0 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 13460 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.10 BrC1=CC2=CC=CC=C2C1 9657 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.10 BrC1=CN2C=CC=CC2=N1 22085 [0,0,0,0,0,0|3,0,0]=3 3 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 16113 [0,0,0,0,0,0|2,0,0]=2 4 B11R2.10 BrC1=NC2=C(C=CC=C2)O1 33485 [0,0,0,0,0,0|1,0,0]=1 5 B11R2.10 CC1=CC2=CC=CC=C2C1 5381 [0,0,0,0,0,0|2,0,0]=2 6 B11R2.10 CC1=CC2=CC=CC=C2N1 7504 [0,0,0,0,0,0|1,0,1]=2 7 B11R2.10 CC1=CN2C=CC=CC2=N1 27917 [0,0,0,0,0,0|2,0,0]=2 8 B11R2.10 CC1=NC2=C(C=CC=C2)N1 7540 [0,0,0,0,0,0|1,0,0]=1 9 B11R2.10 CC1=NC2=C(C=CC=C2)O1 8631 [0,0,0,0,0,0|0,0,0]=0 10 B11R2.10 CC1=NC2=C(C=CC=C2)S1 10877 [0,0,0,0,0,0|0,1,0]=1 11 B11R2.10 CC1=NC2=CC=CN=C2S1 31818 [0,0,0,0,0,0|1,1,0]=2 12 B11R2.10 CC1CC2=CC=CC=C2N1 7439 [0,0,0,0,0,0|1,0,2]=3 13 B11R2.10 CN1C=C2C=CC=CC2=N1 15667 [0,0,0,0,0,0|2,0,0]=2 14 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 7598 [0,0,0,0,0,0|2,0,0]=2 15 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 21885 [0,0,0,0,0,0|1,0,0]=1 16 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 21853 [0,0,0,0,0,0|1,1,0]=2 17 B11R2.10 ClC1=NC2=CC=CN=C2O1 33490 [0,0,0,0,0,0|2,0,0]=2 18 B11R2.10 ClC1=NC2=NC=CC=C2N1 15408 [0,0,0,0,0,0|3,0,0]=3 19 B11R2.10 ClC1=NC2=NC=CC=C2S1 35667 [0,0,0,0,0,0|2,1,0]=3 20 B11R2.10 FC1=NC2=C(C=CC=C2)N1 13608 [0,0,0,0,0,0|2,0,0]=2 21 B11R2.10 NC1=NC2=C(C=CC=C2)N1 9020 [0,0,0,0,0,0|2,0,0]=2 22 B11R2.10 NC1=NC2=C(C=CC=C2)O1 17695 [0,0,0,0,0,0|1,0,0]=1 23 B11R2.10 NC1=NC2=C(C=CC=C2)S1 13382 [0,0,0,0,0,0|1,1,0]=2 24 B11R2.10 NC1=NC2=C(C=CN=C2)O1 33487 [0,0,0,0,0,0|2,0,0]=2 25 B11R2.10 NC1=NC2=C(C=CN=C2)S1 27921 [0,0,0,0,0,0|2,1,0]=3 26 B11R2.10 NC1=NC2=C(C=NC=C2)O1 34279 [0,0,0,0,0,0|2,0,0]=2 27 B11R2.10 NC1=NC2=CC=CN=C2O1 33489 [0,0,0,0,0,0|2,0,0]=2 28 B11R2.10 NC1=NC2=NC=CC=C2N1 33492 [0,0,0,0,0,0|3,0,0]=3 29 B11R2.10 NC1CC2=CC=CC=C2C1 12929 [0,0,0,0,0,0|3,0,1]=4 30 B11R2.10 NN1CC2=CC=CC=C2C1 27745 [0,0,0,0,0,0|4,0,0]=4 31 B11R2.10 O=C1CC2=C(C=CC=C2)O1 22170 [0,0,0,0,0,0|2,0,0]=2 32 B11R2.10 O=C1CC2=CC=CC=C2C1 9653 [0,0,0,0,0,0|3,0,0]=3 33 B11R2.10 O=C1CC2=CC=CC=C2N1 7177 [0,0,0,0,0,0|2,0,1]=3 34 B11R2.10 O=C1CC2=CC=CN=C2N1 35309 [0,0,0,0,0,0|3,0,1]=4 35 B11R2.10 O=C1CC2=CC=NC=C2N1 17713 [0,0,0,0,0,0|3,0,1]=4 36 B11R2.10 O=C1CN2C=CC=CC2=N1 23698 [0,0,0,0,0,0|3,0,0]=3 37 B11R2.10 O=C1CN2C=CC=CC2=N1 23703 [0,0,0,0,0,0|3,0,0]=3 38 B11R2.10 O=C1NC2=C(C=CC=C2)O1 8633 [0,0,0,0,0,0|1,0,1]=2 39 B11R2.10 O=C1NC2=C(C=CC=C2)S1 21831 [0,0,0,0,0,0|1,1,1]=3 40 B11R2.10 O=C1NC2=CC=CN=C2N1 18669 [0,0,0,0,0,0|3,0,1]=4 41 B11R2.10 O=C1NC2=NC=CC=C2O1 11061 [0,0,0,0,0,0|2,0,1]=3 42 B11R2.10 OC1=CN2C=CC=CC2=N1 23702 [0,0,0,0,0,0|3,0,0]=3 43 B11R2.10 OC1=NC2=C(C=CC=C2)N1 7606 [0,0,0,0,0,0|2,0,0]=2 44 B11R2.10 OC1CC2=CC=CC=C2C1 9652 [0,0,0,0,0,0|3,0,1]=4 45 B11R2.10 SC1=NC2=C(C=CC=C2)N1 13567 [0,0,0,0,0,0|2,0,0]=2 46 B11R2.10 SC1=NC2=C(C=CC=C2)O1 8630 [0,0,0,0,0,0|1,0,0]=1 47 B11R2.10 SC1=NC2=C(C=CC=C2)S1 20577 [0,0,0,0,0,0|1,1,0]=2 48 B11R2.10 SC1=NC2=NC=CC=C2O1 23120 [0,0,0,0,0,0|2,0,0]=2 49 B10R2.7 B1OC2=C(C=CC=C2)O1 18191 [1,0,0,0,0,0|2,0,0]=3 50 B10R2.7 C1=CC2=C(C=C1)NC=N2 11074 [1,0,0,0,0,0|1,0,0]=2 51 B10R2.7 C1=CC2=C(C=C1)NN=N2 16004 [1,0,0,0,0,0|2,0,0]=3 52 B10R2.7 C1=CC2=C(C=C1)OC=C2 7003 [1,0,0,0,0,0|1,0,0]=2 53 B10R2.7 C1=CC2=C(C=C1)OC=N2 21884 [1,0,0,0,0,0|0,0,0]=1 54 B10R2.7 C1=CC2=C(C=C1)OCC2 6931 [1,0,0,0,0,0|1,0,1]=3 55 B10R2.7 C1=CC2=C(C=C1)OCO2 2537 [1,0,0,0,0,0|1,0,1]=3 56 B10R2.7 C1=CC2=C(C=C1)SC=C2 13545 [1,0,0,0,0,0|1,1,0]=3 57 B10R2.7 C1=CC2=C(C=CS2)C=N1 32513 [1,0,0,0,0,0|2,1,0]=4 58 B10R2.7 C1=CC2=C(N=C1)NC=N2 30310 [1,0,0,0,0,0|2,0,0]=3 59 B10R2.7 C1=CC2=CC=CN2C=C1 28088 [1,0,0,0,0,0|3,0,0]=4 60 B10R2.7 C1=CC2=CC=NC=C2N1 7678 [1,0,0,0,0,0|2,0,1]=4 61 B10R2.7 C1=CC2=CC=NC=C2S1 32508 [1,0,0,0,0,0|2,1,0]=4 62 B10R2.7 C1=CC2=CN=CC=C2N1 7676 [1,0,0,0,0,0|2,0,1]=4 63 B10R2.7 C1=CC2=NC=CN2C=C1 17181 [1,0,0,0,0,0|2,0,0]=3 64 B10R2.7 C1=CC2=NC=CN2C=N1 34411 [1,0,0,0,0,0|3,0,0]=4 65 B10R2.7 C1=CC2=NC=CN2N=C1 11271 [1,0,0,0,0,0|3,0,0]=4 66 B10R2.7 C1=CC2=NN=CN2C=C1 33799 [1,0,0,0,0,0|3,0,0]=4 67 B10R2.7 C1=CC2=NNC=C2C=N1 33786 [1,0,0,0,0,0|3,0,0]=4 68 B10R2.7 C1=CC2=NON=C2C=C1 22999 [1,0,0,0,0,0|2,0,0]=3 69 B10R2.7 C1=CC2=NSN=C2C=C1 15689 [1,0,0,0,0,0|2,0,0]=3 70 B10R2.7 C1=CC=C2CC=CC2=C1 20728 [1,0,0,0,0,0|2,0,0]=3 71 B10R2.7 C1=CC=C2CCCC2=C1 20379 [1,0,0,0,0,0|2,0,1]=4 72 B10R2.7 C1=CC=C2CNCC2=C1 16248 [1,0,0,0,0,0|3,0,0]=4 73 B10R2.7 C1=CC=C2CNCC2=C1 16512 [1,0,0,0,0,0|3,0,0]=4 74 B10R2.7 C1=CC=C2CNCC2=C1 33470 [1,0,0,0,0,0|3,0,0]=4 75 B10R2.7 C1=CC=C2NCCC2=C1 7502 [1,0,0,0,0,0|1,0,2]=4 76 B10R2.7 C1=CC=C2NN=CC2=C1 15665 [1,0,0,0,0,0|2,0,1]=4 77 B10R2.7 C1=CN2C=CN=C2C=N1 18785 [1,0,0,0,0,0|3,0,0]=4 78 B10R2.7 C1=CN2C=CN=C2N=C1 14838 [1,0,0,0,0,0|3,0,0]=4 79 B10R2.7 C1=CN=C2C=CNC2=C1 7675 [1,0,0,0,0,0|2,0,1]=4 80 B10R2.7 C1=CN=C2NC=CC2=C1 7679 [1,0,0,0,0,0|2,0,1]=4 81 B10R2.7 C1=CN=C2SC=CC2=C1 32500 [1,0,0,0,0,0|2,1,0]=4 82 B10R2.7 C1=NC=C2NC=NC2=N1 25929 [1,0,0,0,0,0|3,0,0]=4 83 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 7334 [0,1,0,0,0,0|1,0,1]=3 84 B12R2.18 CC1=CC2=CC=CC=C2N1C 7333 [0,1,0,0,0,0|1,0,1]=3 85 B12R2.18 CC1CC2=CC=CC=C2C1=O 2387 [0,1,0,0,0,0|2,0,1]=4 86 B12R2.18 CC1CC2=CC=CC=C2N1N 23226 [0,1,0,0,0,0|1,0,2]=4 87 B12R2.18 CC1CC2=CC=CC=C2N1N 9485 [0,1,0,0,0,0|1,0,2]=4 88 B12R2.18 CN1C(S)=NC2=C1C=CC=C2 8070 [0,1,0,0,0,0|2,0,0]=3 89 B12R2.18 CN1NC2=CC=CC=C2C1=O 27652 [0,1,0,0,0,0|2,0,1]=4 90 B12R2.18 CN1SC2=C(C=CC=C2)C1=O 29423 [0,1,0,0,0,0|2,1,0]=4 91 B12R2.18 Cn1c(=O)oc2ccccc21 8685 [0,1,0,0,0,0|1,0,1]=3 92 B12R2.18 O=C1NC2=CC=CC=C2C1=O 13609 [0,1,0,0,0,0|2,0,1]=4 93 B12R2.32 BrCC1=NC2=C(C=CC=C2)S1 3912 [0,1,0,0,0,0|0,1,0]=2 94 B12R2.32 C=CC1=NC2=C(C=CC=C2)N1 8069 [0,1,0,0,0,0|1,0,1]=3 95 B12R2.32 CCC1=CC2=CC=CC=C2C1 5396 [0,1,0,0,0,0|2,0,0]=3 96 B12R2.32 CCC1=CC2=CC=CC=C2N1 22566 [0,1,0,0,0,0|1,0,1]=3 97 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 21432 [0,1,0,0,0,0|1,0,0]=2 98 B12R2.32 CSC1=CN2C=CC=CC2=C1 33411 [0,1,0,0,0,0|3,0,0]=4 99 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 21889 [0,1,0,0,0,0|0,0,0]=1 100 B12R2.32 CSC1=NC2=C(C=CC=C2)S1 21828 [0,1,0,0,0,0|0,1,0]=2 101 B12R2.32 CSC1=NC2=NC=CC=C2O1 14665 [0,1,0,0,0,0|1,0,0]=2 102 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 7545 [0,1,0,0,0,0|1,0,0]=2 103 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 33484 [0,1,0,0,0,0|0,0,0]=1 104 B12R2.32 ClCC1=NC2=C(C=CC=C2)S1 29207 [0,1,0,0,0,0|0,1,0]=2 105 B12R2.32 ClCC1=NC2=CC=CN=C2O1 34798 [0,1,0,0,0,0|1,0,0]=2 106 B12R2.32 NCC1=CC2=CC=CC=C2N1 20289 [0,1,0,0,0,0|1,0,1]=3 107 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 26374 [0,1,0,0,0,0|1,0,0]=2 108 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 7004 [0,1,0,0,0,0|1,0,1]=3 109 B12R2.32 O=CC1=CC2=CC=CC=C2N1 18050 [0,1,0,0,0,0|1,0,2]=4 110 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 7591 [0,1,0,0,0,0|1,0,1]=3 111 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 14482 [0,1,0,0,0,0|0,1,1]=3 112 B12R2.32 OCC1=CC2=C(C=CC=C2)O1 7021 [0,1,0,0,0,0|1,0,0]=2 113 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 7590 [0,1,0,0,0,0|1,0,0]=2 114 B12R2.32 OCC1=NC2=C(C=CC=C2)S1 14535 [0,1,0,0,0,0|0,1,0]=2 115 B12R2.95 FC1(F)OC2=C(C=CC=C2)O1 17570 [0,1,0,0,0,0|2,0,1]=4 116 B12R2.202 CC1=CC2=C(Br)C=CC=C2C1 35099 [0,1,0,0,0,0|2,0,0]=3 117 B12R2.202 CC1=CC2=C(C=CN=C2Cl)S1 17957 [0,1,0,0,0,0|2,1,0]=4 118 B12R2.202 CC1=CC2=C(C=CNC2=O)S1 23128 [0,1,0,0,0,0|2,1,0]=4 119 B12R2.202 CC1=CC2=C(Cl)C=CC=C2C1 35009 [0,1,0,0,0,0|2,0,0]=3 120 B12R2.202 CC1=CC2=C(O)C=CC=C2N1 9379 [0,1,0,0,0,0|1,0,1]=3 121 B12R2.202 CC1=CC2=CC=CC(Br)=C2C1 24325 [0,1,0,0,0,0|2,0,0]=3 122 B12R2.202 CC1=CC=CC2=C1N=C(C)S2 21872 [0,1,0,0,0,0|0,1,0]=2 123 B12R2.202 CC1=CC=CC2=C1N=C(Cl)S2 21870 [0,1,0,0,0,0|1,1,0]=3 124 B12R2.202 CC1=CC=CC2=C1N=C(N)S2 8423 [0,1,0,0,0,0|1,1,0]=3 125 B12R2.202 CC1=CC=CC2=C1NC(=O)S2 21873 [0,1,0,0,0,0|1,1,1]=4 126 B12R2.202 CC1=CN2C(Br)=CC=CC2=N1 27912 [0,1,0,0,0,0|2,0,0]=3 127 B12R2.202 CC1=NC2=C(C=CC=C2Br)O1 33472 [0,1,0,0,0,0|0,0,0]=1 128 B12R2.202 CC1=NC2=C(O1)C(Br)=CC=C2 33473 [0,1,0,0,0,0|0,0,0]=1 129 B12R2.202 CN1C=C2C(Br)=CC=CC2=N1 16375 [0,1,0,0,0,0|2,0,0]=3 130 B12R2.202 CN1C=C2C=CC=C(Br)C2=N1 17419 [0,1,0,0,0,0|2,0,0]=3 131 B12R2.202 ClC1=CC=CC2=C1N=C(Cl)S2 21808 [0,1,0,0,0,0|1,1,0]=3 132 B12R2.202 ClC1=CC=CC2=C1SC(Cl)=N2 25930 [0,1,0,0,0,0|1,1,0]=3 133 B12R2.202 ClC1=NC2=C(C=CC=C2Br)S1 21771 [0,1,0,0,0,0|1,1,0]=3 134 B12R2.202 ClC1=NC2=C(S1)C(Br)=CC=C2 26538 [0,1,0,0,0,0|1,1,0]=3 135 B12R2.202 FC1=CC=CC2=C1N=C(Cl)S2 21813 [0,1,0,0,0,0|1,1,0]=3 136 B12R2.202 NC1=CC=CC2=C1SC(N)=N2 24299 [0,1,0,0,0,0|1,1,0]=3 137 B12R2.202 NC1=NC2=C(C=CC=C2Br)S1 21846 [0,1,0,0,0,0|1,1,0]=3 138 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 21701 [0,1,0,0,0,0|1,1,0]=3 139 B12R2.202 NC1=NC2=C(C=CC=C2F)S1 21849 [0,1,0,0,0,0|1,1,0]=3 140 B12R2.202 NC1=NC2=C(C=CC=C2O)S1 13340 [0,1,0,0,0,0|1,1,0]=3 141 B12R2.202 NC1=NC2=C(S1)C(F)=CC=C2 28930 [0,1,0,0,0,0|1,1,0]=3 142 B12R2.202 NC1=NN2C(Br)=CC=CC2=N1 35545 [0,1,0,0,0,0|3,0,0]=4 143 B12R2.202 O=C1CC2=C(Br)C=CC=C2N1 7952 [0,1,0,0,0,0|2,0,1]=4 144 B12R2.202 O=C1CC2=CC=CC(Br)=C2C1 18017 [0,1,0,0,0,0|3,0,0]=4 145 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 8934 [0,1,0,0,0,0|2,0,1]=4 146 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 18014 [0,1,0,0,0,0|3,0,0]=4 147 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 8305 [0,1,0,0,0,0|2,0,1]=4 148 B12R2.202 O=C1CC2=CC=CC(F)=C2C1 18006 [0,1,0,0,0,0|3,0,0]=4 149 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 8552 [0,1,0,0,0,0|2,0,1]=4 150 B12R2.202 O=C1NC2=C(C=CC=C2Cl)S1 21835 [0,1,0,0,0,0|1,1,1]=4 151 B12R2.202 O=C1NC2=C(C=CC=C2F)S1 21838 [0,1,0,0,0,0|1,1,1]=4 152 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 19276 [0,1,0,0,0,0|1,0,1]=3 153 B12R2.202 SC1=NC2=C(C=CC=C2Cl)S1 21858 [0,1,0,0,0,0|1,1,0]=3 154 B12R2.202 SC1=NC2=C(S1)C(Br)=CC=C2 14880 [0,1,0,0,0,0|1,1,0]=3 155 B12R2.202 SC1=NC2=C(S1)C(Cl)=CN=C2 14884 [0,1,0,0,0,0|2,1,0]=4 156 B12R2.606 BrC1=CC2=C(C=C1)N=C(Br)S2 16896 [0,1,0,0,0,0|1,1,0]=3 157 B12R2.606 BrC1=CC2=C(C=C1)SC(Br)=N2 17321 [0,1,0,0,0,0|1,1,0]=3 158 B12R2.606 BrC1=CN=C2C=C(I)OC2=C1 26893 [0,1,0,0,0,0|3,0,0]=4 159 B12R2.606 CC1=CC2=C(C=C1)N=C(C)N2 7657 [0,1,0,0,0,0|1,0,0]=2 160 B12R2.606 CC1=CC2=C(C=C1)N=C(C)S2 21826 [0,1,0,0,0,0|0,1,0]=2 161 B12R2.606 CC1=CC2=C(C=C1)N=C(Cl)S2 21875 [0,1,0,0,0,0|1,1,0]=3 162 B12R2.606 CC1=CC2=C(C=C1)N=C(N)S2 8469 [0,1,0,0,0,0|1,1,0]=3 163 B12R2.606 CC1=CC2=C(C=C1)N=C(S)N2 7610 [0,1,0,0,0,0|2,0,0]=3 164 B12R2.606 CC1=CC2=C(C=C1)NC(=O)S2 21721 [0,1,0,0,0,0|1,1,1]=4 165 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 8640 [0,1,0,0,0,0|0,0,0]=1 166 B12R2.606 CC1=CC2=C(C=C1)OC(N)=N2 17701 [0,1,0,0,0,0|1,0,0]=2 167 B12R2.606 CC1=CC2=C(C=C1)SC(N)=N2 26064 [0,1,0,0,0,0|1,1,0]=3 168 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 32466 [0,1,0,0,0,0|1,0,0]=2 169 B12R2.606 CC1=CC2=CC(Br)=CC=C2N1 9382 [0,1,0,0,0,0|1,0,1]=3 170 B12R2.606 CC1=CC2=CC(Br)=CN=C2N1 27135 [0,1,0,0,0,0|2,0,1]=4 171 B12R2.606 CC1=CC2=CC(Cl)=CC=C2N1 17201 [0,1,0,0,0,0|1,0,1]=3 172 B12R2.606 CC1=CC2=CC(F)=CC=C2N1 2158 [0,1,0,0,0,0|1,0,1]=3 173 B12R2.606 CC1=CC2=CC(N)=CC=C2N1 7273 [0,1,0,0,0,0|1,0,1]=3 174 B12R2.606 CC1=CC2=CC(O)=CC=C2N1 8551 [0,1,0,0,0,0|1,0,1]=3 175 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 19921 [0,1,0,0,0,0|1,0,1]=3 176 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 19920 [0,1,0,0,0,0|1,0,1]=3 177 B12R2.606 CC1=CC2=CC=C(O)C=C2N1 19945 [0,1,0,0,0,0|1,0,1]=3 178 B12R2.606 CC1=CC=C2NC(=O)CC2=C1 8314 [0,1,0,0,0,0|2,0,1]=4 179 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 7330 [0,1,0,0,0,0|1,0,1]=3 180 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)S1 20276 [0,1,0,0,0,0|0,1,0]=2 181 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)N1 7651 [0,1,0,0,0,0|1,0,0]=2 182 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 33482 [0,1,0,0,0,0|0,0,0]=1 183 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)S1 21823 [0,1,0,0,0,0|0,1,0]=2 184 B12R2.606 CC1=NC2=C(C=C(F)C=C2)N1 6528 [0,1,0,0,0,0|1,0,0]=2 185 B12R2.606 CC1=NC2=C(C=C(F)C=C2)S1 21915 [0,1,0,0,0,0|0,1,0]=2 186 B12R2.606 CC1=NC2=C(C=C(I)C=C2)N1 27312 [0,1,0,0,0,0|1,0,0]=2 187 B12R2.606 CC1=NC2=C(C=C(N)C=C2)N1 33480 [0,1,0,0,0,0|1,0,0]=2 188 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 27581 [0,1,0,0,0,0|0,0,0]=1 189 B12R2.606 CC1=NC2=C(C=C(N)C=C2)S1 20725 [0,1,0,0,0,0|0,1,0]=2 190 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 24256 [0,1,0,0,0,0|0,0,0]=1 191 B12R2.606 CC1=NC2=C(C=C(O)C=C2)S1 17329 [0,1,0,0,0,0|0,1,0]=2 192 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 33471 [0,1,0,0,0,0|0,0,0]=1 193 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)S1 13564 [0,1,0,0,0,0|0,1,0]=2 194 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 8645 [0,1,0,0,0,0|0,0,0]=1 195 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)S1 10878 [0,1,0,0,0,0|0,1,0]=2 196 B12R2.606 CC1=NC2=C(C=CC(F)=C2)S1 21824 [0,1,0,0,0,0|0,1,0]=2 197 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 33731 [0,1,0,0,0,0|0,0,0]=1 198 B12R2.606 CC1=NC2=CC(Br)=CN=C2O1 33488 [0,1,0,0,0,0|1,0,0]=2 199 B12R2.606 CC1=NC2=NC=C(Br)C=C2N1 33493 [0,1,0,0,0,0|2,0,0]=3 200 B12R2.606 CN1C=C2C=C(Br)C=CC2=N1 20576 [0,1,0,0,0,0|2,0,0]=3 201 B12R2.606 CN1C=C2C=CC(Br)=CC2=N1 20671 [0,1,0,0,0,0|2,0,0]=3 202 B12R2.606 ClC1=CC2=C(C=C1)N=C(Br)S2 17388 [0,1,0,0,0,0|1,1,0]=3 203 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)O2 8637 [0,1,0,0,0,0|1,0,0]=2 204 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)S2 17324 [0,1,0,0,0,0|1,1,0]=3 205 B12R2.606 ClC1=CC2=C(C=C1)NC(Cl)=N2 32274 [0,1,0,0,0,0|2,0,0]=3 206 B12R2.606 ClC1=CC2=C(C=C1)SC(Cl)=N2 21854 [0,1,0,0,0,0|1,1,0]=3 207 B12R2.606 ClC1=CC=C2NC(Cl)=NC2=N1 15438 [0,1,0,0,0,0|3,0,0]=4 208 B12R2.606 ClC1=CN2C=C(Br)C=CC2=N1 30419 [0,1,0,0,0,0|3,0,0]=4 209 B12R2.606 ClC1=NC2=C(C=C(Br)C=C2)S1 11132 [0,1,0,0,0,0|1,1,0]=3 210 B12R2.606 ClC1=NC2=C(C=C(I)C=C2)S1 24302 [0,1,0,0,0,0|1,1,0]=3 211 B12R2.606 ClC1=NC2=C(C=CC(Br)=C2)S1 17323 [0,1,0,0,0,0|1,1,0]=3 212 B12R2.606 FC1=CC2=C(C=C1)N=C(Cl)S2 21812 [0,1,0,0,0,0|1,1,0]=3 213 B12R2.606 FC1=CC2=C(C=C1)N=C(S)S2 21868 [0,1,0,0,0,0|1,1,0]=3 214 B12R2.606 FC1=CC2=C(C=C1)OC(Cl)=N2 21891 [0,1,0,0,0,0|1,0,0]=2 215 B12R2.606 FC1=CC2=C(C=C1)SC(Cl)=N2 21862 [0,1,0,0,0,0|1,1,0]=3 216 B12R2.606 FC1=CC2=C(C=C1)SC(S)=N2 21866 [0,1,0,0,0,0|1,1,0]=3 217 B12R2.606 NC1=CC2=C(C=C1)N=C(Br)S2 17317 [0,1,0,0,0,0|1,1,0]=3 218 B12R2.606 NC1=CC2=C(C=C1)N=C(Cl)S2 17257 [0,1,0,0,0,0|1,1,0]=3 219 B12R2.606 NC1=CC2=C(C=C1)N=C(S)N2 15049 [0,1,0,0,0,0|2,0,0]=3 220 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 21730 [0,1,0,0,0,0|1,1,1]=4 221 B12R2.606 NC1=CC2=C(C=C1)SC(Cl)=N2 17319 [0,1,0,0,0,0|1,1,0]=3 222 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 7209 [0,1,0,0,0,0|2,0,1]=4 223 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)O1 34173 [0,1,0,0,0,0|1,0,0]=2 224 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)S1 9981 [0,1,0,0,0,0|1,1,0]=3 225 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 21894 [0,1,0,0,0,0|1,0,0]=2 226 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)S1 21696 [0,1,0,0,0,0|1,1,0]=3 227 B12R2.606 NC1=NC2=C(C=C(F)C=C2)S1 14467 [0,1,0,0,0,0|1,1,0]=3 228 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 20528 [0,1,0,0,0,0|1,1,0]=3 229 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)N1 27876 [0,1,0,0,0,0|2,0,0]=3 230 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)O1 27923 [0,1,0,0,0,0|1,0,0]=2 231 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)S1 21702 [0,1,0,0,0,0|1,1,0]=3 232 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)N1 7587 [0,1,0,0,0,0|2,0,0]=3 233 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)O1 12473 [0,1,0,0,0,0|1,0,0]=2 234 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)S1 21698 [0,1,0,0,0,0|1,1,0]=3 235 B12R2.606 NC1=NC2=C(C=CC(F)=C2)O1 21895 [0,1,0,0,0,0|1,0,0]=2 236 B12R2.606 NC1=NC2=C(C=CC(F)=C2)S1 21850 [0,1,0,0,0,0|1,1,0]=3 237 B12R2.606 NC1=NC2=C(C=CC(O)=C2)N1 34431 [0,1,0,0,0,0|2,0,0]=3 238 B12R2.606 Nc1ccc2nc(=O)nc2c1 7162 [0,1,0,0,0,0|2,0,0]=3 239 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 7169 [0,1,0,0,0,0|2,0,1]=4 240 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 1673 [0,1,0,0,0,0|2,0,1]=4 241 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 1687 [0,1,0,0,0,0|2,0,1]=4 242 B12R2.606 O=C1CC2=CC(O)=CC=C2N1 7348 [0,1,0,0,0,0|2,0,1]=4 243 B12R2.606 O=C1CC2=CC=C(Br)C=C2C1 18044 [0,1,0,0,0,0|3,0,0]=4 244 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 7320 [0,1,0,0,0,0|2,0,1]=4 245 B12R2.606 O=C1CC2=CC=C(Cl)C=C2C1 18039 [0,1,0,0,0,0|3,0,0]=4 246 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 1674 [0,1,0,0,0,0|2,0,1]=4 247 B12R2.606 O=C1CC2=CC=C(F)C=C2C1 18032 [0,1,0,0,0,0|3,0,0]=4 248 B12R2.606 O=C1CC2=CC=C(F)C=C2N1 1688 [0,1,0,0,0,0|2,0,1]=4 249 B12R2.606 O=C1CC2=CC=C(I)C=C2C1 18087 [0,1,0,0,0,0|3,0,0]=4 250 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 21893 [0,1,0,0,0,0|1,0,1]=3 251 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)S1 21839 [0,1,0,0,0,0|1,1,1]=4 252 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 8644 [0,1,0,0,0,0|1,0,1]=3 253 B12R2.606 O=C1NC2=C(C=C(F)C=C2)S1 21837 [0,1,0,0,0,0|1,1,1]=4 254 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 21892 [0,1,0,0,0,0|1,0,1]=3 255 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)S1 21841 [0,1,0,0,0,0|1,1,1]=4 256 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 8642 [0,1,0,0,0,0|1,0,1]=3 257 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)S1 13573 [0,1,0,0,0,0|1,1,1]=4 258 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 17712 [0,1,0,0,0,0|2,0,1]=4 259 B12R2.606 O=C1NC2=NC=C(Cl)C=C2O1 26466 [0,1,0,0,0,0|2,0,1]=4 260 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 15342 [0,1,0,0,0,0|2,0,0]=3 261 B12R2.606 SC1=NC2=C(C=C(Br)C=C2)N1 14386 [0,1,0,0,0,0|2,0,0]=3 262 B12R2.606 SC1=NC2=C(C=C(Br)C=C2)S1 21819 [0,1,0,0,0,0|1,1,0]=3 263 B12R2.606 SC1=NC2=C(C=C(Cl)C=C2)O1 8714 [0,1,0,0,0,0|1,0,0]=2 264 B12R2.606 SC1=NC2=C(C=C(Cl)C=C2)S1 21821 [0,1,0,0,0,0|1,1,0]=3 265 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)O1 8704 [0,1,0,0,0,0|1,0,0]=2 266 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)S1 17578 [0,1,0,0,0,0|1,1,0]=3 267 B10R1.4 CC1=C(N=C=S)C=CC=C1 10740 [0,0,1,0,0,0|2,0,1]=4 268 B10R1.4 CCCC1=C(N)C=CC=C1 13695 [0,0,1,0,0,0|1,0,2]=4 269 B10R1.4 CCOC1=C(Br)C=CC=C1 3136 [0,0,1,0,0,0|1,0,1]=3 270 B10R1.4 CCOC1=C(Br)C=CN=C1 6659 [0,0,1,0,0,0|2,0,1]=4 271 B10R1.4 CCOC1=C(Br)C=NC=C1 34353 [0,0,1,0,0,0|2,0,1]=4 272 B10R1.4 CCOC1=C(C)C=CC=C1 3179 [0,0,1,0,0,0|1,0,1]=3 273 B10R1.4 CCOC1=C(Cl)C=CC=C1 3158 [0,0,1,0,0,0|1,0,1]=3 274 B10R1.4 CCOC1=C(Cl)C=CN=C1 6666 [0,0,1,0,0,0|2,0,1]=4 275 B10R1.4 CCOC1=C(F)C=CC=C1 3173 [0,0,1,0,0,0|1,0,1]=3 276 B10R1.4 CCOC1=C(N)C=CN=C1 27756 [0,0,1,0,0,0|1,0,2]=4 277 B10R1.4 CCOC1=C(N)C=NC=C1 9610 [0,0,1,0,0,0|1,0,2]=4 278 B10R1.4 CCOC1=C(O)C=CC=C1 9505 [0,0,1,0,0,0|1,0,1]=3 279 B10R1.4 CCOC1=C(S)C=CC=C1 10527 [0,0,1,0,0,0|1,0,1]=3 280 B10R1.4 CCOC1=CC=CN=C1Br 5890 [0,0,1,0,0,0|2,0,1]=4 281 B10R1.4 CCOC1=CC=CN=C1C 34423 [0,0,1,0,0,0|2,0,1]=4 282 B10R1.4 CCOC1=CC=CN=C1N 5585 [0,0,1,0,0,0|1,0,2]=4 283 B10R1.4 CCOC1=NC=CC=C1Br 6233 [0,0,1,0,0,0|2,0,1]=4 284 B10R1.4 CCOC1=NC=CC=C1I 9248 [0,0,1,0,0,0|2,0,1]=4 285 B10R1.4 CCSC1=C(Br)C=CC=C1 10531 [0,0,1,0,0,0|1,1,1]=4 286 B10R1.4 COCC1=C(Br)C=CC=C1 34659 [0,0,1,0,0,0|3,0,0]=4 287 B10R1.4 FC1=C(N=C=S)C=CC=C1 5002 [0,0,1,0,0,0|2,0,1]=4 288 B10R1.4 NCCC1=C(O)C=CC=C1 16394 [0,0,1,0,0,0|2,0,1]=4 289 B10R1.4 N\N=C\C1=CC=CC=C1O 22926 [0,0,1,0,0,0|3,0,0]=4 290 B10R1.4 O=C=NC1=C(F)C=CC=C1 4455 [0,0,1,0,0,0|2,0,1]=4 291 B10R1.4 OCCC1=C(O)C=CC=C1 31971 [0,0,1,0,0,0|2,0,1]=4 292 B10R1.4 S=C=NC1=C(Br)C=CC=C1 35890 [0,0,1,0,0,0|2,0,1]=4 293 B10R1.4 S=C=NC1=C(I)C=CC=C1 35920 [0,0,1,0,0,0|2,0,1]=4 294 B10R1.18 CC(=O)CC1=CC=NC=C1 21323 [0,0,1,0,0,0|2,0,1]=4 295 B10R1.18 CC(=O)CC1=NC=CC=C1 32233 [0,0,1,0,0,0|2,0,1]=4 296 B10R1.18 CC(=O)SC1=CC=CC=C1 15324 [0,0,1,0,0,0|1,0,1]=3 297 B10R1.18 CC(C)OC1=CC=CC=C1 13188 [0,0,1,0,0,0|1,0,1]=3 298 B10R1.18 CC(C)OC1=CC=NC=C1 6684 [0,0,1,0,0,0|2,0,1]=4 299 B10R1.18 CC(O)CC1=CC=CC=C1 36130 [0,0,1,0,0,0|1,0,1]=3 300 B10R1.18 NC(=S)NC1=CC=CC=C1 35672 [0,0,1,0,0,0|1,1,1]=4 301 B10R1.18 O=C(Cl)CC1=CC=CC=C1 35236 [0,0,1,0,0,0|2,0,1]=4 302 B10R1.18 O=C(O)CC1=CC=CN=C1 13998 [0,0,1,0,0,0|3,0,0]=4 303 B10R1.18 O=C(O)CC1=CC=NC=C1 14000 [0,0,1,0,0,0|3,0,0]=4 304 B10R1.18 O=C(O)CC1=NC=CC=C1 14404 [0,0,1,0,0,0|3,0,0]=4 305 B10R1.18 O=C([O-])CC1=CC=CC=C1 20019 [0,0,1,0,0,0|2,0,1]=4 306 B10R1.18 OB(O)CC1=CC=CC=C1 5320 [0,0,1,0,0,0|3,0,0]=4 307 B10R1.18 OC(=S)CC1=CC=CC=C1 10786 [0,0,1,0,0,0|2,0,0]=3 308 B10R2.2 CC1=NC2=C(C=CS2)S1 14385 [0,0,0,0,1,0|1,1,0]=3 309 B10R2.2 NC1=NC2=C(C=CS2)S1 36384 [0,0,0,0,1,0|2,1,0]=4 310 B10R2.320 BrC1CC2=CC=CC=C21 36330 [0,0,0,0,1,0|2,0,1]=4 311 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 9426 [0,0,0,0,0,1|3,0,0]=4 312 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 20629 [0,0,0,0,0,1|2,0,0]=3 313 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 5814 [0,0,0,0,0,1|2,0,0]=3 314 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 33544 [0,0,0,0,0,1|3,0,0]=4 315 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 22963 [0,0,0,0,0,1|3,0,0]=4 316 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 21827 [0,0,0,0,0,1|2,0,0]=3 317 B12R2.24 BrC1=NC2=CN=CC=C2C=C1 25764 [0,0,0,0,0,1|3,0,0]=4 318 B12R2.24 BrC1=NC2=NC=CC=C2C=C1 18424 [0,0,0,0,0,1|3,0,0]=4 319 B12R2.24 CC1=CC2=CC=CC=C2N=C1 2344 [0,0,0,0,0,1|1,0,0]=2 320 B12R2.24 CC1=CC=C2C=CC=NC2=C1 5811 [0,0,0,0,0,1|3,0,0]=4 321 B12R2.24 CC1=CC=C2C=NC=CC2=C1 6210 [0,0,0,0,0,1|3,0,0]=4 322 B12R2.24 CC1=CC=C2N=CC=CC2=C1 5807 [0,0,0,0,0,1|3,0,0]=4 323 B12R2.24 CC1=NC2=C(C=CC=C2)N=N1 24093 [0,0,0,0,0,1|1,0,0]=2 324 B12R2.24 CC1=NC2=CC=CC=C2C=C1 5809 [0,0,0,0,0,1|1,0,0]=2 325 B12R2.24 CC1=NC2=NC=CC=C2C=C1 13904 [0,0,0,0,0,1|2,0,0]=3 326 B12R2.24 CC1CCC2=CC=CC=C2N1 7515 [0,0,0,0,0,1|1,0,2]=4 327 B12R2.24 ClC1=CC2=CC=CC=C2C=C1 9464 [0,0,0,0,0,1|3,0,0]=4 328 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 6215 [0,0,0,0,0,1|2,0,0]=3 329 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 14555 [0,0,0,0,0,1|2,0,0]=3 330 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 7580 [0,0,0,0,0,1|2,0,0]=3 331 B12R2.24 ClC1=NC2=CC=CC=C2C=N1 14666 [0,0,0,0,0,1|2,0,0]=3 332 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 15447 [0,0,0,0,0,1|2,0,0]=3 333 B12R2.24 ClC1=NC2=CC=NC=C2C=C1 14667 [0,0,0,0,0,1|3,0,0]=4 334 B12R2.24 ClC1=NC2=CN=CC=C2C=C1 25766 [0,0,0,0,0,1|3,0,0]=4 335 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 18422 [0,0,0,0,0,1|3,0,0]=4 336 B12R2.24 FC1=CC2=CC=CC=C2C=C1 19886 [0,0,0,0,0,1|3,0,0]=4 337 B12R2.24 IC1=NC2=CC=CC=C2C=C1 24681 [0,0,0,0,0,1|2,0,0]=3 338 B12R2.24 NC1=CC2=CC=CC=C2C=C1 23236 [0,0,0,0,0,1|3,0,0]=4 339 B12R2.24 NC1=CC2=CC=CC=C2C=N1 6217 [0,0,0,0,0,1|2,0,0]=3 340 B12R2.24 NC1=CC2=CC=CC=C2N=C1 12769 [0,0,0,0,0,1|2,0,0]=3 341 B12R2.24 NC1=CC2=NC=CC=C2N=C1 27125 [0,0,0,0,0,1|3,0,0]=4 342 B12R2.24 NC1=NC2=CC=CC=C2C=C1 5818 [0,0,0,0,0,1|2,0,0]=3 343 B12R2.24 NC1=NC2=CC=CC=C2N=C1 15443 [0,0,0,0,0,1|2,0,0]=3 344 B12R2.24 NC1=NC2=CC=CN=C2C=C1 18361 [0,0,0,0,0,1|3,0,0]=4 345 B12R2.24 NC1=NC2=CN=CC=C2C=C1 25757 [0,0,0,0,0,1|3,0,0]=4 346 B12R2.24 O=C1C=CC2=CC=CC=C2O1 21620 [0,0,0,0,0,1|2,0,0]=3 347 B12R2.24 O=C1CC2=CC=CC=C2CO1 22155 [0,0,0,0,0,1|2,0,0]=3 348 B12R2.24 O=C1CCC2=CC=CC=C2C1 17934 [0,0,0,0,0,1|3,0,0]=4 349 B12R2.24 O=C1COC2=C(C=CC=C2)N1 18791 [0,0,0,0,0,1|1,0,1]=3 350 B12R2.24 O=C1COC2=CC=CC=C2C1 9704 [0,0,0,0,0,1|2,0,0]=3 351 B12R2.24 OC1=CC2=CC=CC=C2N=C1 12770 [0,0,0,0,0,1|2,0,0]=3 352 B12R2.24 OC1=NC2=CC=CC=C2N=C1 15472 [0,0,0,0,0,1|2,0,0]=3 353 B12R2.24 OC1=NC2=CC=CN=C2C=C1 27746 [0,0,0,0,0,1|3,0,0]=4 354 B12R2.24 SC1=CC2=CC=CC=C2C=C1 6833 [0,0,0,0,0,1|3,0,0]=4 355 B12R2.24 SC1=NC2=CC=CC=C2N=C1 15427 [0,0,0,0,0,1|2,0,0]=3 356 B12R2.1041 CC1=CC2=CC=CC=CC2=C1 35006 [0,0,0,0,0,1|2,0,0]=3 357 B12R2.1041 CC1=CC2=CC=CC=CC2=C1 35421 [0,0,0,0,0,1|2,0,0]=3 358 B9R1.8 C=CCC1=CC=CC=C1 29358 [1,0,1,0,0,0|1,0,1]=4 359 B9R1.8 C=CSC1=CC=CC=C1 10778 [1,0,1,0,0,0|0,1,1]=4 360 B9R1.8 CCCC1=CC=CC=C1 10852 [1,0,1,0,0,0|1,0,1]=4 361 B9R1.8 CCOC1=CC=NC=C1 1125 [1,0,1,0,0,0|1,0,1]=4 362 B9R1.8 CCOC1=NC=CC=C1 1126 [1,0,1,0,0,0|1,0,1]=4 363 B9R1.8 CCSC1=CC=CC=C1 10773 [1,0,1,0,0,0|0,1,1]=4 364 B9R1.8 CNCC1=CC=CC=C1 19910 [1,0,1,0,0,0|2,0,0]=4 365 B9R1.8 CNCC1=CC=CC=C1 25218 [1,0,1,0,0,0|2,0,0]=4 366 B9R1.8 CNCC1=CC=CC=C1 5801 [1,0,1,0,0,0|2,0,0]=4 367 B9R1.8 COCC1=CC=CC=C1 15300 [1,0,1,0,0,0|2,0,0]=4 368 B9R1.8 ONCC1=CC=CC=C1 25520 [1,0,1,0,0,0|2,0,0]=4 369 B9R1.8 S=C=NC1=CC=CC=C1 18702 [1,0,1,0,0,0|0,1,1]=4 370 B9R1.15 C=CC1=C(Br)C=CC=C1 23975 [1,0,1,0,0,0|1,0,1]=4 371 B9R1.15 CC1=CC=CC=C1C=O 15511 [1,0,1,0,0,0|2,0,0]=4 372 B9R1.15 CCC1=C(Br)C=CC=C1 3770 [1,0,1,0,0,0|1,0,1]=4 373 B9R1.15 CCC1=C(I)C=CC=C1 3876 [1,0,1,0,0,0|1,0,1]=4 374 B9R1.15 CCC1=C(N)C=CC=C1 20945 [1,0,1,0,0,0|0,0,2]=4 375 B9R1.15 CCC1=C(N)C=CC=C1 21080 [1,0,1,0,0,0|0,0,2]=4 376 B9R1.15 CCC1=C(O)C=CC=C1 3871 [1,0,1,0,0,0|0,0,1]=3 377 B9R1.15 CCC1=C(S)C=CC=C1 6844 [1,0,1,0,0,0|0,1,1]=4 378 B9R1.15 CNC1=C(F)C=CC=C1 15527 [1,0,1,0,0,0|1,0,1]=4 379 B9R1.15 CNC1=CC=CC=C1N 14987 [1,0,1,0,0,0|1,0,1]=4 380 B9R1.15 COC1=C(Br)C=CC=C1 3725 [1,0,1,0,0,0|1,0,0]=3 381 B9R1.15 COC1=C(Br)C=CN=C1 20095 [1,0,1,0,0,0|2,0,0]=4 382 B9R1.15 COC1=C(Br)C=CN=C1 34713 [1,0,1,0,0,0|2,0,0]=4 383 B9R1.15 COC1=C(Br)C=NC=C1 6686 [1,0,1,0,0,0|2,0,0]=4 384 B9R1.15 COC1=C(C)C=CN=C1 34674 [1,0,1,0,0,0|2,0,0]=4 385 B9R1.15 COC1=C(Cl)C=CC=C1 3614 [1,0,1,0,0,0|1,0,0]=3 386 B9R1.15 COC1=C(Cl)C=CN=C1 33677 [1,0,1,0,0,0|2,0,0]=4 387 B9R1.15 COC1=C(Cl)C=NC=C1 6687 [1,0,1,0,0,0|2,0,0]=4 388 B9R1.15 COC1=C(F)C=CC=C1 3473 [1,0,1,0,0,0|1,0,0]=3 389 B9R1.15 COC1=C(I)C=CC=C1 3898 [1,0,1,0,0,0|1,0,0]=3 390 B9R1.15 COC1=C(I)C=NC=C1 34558 [1,0,1,0,0,0|2,0,0]=4 391 B9R1.15 COC1=C(N)C=CN=C1 27755 [1,0,1,0,0,0|1,0,1]=4 392 B9R1.15 COC1=C(O)C=CN=C1 34289 [1,0,1,0,0,0|2,0,0]=4 393 B9R1.15 COC1=C(S)C=CC=C1 6816 [1,0,1,0,0,0|1,0,0]=3 394 B9R1.15 COC1=CC=CC=C1O 26545 [1,0,1,0,0,0|1,0,0]=3 395 B9R1.15 COC1=CC=CN=C1Br 5916 [1,0,1,0,0,0|2,0,0]=4 396 B9R1.15 COC1=CC=CN=C1C 6637 [1,0,1,0,0,0|2,0,0]=4 397 B9R1.15 COC1=CC=CN=C1Cl 6146 [1,0,1,0,0,0|2,0,0]=4 398 B9R1.15 COC1=CC=CN=C1N 28123 [1,0,1,0,0,0|1,0,1]=4 399 B9R1.15 COC1=CC=CN=C1O 6543 [1,0,1,0,0,0|2,0,0]=4 400 B9R1.15 COC1=NC=CC=C1Br 1180 [1,0,1,0,0,0|2,0,0]=4 401 B9R1.15 COC1=NC=CC=C1C 6594 [1,0,1,0,0,0|2,0,0]=4 402 B9R1.15 COC1=NC=CC=C1Cl 1189 [1,0,1,0,0,0|2,0,0]=4 403 B9R1.15 COC1=NC=CC=C1F 10624 [1,0,1,0,0,0|2,0,0]=4 404 B9R1.15 COC1=NC=CC=C1I 6586 [1,0,1,0,0,0|2,0,0]=4 405 B9R1.15 COC1=NC=CC=C1N 1269 [1,0,1,0,0,0|1,0,1]=4 406 B9R1.15 CSC1=C(Br)C=CC=C1 10648 [1,0,1,0,0,0|1,1,0]=4 407 B9R1.15 CSC1=C(C)C=CC=C1 10730 [1,0,1,0,0,0|1,1,0]=4 408 B9R1.15 CSC1=C(Cl)C=CC=C1 10643 [1,0,1,0,0,0|1,1,0]=4 409 B9R1.15 CSC1=C(F)C=CC=C1 10638 [1,0,1,0,0,0|1,1,0]=4 410 B9R1.15 CSC1=C(I)C=CC=C1 10668 [1,0,1,0,0,0|1,1,0]=4 411 B9R1.15 CSC1=C(N)C=CC=C1 10633 [1,0,1,0,0,0|0,1,1]=4 412 B9R1.15 CSC1=C(O)C=CC=C1 10666 [1,0,1,0,0,0|1,0,0]=3 413 B9R1.15 N#CC1=C(O)C=CC=C1 4803 [1,0,1,0,0,0|1,0,1]=4 414 B9R1.15 NC1=C(C=O)C=CC=C1 15692 [1,0,1,0,0,0|1,0,1]=4 415 B9R1.15 NCC1=C(O)C=CC=C1 7383 [1,0,1,0,0,0|1,0,1]=4 416 B9R1.15 O=CC1=C(Br)C=CC=C1 3727 [1,0,1,0,0,0|2,0,0]=4 417 B9R1.15 O=CC1=C(F)C=CC=C1 3476 [1,0,1,0,0,0|2,0,0]=4 418 B9R1.15 O=CC1=C(I)C=CC=C1 3914 [1,0,1,0,0,0|2,0,0]=4 419 B9R1.15 O=CC1=C(O)C=NC=C1 33398 [1,0,1,0,0,0|2,0,0]=4 420 B9R1.15 O=CC1=C(O)N=CC=C1 17177 [1,0,1,0,0,0|2,0,0]=4 421 B9R1.15 O=CC1=NC=CC=C1O 12415 [1,0,1,0,0,0|2,0,0]=4 422 B9R1.15 OCC1=C(O)C=CC=C1 21869 [1,0,1,0,0,0|1,0,1]=4 423 B9R1.12 O=C\C=C\C1=CC=CO1 6949 [1,0,1,0,0,0|2,0,0]=4 424 B11R1.13 CCOC1=C(F)C(F)=CC=C1 2326 [0,1,1,0,0,0|1,0,1]=4 425 B11R1.13 CCOC1=CC=CC(Br)=C1I 19689 [0,1,1,0,0,0|1,0,1]=4 426 B11R1.17 CCCOC1=C(O)C=CC=C1 13203 [0,1,1,0,0,0|1,0,1]=4 427 B11R1.17 FC1=C(OCCBr)C=CC=C1 16330 [0,1,1,0,0,0|1,0,1]=4 428 B11R1.17 NCCOC1=C(F)C=CC=C1 19159 [0,1,1,0,0,0|1,0,1]=4 429 B11R1.41 CCOC1=C(C#N)C=CC=C1 4773 [0,1,1,0,0,0|0,0,2]=4 430 B11R1.41 CCOC1=C(C=O)C=CC=C1 9726 [0,1,1,0,0,0|1,0,1]=4 431 B11R1.41 CCOC1=C(CN)C=CC=C1 7400 [0,1,1,0,0,0|0,0,2]=4 432 B11R1.41 CCOC1=C(OC)C=CC=C1 3067 [0,1,1,0,0,0|1,0,1]=4 433 B11R1.41 COC1=C(CC=O)C=CC=C1 17222 [0,1,1,0,0,0|2,0,0]=4 434 B11R1.81 CCCC1=C(O)C=C(O)C=C1 25562 [0,1,1,0,0,0|1,0,1]=4 435 B11R1.81 CCOC1=C(Cl)C=C(Cl)C=C1 9513 [0,1,1,0,0,0|1,0,1]=4 436 B11R1.81 CCOC1=C(Cl)C=C(F)C=C1 3155 [0,1,1,0,0,0|1,0,1]=4 437 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 3163 [0,1,1,0,0,0|1,0,1]=4 438 B11R1.81 CCOC1=C(N)C=C(N)C=C1 3168 [0,1,1,0,0,0|0,0,2]=4 439 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 23388 [0,1,1,0,0,0|2,0,0]=4 440 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 28140 [0,1,1,0,0,0|2,0,0]=4 441 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 28149 [0,1,1,0,0,0|2,0,0]=4 442 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 3830 [0,1,1,0,0,0|0,0,1]=3 443 B11R1.86 CC(=O)NC1=C(O)C=CN=C1 26792 [0,1,1,0,0,0|1,0,1]=4 444 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 26790 [0,1,1,0,0,0|1,0,1]=4 445 B11R1.86 CC(=O)NC1=NC=CC=C1O 26791 [0,1,1,0,0,0|1,0,1]=4 446 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 3055 [0,1,1,0,0,0|1,0,0]=3 447 B11R1.86 CC(=O)OC1=C(F)C=CC=C1 3059 [0,1,1,0,0,0|1,0,0]=3 448 B11R1.86 CC(=O)OC1=C(I)C=CC=C1 3062 [0,1,1,0,0,0|1,0,0]=3 449 B11R1.86 CC(C)OC1=C(Br)C=CC=C1 3828 [0,1,1,0,0,0|1,0,1]=4 450 B11R1.86 CC(C)OC1=C(O)C=CC=C1 13205 [0,1,1,0,0,0|1,0,1]=4 451 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 20030 [0,1,1,0,0,0|2,0,0]=4 452 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 1919 [0,1,1,0,0,0|1,0,1]=4 453 B11R1.182 CCOC1=C(Cl)C=CC(F)=C1 3157 [0,1,1,0,0,0|1,0,1]=4 454 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 3166 [0,1,1,0,0,0|1,0,1]=4 455 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 21422 [0,1,1,0,0,0|1,0,1]=4 456 B11R1.605 CCCC1=C(O)C=CC=C1O 19795 [0,1,1,0,0,0|1,0,1]=4 457 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 31604 [0,1,1,0,0,0|1,0,1]=4 458 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 28145 [0,1,1,0,0,0|1,0,1]=4 459 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 28133 [0,1,1,0,0,0|1,0,1]=4 460 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 35682 [0,1,1,0,0,0|1,0,1]=4 461 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 3342 [0,1,1,0,0,0|0,0,2]=4 462 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 26262 [0,1,1,0,0,0|0,0,2]=4 463 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 3293 [0,1,1,0,0,0|0,0,2]=4 464 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 17726 [0,1,1,0,0,0|0,0,2]=4 465 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 6832 [0,1,1,0,0,0|0,0,2]=4 466 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 3061 [0,1,1,0,0,0|1,0,0]=3 467 B11R1.20 CC(C)OC1=CC=C(N)C=C1 28330 [0,1,1,0,0,0|1,0,1]=4 468 B11R1.20 CC(C)OC1=CC=C(O)C=C1 34515 [0,1,1,0,0,0|1,0,1]=4 469 B11R1.20 CC1=CC=C(CC(O)=S)C=C1 10789 [0,1,1,0,0,0|2,0,0]=4 470 B11R1.20 Nc1ccc(CC(=O)O)cc1 22147 [0,1,1,0,0,0|2,0,0]=4 471 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 4246 [0,1,1,0,0,0|2,0,0]=4 472 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 4250 [0,1,1,0,0,0|2,0,0]=4 473 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 13432 [0,1,1,0,0,0|2,0,0]=4 474 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 19614 [0,1,1,0,0,0|2,0,0]=4 475 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 18835 [0,1,1,0,0,0|2,0,0]=4 476 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 22193 [0,1,1,0,0,0|2,0,0]=4 477 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 34915 [0,1,1,0,0,0|2,0,0]=4 478 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 35902 [0,1,1,0,0,0|2,0,0]=4 479 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 21081 [0,1,1,0,0,0|2,0,0]=4 480 B11R1.36 C[C@@H](C(=O)O)c1ccccc1 6079 [0,1,1,0,0,0|2,0,0]=4 481 B11R1.36 C[C@H](C(=O)O)c1ccccc1 6862 [0,1,1,0,0,0|2,0,0]=4 482 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 16811 [0,1,1,0,0,0|2,0,0]=4 483 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 11005 [0,1,1,0,0,0|2,0,0]=4 484 B11R1.36 N[C@H](C(=O)O)c1ccccc1 23858 [0,1,1,0,0,0|2,0,0]=4 485 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 6066 [0,1,1,0,0,0|2,0,0]=4 486 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 6067 [0,1,1,0,0,0|2,0,0]=4 487 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 21083 [0,1,1,0,0,0|2,0,0]=4 488 B11R1.40 CCC(=O)NC1=CC=CC=C1 3338 [0,1,1,0,0,0|0,0,2]=4 489 B11R1.40 CNC(=O)OC1=CC=CC=C1 35857 [0,1,1,0,0,0|1,0,0]=3 490 B11R1.40 O=C(CF)NC1=CC=CC=C1 3369 [0,1,1,0,0,0|0,0,2]=4 491 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 25423 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.157 CC(=O)CC1=CC(Cl)=CC=C1 19805 [0,1,1,0,0,0|1,0,1]=4 493 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 35854 [0,1,1,0,0,0|1,0,1]=4 494 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 3340 [0,1,1,0,0,0|0,0,2]=4 495 B11R1.157 CC(=O)NC1=CC(I)=CC=C1 3291 [0,1,1,0,0,0|0,0,2]=4 496 B11R1.157 CC(=O)NC1=CC=CC(O)=C1 3835 [0,1,1,0,0,0|0,0,2]=4 497 B11R1.157 CC(=O)OC1=CC(Cl)=CC=C1 3057 [0,1,1,0,0,0|1,0,0]=3 498 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 3060 [0,1,1,0,0,0|1,0,0]=3 499 B11R1.157 CC(C)OC1=CC=CC(Br)=C1 14867 [0,1,1,0,0,0|1,0,1]=4 500 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 28872 [0,1,1,0,0,0|2,0,0]=4 501 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 1961 [0,1,1,0,0,0|2,0,0]=4 502 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 4244 [0,1,1,0,0,0|2,0,0]=4 503 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 16510 [0,1,1,0,0,0|2,0,0]=4 504 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 4167 [0,1,1,0,0,0|2,0,0]=4 505 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 4195 [0,1,1,0,0,0|2,0,0]=4 506 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 21773 [0,1,1,0,0,0|2,0,0]=4 507 B11R2.1 BrC1=CN=C2C=CC=CN12 17183 [1,1,0,0,0,0|2,0,0]=4 508 B11R2.1 BrC1=CNC2=CC=CC=C12 11087 [1,1,0,0,0,0|1,0,1]=4 509 B11R2.1 BrC1=COC2=C1C=CC=C2 28021 [1,1,0,0,0,0|1,0,0]=3 510 B11R2.1 BrC1=CSC2=C1C=CC=C2 13106 [1,1,0,0,0,0|1,1,0]=4 511 B11R2.1 CC1=CCC2=CC=CC=C12 15081 [1,1,0,0,0,0|2,0,0]=4 512 B11R2.1 CC1=CNC2=CC=CC=C12 7505 [1,1,0,0,0,0|1,0,1]=4 513 B11R2.1 CC1=CSC2=C1C=CC=C2 13547 [1,1,0,0,0,0|1,1,0]=4 514 B11R2.1 CC1C=CC2=CC=CC=C21 15080 [1,1,0,0,0,0|2,0,0]=4 515 B11R2.1 CN1C=CC2=CC=CC=C21 7436 [1,1,0,0,0,0|1,0,1]=4 516 B11R2.1 CN1C=NC2=C1C=CC=C2 7613 [1,1,0,0,0,0|1,0,0]=3 517 B11R2.1 CN1C=NC2=CC=CN=C21 26941 [1,1,0,0,0,0|2,0,0]=4 518 B11R2.1 CN1N=NC2=C1C=CC=C2 28190 [1,1,0,0,0,0|2,0,0]=4 519 B11R2.1 ClC1=CNC2=CC=CC=C12 25672 [1,1,0,0,0,0|1,0,1]=4 520 B11R2.1 ClC1=NOC2=C1C=CC=C2 8716 [1,1,0,0,0,0|2,0,0]=4 521 B11R2.1 NC1=NOC2=C1C=CC=C2 14511 [1,1,0,0,0,0|2,0,0]=4 522 B11R2.1 NN1N=NC2=C1C=CC=C2 19954 [1,1,0,0,0,0|2,0,0]=4 523 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [1,1,0,0,0,0|1,0,1]=4 524 B11R2.1 OC1=CNC2=CC=CC=C12 7264 [1,1,0,0,0,0|1,0,1]=4 525 B11R2.1 OC1=NOC2=C1C=CC=C2 27626 [1,1,0,0,0,0|2,0,0]=4 526 B11R2.1 ON1N=NC2=C1C=CC=C2 12739 [1,1,0,0,0,0|2,0,0]=4 527 B11R2.1 ON1N=NC2=C1C=CC=C2 35769 [1,1,0,0,0,0|2,0,0]=4 528 B11R2.1 ON1N=NC2=C1C=CC=C2 9767 [1,1,0,0,0,0|2,0,0]=4 529 B11R2.1 [O-][N+]1=C2C=CC=CC2=NO1 23000 [1,1,0,0,0,0|2,0,0]=4 530 B11R2.36 BrC1=CC2=C(C=C1)CCO2 28031 [1,1,0,0,0,0|1,0,1]=4 531 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 34235 [1,1,0,0,0,0|0,0,0]=2 532 B11R2.36 BrC1=CC2=C(C=C1)N=CS2 21861 [1,1,0,0,0,0|0,1,0]=3 533 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 9618 [1,1,0,0,0,0|1,0,0]=3 534 B11R2.36 BrC1=CC2=C(C=C1)OC=C2 22017 [1,1,0,0,0,0|1,0,0]=3 535 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 17145 [1,1,0,0,0,0|0,0,0]=2 536 B11R2.36 BrC1=CC2=C(C=C1)OCC2 7055 [1,1,0,0,0,0|1,0,1]=4 537 B11R2.36 BrC1=CC2=C(C=C1)OCO2 3738 [1,1,0,0,0,0|1,0,1]=4 538 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 15353 [1,1,0,0,0,0|1,1,0]=4 539 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 7752 [1,1,0,0,0,0|1,1,0]=4 540 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 21859 [1,1,0,0,0,0|0,1,0]=3 541 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 28003 [1,1,0,0,0,0|1,0,0]=3 542 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 27849 [1,1,0,0,0,0|1,1,0]=4 543 B11R2.36 BrC1=CC2=NC=CN2C=C1 22087 [1,1,0,0,0,0|2,0,0]=4 544 B11R2.36 BrC1=CC2=NON=C2C=C1 15922 [1,1,0,0,0,0|2,0,0]=4 545 B11R2.36 BrC1=CC2=NSN=C2C=C1 12684 [1,1,0,0,0,0|2,0,0]=4 546 B11R2.36 BrC1=CC=C2C=CNC2=C1 1662 [1,1,0,0,0,0|1,0,1]=4 547 B11R2.36 BrC1=CC=C2N=COC2=N1 27601 [1,1,0,0,0,0|1,0,0]=3 548 B11R2.36 BrC1=CC=C2NC=CC2=C1 1661 [1,1,0,0,0,0|1,0,1]=4 549 B11R2.36 BrC1=CC=C2NC=NC2=N1 15410 [1,1,0,0,0,0|2,0,0]=4 550 B11R2.36 BrC1=CN2C=CN=C2C=C1 14736 [1,1,0,0,0,0|2,0,0]=4 551 B11R2.36 BrC1=CN=C2N=COC2=C1 22321 [1,1,0,0,0,0|1,0,0]=3 552 B11R2.36 BrC1=CN=C2NC=NC2=C1 17714 [1,1,0,0,0,0|2,0,0]=4 553 B11R2.36 BrC1=CN=C2OC=CC2=C1 26778 [1,1,0,0,0,0|2,0,0]=4 554 B11R2.36 BrC1=CN=C2OC=NC2=C1 24136 [1,1,0,0,0,0|1,0,0]=3 555 B11R2.36 CC1=CC2=C(C=C1)N=CN2 7666 [1,1,0,0,0,0|1,0,0]=3 556 B11R2.36 CC1=CC2=C(C=C1)OC=C2 28016 [1,1,0,0,0,0|1,0,0]=3 557 B11R2.36 CC1=CC2=C(C=C1)OC=N2 8638 [1,1,0,0,0,0|0,0,0]=2 558 B11R2.36 CC1=CC2=C(C=CS2)C=C1 15767 [1,1,0,0,0,0|1,1,0]=4 559 B11R2.36 CC1=CC2=NON=C2C=C1 14814 [1,1,0,0,0,0|2,0,0]=4 560 B11R2.36 CC1=CC=C2C=CNC2=C1 7240 [1,1,0,0,0,0|1,0,1]=4 561 B11R2.36 CC1=CC=C2NC=CC2=C1 7238 [1,1,0,0,0,0|1,0,1]=4 562 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 7649 [1,1,0,0,0,0|1,0,0]=3 563 B11R2.36 ClC1=CC2=C(C=C1)N=CS2 31808 [1,1,0,0,0,0|0,1,0]=3 564 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 28012 [1,1,0,0,0,0|1,0,0]=3 565 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 8712 [1,1,0,0,0,0|0,0,0]=2 566 B11R2.36 ClC1=CC2=C(C=C1)OCO2 3620 [1,1,0,0,0,0|1,0,1]=4 567 B11R2.36 ClC1=CC2=C(C=C1)SC=N2 21704 [1,1,0,0,0,0|0,1,0]=3 568 B11R2.36 ClC1=CC2=C(C=CO2)C=C1 32456 [1,1,0,0,0,0|1,0,0]=3 569 B11R2.36 ClC1=CC2=C(C=CS2)C=C1 32442 [1,1,0,0,0,0|1,1,0]=4 570 B11R2.36 ClC1=CC=C2C=CNC2=C1 1669 [1,1,0,0,0,0|1,0,1]=4 571 B11R2.36 ClC1=CC=C2N=CNC2=N1 22839 [1,1,0,0,0,0|2,0,0]=4 572 B11R2.36 ClC1=CC=C2NC=CC2=C1 1668 [1,1,0,0,0,0|1,0,1]=4 573 B11R2.36 ClC1=CN2C=CN=C2C=C1 26707 [1,1,0,0,0,0|2,0,0]=4 574 B11R2.36 FC1=CC2=C(C=C1)N=CN2 6519 [1,1,0,0,0,0|1,0,0]=3 575 B11R2.36 FC1=CC2=C(C=C1)OC=C2 16047 [1,1,0,0,0,0|1,0,0]=3 576 B11R2.36 FC1=CC2=C(C=C1)OC=N2 21888 [1,1,0,0,0,0|0,0,0]=2 577 B11R2.36 FC1=CC2=C(C=C1)OCC2 24189 [1,1,0,0,0,0|1,0,1]=4 578 B11R2.36 FC1=CC2=C(C=C1)SC=C2 16046 [1,1,0,0,0,0|1,1,0]=4 579 B11R2.36 FC1=CC2=C(C=CS2)C=C1 34529 [1,1,0,0,0,0|1,1,0]=4 580 B11R2.36 FC1=CC=C2C=CNC2=C1 1682 [1,1,0,0,0,0|1,0,1]=4 581 B11R2.36 FC1=CC=C2NC=CC2=C1 1681 [1,1,0,0,0,0|1,0,1]=4 582 B11R2.36 IC1=CC2=C(C=C1)OCC2 27760 [1,1,0,0,0,0|1,0,1]=4 583 B11R2.36 IC1=CC2=C(C=C1)OCO2 33795 [1,1,0,0,0,0|1,0,1]=4 584 B11R2.36 IC1=CC=C2NC=CC2=C1 27398 [1,1,0,0,0,0|1,0,1]=4 585 B11R2.36 IC1=CN2N=CN=C2C=C1 17710 [1,1,0,0,0,0|2,0,0]=4 586 B11R2.36 NC1=CC2=C(C=C1)C=NO2 24258 [1,1,0,0,0,0|2,0,0]=4 587 B11R2.36 NC1=CC2=C(C=C1)N=CN2 20258 [1,1,0,0,0,0|1,0,0]=3 588 B11R2.36 NC1=CC2=C(C=C1)N=CO2 17704 [1,1,0,0,0,0|0,0,0]=2 589 B11R2.36 NC1=CC2=C(C=C1)N=CS2 15630 [1,1,0,0,0,0|0,1,0]=3 590 B11R2.36 NC1=CC2=C(C=C1)OC=N2 34838 [1,1,0,0,0,0|0,0,0]=2 591 B11R2.36 NC1=CC2=C(C=C1)OCC2 16462 [1,1,0,0,0,0|1,0,1]=4 592 B11R2.36 NC1=CC2=C(C=C1)OCC2 20541 [1,1,0,0,0,0|1,0,1]=4 593 B11R2.36 NC1=CC2=C(C=C1)OCO2 22150 [1,1,0,0,0,0|1,0,1]=4 594 B11R2.36 NC1=CC2=C(C=C1)SC=C2 27144 [1,1,0,0,0,0|1,1,0]=4 595 B11R2.36 NC1=CC2=C(C=CS2)C=C1 34225 [1,1,0,0,0,0|1,1,0]=4 596 B11R2.36 NC1=CC=C2C=CNC2=C1 7311 [1,1,0,0,0,0|1,0,1]=4 597 B11R2.36 NC1=CC=C2NC=CC2=C1 7234 [1,1,0,0,0,0|1,0,1]=4 598 B11R2.36 NC1=CN2C=CN=C2C=C1 23882 [1,1,0,0,0,0|2,0,0]=4 599 B11R2.36 OC1=CC2=C(C=C1)CCO2 32303 [1,1,0,0,0,0|1,0,1]=4 600 B11R2.36 OC1=CC2=C(C=C1)OC=C2 34267 [1,1,0,0,0,0|1,0,0]=3 601 B11R2.36 OC1=CC2=C(C=C1)OCO2 15359 [1,1,0,0,0,0|1,0,1]=4 602 B11R2.36 OC1=CC2=C(C=CO2)C=C1 28025 [1,1,0,0,0,0|1,0,0]=3 603 B11R2.36 OC1=CC2=C(C=CS2)C=C1 33018 [1,1,0,0,0,0|1,1,0]=4 604 B11R2.36 OC1=CC=C2C=CNC2=C1 7261 [1,1,0,0,0,0|1,0,1]=4 605 B11R2.36 OC1=CC=C2NC=CC2=C1 7263 [1,1,0,0,0,0|1,0,1]=4 606 B11R2.36 SC1=CC2=C(C=C1)OCO2 15612 [1,1,0,0,0,0|1,0,1]=4 607 B11R2.106 BrC1=C2C=CNC2=CC=C1 7449 [1,1,0,0,0,0|1,0,1]=4 608 B11R2.106 BrC1=C2NC=CC2=CC=C1 7318 [1,1,0,0,0,0|1,0,1]=4 609 B11R2.106 BrC1=CC=CC2=C1C=CO2 32457 [1,1,0,0,0,0|1,0,0]=3 610 B11R2.106 BrC1=CC=CC2=C1C=CS2 27999 [1,1,0,0,0,0|1,1,0]=4 611 B11R2.106 BrC1=CC=CC2=C1OC=C2 27867 [1,1,0,0,0,0|1,0,0]=3 612 B11R2.106 BrC1=CC=CC2=C1OCC2 34424 [1,1,0,0,0,0|1,0,1]=4 613 B11R2.106 BrC1=CC=CC2=C1OCO2 32045 [1,1,0,0,0,0|1,0,1]=4 614 B11R2.106 BrC1=CC=CC2=C1SC=C2 34196 [1,1,0,0,0,0|1,1,0]=4 615 B11R2.106 BrC1=CC=CC2=NC=CN12 23424 [1,1,0,0,0,0|2,0,0]=4 616 B11R2.106 BrC1=CC=CC2=NC=CN12 26677 [1,1,0,0,0,0|2,0,0]=4 617 B11R2.106 CC1=C2C=CNC2=CC=C1 7233 [1,1,0,0,0,0|1,0,1]=4 618 B11R2.106 CC1=C2NC=CC2=CC=C1 7243 [1,1,0,0,0,0|1,0,1]=4 619 B11R2.106 CC1=CC=CC2=C1C=CS2 27877 [1,1,0,0,0,0|1,1,0]=4 620 B11R2.106 CC1=CC=CC2=C1OC=C2 28017 [1,1,0,0,0,0|1,0,0]=3 621 B11R2.106 CC1=CC=CC2=C1SC=C2 32444 [1,1,0,0,0,0|1,1,0]=4 622 B11R2.106 CC1=CC=CN2C=CN=C12 32071 [1,1,0,0,0,0|2,0,0]=4 623 B11R2.106 ClC1=C2C=CNC2=CC=C1 7232 [1,1,0,0,0,0|1,0,1]=4 624 B11R2.106 ClC1=C2CC=CC2=CC=C1 5384 [1,1,0,0,0,0|2,0,0]=4 625 B11R2.106 ClC1=C2NC=CC2=CC=C1 3195 [1,1,0,0,0,0|1,0,1]=4 626 B11R2.106 ClC1=CC=CC2=C1C=CO2 10451 [1,1,0,0,0,0|1,0,0]=3 627 B11R2.106 ClC1=CC=CC2=C1C=CS2 32446 [1,1,0,0,0,0|1,1,0]=4 628 B11R2.106 ClC1=CC=CC2=C1N=CS2 21694 [1,1,0,0,0,0|0,1,0]=3 629 B11R2.106 ClC1=CC=CC2=C1OC=C2 28022 [1,1,0,0,0,0|1,0,0]=3 630 B11R2.106 ClC1=CC=CC2=C1SC=C2 33790 [1,1,0,0,0,0|1,1,0]=4 631 B11R2.106 ClC1=NC=CC2=C1C=CO2 21417 [1,1,0,0,0,0|2,0,0]=4 632 B11R2.106 FC1=C2C=CNC2=CC=C1 7297 [1,1,0,0,0,0|1,0,1]=4 633 B11R2.106 FC1=C2NC=CC2=CC=C1 7294 [1,1,0,0,0,0|1,0,1]=4 634 B11R2.106 FC1=CC=CC2=C1C=CO2 15663 [1,1,0,0,0,0|1,0,0]=3 635 B11R2.106 FC1=CC=CC2=C1C=CS2 28000 [1,1,0,0,0,0|1,1,0]=4 636 B11R2.106 FC1=CC=CC2=C1OC=C2 28023 [1,1,0,0,0,0|1,0,0]=3 637 B11R2.106 FC1=CC=CC2=C1SC=C2 32445 [1,1,0,0,0,0|1,1,0]=4 638 B11R2.106 FC1=CC=CC2=NC=CN12 34476 [1,1,0,0,0,0|2,0,0]=4 639 B11R2.106 IC1=CN=CC2=C1OC=N2 34854 [1,1,0,0,0,0|1,0,0]=3 640 B11R2.106 NC1=C2C=CNC2=CC=C1 7310 [1,1,0,0,0,0|1,0,1]=4 641 B11R2.106 NC1=C2N=COC2=CC=C1 27744 [1,1,0,0,0,0|0,0,0]=2 642 B11R2.106 NC1=C2OC=CC2=NC=C1 26912 [1,1,0,0,0,0|2,0,0]=4 643 B11R2.106 NC1=C2OCOC2=CC=C1 35364 [1,1,0,0,0,0|1,0,1]=4 644 B11R2.106 NC1=CC=CC2=C1C=CS2 30428 [1,1,0,0,0,0|1,1,0]=4 645 B11R2.106 NC1=CC=CC2=C1NC=N2 8065 [1,1,0,0,0,0|1,0,0]=3 646 B11R2.106 NC1=CC=CC2=C1SC=C2 34224 [1,1,0,0,0,0|1,1,0]=4 647 B11R2.106 NC1=CC=CC2=NC=CN12 26676 [1,1,0,0,0,0|2,0,0]=4 648 B11R2.106 NC1=CC=CC2=NSN=C12 9995 [1,1,0,0,0,0|2,0,0]=4 649 B11R2.106 NC1=CC=CN2C=CN=C12 22323 [1,1,0,0,0,0|2,0,0]=4 650 B11R2.106 O=C1NC=CC2=C1C=CO2 14999 [1,1,0,0,0,0|2,0,0]=4 651 B11R2.106 OC1=C2C=CNC2=CC=C1 7262 [1,1,0,0,0,0|1,0,1]=4 652 B11R2.106 OC1=C2N=COC2=CC=C1 34840 [1,1,0,0,0,0|0,0,0]=2 653 B11R2.106 OC1=C2N=CSC2=CC=C1 15773 [1,1,0,0,0,0|0,1,0]=3 654 B11R2.106 OC1=C2NC=CC2=CC=C1 7345 [1,1,0,0,0,0|1,0,1]=4 655 B11R2.106 OC1=CC=CC2=C1C=CO2 28011 [1,1,0,0,0,0|1,0,0]=3 656 B11R2.106 OC1=CC=CC2=C1C=CS2 16414 [1,1,0,0,0,0|1,1,0]=4 657 B11R2.106 OC1=CC=CC2=C1OC=C2 32455 [1,1,0,0,0,0|1,0,0]=3 658 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 22720 [0,1,0,0,0,1|1,0,0]=3 659 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=N1 27750 [0,1,0,0,0,1|2,0,0]=4 660 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 22813 [0,1,0,0,0,1|2,0,0]=4 661 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 29729 [0,1,0,0,0,1|2,0,0]=4 662 B13R2.57 BrCC1=CC2=CC=CC=C2C=C1 9429 [0,1,0,0,0,1|2,0,0]=4 663 B13R2.57 BrCC1=CC2=CC=CC=C2C=N1 23798 [0,1,0,0,0,1|1,0,0]=3 664 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 23800 [0,1,0,0,0,1|1,0,0]=3 665 B13R2.57 CCC1=CC2=CC=CC=C2N=C1 7519 [0,1,0,0,0,1|1,0,0]=3 666 B13R2.57 COC1=CC2=CC=CC=C2C=C1 29075 [0,1,0,0,0,1|2,0,0]=4 667 B13R2.57 COC1=CC2=NC=CC=C2N=C1 27166 [0,1,0,0,0,1|2,0,0]=4 668 B13R2.57 COC1=NC2=CC=CC=C2C=C1 23493 [0,1,0,0,0,1|1,0,0]=3 669 B13R2.57 ClCC1=CC2=CC=CC=C2C=C1 28940 [0,1,0,0,0,1|2,0,0]=4 670 B13R2.57 N#CC1=CC2=CC=CC=C2C=N1 16887 [0,1,0,0,0,1|1,0,1]=4 671 B13R2.57 N#CC1=CC2=CC=CC=C2N=C1 5827 [0,1,0,0,0,1|1,0,1]=4 672 B13R2.57 N#CC1=NC2=CC=CC=C2C=C1 36052 [0,1,0,0,0,1|1,0,1]=4 673 B13R2.57 NCC1COC2=C(C=CC=C2)O1 14481 [0,1,0,0,0,1|1,0,1]=4 674 B13R2.57 NC[C@@H]1COC2=C(C=CC=C2)O1 11449 [0,1,0,0,0,1|1,0,1]=4 675 B13R2.57 NC[C@H]1COC2=C(C=CC=C2)O1 11450 [0,1,0,0,0,1|1,0,1]=4 676 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 5819 [0,1,0,0,0,1|2,0,0]=4 677 B13R2.57 NNC1=NC2=CC=CC=C2N=C1 15444 [0,1,0,0,0,1|2,0,0]=4 678 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 2277 [0,1,0,0,0,1|1,0,1]=4 679 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 21935 [0,1,0,0,0,1|1,0,1]=4 680 B13R2.57 OCC1CCC2=CC=CC=C2O1 17676 [0,1,0,0,0,1|1,0,1]=4 681 B13R2.57 OC[C@@H]1COC2=C(C=CC=C2)O1 11339 [0,1,0,0,0,1|1,0,1]=4 682 B13R2.57 OC[C@H]1COC2=C(C=CC=C2)O1 11340 [0,1,0,0,0,1|1,0,1]=4 683 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 5850 [0,1,0,0,0,1|1,0,0]=3 684 B13R2.155 CC1=NC2=CC(F)=CC=C2C=C1 5896 [0,1,0,0,0,1|1,0,0]=3 685 B13R2.155 ClC1=CC=C2N=CC(Br)=NC2=C1 18461 [0,1,0,0,0,1|2,0,0]=4 686 B13R2.155 ClC1=CC=C2N=CC(Cl)=NC2=C1 18464 [0,1,0,0,0,1|2,0,0]=4 687 B13R2.155 ClC1=NC2=CC(Br)=CC=C2C=C1 27904 [0,1,0,0,0,1|2,0,0]=4 688 B13R2.155 ClC1=NC2=CC(Br)=CC=C2C=N1 14676 [0,1,0,0,0,1|2,0,0]=4 689 B13R2.155 ClC1=NC2=CC(Br)=CC=C2N=C1 18353 [0,1,0,0,0,1|2,0,0]=4 690 B13R2.155 FC1=CC=C2C=NC(Cl)=NC2=C1 14313 [0,1,0,0,0,1|2,0,0]=4 691 B13R2.155 NC1=CC2=CC(Br)=CC=C2C=N1 14694 [0,1,0,0,0,1|2,0,0]=4 692 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 34537 [0,1,0,0,0,1|2,0,0]=4 693 B13R2.155 NC1=NC2=CC(Cl)=CC=C2C=N1 14697 [0,1,0,0,0,1|2,0,0]=4 694 B13R2.155 NC1=NC2=CC(F)=CC=C2C=N1 14314 [0,1,0,0,0,1|2,0,0]=4 695 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 10607 [0,1,0,0,0,1|2,0,0]=4 696 B13R2.155 O=C1C=NC2=CC=C(Cl)C=C2N1 18465 [0,1,0,0,0,1|2,0,0]=4 697 B13R2.155 O=C1COC2=C(C=C(Br)C=C2)N1 16746 [0,1,0,0,0,1|1,0,1]=4 698 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)N1 27691 [0,1,0,0,0,1|1,0,1]=4 699 B13R2.155 O=C1COC2=C(C=C(O)C=C2)N1 27892 [0,1,0,0,0,1|1,0,1]=4 700 B13R2.155 O=C1COC2=CC=C(Br)C=C2C1 18399 [0,1,0,0,0,1|2,0,0]=4 701 B13R2.155 O=C1COC2=CC=C(Cl)C=C2C1 18387 [0,1,0,0,0,1|2,0,0]=4 702 B13R2.155 O=C1COC2=CC=C(F)C=C2C1 18379 [0,1,0,0,0,1|2,0,0]=4 703 B13R2.155 OC1=NC2=CC(Br)=CC=C2N=C1 20306 [0,1,0,0,0,1|2,0,0]=4 704 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 21848 [0,1,0,0,0,1|1,0,0]=3 705 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 5878 [0,1,0,0,0,1|1,0,0]=3 706 B13R2.162 CC1=NC2=C(Cl)C=CC=C2C=C1 5852 [0,1,0,0,0,1|1,0,0]=3 707 B13R2.162 CC1=NC2=C(O)C=CC=C2C=C1 24684 [0,1,0,0,0,1|1,0,0]=3 708 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 16930 [0,1,0,0,0,1|2,0,0]=4 709 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=N1 14678 [0,1,0,0,0,1|2,0,0]=4 710 B13R2.162 ClC1=NC2=C(Br)C=CC=C2N=C1 34382 [0,1,0,0,0,1|2,0,0]=4 711 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=C1 23770 [0,1,0,0,0,1|2,0,0]=4 712 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 27726 [0,1,0,0,0,1|2,0,0]=4 713 B13R2.162 O=C1COC2=C(N1)C(F)=CC=C2 27628 [0,1,0,0,0,1|1,0,1]=4 714 B13R2.162 O=C1COC2=CC=CC(Br)=C2C1 18371 [0,1,0,0,0,1|2,0,0]=4 715 B13R2.162 O=C1COC2=CC=CC(Cl)=C2C1 18193 [0,1,0,0,0,1|2,0,0]=4 716 B13R2.162 OC1=NC2=C(O)C=CC=C2C=C1 7554 [0,1,0,0,0,1|2,0,0]=4 717 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 5875 [0,1,0,0,0,1|1,0,0]=3 718 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 5879 [0,1,0,0,0,1|2,0,0]=4 719 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 5862 [0,1,0,0,0,1|2,0,0]=4 720 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 19783 [0,1,0,0,0,1|1,0,0]=3 721 B13R2.328 CC1=CC2=CC=CC=C2C(O)=N1 27723 [0,1,0,0,0,1|1,0,0]=3 722 B13R2.328 ClC1=CC2=CC=CC=C2C(Cl)=N1 7254 [0,1,0,0,0,1|2,0,0]=4 723 B13R2.328 ClC1=NC2=CC=CC=C2C(Cl)=N1 9668 [0,1,0,0,0,1|2,0,0]=4 724 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 27641 [0,1,0,0,0,1|2,0,0]=4 725 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 27898 [0,1,0,0,0,1|2,0,0]=4 726 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 27781 [0,1,0,0,0,1|2,0,0]=4 727 B13R2.328 NC1=NC2=CC=CC=C2C(O)=N1 27783 [0,1,0,0,0,1|2,0,0]=4 728 B13R2.328 O=C1C=C(O)C2=CC=CC=C2O1 8693 [0,1,0,0,0,1|2,0,0]=4 729 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 13599 [0,1,0,0,0,1|1,0,1]=4 730 B13R2.328 OC1=CC(O)=NC2=CC=CC=C12 7556 [0,1,0,0,0,1|2,0,0]=4 731 B13R2.328 OC1=NC2=CC=CC=C2C(O)=N1 9671 [0,1,0,0,0,1|2,0,0]=4 732 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl 12431 [0,1,0,0,0,1|1,0,0]=3 733 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl 15428 [0,1,0,0,0,1|1,0,0]=3 734 B13R2.369 CC1=NC2=CC=CC=C2N=C1O 15424 [0,1,0,0,0,1|1,0,0]=3 735 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br 35526 [0,1,0,0,0,1|2,0,0]=4 736 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl 15473 [0,1,0,0,0,1|2,0,0]=4 737 B13R2.369 OC1=NC2=CC=CC=C2N=C1O 25656 [0,1,0,0,0,1|2,0,0]=4 738 B13R2.3683 BrC1=CC2=CC=C(I)C=C2N=C1 35122 [0,1,0,0,0,1|2,0,0]=4 739 B13R2.3683 BrC1=CC=C2N=C(Br)C=NC2=C1 18458 [0,1,0,0,0,1|2,0,0]=4 740 B13R2.3683 BrC1=CC=C2N=C(I)N=CC2=C1 33957 [0,1,0,0,0,1|2,0,0]=4 741 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 33548 [0,1,0,0,0,1|2,0,0]=4 742 B13R2.3683 CC1=CC=C2N=C(C)C=CC2=C1 5876 [0,1,0,0,0,1|1,0,0]=3 743 B13R2.3683 CC1=CC=C2N=C(Cl)C=CC2=C1 13893 [0,1,0,0,0,1|2,0,0]=4 744 B13R2.3683 CC1=CC=C2N=C(Cl)C=NC2=C1 20636 [0,1,0,0,0,1|2,0,0]=4 745 B13R2.3683 CC1=CC=C2OC(=O)C=CC2=C1 9755 [0,1,0,0,0,1|2,0,0]=4 746 B13R2.3683 CC1=CN=C2N=C(C)C=CC2=C1 27323 [0,1,0,0,0,1|2,0,0]=4 747 B13R2.3683 CC1=NC2=CC=C(Br)C=C2C=C1 5882 [0,1,0,0,0,1|1,0,0]=3 748 B13R2.3683 CC1=NC2=CC=C(F)C=C2C=C1 7579 [0,1,0,0,0,1|1,0,0]=3 749 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2N=C1 21575 [0,1,0,0,0,1|2,0,0]=4 750 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 21567 [0,1,0,0,0,1|2,0,0]=4 751 B13R2.3683 ClC1=CC=C2N=C(Br)C=CC2=C1 25737 [0,1,0,0,0,1|2,0,0]=4 752 B13R2.3683 ClC1=CC=C2N=C(Cl)C=NC2=C1 7583 [0,1,0,0,0,1|2,0,0]=4 753 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 14631 [0,1,0,0,0,1|2,0,0]=4 754 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=N1 14677 [0,1,0,0,0,1|2,0,0]=4 755 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2N=C1 14628 [0,1,0,0,0,1|2,0,0]=4 756 B13R2.3683 ClC1=NC2=CC=C(I)C=C2C=C1 14689 [0,1,0,0,0,1|2,0,0]=4 757 B13R2.3683 FC1=CC=C2N=C(Cl)N=CC2=C1 14302 [0,1,0,0,0,1|2,0,0]=4 758 B13R2.3683 NC1=CC2=CC=C(Cl)C=C2N=C1 21568 [0,1,0,0,0,1|2,0,0]=4 759 B13R2.3683 NC1=CC=C2NC(=O)C=NC2=C1 34827 [0,1,0,0,0,1|2,0,0]=4 760 B13R2.3683 NC1=NC2=CC=C(Br)C=C2C=N1 16392 [0,1,0,0,0,1|2,0,0]=4 761 B13R2.3683 NC1=NC2=CC=C(Cl)C=C2C=N1 17841 [0,1,0,0,0,1|2,0,0]=4 762 B13R2.3683 NC1=NC2=CC=C(F)C=C2C=N1 14303 [0,1,0,0,0,1|2,0,0]=4 763 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 11099 [0,1,0,0,0,1|2,0,0]=4 764 B13R2.3683 O=C1C=NC2=CC(Br)=CC=C2N1 18436 [0,1,0,0,0,1|2,0,0]=4 765 B13R2.3683 O=C1C=NC2=CC(Cl)=CC=C2N1 18351 [0,1,0,0,0,1|2,0,0]=4 766 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2O1 17577 [0,1,0,0,0,1|2,0,0]=4 767 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2O1 34522 [0,1,0,0,0,1|2,0,0]=4 768 B13R2.3683 O=C1COC2=C(C=CC(Br)=C2)N1 27579 [0,1,0,0,0,1|1,0,1]=4 769 B13R2.3683 O=C1COC2=C(C=CC(F)=C2)N1 27740 [0,1,0,0,0,1|1,0,1]=4 770 B13R2.3683 O=C1COC2=C(C=CC(O)=C2)N1 27734 [0,1,0,0,0,1|1,0,1]=4 771 B13R2.3683 O=C1COC2=CC(Br)=CC=C2C1 18376 [0,1,0,0,0,1|2,0,0]=4 772 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2C1 18375 [0,1,0,0,0,1|2,0,0]=4 773 B13R2.3683 O=C1COC2=CC(F)=CC=C2C1 18374 [0,1,0,0,0,1|2,0,0]=4 774 B13R2.3683 O=C1N=CC2=CC(Br)=CC=C2N1 35223 [0,1,0,0,0,1|2,0,0]=4 775 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)CO1 29214 [0,1,0,0,0,1|1,0,1]=4 776 B13R2.5179 BrC1=C2N=CC(I)=CC2=CC=C1 27663 [0,1,0,0,0,1|2,0,0]=4 777 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 34782 [0,1,0,0,0,1|2,0,0]=4 778 B13R2.5179 ClC1=NC2=CC=CC(Cl)=C2C=C1 24683 [0,1,0,0,0,1|2,0,0]=4 779 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 35230 [0,1,0,0,0,1|2,0,0]=4 780 B13R2.5179 NC1=NC2=CC=CC(Br)=C2C=C1 27897 [0,1,0,0,0,1|2,0,0]=4 781 B13R2.5179 NC1=NC2=CC=CC(Cl)=C2C=N1 14696 [0,1,0,0,0,1|2,0,0]=4 782 B13R2.5179 O=C1COC2=C(Br)C=CC=C2C1 18173 [0,1,0,0,0,1|2,0,0]=4 783 B13R2.5179 O=C1COC2=C(C=CC=C2O)N1 27895 [0,1,0,0,0,1|1,0,1]=4 784 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 16250 [0,2,0,0,0,0|1,0,1]=4 785 B13R2.45 CN1C(CCl)=NC2=C1C=CC=C2 16816 [0,2,0,0,0,0|1,0,0]=3 786 B13R2.135 CC1=C(C=O)C2=CC=CC=C2N1 7437 [0,2,0,0,0,0|1,0,1]=4 787 B13R2.135 CC1=C(C=O)N2C=CC=CC2=N1 27916 [0,2,0,0,0,0|2,0,0]=4 788 B13R2.135 CCN1C(C)=CC2=CC=CC=C21 25686 [0,2,0,0,0,0|1,0,1]=4 789 B13R2.135 CCN1C(C)=NC2=C1C=CC=C2 7660 [0,2,0,0,0,0|1,0,0]=3 790 B13R2.359 CC1=NC2=CC=CC=C2C1(C)C 7445 [0,2,0,0,0,0|1,0,0]=3 791 B13R2.3028 CC1=C(C)N2C=C(Br)C=CC2=N1 27918 [0,2,0,0,0,0|2,0,0]=4 792 B13R2.26 CCCC1=CC2=CC=CC=C2C1 5403 [0,2,0,0,0,0|2,0,0]=4 793 B13R2.26 CCCC1=NC2=C(C=CC=C2)N1 21433 [0,2,0,0,0,0|1,0,0]=3 794 B13R2.26 N#CCC1=NC2=C(C=CC=C2)N1 7544 [0,2,0,0,0,0|1,0,0]=3 795 B13R2.26 NCCC1=NC2=C(C=CC=C2)N1 35529 [0,2,0,0,0,0|1,0,0]=3 796 B13R2.26 OCCC1=CC2=C(C=CC=C2)S1 12376 [0,2,0,0,0,0|1,1,0]=4 797 B13R2.26 OCCC1=NC2=C(C=CC=C2)S1 20079 [0,2,0,0,0,0|0,1,0]=3 798 B13R2.43 ClCC1=CC2=NC=C(Br)C=C2O1 26724 [0,2,0,0,0,0|2,0,0]=4 799 B13R2.43 N#CC1=NC2=C(C=C(N)C=C2)S1 17255 [0,2,0,0,0,0|0,1,1]=4 800 B13R2.43 N#CC1=NC2=C(C=C(O)C=C2)S1 19680 [0,2,0,0,0,0|0,1,1]=4 801 B13R2.43 NC1=CC2=C(C=C1)NC(CO)=N2 26417 [0,2,0,0,0,0|1,0,0]=3 802 B13R2.43 O=C=C1C=C2C=CC(Cl)=CC2=N1 13946 [0,2,0,0,0,0|1,0,1]=4 803 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)O1 10165 [0,2,0,0,0,0|1,0,1]=4 804 B13R2.43 OCC1=CC2=CC(Br)=CN=C2O1 26953 [0,2,0,0,0,0|2,0,0]=4 805 B13R2.43 OCC1=CC2=NC=C(O)C=C2O1 26962 [0,2,0,0,0,0|2,0,0]=4 806 B13R2.54 CC1=CC=CC2=C1N=C(NN)S2 8422 [0,2,0,0,0,0|1,1,0]=4 807 B13R2.54 CC1=CC=CN2C=C(CCl)N=C12 34789 [0,2,0,0,0,0|2,0,0]=4 808 B13R2.54 CCC1=CC2=CC=CC(Cl)=C2C1 5400 [0,2,0,0,0,0|2,0,0]=4 809 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)O1 6959 [0,2,0,0,0,0|1,0,0]=3 810 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)S1 9425 [0,2,0,0,0,0|1,1,0]=4 811 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 7586 [0,2,0,0,0,0|1,0,0]=3 812 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 9409 [0,2,0,0,0,0|1,0,0]=3 813 B13R2.435 CC(C)C1=CC2=CC=CC=C2C1 35010 [0,2,0,0,0,0|2,0,0]=4 814 B13R2.435 CC(O)C1=CC2=C(C=CC=C2)S1 14794 [0,2,0,0,0,0|1,1,0]=4 815 B13R2.435 O=C(Cl)C1=CC2=C(C=CC=C2)O1 7016 [0,2,0,0,0,0|1,0,1]=4 816 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 7019 [0,2,0,0,0,0|1,0,1]=4 817 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 8062 [0,2,0,0,0,0|1,0,1]=4 818 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)O1 15844 [0,2,0,0,0,0|0,0,1]=3 819 B13R2.435 OB(O)C1=CC2=C(C=CC=C2)O1 1754 [0,2,0,0,0,0|2,0,0]=4 820 B13R2.435 OB(O)C1=NC2=C(C=CC=C2)N1 7876 [0,2,0,0,0,0|2,0,0]=4 821 B13R2.3051 CC1(C)OC2=C(C=C(N)C=C2)O1 34264 [0,2,0,0,0,0|1,0,1]=4 822 B13R2.4826 CC1(C)CC2=C(O1)C(O)=CC=C2 7022 [0,2,0,0,0,0|1,0,1]=4 823 B13R2.581 COC1=CC=CC2=C1N=C(Cl)S2 21817 [0,2,0,0,0,0|1,1,0]=4 824 B13R2.581 COC1=CC=CC2=C1N=C(N)S2 21722 [0,2,0,0,0,0|1,1,0]=4 825 B13R2.3050 CC1=C(C)C2=C(C=C1)SC(Cl)=N2 21764 [0,2,0,0,0,0|1,1,0]=4 826 B13R2.3050 CC1=C(C)C2=C(C=C1)SC(N)=N2 21762 [0,2,0,0,0,0|1,1,0]=4 827 B13R2.3050 CC1=CC2=C(F)C(F)=CC=C2N1 9373 [0,2,0,0,0,0|1,0,1]=4 828 B13R2.3050 CC1=CC2=C(F)C(O)=CC=C2N1 15257 [0,2,0,0,0,0|1,0,1]=4 829 B13R2.3050 CC1=NC2=C(N1)C(F)=C(F)C=C2 6523 [0,2,0,0,0,0|1,0,0]=3 830 B13R2.3050 ClC1=NC2=C(C=CC(Cl)=C2Cl)S1 21750 [0,2,0,0,0,0|1,1,0]=4 831 B13R2.3050 NC1=NC2=C(C=CC(Cl)=C2Cl)S1 21851 [0,2,0,0,0,0|1,1,0]=4 832 B13R2.5139 CC1=CC2=C(C)C=CC(C)=C2C1 5425 [0,2,0,0,0,0|2,0,0]=4 833 B13R2.5139 CC1=CC=C(C)C2=C1N=C(Cl)S2 21769 [0,2,0,0,0,0|1,1,0]=4 834 B13R2.5139 CC1=CC=C(C)C2=C1N=C(N)S2 21768 [0,2,0,0,0,0|1,1,0]=4 835 B13R2.5139 ClC1=CC=C(Cl)C2=C1N=C(Cl)S2 21752 [0,2,0,0,0,0|1,1,0]=4 836 B13R2.5139 ClC1=NC2=C(S1)C(Br)=CC=C2Br 21881 [0,2,0,0,0,0|1,1,0]=4 837 B13R2.5139 FC1=CC=C(F)C2=C1N=C(Cl)S2 21757 [0,2,0,0,0,0|1,1,0]=4 838 B13R2.5139 NC1=NC2=C(S1)C(Br)=CC=C2Br 21880 [0,2,0,0,0,0|1,1,0]=4 839 B13R2.5139 NC1=NC2=C(S1)C(Cl)=CC=C2Cl 21751 [0,2,0,0,0,0|1,1,0]=4 840 B13R2.5139 NC1=NC2=C(S1)C(F)=CC=C2F 21755 [0,2,0,0,0,0|1,1,0]=4 841 B13R2.5397 CC1=CC(C)=C2C=C(C)CC2=C1 5430 [0,2,0,0,0,0|2,0,0]=4 842 B13R2.5397 CC1=CC2=C(Cl)C=C(Cl)C=C2N1 9376 [0,2,0,0,0,0|1,0,1]=4 843 B13R2.5397 CC1=CC2=C(N=C(Cl)S2)C(C)=C1 21816 [0,2,0,0,0,0|1,1,0]=4 844 B13R2.5397 CC1=CC2=C(N=C(N)S2)C(C)=C1 21765 [0,2,0,0,0,0|1,1,0]=4 845 B13R2.5397 ClC1=CC2=C(SC(Cl)=N2)C(Cl)=C1 21754 [0,2,0,0,0,0|1,1,0]=4 846 B13R2.5397 ClC1=NC2=C(C=C(Br)C=C2Br)S1 21878 [0,2,0,0,0,0|1,1,0]=4 847 B13R2.5397 ClC1=NC2=C(S1)C(Br)=CC(Br)=C2 21882 [0,2,0,0,0,0|1,1,0]=4 848 B13R2.5397 FC1=CC2=C(N=C(Cl)S2)C(F)=C1 21814 [0,2,0,0,0,0|1,1,0]=4 849 B13R2.5397 FC1=CC2=C(SC(Cl)=N2)C(F)=C1 21759 [0,2,0,0,0,0|1,1,0]=4 850 B13R2.5397 NC1=NC2=C(C=C(Br)C=C2Br)S1 21760 [0,2,0,0,0,0|1,1,0]=4 851 B13R2.5397 NC1=NC2=C(C=C(Cl)C=C2Cl)S1 21807 [0,2,0,0,0,0|1,1,0]=4 852 B13R2.5397 NC1=NC2=C(C=C(F)C=C2F)S1 21756 [0,2,0,0,0,0|1,1,0]=4 853 B13R2.5397 NC1=NC2=C(S1)C(Br)=CC(Br)=C2 21914 [0,2,0,0,0,0|1,1,0]=4 854 B13R2.5397 NC1=NC2=C(S1)C(Cl)=CC(Cl)=C2 21753 [0,2,0,0,0,0|1,1,0]=4 855 B13R2.5397 NC1=NC2=C(S1)C(F)=CC(F)=C2 21758 [0,2,0,0,0,0|1,1,0]=4 856 B13R2.2121 CC1=NC2=C(C=C(C#N)C=C2)N1 10220 [0,2,0,0,0,0|1,0,0]=3 857 B13R2.2121 CC1=NC2=C(C=C(C#N)C=C2)S1 24300 [0,2,0,0,0,0|0,1,0]=3 858 B13R2.2121 COC1=CC2=C(C=C1)N=C(Br)S2 17252 [0,2,0,0,0,0|1,1,0]=4 859 B13R2.2121 COC1=CC2=C(C=C1)N=C(C)N2 7665 [0,2,0,0,0,0|1,0,0]=3 860 B13R2.2121 COC1=CC2=C(C=C1)N=C(Cl)S2 17253 [0,2,0,0,0,0|1,1,0]=4 861 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 14480 [0,2,0,0,0,0|1,1,0]=4 862 B13R2.2121 COC1=CC2=C(C=C1)N=C(S)N2 7611 [0,2,0,0,0,0|2,0,0]=4 863 B13R2.2121 COC1=CC2=C(C=C1)OC(C)=N2 25985 [0,2,0,0,0,0|0,0,0]=2 864 B13R2.2121 COC1=CC2=C(C=C1)SC(N)=N2 19102 [0,2,0,0,0,0|1,1,0]=4 865 B13R2.2121 COC1=CC=C2C=C(C)NC2=C1 19946 [0,2,0,0,0,0|1,0,1]=4 866 B13R2.2121 COC1=CC=C2NC(C)=CC2=C1 7236 [0,2,0,0,0,0|1,0,1]=4 867 B13R2.2121 CSC1=CC2=C(C=C1)SC(C)=N2 25154 [0,2,0,0,0,0|0,1,0]=3 868 B13R2.2121 N#CC1=CC2=C(C=C1)N=C(Cl)S2 24303 [0,2,0,0,0,0|1,1,0]=4 869 B13R2.2121 N#CC1=CC2=C(C=C1)N=C(N)S2 9962 [0,2,0,0,0,0|1,1,0]=4 870 B13R2.2121 N#CC1=CC2=C(C=C1)N=C(S)S2 24304 [0,2,0,0,0,0|1,1,0]=4 871 B13R2.2121 N#CC1=CC2=C(C=C1)SC(Cl)=N2 24301 [0,2,0,0,0,0|1,1,0]=4 872 B13R2.2121 N#CC1=CC2=C(C=C1)SC(N)=N2 24296 [0,2,0,0,0,0|1,1,0]=4 873 B13R2.13083 CC1=CC2=C(C=C1C)NC(C)=N2 7668 [0,2,0,0,0,0|1,0,0]=3 874 B13R2.13083 CC1=CC2=C(C=C1C)OC(C)=N2 8696 [0,2,0,0,0,0|0,0,0]=2 875 B13R2.13083 CC1=CC2=C(C=C1C)SC(C)=N2 20514 [0,2,0,0,0,0|0,1,0]=3 876 B13R2.13083 CC1=CC2=C(C=C1N)N=C(C)S2 24260 [0,2,0,0,0,0|0,1,0]=3 877 B13R2.13083 CC1=CC2=NC(=O)N=C2C=C1N 7588 [0,2,0,0,0,0|2,0,0]=4 878 B13R2.13083 CC1=NC2=C(C=C(Cl)C(Cl)=C2)N1 7655 [0,2,0,0,0,0|1,0,0]=3 879 B13R2.13083 CC1=NC2=C(C=C(O)C(N)=C2)S1 17335 [0,2,0,0,0,0|0,1,0]=3 880 B13R2.13083 ClC1=CC2=C(C=C1Cl)NC(Cl)=N2 22511 [0,2,0,0,0,0|2,0,0]=4 881 B13R2.13083 FC1=CC2=C(C=C1Cl)N=C(S)N2 6710 [0,2,0,0,0,0|2,0,0]=4 882 B11R2.20 C1=CC2=C(C=C1)OCCN2 22677 [0,0,1,1,0,0|0,0,2]=4 883 B11R2.20 C1=CC2=C(C=C1)OCCO2 9750 [0,0,1,1,0,0|1,0,1]=4 884 B9R1.6 CC(=O)C1=CC=CN=C1 1301 [0,0,1,0,1,0|1,0,1]=4 885 B9R1.6 CC(=O)C1=CC=NC=C1 7542 [0,0,1,0,1,0|1,0,1]=4 886 B9R1.6 CC(=O)C1=NC=CC=C1 13363 [0,0,1,0,1,0|1,0,1]=4 887 B9R1.6 CC(Cl)C1=CC=CC=C1 10204 [0,0,1,0,1,0|1,0,1]=4 888 B9R1.6 CC(N)C1=CC=CC=C1 21079 [0,0,1,0,1,0|0,0,2]=4 889 B9R1.6 CP(C)C1=CC=CC=C1 6420 [0,0,1,0,1,0|2,0,0]=4 890 B9R1.6 C[C@@H](N)c1ccccc1 6026 [0,0,1,0,1,0|0,0,2]=4 891 B9R1.6 C[C@@H](N)c1ccccc1 6060 [0,0,1,0,1,0|0,0,2]=4 892 B9R1.6 C[C@@H](N)c1ccccc1 9918 [0,0,1,0,1,0|0,0,2]=4 893 B9R1.6 C[C@@H](O)C1=CC=CN=C1 27201 [0,0,1,0,1,0|1,0,1]=4 894 B9R1.6 C[C@@H](O)C1=NC=CC=C1 5699 [0,0,1,0,1,0|1,0,1]=4 895 B9R1.6 C[C@@H](O)c1ccccc1 6851 [0,0,1,0,1,0|0,0,1]=3 896 B9R1.6 C[C@H](N)c1ccccc1 6025 [0,0,1,0,1,0|0,0,2]=4 897 B9R1.6 C[C@H](N)c1ccccc1 6061 [0,0,1,0,1,0|0,0,2]=4 898 B9R1.6 C[C@H](O)C1=NC=CC=C1 5701 [0,0,1,0,1,0|1,0,1]=4 899 B9R1.6 C[C@H](O)c1ccccc1 6858 [0,0,1,0,1,0|0,0,1]=3 900 B9R1.6 N=C(N)C1=CC=CN=C1 17590 [0,0,1,0,1,0|2,0,0]=4 901 B9R1.6 N=C(N)C1=CC=C[NH+]=C1 16743 [0,0,1,0,1,0|2,0,0]=4 902 B9R1.6 N=C(N)C1=CC=NC=C1 17463 [0,0,1,0,1,0|2,0,0]=4 903 B9R1.6 N=C(N)C1=NC=CC=C1 20227 [0,0,1,0,1,0|2,0,0]=4 904 B9R1.6 NC(=S)C1=CC=CC=C1 13565 [0,0,1,0,1,0|1,0,1]=4 905 B9R1.6 NC(=S)C1=CC=CC=C1 18582 [0,0,1,0,1,0|1,0,1]=4 906 B9R1.6 O=C(Cl)C1=CC=CC=C1 22045 [0,0,1,0,1,0|1,0,1]=4 907 B9R1.6 O=C(O)C1=CC=NC=C1 2595 [0,0,1,0,1,0|2,0,0]=4 908 B9R1.6 O=C(O)C1=CN=CC=C1 2594 [0,0,1,0,1,0|2,0,0]=4 909 B9R1.6 O=C(O)C1=NC=CC=C1 9774 [0,0,1,0,1,0|2,0,0]=4 910 B9R1.6 OB(O)C1=CC=CC=C1 1753 [0,0,1,0,1,0|2,0,0]=4 911 B9R1.6 OC(=S)C1=CC=CC=C1 36202 [0,0,1,0,1,0|1,0,0]=3 912 B9R2.50 C1=CC=C2CCC2=C1 18889 [1,0,0,0,1,0|1,0,1]=4 913 B11R1.91 CC(=O)COC1=CC=CC=C1 20265 [0,0,1,0,0,1|1,0,0]=3 914 B11R1.91 CC(=O)NCC1=CC=CC=C1 19722 [0,0,1,0,0,1|0,0,2]=4 915 B11R1.91 CC(=O)NNC1=CC=CC=C1 7620 [0,0,1,0,0,1|0,0,2]=4 916 B11R1.91 CC(=O)OCC1=CC=NC=C1 1302 [0,0,1,0,0,1|2,0,0]=4 917 B11R1.91 CC(C)=NNC1=CC=CC=C1 19806 [0,0,1,0,0,1|1,0,0]=3 918 B11R1.91 C[C@H](O)COC1=CC=CC=C1 15590 [0,0,1,0,0,1|1,0,1]=4 919 B11R1.91 NC(=O)COC1=CC=CC=C1 12494 [0,0,1,0,0,1|1,0,1]=4 920 B11R1.91 NC(=O)OCC1=CC=CC=C1 12421 [0,0,1,0,0,1|1,0,1]=4 921 B11R1.91 O=C(Cl)COC1=CC=CC=C1 30326 [0,0,1,0,0,1|2,0,0]=4 922 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 12079 [0,0,1,0,0,1|2,0,0]=4 923 B11R1.91 O=C(O)C#CC1=CC=CC=C1 13737 [0,0,1,0,0,1|2,0,0]=4 924 B11R1.91 O=C(O)CCC1=CC=CC=C1 8185 [0,0,1,0,0,1|2,0,0]=4 925 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 13612 [0,0,1,0,0,1|2,0,0]=4 926 B11R2.18 C1=CC=C2C=CC=C2C=C1 6349 [1,0,0,0,0,1|2,0,0]=4 927 B13R2.33 O=C1C=NC2=C(C=CC=C2)C=N1 2017 [0,0,0,0,0,2|2,0,0]=4