0,0,0|1,0,0]=3 9700 B12R1.279 CCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216331_200025704644 [0,2,0,0,0,0|0,0,0]=2 9701 B12R1.279 CCOc1cccc(c1)C(=S)N 7a_100000738086_100000210202 [0,2,0,0,0,0|1,1,0]=4 9702 B12R1.279 CCOc1cccc(c1)C(C)C 34a_100000211816_100000210202 [0,2,0,0,0,0|1,0,1]=4 9703 B12R1.279 CCOc1cccc(c1)C(C)C 7a_100000211816_100000210202 [0,2,0,0,0,0|1,0,1]=4 9704 B12R1.279 CCOc1cccc(c1)C(C)N 34a_100000740644_100000210202 [0,2,0,0,0,0|1,0,1]=4 9705 B12R1.279 CCOc1cccc(c1)C(C)N 7a_100000740644_100000210202 [0,2,0,0,0,0|1,0,1]=4 9706 B12R1.279 CCOc1cccc(c1)C(C)O 34a_100000748013_100000210202 [0,2,0,0,0,0|0,0,2]=4 9707 B12R1.279 CCOc1cccc(c1)C(C)O 7a_100000748013_100000210202 [0,2,0,0,0,0|0,0,2]=4 9708 B12R1.279 CCOc1cccc(c1)N(C)C 34a_100000738785_100000210202 [0,2,0,0,0,0|2,0,0]=4 9709 B12R1.279 CCOc1cccc(c1)[N+](=O)[O-] 34a_100000185994_100000210202 [0,2,0,0,0,0|2,0,0]=4 9710 B12R1.279 CCOc1cccc(c1)[N+](=O)[O-] 7a_100000185994_100000210202 [0,2,0,0,0,0|2,0,0]=4 9711 B12R1.279 CCOc1cncc(c1)C(=O)N 7a_100000698036_100000210202 [0,2,0,0,0,0|2,0,0]=4 9712 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000210202_100000685609 [0,2,0,0,0,0|1,0,0]=3 9713 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000685609_100000210202 [0,2,0,0,0,0|1,0,0]=3 9714 B12R1.279 CCSc1cc(ccn1)C(=O)N 62a_100000210202_100000229836 [0,2,0,0,0,0|2,0,0]=4 9715 B12R1.279 CCSc1cc(ccn1)C(=O)N 62a_100000229836_100000210202 [0,2,0,0,0,0|2,0,0]=4 9716 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210093_100000210202 [0,2,0,0,0,0|0,0,0]=2 9717 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210202_100000210093 [0,2,0,0,0,0|0,0,0]=2 9718 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000162208_100000210202 [0,2,0,0,0,0|1,0,0]=3 9719 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000210202_100000162208 [0,2,0,0,0,0|1,0,0]=3 9720 B12R1.279 CCSc1cccc(c1)C(C)C 62a_100000210202_100011214899 [0,2,0,0,0,0|1,0,1]=4 9721 B12R1.279 CCSc1cccc(c1)C(C)C 62a_100011214899_100000210202 [0,2,0,0,0,0|1,0,1]=4 9722 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100000210202_100020642005 [0,2,0,0,0,0|1,0,1]=4 9723 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100020642005_100000210202 [0,2,0,0,0,0|1,0,1]=4 9724 B12R1.279 CCSc1cccc(c1)C(C)O 62a_100000210202_100000246457 [0,2,0,0,0,0|0,0,2]=4 9725 B12R1.279 CCSc1cccc(c1)C(C)O 62a_100000246457_100000210202 [0,2,0,0,0,0|0,0,2]=4 9726 B12R1.279 CCSc1cccc(c1)N(C)C 62a_100000210202_100011215952 [0,2,0,0,0,0|2,0,0]=4 9727 B12R1.279 CCSc1cccc(c1)N(C)C 62a_100011215952_100000210202 [0,2,0,0,0,0|2,0,0]=4 9728 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100000210202_100009816267 [0,2,0,0,0,0|1,0,0]=3 9729 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100009816267_100000210202 [0,2,0,0,0,0|1,0,0]=3 9730 B12R1.279 CCSc1cccc(n1)C(=O)C 62a_100000210202_100009816502 [0,2,0,0,0,0|1,0,0]=3 9731 B12R1.279 CCSc1cccc(n1)C(=O)C 62a_100009816502_100000210202 [0,2,0,0,0,0|1,0,0]=3 9732 B12R1.279 CCSc1cccc(n1)C(=O)N 62a_100000210202_100011834053 [0,2,0,0,0,0|2,0,0]=4 9733 B12R1.279 CCSc1cccc(n1)C(=O)N 62a_100011834053_100000210202 [0,2,0,0,0,0|2,0,0]=4 9734 B12R1.279 CCSc1ccnc(c1)C(=O)C 62a_100000210202_100000709912 [0,2,0,0,0,0|1,0,0]=3 9735 B12R1.279 CCSc1ccnc(c1)C(=O)C 62a_100000709912_100000210202 [0,2,0,0,0,0|1,0,0]=3 9736 B12R1.279 CCSc1ccnc(c1)C(=O)N 62a_100000210202_100000229564 [0,2,0,0,0,0|2,0,0]=4 9737 B12R1.279 CCSc1ccnc(c1)C(=O)N 62a_100000229564_100000210202 [0,2,0,0,0,0|2,0,0]=4 9738 B12R1.279 CCSc1cncc(c1)C(=O)C 62a_100000210202_100011216243 [0,2,0,0,0,0|1,0,0]=3 9739 B12R1.279 CCSc1cncc(c1)C(=O)C 62a_100011216243_100000210202 [0,2,0,0,0,0|1,0,0]=3 9740 B12R1.279 CCSc1cncc(c1)C(=O)N 62a_100000162242_100000210202 [0,2,0,0,0,0|2,0,0]=4 9741 B12R1.279 CCSc1cncc(c1)C(=O)N 62a_100000210202_100000162242 [0,2,0,0,0,0|2,0,0]=4 9742 B12R1.279 CCSc1nccc(n1)C(=O)C 62a_100000210202_100010643186 [0,2,0,0,0,0|2,0,0]=4 9743 B12R1.279 CCSc1nccc(n1)C(=O)C 62a_100010643186_100000210202 [0,2,0,0,0,0|2,0,0]=4 9744 B12R1.279 CN(C)c1cccc(c1)CO[13CH3] 34a_100000759682_200025704644 [0,2,0,0,0,0|2,0,0]=4 9745 B12R1.279 CN(C)c1cccc(c1)NCF 34a_100000209982_100015361967 [0,2,0,0,0,0|2,0,0]=4 9746 B12R1.279 CN(C)c1cccc(c1)OCF 34a_100000738785_100015361967 [0,2,0,0,0,0|2,0,0]=4 9747 B12R1.279 CN(C)c1cccc(c1)SCF 62a_100011215952_100015361967 [0,2,0,0,0,0|2,0,0]=4 9748 B12R1.279 CN(C)c1cccc(c1)SCF 62a_100015361967_100011215952 [0,2,0,0,0,0|2,0,0]=4 9749 B12R1.279 CNCc1cccc(c1)C(=O)C 2230a_106832991635_100000084091 [0,2,0,0,0,0|0,0,0]=2 9750 B12R1.279 CNCc1cccc(c1)C(=O)C 26a_100102657272_100000211620 [0,2,0,0,0,0|0,0,0]=2 9751 B12R1.279 CNCc1cccc(c1)C(=O)C 34a_100102657272_100000084091 [0,2,0,0,0,0|0,0,0]=2 9752 B12R1.279 CNCc1cccc(c1)C(=O)C 7a_106832991635_100000084091 [0,2,0,0,0,0|0,0,0]=2 9753 B12R1.279 CNCc1cccc(c1)C(=O)N 207a_100102657272_100000059704 [0,2,0,0,0,0|1,0,0]=3 9754 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_100000746036_200000210301 [0,2,0,0,0,0|1,0,0]=3 9755 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_106832991635_100000738444 [0,2,0,0,0,0|1,0,0]=3 9756 B12R1.279 CNCc1cccc(c1)C(=O)N 270004a_106832991635_100000059704 [0,2,0,0,0,0|1,0,0]=3 9757 B12R1.279 CNCc1cccc(c1)C(=O)N 34a_100102657272_100000738444 [0,2,0,0,0,0|1,0,0]=3 9758 B12R1.279 CNCc1cccc(c1)C(=O)N 7a_106832991635_100000738444 [0,2,0,0,0,0|1,0,0]=3 9759 B12R1.279 CNCc1cccc(c1)C(=O)O 269956a_100000752609_200000210301 [0,2,0,0,0,0|1,0,0]=3 9760 B12R1.279 CNCc1cccc(c1)C(=O)[O-] 26a_100102657272_200020627138 [0,2,0,0,0,0|1,0,0]=3 9761 B12R1.279 CNCc1cccc(c1)C(C)C 207a_100102657272_100011935327 [0,2,0,0,0,0|1,0,1]=4 9762 B12R1.279 CNCc1cccc(c1)C(C)C 26a_100102657272_100000211816 [0,2,0,0,0,0|1,0,1]=4 9763 B12R1.279 CNCc1cccc(c1)C(C)C 270004a_106832991635_100011935327 [0,2,0,0,0,0|1,0,1]=4 9764 B12R1.279 CNCc1cccc(c1)C(C)O 26a_100102657272_100000748013 [0,2,0,0,0,0|0,0,2]=4 9765 B12R1.279 CNCc1cccc(c1)N(C)C 207a_100102657272_100011794417 [0,2,0,0,0,0|2,0,0]=4 9766 B12R1.279 CNCc1cccc(c1)N(C)C 270004a_106832991635_100011794417 [0,2,0,0,0,0|2,0,0]=4 9767 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 207a_100102657272_100000185827 [0,2,0,0,0,0|2,0,0]=4 9768 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 2230a_100000755791_200000210301 [0,2,0,0,0,0|2,0,0]=4 9769 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 2230a_106832991635_100000737091 [0,2,0,0,0,0|2,0,0]=4 9770 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 26a_100102657272_100000185994 [0,2,0,0,0,0|2,0,0]=4 9771 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 270004a_106832991635_100000185827 [0,2,0,0,0,0|2,0,0]=4 9772 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 34a_100000755791_200000210301 [0,2,0,0,0,0|2,0,0]=4 9773 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 34a_100102657272_100000737091 [0,2,0,0,0,0|2,0,0]=4 9774 B12R1.279 CNCc1cccc(c1)[N+](=O)[O-] 7a_106832991635_100000737091 [0,2,0,0,0,0|2,0,0]=4 9775 B12R1.279 CNCc1cncc(c1)C(=O)N 2230a_106832991635_200010162415 [0,2,0,0,0,0|2,0,0]=4 9776 B12R1.279 CNCc1cncc(c1)C(=O)N 34a_100102657272_200010162415 [0,2,0,0,0,0|2,0,0]=4 9777 B12R1.279 CNCc1cncc(c1)C(=O)N 7a_106832991635_200010162415 [0,2,0,0,0,0|2,0,0]=4 9778 B12R1.279 COCc1cccc(c1)C(=O)C 1458a_100000199024_200000210301 [0,2,0,0,0,0|0,0,0]=2 9779 B12R1.279 COCc1cccc(c1)C(=O)C 34a_100138415774_100000084091 [0,2,0,0,0,0|0,0,0]=2 9780 B12R1.279 COCc1cccc(c1)C(=O)N 34a_100138415774_100000738444 [0,2,0,0,0,0|1,0,0]=3 9781 B12R1.279 COCc1cccc(c1)C(=O)[13CH3] 1458a_100000199024_200025704644 [0,2,0,0,0,0|0,0,0]=2 9782 B12R1.279 COCc1cccc(c1)N(C)C 34a_100000759682_200000210301 [0,2,0,0,0,0|2,0,0]=4 9783 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 34a_100000238370_200000210301 [0,2,0,0,0,0|2,0,0]=4 9784 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 34a_100138415774_100000737091 [0,2,0,0,0,0|2,0,0]=4 9785 B12R1.279 COCc1cccc(c1)[N+](=O)[O-] 7a_100000238370_200000210301 [0,2,0,0,0,0|2,0,0]=4 9786 B12R1.279 COCc1cncc(c1)C(=O)N 34a_100138415774_200010162415 [0,2,0,0,0,0|2,0,0]=4 9787 B12R1.279 CS(=O)c1cccc(c1)SCF 62a_100009816267_100015361967 [0,2,0,0,0,0|1,0,0]=3 9788 B12R1.279 CS(=O)c1cccc(c1)SCF 62a_100015361967_100009816267 [0,2,0,0,0,0|1,0,0]=3 9789 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_100000084091_200000210301 [0,2,0,0,0,0|0,0,0]=2 9790 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_200000210301_100000084091 [0,2,0,0,0,0|0,0,0]=2 9791 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_100000738444_200000210301 [0,2,0,0,0,0|1,0,0]=3 9792 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_200000210301_100000738444 [0,2,0,0,0,0|1,0,0]=3 9793 B12R1.279 CSCc1cccc(c1)[N+](=O)[O-] 62a_100000187168_200000210301 [0,2,0,0,0,0|2,0,0]=4 9794 B12R1.279 CSCc1cccc(c1)[N+](=O)[O-] 62a_200000210301_100000737091 [0,2,0,0,0,0|2,0,0]=4 9795 B12R1.279 CSCc1cncc(c1)C(=O)N 62a_200000210301_200010162415 [0,2,0,0,0,0|2,0,0]=4 9796 B12R1.279 CSCc1cncc(c1)C(=O)N 62a_200010162415_200000210301 [0,2,0,0,0,0|2,0,0]=4 9797 B12R1.279 NC(=O)c1cc(ccn1)SCF 62a_100000229564_100015361967 [0,2,0,0,0,0|2,0,0]=4 9798 B12R1.279 NC(=O)c1cc(ccn1)SCF 62a_100015361967_100000229564 [0,2,0,0,0,0|2,0,0]=4 9799 B12R1.279 NC(=O)c1cccc(c1)NCF 34a_100000217337_100015361967 [0,2,0,0,0,0|1,0,0]=3 9800 B12R1.279 NC(=O)c1cccc(c1)OCF 34a_100000162170_100015361967 [0,2,0,0,0,0|1,0,0]=3 9801 B12R1.279 NC(=O)c1cccc(c1)OCF 7a_100000162170_100015361967 [0,2,0,0,0,0|1,0,0]=3 9802 B12R1.279 NC(=O)c1cccc(c1)SCF 62a_100000162208_100015361967 [0,2,0,0,0,0|1,0,0]=3 9803 B12R1.279 NC(=O)c1cccc(c1)SCF 62a_100015361967_100000162208 [0,2,0,0,0,0|1,0,0]=3 9804 B12R1.279 NC(=O)c1cccc(n1)SCF 62a_100011834053_100015361967 [0,2,0,0,0,0|2,0,0]=4 9805 B12R1.279 NC(=O)c1cccc(n1)SCF 62a_100015361967_100011834053 [0,2,0,0,0,0|2,0,0]=4 9806 B12R1.279 NC(=O)c1ccnc(c1)SCF 62a_100000229836_100015361967 [0,2,0,0,0,0|2,0,0]=4 9807 B12R1.279 NC(=O)c1ccnc(c1)SCF 62a_100015361967_100000229836 [0,2,0,0,0,0|2,0,0]=4 9808 B12R1.279 NC(=O)c1cncc(c1)OCF 7a_100000698036_100015361967 [0,2,0,0,0,0|2,0,0]=4 9809 B12R1.279 NC(=O)c1cncc(c1)SCF 62a_100000162242_100015361967 [0,2,0,0,0,0|2,0,0]=4 9810 B12R1.279 NC(=O)c1cncc(c1)SCF 62a_100015361967_100000162242 [0,2,0,0,0,0|2,0,0]=4 9811 B12R1.279 NC(=S)c1cccc(c1)OCF 7a_100000738086_100015361967 [0,2,0,0,0,0|1,1,0]=4 9812 B12R1.279 O=[N+]([O-])c1cccc(c1)NCF 34a_100000184103_100015361967 [0,2,0,0,0,0|2,0,0]=4 9813 B12R1.279 O=[N+]([O-])c1cccc(c1)OCF 34a_100000185994_100015361967 [0,2,0,0,0,0|2,0,0]=4 9814 B12R1.279 O=[N+]([O-])c1cccc(c1)OCF 7a_100000185994_100015361967 [0,2,0,0,0,0|2,0,0]=4 9815 B12R1.279 [13CH3]C(=O)c1cccc(c1)CC#N 1458a_100000027370_200025704644 [0,2,0,0,0,0|0,0,0]=2 9816 B12R1.279 [13CH3]C(=O)c1cccc(c1)CCO 1458a_100009869812_200025704644 [0,2,0,0,0,0|0,0,0]=2 9817 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)N 2230a_100000746036_200025704644 [0,2,0,0,0,0|1,0,0]=3 9818 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)O 269956a_100000752609_200025704644 [0,2,0,0,0,0|1,0,0]=3 9819 B12R1.279 [13CH3]NCc1cccc(c1)[N+](=O)[O-] 2230a_100000755791_200025704644 [0,2,0,0,0,0|2,0,0]=4 9820 B12R1.279 [13CH3]NCc1cccc(c1)[N+](=O)[O-] 34a_100000755791_200025704644 [0,2,0,0,0,0|2,0,0]=4 9821 B12R1.279 [13CH3]OCc1cccc(c1)[N+](=O)[O-] 34a_100000238370_200025704644 [0,2,0,0,0,0|2,0,0]=4 9822 B12R1.279 [13CH3]OCc1cccc(c1)[N+](=O)[O-] 7a_100000238370_200025704644 [0,2,0,0,0,0|2,0,0]=4 9823 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_100000738444_200025704644 [0,2,0,0,0,0|1,0,0]=3 9824 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_200025704644_100000738444 [0,2,0,0,0,0|1,0,0]=3 9825 B12R1.279 [13CH3]SCc1cccc(c1)[N+](=O)[O-] 62a_100000187168_200025704644 [0,2,0,0,0,0|2,0,0]=4 9826 B12R1.279 [13CH3]SCc1cccc(c1)[N+](=O)[O-] 62a_200025704644_100000737091 [0,2,0,0,0,0|2,0,0]=4 9827 B12R1.279 [13CH3]SCc1cncc(c1)C(=O)N 62a_200010162415_200025704644 [0,2,0,0,0,0|2,0,0]=4 9828 B12R1.279 [13CH3]SCc1cncc(c1)C(=O)N 62a_200025704644_200010162415 [0,2,0,0,0,0|2,0,0]=4 9829 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [0,0,1,1,0,0|1,0,1]=4 9830 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [0,0,1,1,0,0|1,0,0]=3 9831 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [0,0,1,1,0,0|2,0,0]=4 9832 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [0,0,1,1,0,0|1,0,1]=4 9833 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,0,1,1,0,0|1,0,0]=3 9834 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [0,0,1,1,0,0|1,0,1]=4 9835 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [0,0,1,1,0,0|1,0,1]=4 9836 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [0,0,1,1,0,0|1,0,1]=4 9837 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [0,0,1,1,0,0|0,0,2]=4 9838 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [0,0,1,1,0,0|2,0,0]=4 9839 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [0,0,1,1,0,0|1,0,0]=3 9840 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [0,0,1,1,0,0|2,0,0]=4 9841 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [0,0,1,1,0,0|2,0,0]=4 9842 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,0,1,1,0,0|2,0,0]=4 9843 B10R1.4 CC=Cc1ccn[nH]c1=O 271570a_100016259895_100000087129 [0,0,1,1,0,0|2,0,0]=4 9844 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [0,0,1,1,0,0|2,0,0]=4 9845 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [0,0,1,1,0,0|2,0,0]=4 9846 B10R1.4 CC=Cc1cncnc1C 271570a_100016259895_100009819671 [0,0,1,1,0,0|2,0,0]=4 9847 B10R1.4 CC=Cc1ncc[nH]c1=O 271570a_100016259895_100000763361 [0,0,1,1,0,0|2,0,0]=4 9848 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [0,0,1,1,0,0|2,0,0]=4 9849 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [0,0,1,1,0,0|2,0,0]=4 9850 B10R1.130 C=C=Cc1cc(sc1C)C 271570a_100015277604_100000688054 [0,0,1,1,0,0|0,1,1]=4 9851 B10R1.130 CC=Cc1cc(sc1C)C 271570a_100016259895_100000688054 [0,0,1,1,0,0|0,1,1]=4 9852 B10R1.64 CC(=Cc1ccsc1C)C 271570a_100102525489_100000684487 [0,0,1,1,0,0|0,1,1]=4 9853 B10R1.131 CC=Cc1cc(c(s1)C)C 271570a_100016259895_100009850898 [0,0,1,1,0,0|0,1,1]=4 9854 B10R1.66 CC(=O)C=CC1=CCCC1 1458a_100016262312_200000210301 [0,0,1,1,0,0|0,0,2]=4 9855 B10R1.66 CC(=O)C=Cc1c[nH]cn1 1458a_100102678534_200000210301 [0,0,1,1,0,0|2,0,0]=4 9856 B10R1.66 CC(=O)C=Cc1cccs1 1458a_100000182767_200000210301 [0,0,1,1,0,0|1,0,0]=3 9857 B10R1.66 CC(=O)C=Cc1ccoc1 1458a_100000238621_200000210301 [0,0,1,1,0,0|1,0,1]=4 9858 B10R1.66 CC(=O)C=Cc1ccsc1 1458a_100000698588_200000210301 [0,0,1,1,0,0|1,0,1]=4 9859 B10R1.66 CC(=O)C=Cc1cscn1 1458a_200000747928_200000210301 [0,0,1,1,0,0|2,0,0]=4 9860 B10R1.66 CC(=O)C=Cc1nccs1 1458a_100102558208_200000210301 [0,0,1,1,0,0|2,0,0]=4 9861 B10R1.66 [13CH3]C(=O)C=CC1=CCCC1 1458a_100016262312_200025704644 [0,0,1,1,0,0|0,0,2]=4 9862 B10R1.66 [13CH3]C(=O)C=Cc1c[nH]cn1 1458a_100102678534_200025704644 [0,0,1,1,0,0|2,0,0]=4 9863 B10R1.66 [13CH3]C(=O)C=Cc1cccs1 1458a_100000182767_200025704644 [0,0,1,1,0,0|1,0,0]=3 9864 B10R1.66 [13CH3]C(=O)C=Cc1ccoc1 1458a_100000238621_200025704644 [0,0,1,1,0,0|1,0,1]=4 9865 B10R1.66 [13CH3]C(=O)C=Cc1ccsc1 1458a_100000698588_200025704644 [0,0,1,1,0,0|1,0,1]=4 9866 B10R1.66 [13CH3]C(=O)C=Cc1cscn1 1458a_200000747928_200025704644 [0,0,1,1,0,0|2,0,0]=4 9867 B10R1.66 [13CH3]C(=O)C=Cc1nccs1 1458a_100102558208_200025704644 [0,0,1,1,0,0|2,0,0]=4 9868 B10R1.54 CC(=Cc1cc(cs1)C)C 271570a_100102525489_100009876951 [0,0,1,1,0,0|2,0,0]=4 9869 B10R1.54 CC(=Cc1ccc(s1)C)C 271570a_100102525489_100000761539 [0,0,1,1,0,0|0,1,1]=4 9870 B10R1.54 CC(=Cc1csc(c1)C)C 271570a_100102525489_100000759034 [0,0,1,1,0,0|2,0,0]=4 9871 B10R2.31 Oc1ccc2c(c1)CC2 271570a_203496583355_100009818592 [1,0,0,1,0,0|1,0,1]=4 9872 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|1,0,1]=4 9873 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,0,0,1,0,1|2,0,0]=4 9874 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,0,0,1,0,1|2,0,0]=4 9875 B12R2.202 Cc1cccc2c1CN(C2)C 2230a_100020635169_200000210301 [0,0,0,1,0,1|2,0,0]=4 9876 B12R2.202 Cc1cccc2c1CN(C2)C 269982a_100020635169_200000210301 [0,0,0,1,0,1|2,0,0]=4 9877 B12R2.202 Cc1cccc2c1CN(C2)C 34a_100020635169_200000210301 [0,0,0,1,0,1|2,0,0]=4 9878 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 2230a_100020635169_200025704644 [0,0,0,1,0,1|2,0,0]=4 9879 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 269982a_100020635169_200025704644 [0,0,0,1,0,1|2,0,0]=4 9880 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 34a_100020635169_200025704644 [0,0,0,1,0,1|2,0,0]=4 9881 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,0,0,1,0,1|1,0,1]=4 9882 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,0,0,1,0,1|2,0,0]=4 9883 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,0,0,1,0,1|2,0,0]=4 9884 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,0,0,1,0,1|2,0,0]=4 9885 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,0,0,1,0,1|1,0,1]=4 9886 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,0,0,1,0,1|1,1,0]=4 9887 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,0,0,1,0,1|1,0,0]=3 9888 B12R2.202 O=C1Cc2c(ccnc2N1)O 271570a_203496583355_100000104061 [0,0,0,1,0,1|2,0,0]=4 9889 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,0,0,1,0,1|1,0,0]=3 9890 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,0,0,1,0,1|2,0,0]=4 9891 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,0,0,1,0,1|2,0,0]=4 9892 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,0,0,1,0,1|2,0,0]=4 9893 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,0,0,1,0,1|1,1,0]=4 9894 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,0,0,1,0,1|2,0,0]=4 9895 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [0,0,0,1,0,1|1,0,1]=4 9896 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,0,0,1,0,1|2,0,0]=4 9897 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,0,0,1,0,1|1,0,1]=4 9898 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,0,0,1,0,1|1,1,0]=4 9899 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,0,0,1,0,1|2,0,0]=4 9900 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,0,0,1,0,1|2,0,0]=4 9901 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,0,0,1,0,1|2,0,0]=4 9902 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,0,0,1,0,1|1,0,0]=3 9903 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,0,0,1,0,1|1,0,0]=3 9904 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [0,0,0,1,0,1|2,0,0]=4 9905 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [0,0,0,1,0,1|2,0,0]=4 9906 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [0,0,0,1,0,1|2,0,0]=4 9907 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,0,0,1,0,1|2,0,0]=4 9908 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,0,0,1,0,1|2,0,0]=4 9909 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,0,0,1,0,1|2,0,0]=4 9910 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,0,0,1,0,1|2,0,0]=4 9911 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,0,0,1,0,1|2,0,0]=4 9912 B12R2.1286 Cc1cccc(c1)NC2CC2 34a_100000188690_100000211595 [0,0,0,1,0,1|1,0,1]=4 9913 B12R2.1286 Cc1cccc(c1)OC2CC2 34a_100000210337_100000211595 [0,0,0,1,0,1|1,0,1]=4 9914 B12R2.1286 Cc1cccc(c1)SC2CC2 62a_100011215228_100000211595 [0,0,0,1,0,1|1,0,1]=4 9915 B12R2.291 Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100009813585 [0,1,0,1,0,0|1,0,1]=4 9916 B12R2.291 Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100000049509 [0,1,0,1,0,0|1,0,1]=4 9917 B12R2.291 Cc1cc(ccc1F)C2CC2 271570a_100011220607_100011218330 [0,1,0,1,0,0|1,0,1]=4 9918 B12R2.291 Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000211769 [0,1,0,1,0,0|1,0,1]=4 9919 B12R2.291 Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186361 [0,1,0,1,0,0|1,0,1]=4 9920 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [0,1,0,1,0,0|1,0,1]=4 9921 B12R2.1384 C=C(C)c1ccc2c(c1)CC2 271570a_100000694244_100009818592 [0,1,0,1,0,0|1,0,0]=3 9922 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [0,1,0,1,0,0|0,0,0]=2 9923 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [0,1,0,1,0,0|0,0,0]=2 9924 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,1,0,0|2,0,0]=4 9925 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,1,0,1,0,0|1,0,1]=4 9926 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,1,0,0|1,0,1]=4 9927 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,1,0,0|1,1,0]=4 9928 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,1,0,1,0,0|2,0,0]=4 9929 B12R2.132 Cc1noc2c1cc(cc2)O 271570a_203496583355_100010196875 [0,1,0,1,0,0|1,0,1]=4 9930 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,1,0,0|1,0,0]=3 9931 B12R2.132 O=C1CCc2c1cc(cn2)O 271570a_203496583355_100010174022 [0,1,0,1,0,0|2,0,0]=4 9932 B12R2.132 O=C1CCc2c1nc(cc2)O 271570a_203496583355_100000701527 [0,1,0,1,0,0|2,0,0]=4 9933 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,1,0,0|1,0,0]=3 9934 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,1,0,1,0,0|1,0,0]=3 9935 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,1,0,0|1,0,0]=3 9936 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,1,0,1,0,0|2,0,0]=4 9937 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,1,0,0|2,0,0]=4 9938 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,1,0,0|2,0,0]=4 9939 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [0,1,0,1,0,0|1,0,1]=4 9940 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,1,0,1,0,0|2,0,0]=4 9941 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,1,0,0|1,0,0]=3 9942 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,1,0,0|1,0,0]=3 9943 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,1,0,0|1,0,0]=3 9944 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,1,0,0|1,0,0]=3 9945 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,1,0,0|2,0,0]=4 9946 B12R2.2294 Cc1cc(cc(c1)C2CC2)C 271570a_100011220607_100011215608 [0,1,0,1,0,0|1,0,1]=4 9947 B12R2.2294 Cc1cc(cc(c1)C2CC2)Cl 271570a_100011220607_100010172791 [0,1,0,1,0,0|1,0,1]=4 9948 B12R2.2294 Cc1cc(cc(c1)C2CC2)F 271570a_100011220607_100011356977 [0,1,0,1,0,0|1,0,1]=4 9949 B12R2.2294 Cc1cc(cc(c1)C2CC2)N 271570a_100011220607_100000695972 [0,1,0,1,0,0|1,0,1]=4 9950 B12R2.2294 Cc1cc(cc(c1)C2CC2)O 271570a_100011220607_100011999630 [0,1,0,1,0,0|1,0,1]=4 9951 B12R2.81 Cc1cccc(c1C)C2CC2 271570a_100011220607_100011214922 [0,1,0,1,0,0|1,0,1]=4 9952 B12R2.81 Cc1cccc(c1Cl)C2CC2 271570a_100011220607_200012352035 [0,1,0,1,0,0|1,0,1]=4 9953 B12R2.81 Cc1cccc(c1F)C2CC2 271570a_100011220607_100000717567 [0,1,0,1,0,0|1,0,1]=4 9954 B12R2.81 Cc1cccc(c1N)C2CC2 271570a_100011220607_100011834072 [0,1,0,1,0,0|1,0,1]=4 9955 B12R2.81 Cc1cccc(c1O)C2CC2 271570a_100011220607_100009817157 [0,1,0,1,0,0|1,0,1]=4 9956 B12R2.1316 Cc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100012353751 [0,1,0,1,0,0|1,0,1]=4 9957 B12R2.1316 Cc1ccc(c(c1)C2CC2)C 271570a_100011220607_100000210833 [0,1,0,1,0,0|1,0,1]=4 9958 B12R2.1316 Cc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100012356289 [0,1,0,1,0,0|1,0,1]=4 9959 B12R2.1316 Cc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000736223 [0,1,0,1,0,0|1,0,1]=4 9960 B12R2.1316 Cc1ccc(c(c1)C2CC2)N 271570a_100011220607_100000210942 [0,1,0,1,0,0|1,0,1]=4 9961 B12R2.1316 Cc1ccc(c(c1)C2CC2)O 271570a_100011220607_100000765521 [0,1,0,1,0,0|1,0,1]=4 9962 B12R2.43 CCc1cccc(c1)C2CC2 271570a_100011220607_100000684523 [0,1,0,1,0,0|1,0,1]=4 9963 B12R2.43 CNc1cccc(c1)C2CC2 271570a_100011220607_100000219648 [0,1,0,1,0,0|1,0,1]=4 9964 B12R2.43 CNc1cccc(c1)C2CC2 34a_100025755985_200000210301 [0,1,0,1,0,0|1,0,1]=4 9965 B12R2.43 CNc1cccc(c1)C2CC2 7a_100025755985_200000210301 [0,1,0,1,0,0|1,0,1]=4 9966 B12R2.43 COc1cccc(c1)C2CC2 271570a_100011220607_100000170001 [0,1,0,1,0,0|1,0,1]=4 9967 B12R2.43 COc1cccc(c1)C2CC2 34a_100011787725_200000210301 [0,1,0,1,0,0|1,0,1]=4 9968 B12R2.43 COc1cccc(c1)C2CC2 7a_100011787725_200000210301 [0,1,0,1,0,0|1,0,1]=4 9969 B12R2.43 CSc1cccc(c1)C2CC2 271570a_100011220607_100011215954 [0,1,0,1,0,0|1,0,1]=4 9970 B12R2.43 CSc1cccc(c1)C2CC2 62a_200000210301_100009816567 [0,1,0,1,0,0|1,0,1]=4 9971 B12R2.43 FCc1cccc(c1)C2CC2 271570a_100011220607_100010878472 [0,1,0,1,0,0|1,0,1]=4 9972 B12R2.43 NCc1cccc(c1)C2CC2 271570a_100011220607_100000106179 [0,1,0,1,0,0|1,0,1]=4 9973 B12R2.43 OCc1cccc(c1)C2CC2 271570a_100011220607_100000687537 [0,1,0,1,0,0|1,0,1]=4 9974 B12R2.43 [13CH3]Nc1cccc(c1)C2CC2 34a_100025755985_200025704644 [0,1,0,1,0,0|1,0,1]=4 9975 B12R2.43 [13CH3]Nc1cccc(c1)C2CC2 7a_100025755985_200025704644 [0,1,0,1,0,0|1,0,1]=4 9976 B12R2.43 [13CH3]Oc1cccc(c1)C2CC2 34a_100011787725_200025704644 [0,1,0,1,0,0|1,0,1]=4 9977 B12R2.43 [13CH3]Oc1cccc(c1)C2CC2 7a_100011787725_200025704644 [0,1,0,1,0,0|1,0,1]=4 9978 B12R2.43 [13CH3]Sc1cccc(c1)C2CC2 62a_200025704644_100009816567 [0,1,0,1,0,0|1,0,1]=4 9979 B8R0.28 C=C(C)C=NNC(=O)C 4a_100000189765_100000210575 [0,0,1,0,1,0|2,0,0]=4 9980 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,0,0,0,1,0|1,0,1]=4 9981 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,0,0,0,1,0|1,0,1]=4 9982 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,0,0,0,1,0|1,0,1]=4 9983 B8R1.1 CSc1cc(cs1)C 62a_100009876951_200000210301 [1,0,0,0,1,0|2,0,0]=4 9984 B8R1.1 CSc1cc(cs1)C 62a_200000210301_100009876951 [1,0,0,0,1,0|2,0,0]=4 9985 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,0,0,0,1,0|2,0,0]=4 9986 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,0,0,0,1,0|2,0,0]=4 9987 B8R1.1 CSc1csc(c1)C 62a_100000759034_200000210301 [1,0,0,0,1,0|2,0,0]=4 9988 B8R1.1 CSc1csc(c1)C 62a_200000210301_100000759034 [1,0,0,0,1,0|2,0,0]=4 9989 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_100000759034_200025704644 [1,0,0,0,1,0|2,0,0]=4 9990 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_200025704644_100000759034 [1,0,0,0,1,0|2,0,0]=4 9991 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,0,0,0,1,0|2,0,0]=4 9992 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,0,0,0,1,0|2,0,0]=4 9993 B8R1.1 Cc1csc(c1)S[13CH3] 62a_100009876951_200025704644 [1,0,0,0,1,0|2,0,0]=4 9994 B8R1.1 Cc1csc(c1)S[13CH3] 62a_200025704644_100009876951 [1,0,0,0,1,0|2,0,0]=4 9995 B8R1.1 O=Cc1c[nH]c(c1)O 271570a_203496583355_100009882863 [1,0,0,0,1,0|2,0,0]=4 9996 B8R1.1 O=Cc1cc(co1)O 271570a_203496583355_100000747035 [1,0,0,0,1,0|2,0,0]=4 9997 B8R1.1 O=Cc1cc(cs1)O 271570a_203496583355_100000211722 [1,0,0,0,1,0|2,0,0]=4 9998 B8R1.1 O=Cc1ccc(o1)O 271570a_203496583355_100000185145 [1,0,0,0,1,0|2,0,0]=4 9999 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,0,0,0,1,0|2,0,0]=4 10000 B8R1.1 O=Cc1csc(c1)O 271570a_203496583355_100000737087 [1,0,0,0,1,0|2,0,0]=4 10001 B8R1.11 C=Cc1ccsc1C 271570a_100011290941_100000684487 [1,0,0,0,1,0|1,0,1]=4 10002 B8R1.11 C=Cc1cscc1C 271570a_100011290941_100000759966 [1,0,0,0,1,0|1,0,1]=4 10003 B8R1.11 C=Cc1sccc1C 271570a_100011290941_100000742657 [1,0,0,0,1,0|1,0,1]=4 10004 B8R1.11 CSc1ccsc1C 62a_100000684487_200000210301 [1,0,0,0,1,0|2,0,0]=4 10005 B8R1.11 CSc1ccsc1C 62a_200000210301_100000684487 [1,0,0,0,1,0|2,0,0]=4 10006 B8R1.11 CSc1cscc1C 62a_100000759966_200000210301 [1,0,0,0,1,0|2,0,0]=4 10007 B8R1.11 CSc1cscc1C 62a_200000210301_100000759966 [1,0,0,0,1,0|2,0,0]=4 10008 B8R1.11 CSc1sccc1C 62a_100010247149_200000210301 [1,0,0,0,1,0|2,0,0]=4 10009 B8R1.11 CSc1sccc1C 62a_200000210301_100010247149 [1,0,0,0,1,0|2,0,0]=4 10010 B8R1.11 Cc1ccsc1S[13CH3] 62a_100010247149_200025704644 [1,0,0,0,1,0|2,0,0]=4 10011 B8R1.11 Cc1ccsc1S[13CH3] 62a_200025704644_100010247149 [1,0,0,0,1,0|2,0,0]=4 10012 B8R1.11 Cc1cscc1S[13CH3] 62a_100000759966_200025704644 [1,0,0,0,1,0|2,0,0]=4 10013 B8R1.11 Cc1cscc1S[13CH3] 62a_200025704644_100000759966 [1,0,0,0,1,0|2,0,0]=4 10014 B8R1.11 Cc1sccc1S[13CH3] 62a_100000684487_200025704644 [1,0,0,0,1,0|2,0,0]=4 10015 B8R1.11 Cc1sccc1S[13CH3] 62a_200025704644_100000684487 [1,0,0,0,1,0|2,0,0]=4 10016 B8R1.11 O=Cc1ccsc1O 271570a_203496583355_100009816921 [1,0,0,0,1,0|2,0,0]=4 10017 B8R1.11 O=Cc1cscc1O 271570a_203496583355_100000685484 [1,0,0,0,1,0|2,0,0]=4 10018 B8R1.11 O=Cc1occc1O 271570a_203496583355_100000756499 [1,0,0,0,1,0|2,0,0]=4 10019 B8R1.11 O=Cc1sccc1O 271570a_203496583355_100000766043 [1,0,0,0,1,0|2,0,0]=4 10020 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [1,0,0,0,1,0|2,0,0]=4 10021 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,0,0,0,1,0|2,0,0]=4 10022 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,0,0,0,1,0|2,0,0]=4 10023 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,0,0,0,1,0|2,0,0]=4 10024 B10R0.6 C/C=C/C=CC(=O)CC(=O)N 1458a_100000185730_100000187820 [0,0,1,0,0,1|2,0,0]=4 10025 B10R0.6 C/C=C/C=CC(=O)CC(=O)[O-] 1458a_100000185730_100020667443 [0,0,1,0,0,1|2,0,0]=4 10026 B10R0.6 C=C(C)CC(=O)C=C/C=C/C 1458a_100000185730_100000748629 [0,0,1,0,0,1|2,0,0]=4 10027 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,0,0,0,1|1,0,0]=3 10028 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,0,0,0,0,1|2,0,0]=4 10029 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,0,0,0,1|2,0,0]=4 10030 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,0,0,0,0,1|2,0,0]=4 10031 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,0,0,0,0,1|1,0,0]=3 10032 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,1|0,0,0]=2 10033 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,0,0,0,0,1|1,0,0]=3 10034 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,0,0,0,0,1|1,0,0]=3 10035 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,0,0,0,0,1|1,0,0]=3 10036 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,0,0,0,0,1|1,0,0]=3 10037 B10R1.18 CC(=O)Cc1cccnn1 1458a_100000070787_100016990269 [1,0,0,0,0,1|2,0,0]=4 10038 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,0,0,0,0,1|1,0,0]=3 10039 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [1,0,0,0,0,1|2,0,0]=4 10040 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000070787_100015196519 [1,0,0,0,0,1|2,0,0]=4 10041 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000721575_200000210301 [1,0,0,0,0,1|2,0,0]=4 10042 B10R1.18 CC(=O)Cc1ncccn1 1458a_100000070787_100000703007 [1,0,0,0,0,1|2,0,0]=4 10043 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,1|0,0,0]=2 10044 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,1|0,0,0]=2 10045 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,1|0,0,0]=2 10046 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,1|0,0,0]=2 10047 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,0,0,0,0,1|1,0,1]=4 10048 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,1|1,0,1]=4 10049 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,1|1,0,1]=4 10050 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,0,0,0,0,1|1,0,1]=4 10051 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,0,0,0,0,1|1,0,1]=4 10052 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,0,0,0,0,1|2,0,0]=4 10053 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,0,0,0,0,1|2,0,0]=4 10054 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,0,0,0,0,1|2,0,0]=4 10055 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,0,0,0,0,1|2,0,0]=4 10056 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,0,0,0,0,1|2,0,0]=4 10057 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,0,0,0,0,1|2,0,0]=4 10058 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,0,0,0,0,1|2,0,0]=4 10059 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,0,0,0,0,1|1,0,0]=3 10060 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,0,0,0,0,1|1,0,0]=3 10061 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,0,0,0,0,1|1,0,0]=3 10062 B10R1.18 [13CH3]C(=O)Cc1cncnc1 1458a_100000721575_200025704644 [1,0,0,0,0,1|2,0,0]=4 10063 B12R1.226 C=C(C)CNc1cccc(c1)Br 34a_100000210019_100000748629 [0,0,0,0,0,2|2,0,0]=4 10064 B12R1.226 C=C(C)CNc1cccc(c1)C 2230a_100000188690_100000748629 [0,0,0,0,0,2|1,0,0]=3 10065 B12R1.226 C=C(C)CNc1cccc(c1)C 34a_100000188690_100000748629 [0,0,0,0,0,2|1,0,0]=3 10066 B12R1.226 C=C(C)CNc1cccc(c1)Cl 34a_100000185859_100000748629 [0,0,0,0,0,2|2,0,0]=4 10067 B12R1.226 C=C(C)CNc1cccc(c1)F 34a_100000210047_100000748629 [0,0,0,0,0,2|2,0,0]=4 10068 B12R1.226 C=C(C)CNc1cccc(c1)I 34a_100000211102_100000748629 [0,0,0,0,0,2|2,0,0]=4 10069 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [0,0,0,0,0,2|2,0,0]=4 10070 B12R1.226 C=C(C)CNc1ccnc(c1)C 27a_100000765925_100000758586 [0,0,0,0,0,2|2,0,0]=4 10071 B12R1.226 C=C(C)COc1cccc(c1)Br 34a_100000210342_100000748629 [0,0,0,0,0,2|2,0,0]=4 10072 B12R1.226 C=C(C)COc1cccc(c1)Br 7a_100000210342_100000748629 [0,0,0,0,0,2|2,0,0]=4 10073 B12R1.226 C=C(C)COc1cccc(c1)C 34a_100000210337_100000748629 [0,0,0,0,0,2|1,0,0]=3 10074 B12R1.226 C=C(C)COc1cccc(c1)C 7a_100000210337_100000748629 [0,0,0,0,0,2|1,0,0]=3 10075 B12R1.226 C=C(C)COc1cccc(c1)Cl 34a_100000210295_100000748629 [0,0,0,0,0,2|2,0,0]=4 10076 B12R1.226 C=C(C)COc1cccc(c1)Cl 7a_100000210295_100000748629 [0,0,0,0,0,2|2,0,0]=4 10077 B12R1.226 C=C(C)COc1cccc(c1)F 34a_100000210426_100000748629 [0,0,0,0,0,2|2,0,0]=4 10078 B12R1.226 C=C(C)COc1cccc(c1)F 7a_100000210426_100000748629 [0,0,0,0,0,2|2,0,0]=4 10079 B12R1.226 C=C(C)COc1cccc(c1)I 34a_100000211634_100000748629 [0,0,0,0,0,2|2,0,0]=4 10080 B12R1.226 C=C(C)COc1cccc(c1)I 7a_100000211634_100000748629 [0,0,0,0,0,2|2,0,0]=4 10081 B12R1.226 C=C(C)COc1cccc(c1)N 34a_100000210217_100000748629 [0,0,0,0,0,2|2,0,0]=4 10082 B12R1.226 C=C(C)COc1ccnc(c1)C 34a_100000688365_100000748629 [0,0,0,0,0,2|2,0,0]=4 10083 B12R1.226 C=C(C)COc1cncc(c1)C 34a_100011830280_100000748629 [0,0,0,0,0,2|2,0,0]=4 10084 B12R1.226 C=C(C)COc1cncc(c1)C 7a_100011830280_100000748629 [0,0,0,0,0,2|2,0,0]=4 10085 B12R1.226 C=C(C)CSc1cc(ccn1)C 62a_100000748629_100000750283 [0,0,0,0,0,2|2,0,0]=4 10086 B12R1.226 C=C(C)CSc1cc(ccn1)C 62a_100000750283_100000211660 [0,0,0,0,0,2|2,0,0]=4 10087 B12R1.226 C=C(C)CSc1ccc[n+](c1)C 62a_100000748629_100009996589 [0,0,0,0,0,2|2,0,0]=4 10088 B12R1.226 C=C(C)CSc1ccc[n+](c1)C 62a_100009996589_100000211660 [0,0,0,0,0,2|2,0,0]=4 10089 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000691529_100000211660 [0,0,0,0,0,2|2,0,0]=4 10090 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000748629_100000691529 [0,0,0,0,0,2|2,0,0]=4 10091 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100000748629_100011215228 [0,0,0,0,0,2|1,0,0]=3 10092 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100011215228_100000211660 [0,0,0,0,0,2|1,0,0]=3 10093 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000699651_100000211660 [0,0,0,0,0,2|2,0,0]=4 10094 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000748629_100000699651 [0,0,0,0,0,2|2,0,0]=4 10095 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000685547_100000211660 [0,0,0,0,0,2|2,0,0]=4 10096 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000748629_100000685547 [0,0,0,0,0,2|2,0,0]=4 10097 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000210019_100000211660 [0,0,0,0,0,2|2,0,0]=4 10098 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000748629_100000210019 [0,0,0,0,0,2|2,0,0]=4 10099 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [0,0,0,0,0,2|2,0,0]=4 10100 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_100000748629_114929384022 [0,0,0,0,0,2|2,0,0]=4 10101 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_114929384022_100000211660 [0,0,0,0,0,2|2,0,0]=4 10102 B12R1.226 C=C(C)CSc1cccc(n1)C 62a_100000742759_100000211660 [0,0,0,0,0,2|2,0,0]=4 10103 B12R1.226 C=C(C)CSc1cccc(n1)C 62a_100000748629_100000742759 [0,0,0,0,0,2|2,0,0]=4 10104 B12R1.226 C=C(C)CSc1ccnc(c1)C 62a_100000748629_100000758586 [0,0,0,0,0,2|2,0,0]=4 10105 B12R1.226 C=C(C)CSc1ccnc(c1)C 62a_100000758586_100000211660 [0,0,0,0,0,2|2,0,0]=4 10106 B12R1.226 C=C(C)CSc1cncc(c1)C 62a_100000748629_100000760492 [0,0,0,0,0,2|2,0,0]=4 10107 B12R1.226 C=C(C)CSc1cncc(c1)C 62a_100000760492_100000211660 [0,0,0,0,0,2|2,0,0]=4 10108 B12R1.226 C=C(F)CNc1cccc(c1)C 2230a_100000188690_100009893438 [0,0,0,0,0,2|1,0,1]=4 10109 B12R1.226 C=C(F)CNc1cccc(c1)C 34a_100000188690_100009893438 [0,0,0,0,0,2|1,0,1]=4 10110 B12R1.226 C=C(F)COc1cccc(c1)C 34a_100000210337_100009893438 [0,0,0,0,0,2|1,0,1]=4 10111 B12R1.226 C=C(F)COc1cccc(c1)C 7a_100000210337_100000042424 [0,0,0,0,0,2|1,0,1]=4 10112 B12R1.226 C=C(F)CSc1cccc(c1)C 62a_100000042424_100011215228 [0,0,0,0,0,2|1,0,1]=4 10113 B12R1.226 C=C(F)CSc1cccc(c1)C 62a_100011215228_100000042424 [0,0,0,0,0,2|1,0,1]=4 10114 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [0,0,0,0,0,2|1,0,0]=3 10115 B12R1.226 CC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200000210301 [0,0,0,0,0,2|1,0,0]=3 10116 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [0,0,0,0,0,2|0,0,0]=2 10117 B12R1.226 CC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200000210301 [0,0,0,0,0,2|1,0,0]=3 10118 B12R1.226 CC(=O)C#Cc1cccc(c1)F 1458a_100011892744_200000210301 [0,0,0,0,0,2|1,0,0]=3 10119 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [0,0,0,0,0,2|1,0,0]=3 10120 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [0,0,0,0,0,2|1,0,0]=3 10121 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,0,0,0,0,2|0,0,0]=2 10122 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [0,0,0,0,0,2|1,0,0]=3 10123 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [0,0,0,0,0,2|1,0,0]=3 10124 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [0,0,0,0,0,2|1,0,0]=3 10125 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [0,0,0,0,0,2|1,0,0]=3 10126 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [0,0,0,0,0,2|1,0,0]=3 10127 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [0,0,0,0,0,2|0,0,0]=2 10128 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [0,0,0,0,0,2|0,0,0]=2 10129 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [0,0,0,0,0,2|1,0,0]=3 10130 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [0,0,0,0,0,2|1,0,0]=3 10131 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [0,0,0,0,0,2|1,0,0]=3 10132 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [0,0,0,0,0,2|1,0,0]=3 10133 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [0,0,0,0,0,2|1,0,0]=3 10134 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [0,0,0,0,0,2|1,0,0]=3 10135 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [0,0,0,0,0,2|1,0,0]=3 10136 B12R1.226 CC(=O)COc1cccc(c1)Br 1458a_100000182359_200000210301 [0,0,0,0,0,2|1,0,0]=3 10137 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [0,0,0,0,0,2|0,0,0]=2 10138 B12R1.226 CC(=O)COc1cccc(c1)Cl 1458a_100000184978_200000210301 [0,0,0,0,0,2|1,0,0]=3 10139 B12R1.226 CC(=O)COc1cccc(c1)F 1458a_100000182781_200000210301 [0,0,0,0,0,2|1,0,0]=3 10140 B12R1.226 CC(=O)CSc1cccc(c1)Br 1458a_100000760868_200000210301 [0,0,0,0,0,2|1,0,0]=3 10141 B12R1.226 CC(=O)CSc1nccc(n1)C 1458a_200000179490_200000210301 [0,0,0,0,0,2|2,0,0]=4 10142 B12R1.226 CC(=O)NCc1cc(ccn1)Br 11a_100009818019_100015343762 [0,0,0,0,0,2|2,0,0]=4 10143 B12R1.226 CC(=O)NCc1cc(ccn1)Br 1626a_100009818019_100015343762 [0,0,0,0,0,2|2,0,0]=4 10144 B12R1.226 CC(=O)NCc1cc(ccn1)Br 240690a_100009818019_100015343762 [0,0,0,0,0,2|2,0,0]=4 10145 B12R1.226 CC(=O)NCc1cc(ccn1)Br 527a_100009818019_100103153847 [0,0,0,0,0,2|2,0,0]=4 10146 B12R1.226 CC(=O)NCc1cc(ccn1)C 11a_100011934573_100015343762 [0,0,0,0,0,2|1,0,0]=3 10147 B12R1.226 CC(=O)NCc1cc(ccn1)C 1626a_100011934573_100015343762 [0,0,0,0,0,2|1,0,0]=3 10148 B12R1.226 CC(=O)NCc1cc(ccn1)C 240690a_100011934573_100015343762 [0,0,0,0,0,2|1,0,0]=3 10149 B12R1.226 CC(=O)NCc1cc(ccn1)C 527a_100011934573_100103153847 [0,0,0,0,0,2|1,0,0]=3 10150 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 11a_100000085674_100015343762 [0,0,0,0,0,2|2,0,0]=4 10151 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 1626a_100000085674_100015343762 [0,0,0,0,0,2|2,0,0]=4 10152 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 240690a_100000085674_100015343762 [0,0,0,0,0,2|2,0,0]=4 10153 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 527a_100000085674_100103153847 [0,0,0,0,0,2|2,0,0]=4 10154 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 11a_100000696482_100015343762 [0,0,0,0,0,2|2,0,0]=4 10155 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 1626a_100000696482_100015343762 [0,0,0,0,0,2|2,0,0]=4 10156 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 240690a_100000696482_100015343762 [0,0,0,0,0,2|2,0,0]=4 10157 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 527a_100000696482_100103153847 [0,0,0,0,0,2|2,0,0]=4 10158 B12R1.226 CC(=O)NCc1cccc(c1)Br 11a_100000174977_100015343762 [0,0,0,0,0,2|1,0,0]=3 10159 B12R1.226 CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100015343762 [0,0,0,0,0,2|1,0,0]=3 10160 B12R1.226 CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100015343762 [0,0,0,0,0,2|1,0,0]=3 10161 B12R1.226 CC(=O)NCc1cccc(c1)Br 527a_100000174977_100103153847 [0,0,0,0,0,2|1,0,0]=3 10162 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [0,0,0,0,0,2|0,0,0]=2 10163 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [0,0,0,0,0,2|0,0,0]=2 10164 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [0,0,0,0,0,2|0,0,0]=2 10165 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [0,0,0,0,0,2|0,0,0]=2 10166 B12R1.226 CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100015343762 [0,0,0,0,0,2|1,0,0]=3 10167 B12R1.226 CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100015343762 [0,0,0,0,0,2|1,0,0]=3 10168 B12R1.226 CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100015343762 [0,0,0,0,0,2|1,0,0]=3 10169 B12R1.226 CC(=O)NCc1cccc(c1)Cl 527a_100000174878_100103153847 [0,0,0,0,0,2|1,0,0]=3 10170 B12R1.226 CC(=O)NCc1cccc(c1)F 11a_100000174948_100015343762 [0,0,0,0,0,2|1,0,0]=3 10171 B12R1.226 CC(=O)NCc1cccc(c1)F 1626a_100000174948_100015343762 [0,0,0,0,0,2|1,0,0]=3 10172 B12R1.226 CC(=O)NCc1cccc(c1)F 240690a_100000174948_100015343762 [0,0,0,0,0,2|1,0,0]=3 10173 B12R1.226 CC(=O)NCc1cccc(c1)F 527a_100000174948_100103153847 [0,0,0,0,0,2|1,0,0]=3 10174 B12R1.226 CC(=O)NCc1cccc(c1)I 11a_100000106179_100015343762 [0,0,0,0,0,2|1,0,0]=3 10175 B12R1.226 CC(=O)NCc1cccc(c1)I 1626a_100000106179_100015343762 [0,0,0,0,0,2|1,0,0]=3 10176 B12R1.226 CC(=O)NCc1cccc(c1)I 240690a_100000106179_100015343762 [0,0,0,0,0,2|1,0,0]=3 10177 B12R1.226 CC(=O)NCc1cccc(c1)I 527a_100000106179_100103153847 [0,0,0,0,0,2|1,0,0]=3 10178 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [0,0,0,0,0,2|1,0,0]=3 10179 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [0,0,0,0,0,2|1,0,0]=3 10180 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [0,0,0,0,0,2|1,0,0]=3 10181 B12R1.226 CC(=O)NCc1cccc(n1)Br 11a_100016987751_100015343762 [0,0,0,0,0,2|2,0,0]=4 10182 B12R1.226 CC(=O)NCc1cccc(n1)Br 1626a_100016987751_100015343762 [0,0,0,0,0,2|2,0,0]=4 10183 B12R1.226 CC(=O)NCc1cccc(n1)Br 240690a_100016987751_100015343762 [0,0,0,0,0,2|2,0,0]=4 10184 B12R1.226 CC(=O)NCc1cccc(n1)Br 527a_100016987751_100103153847 [0,0,0,0,0,2|2,0,0]=4 10185 B12R1.226 CC(=O)NCc1cccc(n1)C 11a_100000701342_100015343762 [0,0,0,0,0,2|1,0,0]=3 10186 B12R1.226 CC(=O)NCc1cccc(n1)C 1626a_100000701342_100015343762 [0,0,0,0,0,2|1,0,0]=3 10187 B12R1.226 CC(=O)NCc1cccc(n1)C 240690a_100000701342_100015343762 [0,0,0,0,0,2|1,0,0]=3 10188 B12R1.226 CC(=O)NCc1cccc(n1)C 527a_100000701342_100103153847 [0,0,0,0,0,2|1,0,0]=3 10189 B12R1.226 CC(=O)NCc1cccc(n1)Cl 11a_100016990191_100015343762 [0,0,0,0,0,2|2,0,0]=4 10190 B12R1.226 CC(=O)NCc1cccc(n1)Cl 1626a_100016990191_100015343762 [0,0,0,0,0,2|2,0,0]=4 10191 B12R1.226 CC(=O)NCc1cccc(n1)Cl 240690a_100016990191_100015343762 [0,0,0,0,0,2|2,0,0]=4 10192 B12R1.226 CC(=O)NCc1cccc(n1)Cl 527a_100016990191_100103153847 [0,0,0,0,0,2|2,0,0]=4 10193 B12R1.226 CC(=O)NCc1cccc(n1)F 11a_100015188798_100015343762 [0,0,0,0,0,2|2,0,0]=4 10194 B12R1.226 CC(=O)NCc1cccc(n1)F 1626a_100015188798_100015343762 [0,0,0,0,0,2|2,0,0]=4 10195 B12R1.226 CC(=O)NCc1cccc(n1)F 240690a_100015188798_100015343762 [0,0,0,0,0,2|2,0,0]=4 10196 B12R1.226 CC(=O)NCc1cccc(n1)F 527a_100015188798_100103153847 [0,0,0,0,0,2|2,0,0]=4 10197 B12R1.226 CC(=O)NCc1ccnc(c1)Br 11a_100025757509_100015343762 [0,0,0,0,0,2|2,0,0]=4 10198 B12R1.226 CC(=O)NCc1ccnc(c1)Br 240690a_100025757509_100015343762 [0,0,0,0,0,2|2,0,0]=4 10199 B12R1.226 CC(=O)NCc1ccnc(c1)Br 527a_100025757509_100103153847 [0,0,0,0,0,2|2,0,0]=4 10200 B12R1.226 CC(=O)NCc1ccnc(c1)C 11a_100011934566_100015343762 [0,0,0,0,0,2|1,0,0]=3 10201 B12R1.226 CC(=O)NCc1ccnc(c1)C 1626a_100011934566_100015343762 [0,0,0,0,0,2|1,0,0]=3 10202 B12R1.226 CC(=O)NCc1ccnc(c1)C 240690a_100011934566_100015343762 [0,0,0,0,0,2|1,0,0]=3 10203 B12R1.226 CC(=O)NCc1ccnc(c1)C 527a_100011934566_100103153847 [0,0,0,0,0,2|1,0,0]=3 10204 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 11a_100015205668_100015343762 [0,0,0,0,0,2|2,0,0]=4 10205 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 1626a_100015205668_100015343762 [0,0,0,0,0,2|2,0,0]=4 10206 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 240690a_100015205668_100015343762 [0,0,0,0,0,2|2,0,0]=4 10207 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 527a_100015205668_100103153847 [0,0,0,0,0,2|2,0,0]=4 10208 B12R1.226 CC(=O)NCc1ccnc(c1)F 11a_100015188774_100015343762 [0,0,0,0,0,2|2,0,0]=4 10209 B12R1.226 CC(=O)NCc1ccnc(c1)F 1626a_100015188774_100015343762 [0,0,0,0,0,2|2,0,0]=4 10210 B12R1.226 CC(=O)NCc1ccnc(c1)F 240690a_100015188774_100015343762 [0,0,0,0,0,2|2,0,0]=4 10211 B12R1.226 CC(=O)NCc1ccnc(c1)F 527a_100015188774_100103153847 [0,0,0,0,0,2|2,0,0]=4 10212 B12R1.226 CC(=O)NCc1ccnc(c1)O 11a_100000748557_100015343762 [0,0,0,0,0,2|2,0,0]=4 10213 B12R1.226 CC(=O)NCc1ccnc(c1)O 240690a_100000748557_100015343762 [0,0,0,0,0,2|2,0,0]=4 10214 B12R1.226 CC(=O)NCc1ccnc(c1)O 527a_100000748557_100103153847 [0,0,0,0,0,2|2,0,0]=4 10215 B12R1.226 CC(=O)NCc1cncc(c1)Br 11a_100011249555_100015343762 [0,0,0,0,0,2|2,0,0]=4 10216 B12R1.226 CC(=O)NCc1cncc(c1)Br 240690a_100011249555_100015343762 [0,0,0,0,0,2|2,0,0]=4 10217 B12R1.226 CC(=O)NCc1cncc(c1)Br 527a_100011249555_100103153847 [0,0,0,0,0,2|2,0,0]=4 10218 B12R1.226 CC(=O)NCc1cncc(c1)C 11a_100000692839_100015343762 [0,0,0,0,0,2|1,0,0]=3 10219 B12R1.226 CC(=O)NCc1cncc(c1)C 1626a_100000692839_100015343762 [0,0,0,0,0,2|1,0,0]=3 10220 B12R1.226 CC(=O)NCc1cncc(c1)C 240690a_100000692839_100015343762 [0,0,0,0,0,2|1,0,0]=3 10221 B12R1.226 CC(=O)NCc1cncc(c1)C 527a_100000692839_100103153847 [0,0,0,0,0,2|1,0,0]=3 10222 B12R1.226 CC(=O)NCc1cncc(c1)Cl 11a_200020614424_100015343762 [0,0,0,0,0,2|2,0,0]=4 10223 B12R1.226 CC(=O)NCc1cncc(c1)Cl 1626a_200020614424_100015343762 [0,0,0,0,0,2|2,0,0]=4 10224 B12R1.226 CC(=O)NCc1cncc(c1)Cl 240690a_200020614424_100015343762 [0,0,0,0,0,2|2,0,0]=4 10225 B12R1.226 CC(=O)NCc1cncc(c1)Cl 527a_200020614424_100103153847 [0,0,0,0,0,2|2,0,0]=4 10226 B12R1.226 CC(=O)NCc1cncc(c1)F 11a_100011962886_100015343762 [0,0,0,0,0,2|2,0,0]=4 10227 B12R1.226 CC(=O)NCc1cncc(c1)F 1626a_100011962886_100015343762 [0,0,0,0,0,2|2,0,0]=4 10228 B12R1.226 CC(=O)NCc1cncc(c1)F 240690a_100011962886_100015343762 [0,0,0,0,0,2|2,0,0]=4 10229 B12R1.226 CC(=O)NCc1cncc(c1)F 527a_100011962886_100103153847 [0,0,0,0,0,2|2,0,0]=4 10230 B12R1.226 CC(=O)NCc1nccc(n1)C 11a_100015186494_100015343762 [0,0,0,0,0,2|2,0,0]=4 10231 B12R1.226 CC(=O)NCc1nccc(n1)C 1626a_100015186494_100015343762 [0,0,0,0,0,2|2,0,0]=4 10232 B12R1.226 CC(=O)NCc1nccc(n1)C 240690a_100015186494_100015343762 [0,0,0,0,0,2|2,0,0]=4 10233 B12R1.226 CC(=O)NCc1nccc(n1)C 527a_100015186494_100103153847 [0,0,0,0,0,2|2,0,0]=4 10234 B12R1.226 CC(=O)NNc1cc(ccn1)Br 22a_100000764631_100000070787 [0,0,0,0,0,2|2,0,0]=4 10235 B12R1.226 CC(=O)NNc1cc(ccn1)C 22a_100000746014_100000070787 [0,0,0,0,0,2|1,0,0]=3 10236 B12R1.226 CC(=O)NNc1cc(ccn1)Cl 22a_100102524961_100000070787 [0,0,0,0,0,2|2,0,0]=4 10237 B12R1.226 CC(=O)NNc1cc(ccn1)I 22a_100010221011_100000070787 [0,0,0,0,0,2|2,0,0]=4 10238 B12R1.226 CC(=O)NNc1cc[nH]c(=O)c1 22a_100000120847_100000070787 [0,0,0,0,0,2|2,0,0]=4 10239 B12R1.226 CC(=O)NNc1cccc(c1)Br 22a_100000217339_100000070787 [0,0,0,0,0,2|1,0,0]=3 10240 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [0,0,0,0,0,2|0,0,0]=2 10241 B12R1.226 CC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000070787 [0,0,0,0,0,2|1,0,0]=3 10242 B12R1.226 CC(=O)NNc1cccc(c1)F 22a_100000745080_100000070787 [0,0,0,0,0,2|1,0,0]=3 10243 B12R1.226 CC(=O)NNc1cccc(c1)I 22a_100020605690_100000070787 [0,0,0,0,0,2|1,0,0]=3 10244 B12R1.226 CC(=O)NNc1cccc(n1)Br 22a_100009817029_100000070787 [0,0,0,0,0,2|2,0,0]=4 10245 B12R1.226 CC(=O)NNc1cccc(n1)C 22a_100011363444_100000070787 [0,0,0,0,0,2|1,0,0]=3 10246 B12R1.226 CC(=O)NNc1cccc(n1)Cl 22a_100102524919_100000070787 [0,0,0,0,0,2|2,0,0]=4 10247 B12R1.226 CC(=O)NNc1cccc(n1)F 22a_100000075452_100000070787 [0,0,0,0,0,2|2,0,0]=4 10248 B12R1.226 CC(=O)NNc1cccc(n1)O 271570a_203496583355_200000079166 [0,0,0,0,0,2|2,0,0]=4 10249 B12R1.226 CC(=O)NNc1cncc(c1)Br 22a_100000727789_100000070787 [0,0,0,0,0,2|2,0,0]=4 10250 B12R1.226 CC(=O)NNc1cncc(c1)F 22a_200011955905_100000070787 [0,0,0,0,0,2|2,0,0]=4 10251 B12R1.226 CC(=O)NNc1nccc(n1)C 22a_100011780740_100000070787 [0,0,0,0,0,2|2,0,0]=4 10252 B12R1.226 C[n+]1cccc(c1)SCC(=O)N 62a_100000747473_100009996589 [0,0,0,0,0,2|2,0,0]=4 10253 B12R1.226 C[n+]1cccc(c1)SCC(=O)N 62a_100009996589_100000747473 [0,0,0,0,0,2|2,0,0]=4 10254 B12R1.226 C[n+]1cccc(c1)SCC(=O)[O-] 62a_100009996589_100020667443 [0,0,0,0,0,2|2,0,0]=4 10255 B12R1.226 C[n+]1cccc(c1)SCC(=O)[O-] 62a_100020667443_100009996589 [0,0,0,0,0,2|2,0,0]=4 10256 B12R1.226 Cc1cc(ccn1)OCC(=O)N 34a_100000688365_100000187820 [0,0,0,0,0,2|2,0,0]=4 10257 B12R1.226 Cc1cc(ccn1)OCC(=O)[O-] 34a_100000688365_100020667443 [0,0,0,0,0,2|2,0,0]=4 10258 B12R1.226 Cc1cc(ccn1)SCC(=O)N 62a_100000747473_100000758586 [0,0,0,0,0,2|2,0,0]=4 10259 B12R1.226 Cc1cc(ccn1)SCC(=O)N 62a_100000758586_100000747473 [0,0,0,0,0,2|2,0,0]=4 10260 B12R1.226 Cc1cc(ccn1)SCC(=O)[O-] 62a_100000758586_100020667443 [0,0,0,0,0,2|2,0,0]=4 10261 B12R1.226 Cc1cc(ccn1)SCC(=O)[O-] 62a_100020667443_100000758586 [0,0,0,0,0,2|2,0,0]=4 10262 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [0,0,0,0,0,2|0,0,0]=2 10263 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,0,0,0,0,2|0,0,0]=2 10264 B12R1.226 Cc1cccc(c1)C=CC(C)C 271570a_100016257149_100011215228 [0,0,0,0,0,2|1,0,1]=4 10265 B12R1.226 Cc1cccc(c1)C=CC(C)O 271570a_200011019289_100011215228 [0,0,0,0,0,2|0,0,2]=4 10266 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [0,0,0,0,0,2|0,0,0]=2 10267 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_100102631434_100011713685 [0,0,0,0,0,2|2,0,0]=4 10268 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_114849113767_200000210301 [0,0,0,0,0,2|2,0,0]=4 10269 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_100102631434_100011713685 [0,0,0,0,0,2|2,0,0]=4 10270 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_114849113767_200000210301 [0,0,0,0,0,2|2,0,0]=4 10271 B12R1.226 Cc1cccc(c1)CCN(C)C 34a_114849113767_200000210301 [0,0,0,0,0,2|2,0,0]=4 10272 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 2230a_114849113767_200025704644 [0,0,0,0,0,2|2,0,0]=4 10273 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 269982a_114849113767_200025704644 [0,0,0,0,0,2|2,0,0]=4 10274 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 34a_114849113767_200025704644 [0,0,0,0,0,2|2,0,0]=4 10275 B12R1.226 Cc1cccc(c1)CNC(C)C 207a_100138425928_100000211157 [0,0,0,0,0,2|1,0,1]=4 10276 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100000185548_100000210206 [0,0,0,0,0,2|1,0,1]=4 10277 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100138425928_100000211840 [0,0,0,0,0,2|1,0,1]=4 10278 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100000185548_100000210206 [0,0,0,0,0,2|1,0,1]=4 10279 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100138425928_100000211840 [0,0,0,0,0,2|1,0,1]=4 10280 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100000212225_100000211840 [0,0,0,0,0,2|1,0,1]=4 10281 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100011217746_100000210206 [0,0,0,0,0,2|1,0,1]=4 10282 B12R1.226 Cc1cccc(c1)COC(C)C 7a_100011217746_100000210206 [0,0,0,0,0,2|1,0,1]=4 10283 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000210206_100000211840 [0,0,0,0,0,2|1,0,1]=4 10284 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000211840_100000210206 [0,0,0,0,0,2|1,0,1]=4 10285 B12R1.226 Cc1cccc(c1)NCC(=O)N 2230a_100000188690_100000747473 [0,0,0,0,0,2|1,0,0]=3 10286 B12R1.226 Cc1cccc(c1)NCC(=O)N 34a_100000188690_100000187820 [0,0,0,0,0,2|1,0,0]=3 10287 B12R1.226 Cc1cccc(c1)NCC(=O)[O-] 34a_100000188690_100020667443 [0,0,0,0,0,2|1,0,0]=3 10288 B12R1.226 Cc1cccc(c1)NCC(C)C 2230a_100000188690_100000210760 [0,0,0,0,0,2|1,0,1]=4 10289 B12R1.226 Cc1cccc(c1)NCC(C)C 34a_100000188690_100000210624 [0,0,0,0,0,2|1,0,1]=4 10290 B12R1.226 Cc1cccc(c1)NCC(C)O 2230a_100000188690_100011218427 [0,0,0,0,0,2|0,0,2]=4 10291 B12R1.226 Cc1cccc(c1)NCC(C)O 34a_100000188690_100011218427 [0,0,0,0,0,2|0,0,2]=4 10292 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 2230a_100000188690_100009817552 [0,0,0,0,0,2|0,0,2]=4 10293 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 34a_100000188690_100009817552 [0,0,0,0,0,2|0,0,2]=4 10294 B12R1.226 Cc1cccc(c1)NC[N+](=O)[O-] 34a_100000188690_100000761209 [0,0,0,0,0,2|2,0,0]=4 10295 B12R1.226 Cc1cccc(c1)OCC(=O)N 34a_100000210337_100000187820 [0,0,0,0,0,2|1,0,0]=3 10296 B12R1.226 Cc1cccc(c1)OCC(=O)N 7a_100000210337_100000187820 [0,0,0,0,0,2|1,0,0]=3 10297 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [0,0,0,0,0,2|0,0,0]=2 10298 B12R1.226 Cc1cccc(c1)OCC(=O)[O-] 34a_100000210337_100020667443 [0,0,0,0,0,2|1,0,0]=3 10299 B12R1.226 Cc1cccc(c1)OCC(C)C 34a_100000210337_100000210624 [0,0,0,0,0,2|1,0,1]=4 10300 B12R1.226 Cc1cccc(c1)OCC(C)C 7a_100000210337_100000210760 [0,0,0,0,0,2|1,0,1]=4 10301 B12R1.226 Cc1cccc(c1)OCC(C)O 34a_100000210337_100011218427 [0,0,0,0,0,2|0,0,2]=4 10302 B12R1.226 Cc1cccc(c1)OCC(C)O 7a_100000210337_100011218427 [0,0,0,0,0,2|0,0,2]=4 10303 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 34a_100000210337_100009817552 [0,0,0,0,0,2|0,0,2]=4 10304 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 7a_100000210337_100009817552 [0,0,0,0,0,2|0,0,2]=4 10305 B12R1.226 Cc1cccc(c1)OC[N+](=O)[O-] 34a_100000210337_100000761209 [0,0,0,0,0,2|2,0,0]=4 10306 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100000747473_100011215228 [0,0,0,0,0,2|1,0,0]=3 10307 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100011215228_100000747473 [0,0,0,0,0,2|1,0,0]=3 10308 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100011215228_100020667443 [0,0,0,0,0,2|1,0,0]=3 10309 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011215228 [0,0,0,0,0,2|1,0,0]=3 10310 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100000210624_100011215228 [0,0,0,0,0,2|1,0,1]=4 10311 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100011215228_100000210760 [0,0,0,0,0,2|1,0,1]=4 10312 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011215228_100011218427 [0,0,0,0,0,2|0,0,2]=4 10313 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011218427_100011215228 [0,0,0,0,0,2|0,0,2]=4 10314 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011215228 [0,0,0,0,0,2|0,0,2]=4 10315 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100011215228_100009817552 [0,0,0,0,0,2|0,0,2]=4 10316 B12R1.226 Cc1cccc(c1)SC[N+](=O)[O-] 62a_100011215228_100000761209 [0,0,0,0,0,2|2,0,0]=4 10317 B12R1.226 Cc1cccc(n1)SCC(=O)N 62a_100000742759_100000747473 [0,0,0,0,0,2|2,0,0]=4 10318 B12R1.226 Cc1cccc(n1)SCC(=O)N 62a_100000747473_100000742759 [0,0,0,0,0,2|2,0,0]=4 10319 B12R1.226 Cc1cccc(n1)SCC(=O)[O-] 62a_100000742759_100020667443 [0,0,0,0,0,2|2,0,0]=4 10320 B12R1.226 Cc1cccc(n1)SCC(=O)[O-] 62a_100020667443_100000742759 [0,0,0,0,0,2|2,0,0]=4 10321 B12R1.226 Cc1ccnc(c1)SCC(=O)N 62a_100000747473_100000750283 [0,0,0,0,0,2|2,0,0]=4 10322 B12R1.226 Cc1ccnc(c1)SCC(=O)N 62a_100000750283_100000747473 [0,0,0,0,0,2|2,0,0]=4 10323 B12R1.226 Cc1ccnc(c1)SCC(=O)[O-] 62a_100000750283_100020667443 [0,0,0,0,0,2|2,0,0]=4 10324 B12R1.226 Cc1ccnc(c1)SCC(=O)[O-] 62a_100020667443_100000750283 [0,0,0,0,0,2|2,0,0]=4 10325 B12R1.226 Cc1ccnc(n1)SCC(=O)[13CH3] 1458a_200000179490_200025704644 [0,0,0,0,0,2|2,0,0]=4 10326 B12R1.226 Cc1cncc(c1)OCC(=O)N 34a_100011830280_100000187820 [0,0,0,0,0,2|2,0,0]=4 10327 B12R1.226 Cc1cncc(c1)OCC(=O)N 7a_100011830280_100000187820 [0,0,0,0,0,2|2,0,0]=4 10328 B12R1.226 Cc1cncc(c1)OCC(=O)[O-] 34a_100011830280_100020667443 [0,0,0,0,0,2|2,0,0]=4 10329 B12R1.226 Cc1cncc(c1)SCC(=O)N 62a_100000747473_100000760492 [0,0,0,0,0,2|2,0,0]=4 10330 B12R1.226 Cc1cncc(c1)SCC(=O)N 62a_100000760492_100000747473 [0,0,0,0,0,2|2,0,0]=4 10331 B12R1.226 Cc1cncc(c1)SCC(=O)[O-] 62a_100000760492_100020667443 [0,0,0,0,0,2|2,0,0]=4 10332 B12R1.226 Cc1cncc(c1)SCC(=O)[O-] 62a_100020667443_100000760492 [0,0,0,0,0,2|2,0,0]=4 10333 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [0,0,0,0,0,2|2,0,0]=4 10334 B12R1.226 NC(=O)CNc1cccc(c1)Br 34a_100000210019_100000187820 [0,0,0,0,0,2|2,0,0]=4 10335 B12R1.226 NC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000187820 [0,0,0,0,0,2|2,0,0]=4 10336 B12R1.226 NC(=O)CNc1cccc(c1)F 34a_100000210047_100000187820 [0,0,0,0,0,2|2,0,0]=4 10337 B12R1.226 NC(=O)CNc1cccc(c1)I 34a_100000211102_100000187820 [0,0,0,0,0,2|2,0,0]=4 10338 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [0,0,0,0,0,2|2,0,0]=4 10339 B12R1.226 NC(=O)COc1cccc(c1)Br 34a_100000210342_100000187820 [0,0,0,0,0,2|2,0,0]=4 10340 B12R1.226 NC(=O)COc1cccc(c1)Br 7a_100000210342_100000187820 [0,0,0,0,0,2|2,0,0]=4 10341 B12R1.226 NC(=O)COc1cccc(c1)Cl 34a_100000210295_100000187820 [0,0,0,0,0,2|2,0,0]=4 10342 B12R1.226 NC(=O)COc1cccc(c1)Cl 7a_100000210295_100000187820 [0,0,0,0,0,2|2,0,0]=4 10343 B12R1.226 NC(=O)COc1cccc(c1)F 34a_100000210426_100000187820 [0,0,0,0,0,2|2,0,0]=4 10344 B12R1.226 NC(=O)COc1cccc(c1)F 7a_100000210426_100000187820 [0,0,0,0,0,2|2,0,0]=4 10345 B12R1.226 NC(=O)COc1cccc(c1)I 34a_100000211634_100000187820 [0,0,0,0,0,2|2,0,0]=4 10346 B12R1.226 NC(=O)COc1cccc(c1)I 7a_100000211634_100000187820 [0,0,0,0,0,2|2,0,0]=4 10347 B12R1.226 NC(=O)COc1cccc(c1)N 34a_100000210217_100000187820 [0,0,0,0,0,2|2,0,0]=4 10348 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [0,0,0,0,0,2|2,0,0]=4 10349 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747473 [0,0,0,0,0,2|2,0,0]=4 10350 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000747473_100000691529 [0,0,0,0,0,2|2,0,0]=4 10351 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747473 [0,0,0,0,0,2|2,0,0]=4 10352 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000747473_100000699651 [0,0,0,0,0,2|2,0,0]=4 10353 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000685547_100000747473 [0,0,0,0,0,2|2,0,0]=4 10354 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000747473_100000685547 [0,0,0,0,0,2|2,0,0]=4 10355 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000210019_100000747473 [0,0,0,0,0,2|2,0,0]=4 10356 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000747473_100000210019 [0,0,0,0,0,2|2,0,0]=4 10357 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [0,0,0,0,0,2|2,0,0]=4 10358 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_100000747473_114929384022 [0,0,0,0,0,2|2,0,0]=4 10359 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747473 [0,0,0,0,0,2|2,0,0]=4 10360 B12R1.226 Nc1cccc(c1)OCC(=O)[O-] 34a_100000210217_100020667443 [0,0,0,0,0,2|2,0,0]=4 10361 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100000210019_100020667443 [0,0,0,0,0,2|2,0,0]=4 10362 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000210019 [0,0,0,0,0,2|2,0,0]=4 10363 B12R1.226 O=C([O-])CNc1cccc(c1)Br 34a_100000210019_100020667443 [0,0,0,0,0,2|2,0,0]=4 10364 B12R1.226 O=C([O-])CNc1cccc(c1)Cl 34a_100000185859_100020667443 [0,0,0,0,0,2|2,0,0]=4 10365 B12R1.226 O=C([O-])CNc1cccc(c1)F 34a_100000210047_100020667443 [0,0,0,0,0,2|2,0,0]=4 10366 B12R1.226 O=C([O-])CNc1cccc(c1)I 34a_100000211102_100020667443 [0,0,0,0,0,2|2,0,0]=4 10367 B12R1.226 O=C([O-])CNc1cccc(c1)O 34a_100000210217_100020667443 [0,0,0,0,0,2|2,0,0]=4 10368 B12R1.226 O=C([O-])COc1cccc(c1)Br 34a_100000210342_100020667443 [0,0,0,0,0,2|2,0,0]=4 10369 B12R1.226 O=C([O-])COc1cccc(c1)Cl 34a_100000210295_100020667443 [0,0,0,0,0,2|2,0,0]=4 10370 B12R1.226 O=C([O-])COc1cccc(c1)F 34a_100000210426_100020667443 [0,0,0,0,0,2|2,0,0]=4 10371 B12R1.226 O=C([O-])COc1cccc(c1)I 34a_100000211634_100020667443 [0,0,0,0,0,2|2,0,0]=4 10372 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100000691529_100020667443 [0,0,0,0,0,2|2,0,0]=4 10373 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100020667443_100000691529 [0,0,0,0,0,2|2,0,0]=4 10374 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100000699651_100020667443 [0,0,0,0,0,2|2,0,0]=4 10375 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100020667443_100000699651 [0,0,0,0,0,2|2,0,0]=4 10376 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100000685547_100020667443 [0,0,0,0,0,2|2,0,0]=4 10377 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100020667443_100000685547 [0,0,0,0,0,2|2,0,0]=4 10378 B12R1.226 O=C([O-])CSc1cccc(c1)O 62a_100020667443_100000211634 [0,0,0,0,0,2|2,0,0]=4 10379 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_100020667443_114929384022 [0,0,0,0,0,2|2,0,0]=4 10380 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_114929384022_100020667443 [0,0,0,0,0,2|2,0,0]=4 10381 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200025704644 [0,0,0,0,0,2|1,0,0]=3 10382 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200025704644 [0,0,0,0,0,2|1,0,0]=3 10383 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)F 1458a_100011892744_200025704644 [0,0,0,0,0,2|1,0,0]=3 10384 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [0,0,0,0,0,2|1,0,0]=3 10385 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [0,0,0,0,0,2|1,0,0]=3 10386 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [0,0,0,0,0,2|1,0,0]=3 10387 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [0,0,0,0,0,2|1,0,0]=3 10388 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [0,0,0,0,0,2|1,0,0]=3 10389 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [0,0,0,0,0,2|1,0,0]=3 10390 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [0,0,0,0,0,2|1,0,0]=3 10391 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [0,0,0,0,0,2|1,0,0]=3 10392 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [0,0,0,0,0,2|1,0,0]=3 10393 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [0,0,0,0,0,2|1,0,0]=3 10394 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Br 1458a_100000182359_200025704644 [0,0,0,0,0,2|1,0,0]=3 10395 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Cl 1458a_100000184978_200025704644 [0,0,0,0,0,2|1,0,0]=3 10396 B12R1.226 [13CH3]C(=O)COc1cccc(c1)F 1458a_100000182781_200025704644 [0,0,0,0,0,2|1,0,0]=3 10397 B12R1.226 [13CH3]C(=O)CSc1cccc(c1)Br 1458a_100000760868_200025704644 [0,0,0,0,0,2|1,0,0]=3