0 B10R1.13 B(C1=CC=C(C=C1)Br)(O)O 5360 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.13 B(C1=CC=C(C=C1)C)(O)O 5425 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 B(C1=CC=C(C=C1)C)(O)O 9510 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 B(C1=CC=C(C=C1)F)(O)O 6296 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 B(C1=CC=C(C=C1)O)(O)O 6782 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl 8212 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.13 C1=CC(=CC=C1C(=O)Cl)F 9898 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl 6827 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 C1=CC(=CC=C1C(=O)O)F 5362 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.13 C1=CC(=CC=C1C(=O)O)F 8250 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 C1=CC(=CC=C1C(=S)N)Cl 10635 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 C1=CC(=CC=C1C(F)F)Br 6597 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.13 C1=CC(=CC=C1C(F)F)F 10624 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Br 10151 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])F 6117 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])[O-] 10257 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.13 CC(=O)C1=CC=C(C=C1)I 9277 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 CC(=O)C1=CC=C(C=C1)O 8298 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl 9976 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.13 CC(C1=CC=C(C=C1)F)O 6019 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 CC1=CC=C(C=C1)C(=O)O 9874 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.13 CN(C)C1=CC=C(C=C1)F 10045 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] N0068 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] N0068 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 c1cc(ccc1[N+](=O)[O-])O N0023 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.1 C#CC1=CC=C(C=C1)F 10155 [1,0,0,0,0,0|1,0,2]=4 26 B9R1.1 C1=CC(=CC=C1C#N)Br 10589 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.1 C1=CC(=CC=C1C#N)Cl 5712 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.1 C1=CC(=CC=C1C#N)F 10581 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.1 C1=CC(=CC=C1C#N)F 6090 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.1 C1=CC(=CC=C1C#N)N 5665 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.1 C1=CC(=CC=C1C=O)F 6034 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.1 C1=CC(=CC=C1C=O)I 5018 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.1 C1=CC(=CC=C1C=O)O 5740 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.1 C1=CC(=CC=C1CBr)Br 10348 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.1 C1=CC(=CC=C1CCl)Cl 6806 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.1 C1=CC(=CC=C1CN)Br 8072 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.1 C1=CC(=CC=C1CN)F 5139 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.1 C1=CC(=CC=C1CN)O 8602 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.1 C1=CC(=CC=C1CS)Cl 6134 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.1 C1=CC(=CC=C1NN)Br 5240 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 C1=CC(=CC=C1NN)Cl 10440 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.1 C1=CC(=CC=C1NN)F 5594 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 C1=CC(=NC=C1Br)CO 8417 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 C1=CC(=NC=C1CCl)Cl 5674 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 C=CC1=CC=C(C=C1)N 6013 [1,0,0,0,0,0|1,0,2]=4 46 B9R1.1 CC1=CC=C(C=C1)C#N 6644 [1,0,0,0,0,0|1,0,1]=3 47 B9R1.1 CC1=CC=C(C=C1)CBr 9734 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.1 CC1=CC=C(C=C1)CN 9612 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.1 CC1=CN=C(C=C1)C#N 6614 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.1 COC1=CC=C(C=C1)Br 6813 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.1 COC1=CC=C(C=C1)F 5383 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.1 COC1=CC=C(C=C1)N 8631 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.1 COC1=CC=C(C=C1)S 8726 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.1 COC1=NC=C(C=C1)Br 9358 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 COC1=NC=C(C=C1)Br 9555 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 COC1=NC=C(C=C1)Cl 9538 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 COC1=NC=C(C=C1)N 9999 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 CSC1=CC=C(C=C1)F 9086 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.6 C1=CC=C(C=C1)C(=O)O 9205 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.6 C1=CC=C(C=C1)C(=S)N 5715 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.6 C1=CC=C(C=C1)P(=O)O 5787 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.6 C1=CC=C(C=C1)S(=O)O 5284 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.6 CC(C1=CC=NC=C1)O 9776 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.6 CN(C)C1=CC=NC=C1 5603 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.6 CN(C)c1ccncc1 D0718 [1,0,0,0,0,0|2,0,0]=3 66 B11R1.3 B(C1=CC=C(C=C1)CBr)(O)O 8393 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.3 B(C1=CC=C(C=C1)CC)(O)O 5017 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.3 B(C1=CC=C(C=C1)CO)(O)O 6503 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.3 B(C1=CC=C(C=C1)OC)(O)O 9492 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.3 C1=CC(=CC=C1CN)C(=O)O 6756 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N 6778 [0,1,0,0,0,0|1,0,2]=4 72 B11R1.3 CN(C)C1=CC=C(C=C1)CN 9794 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.3 COC1=CC=C(C=C1)C(=O)O 10197 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.19 C1=CC(=CC=C1C(F)(F)F)Br 6088 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.19 C1=CC(=CC=C1C(F)(F)F)I 8388 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.19 C1=CC(=CC=C1C(F)(F)F)S 5413 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Br 5112 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O 9567 [0,1,0,0,0,0|1,0,0]=2 79 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)C 9927 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O 5499 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O 8893 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)Br 6161 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)N 8975 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)O 5187 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.21 B(C1=CC(=C(C=C1)C)F)(O)O 9368 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br 6438 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F 5378 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F 6468 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)F 8214 [0,1,0,0,0,0|1,0,1]=3 90 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)F 5569 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)C 10163 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F 8586 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl 6856 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F 5127 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F 8978 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I 6495 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])Br 5341 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])F 5574 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])I 5610 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])N 9544 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Br 5388 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Cl 8413 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 5562 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 6515 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.22 C1=CC(=CC=C1C(=O)CBr)O 10265 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.22 COC(=O)C1=CC=C(C=C1)N 6641 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.166 C1=CC(=C(C=C1F)Br)C(F)F 8041 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)F 10081 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)O 9883 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6607 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6608 [0,1,0,0,0,0|2,0,1]=4 112 B9R1.35 CC1=CC=C(S1)C(=O)C 10140 [0,0,0,0,1,0|2,0,1]=4 113 B11R1.20 C1=CC(=CC=C1N)OC(F)F 5637 [0,0,0,0,0,1|3,0,0]=4 114 B11R1.20 C1=CC(=CC=C1OC(F)F)Br 5636 [0,0,0,0,0,1|3,0,0]=4 115 B11R1.20 C1=CC(=CC=C1OC(F)F)Cl 6686 [0,0,0,0,0,1|3,0,0]=4 116 B11R1.20 C1=CC(=CC=C1OC(F)F)I 6213 [0,0,0,0,0,1|3,0,0]=4 117 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl 5593 [0,0,0,0,0,1|2,0,1]=4 118 B11R1.20 CC(=O)Nc1ccc(cc1)O A0029 [0,0,0,0,0,1|2,0,1]=4 119 B11R1.20 CC(C)OC1=CC=C(C=C1)Br 8626 [0,0,0,0,0,1|1,0,0]=2 120 B11R1.20 CC(C)OC1=CC=C(C=C1)N 9611 [0,0,0,0,0,1|1,0,0]=2 121 B8R1.2 C1=CC(=CN=C1)CCl 5990 [2,0,0,0,0,0|2,0,0]=4 122 B8R1.2 C1=CC(=CN=C1)CN 10146 [2,0,0,0,0,0|2,0,0]=4 123 B8R1.2 C1=CC(=CN=C1)CO 8600 [2,0,0,0,0,0|2,0,0]=4 124 B8R1.2 C1=CC=C(C=C1)NN 6820 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.2 C1=CC=NC(=C1)CCl 10463 [2,0,0,0,0,0|2,0,0]=4 126 B8R1.2 C1=CC=NC(=C1)CN 5496 [2,0,0,0,0,0|2,0,0]=4 127 B8R1.2 C1=CN=CC=C1CCl 8451 [2,0,0,0,0,0|2,0,0]=4 128 B8R1.2 COC1=CC=CC=N1 9619 [2,0,0,0,0,0|2,0,0]=4 129 B8R1.2 COC1=CC=NC=C1 10117 [2,0,0,0,0,0|2,0,0]=4 130 B8R1.3 C1=CC(=CC=C1F)Br 6014 [2,0,0,0,0,0|2,0,0]=4 131 B8R1.3 C1=CC(=CC=C1F)Cl 9763 [2,0,0,0,0,0|2,0,0]=4 132 B8R1.3 C1=CC(=CC=C1F)F 10591 [2,0,0,0,0,0|2,0,0]=4 133 B8R1.3 C1=CC(=CC=C1N)Cl 6700 [2,0,0,0,0,0|2,0,0]=4 134 B8R1.3 C1=CC(=CC=C1N)F 5032 [2,0,0,0,0,0|2,0,0]=4 135 B8R1.3 C1=CC(=CC=C1N)I 8418 [2,0,0,0,0,0|2,0,0]=4 136 B8R1.3 CC1=CN=C(C=C1)Br 9393 [2,0,0,0,0,0|2,0,0]=4 137 B8R1.3 CC1=CN=C(C=C1)F 5449 [2,0,0,0,0,0|2,0,0]=4 138 B8R1.3 CC1=CNC(=O)C=C1 9951 [2,0,0,0,0,0|2,0,0]=4 139 B8R1.3 CC1=NC=C(C=C1)Br 5076 [2,0,0,0,0,0|2,0,0]=4 140 B8R1.3 CC1=NC=C(C=C1)N 10240 [2,0,0,0,0,0|2,0,0]=4 141 B8R1.3 c1cc(ccc1F)Br B0238 [2,0,0,0,0,0|2,0,0]=4 142 B8R1.3 c1cc(ccc1N)F F0045 [2,0,0,0,0,0|2,0,0]=4 143 B10R1.1 C1=CC(=CC=C1CC#N)Cl 6796 [1,1,0,0,0,0|1,0,1]=4 144 B10R1.1 C1=CC(=CC=C1CC#N)F 10336 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.1 C1=CC(=CC=C1CCCl)F 6441 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.1 C1=CC(=CC=C1CCN)Br 8160 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.1 C1=CC(=CC=C1CCN)Cl 6418 [1,1,0,0,0,0|1,0,0]=3 148 B10R1.1 C1=CC(=CC=C1CCN)F 10276 [1,1,0,0,0,0|1,0,0]=3 149 B10R1.1 C1=CC(=CC=C1CCO)F 9475 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.1 C1=CC(=CC=C1CCO)O 8495 [1,1,0,0,0,0|1,0,0]=3 151 B10R1.1 CC1=CC=C(C=C1)CCN 6556 [1,1,0,0,0,0|0,0,0]=2 152 B10R1.3 C1=CC(=CC=C1CN)C#N C0297 [1,1,0,0,0,0|1,0,1]=4 153 B10R1.3 CCC1=CC=C(C=C1)C#C 10015 [1,1,0,0,0,0|0,0,1]=3 154 B10R1.3 COC1=CC=C(C=C1)C#C 9950 [1,1,0,0,0,0|0,0,2]=4 155 B10R1.3 COC1=CC=C(C=C1)C=O 8125 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.3 COC1=CC=C(C=C1)CN 8511 [1,1,0,0,0,0|1,0,0]=3 157 B10R1.25 C1=CC(=C(C=C1Br)F)CBr 6181 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.25 C1=CC(=C(C=C1Br)F)CN 8039 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.25 C1=CC(=C(C=C1Cl)F)CBr 5211 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.25 C1=CC(=C(C=C1Cl)F)CO 9790 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.25 C1=CC(=C(C=C1F)Cl)CN 6194 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.25 C1=CC(=C(C=C1F)F)CBr 10356 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.25 C1=CC(=C(C=C1F)F)CCl 10529 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.25 C1=CC(=C(C=C1F)F)CN 5064 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.25 C1=CC(=C(C=C1F)F)CO 5619 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.25 CC1=CC(=C(C=C1)C#N)F 6654 [1,1,0,0,0,0|1,0,1]=4 167 B10R1.25 CC1=CC(=C(C=C1)OC)I 6862 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.25 COC1=C(C=C(C=C1)Br)O 6683 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.25 COC1=C(C=C(C=C1)Cl)Br 6521 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.25 COC1=C(C=C(C=C1)Cl)I 6532 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.25 COC1=C(C=C(C=C1)F)Br 6127 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.25 COC1=C(C=C(C=C1)F)Cl 9547 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.25 COC1=C(C=C(C=C1)F)F 5613 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.25 COC1=C(C=C(C=C1)F)O 6489 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.25 COC1=C(C=C(C=C1)N)Br 9331 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.25 COC1=C(C=C(C=C1)N)F 5654 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.25 COC1=C(C=C(C=C1)N)I 10230 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.25 Cc1cc(ccc1CN)F F0029 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl 6739 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl 6576 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.176 C1=CC(=C(C=C1CCl)F)F 5398 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.176 C1=CC(=C(C=C1CN)Cl)F 8697 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.176 C1=CC(=C(C=C1CO)Br)O 9541 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.176 C1=CC(=C(C=C1CO)Cl)F 5350 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.176 C1=CC(=C(C=C1CO)F)Cl 6586 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.176 C1=CC(=C(C=C1CO)F)F 5618 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.176 CC1=C(C=C(C=C1)C#N)Br 6755 [1,1,0,0,0,0|1,0,1]=4 188 B10R1.176 CC1=C(C=C(C=C1)C#N)F 9664 [1,1,0,0,0,0|1,0,1]=4 189 B10R1.176 CC1=C(C=C(C=C1)C#N)N 8423 [1,1,0,0,0,0|1,0,1]=4 190 B10R1.176 CC1=C(C=C(C=C1)C=O)F 6278 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.176 CC1=C(C=C(C=C1)C=O)F 6279 [1,1,0,0,0,0|1,0,1]=4 192 B10R1.176 CC1=C(C=C(C=C1)CBr)F 8915 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.176 CC1=C(C=C(C=C1)CN)C 6547 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.176 CC1=C(C=C(C=C1)CN)F 8324 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.176 CC1=C(C=C(C=C1)CO)F 8904 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.176 CC1=C(C=C(C=C1)OC)Cl 8676 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.176 CC1=C(C=CC(=C1)CBr)F 9893 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.176 CC1=C(C=CC(=C1)CN)F 8722 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.176 COC1=CC(=C(C=C1)Br)F 5203 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.176 COC1=CC(=C(C=C1)Cl)Br 8084 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.176 COC1=CC(=C(C=C1)F)F 5159 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.176 COC1=CC(=C(C=C1)O)Br 8831 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.176 c1cc(c(cc1CN)F)Cl C0229 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.15 C1=CC=C(C=C1)C(=O)CN 5484 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.15 CC(C#N)C1=CC=CC=C1 5998 [1,1,0,0,0,0|0,0,1]=3 206 B10R1.15 CC(CN)C1=CC=CC=C1 9559 [1,1,0,0,0,0|0,0,0]=2 207 B10R1.15 c1ccc(cc1)C(C[NH3+])O A1811 [1,1,0,0,0,0|1,0,0]=3 208 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 6811 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.61 C1=CC=C(C(=C1)C(F)F)Br 6596 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.61 CC(=O)C1=CC=CC=C1Cl 6154 [1,1,0,0,0,0|1,0,1]=4 211 B10R1.61 CC(=O)C1=CC=CC=C1F 5580 [1,1,0,0,0,0|1,0,1]=4 212 B10R1.61 CC(=O)C1=CC=CC=C1F 6042 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.61 CC(C)C1=CC=CC=C1I 8589 [1,1,0,0,0,0|0,0,0]=2 214 B10R1.61 CC(C)C1=CC=CC=C1N 10439 [1,1,0,0,0,0|0,0,0]=2 215 B10R1.61 CC(c1ccccc1N)O A1015 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.113 C1=CC(=CC(=C1)Br)C(F)F 8828 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl 10105 [1,1,0,0,0,0|1,0,1]=4 218 B10R1.113 CC(=O)C1=CC(=CC=C1)F 8337 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.113 CC(=O)C1=CC(=CC=C1)I 6861 [1,1,0,0,0,0|1,0,1]=4 220 B10R1.113 CC(=O)C1=CC(=CC=C1)O 5263 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.4 C1=CC(=CC=C1CN)OC(F)F 9646 [0,1,0,0,0,1|2,0,0]=4 222 B12R1.4 CC(=O)NC1=CC=C(C=C1)CCl 8784 [0,1,0,0,0,1|1,0,1]=4 223 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO 9568 [0,1,0,0,0,1|1,0,1]=4 224 B12R1.4 CC(C)OC1=CC=C(C=C1)C=O 10413 [0,1,0,0,0,1|0,0,1]=3 225 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)O 8442 [0,1,0,0,0,1|1,0,0]=3 226 B12R1.106 CC1=CC=C(C=C1)OC(F)(F)F 9488 [0,1,0,0,0,1|2,0,0]=4 227 B12R1.5 COC1=CC=C(C=C1)C(=O)CBr 9861 [0,2,0,0,0,0|1,0,1]=4 228 B12R1.6 C1=CC(=CC=C1CBr)C(F)(F)F 8363 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.6 C1=CC(=CC=C1CCl)C(F)(F)F 9924 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.6 C1=CC(=CC=C1CO)C(F)(F)F 5169 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.6 CC(C)(C)C1=CC=C(C=C1)NN 9720 [0,2,0,0,0,0|1,0,0]=3 232 B12R1.6 CC(C)(C)c1ccc(cc1)C=O B0039 [0,2,0,0,0,0|0,0,1]=3 233 B12R1.6 CC(C)(C)c1ccc(cc1)C=O B0039 [0,2,0,0,0,0|0,0,1]=3 234 B12R1.6 CS(=O)(=O)C1=CC=C(C=C1)CN 8395 [0,2,0,0,0,0|2,0,0]=4 235 B12R1.48 CC(=O)C1=CC(=C(C=C1)OC)Br 10169 [0,2,0,0,0,0|1,0,1]=4 236 B12R1.48 CC(=O)C1=CC(=C(C=C1)OC)Cl 9943 [0,2,0,0,0,0|1,0,1]=4 237 B12R1.113 CC(C)C1=CC=C(C=C1)N=C=S 8386 [0,2,0,0,0,0|0,0,1]=3 238 B12R1.113 CN(C)c1ccc(cc1)CCN A7891 [0,2,0,0,0,0|1,0,0]=3 239 B12R1.256 CC(=O)C1=CC=C(C=C1)N(C)C 10544 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.256 CC(C)C1=CC=C(C=C1)C(=O)C 10220 [0,2,0,0,0,0|0,0,0]=2 241 B12R1.256 CC(C)C1=CC=C(C=C1)C(C)C 5826 [0,2,0,0,0,0|0,0,0]=2 242 B12R1.256 CN(C)C1=CC=C(C=C1)C(=O)O 9876 [0,2,0,0,0,0|1,0,1]=4 243 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)N)N 10403 [0,2,0,0,0,0|1,0,0]=3 244 B12R1.23 CC1=C(C=C(C=C1)C(F)(F)F)Br 8050 [0,2,0,0,0,0|2,0,0]=4 245 B12R1.126 CC1=CC(=C(C=C1)C(F)(F)F)Cl 8723 [0,2,0,0,0,0|2,0,0]=4 246 B12R2.606 CC1=CC2=C(C=C1)NC(=C2)C 6591 [0,0,0,1,0,1|0,0,2]=4 247 B10R1.18 CC(C)NC1=CC=CC=C1 6823 [1,0,0,0,0,1|0,0,0]=2