0 B10R1.1 C1=CC(=CC=C1CC#N)Cl 6796 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.1 C1=CC(=CC=C1CC#N)F 10336 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.1 C1=CC(=CC=C1CCCl)F 6441 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.1 C1=CC(=CC=C1CCN)Br 8160 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.1 C1=CC(=CC=C1CCN)Cl 6418 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.1 C1=CC(=CC=C1CCN)F 10276 [0,0,0,0,0,0|1,0,0]=1 6 B10R1.1 C1=CC(=CC=C1CCO)F 9475 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.1 C1=CC(=CC=C1CCO)O 8495 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.1 CC1=CC=C(C=C1)CCN 6556 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.1 C#CC1=CC=C(C=C1)F 10155 [1,0,0,0,0,0|1,0,2]=4 10 B9R1.1 C1=CC(=CC=C1C#N)Br 10589 [1,0,0,0,0,0|1,0,2]=4 11 B9R1.1 C1=CC(=CC=C1C#N)Cl 5712 [1,0,0,0,0,0|1,0,2]=4 12 B9R1.1 C1=CC(=CC=C1C#N)F 10581 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.1 C1=CC(=CC=C1C#N)F 6090 [1,0,0,0,0,0|1,0,2]=4 14 B9R1.1 C1=CC(=CC=C1C#N)N 5665 [1,0,0,0,0,0|1,0,2]=4 15 B9R1.1 C1=CC(=CC=C1C=O)F 6034 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.1 C1=CC(=CC=C1C=O)I 5018 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.1 C1=CC(=CC=C1C=O)O 5740 [1,0,0,0,0,0|1,0,1]=3 18 B9R1.1 C1=CC(=CC=C1CBr)Br 10348 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.1 C1=CC(=CC=C1CCl)Cl 6806 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.1 C1=CC(=CC=C1CN)Br 8072 [1,0,0,0,0,0|1,0,0]=2 21 B9R1.1 C1=CC(=CC=C1CN)F 5139 [1,0,0,0,0,0|1,0,0]=2 22 B9R1.1 C1=CC(=CC=C1CN)O 8602 [1,0,0,0,0,0|0,0,0]=1 23 B9R1.1 C1=CC(=CC=C1CS)Cl 6134 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.1 C1=CC(=CC=C1NN)Br 5240 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.1 C1=CC(=CC=C1NN)Cl 10440 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.1 C1=CC(=CC=C1NN)F 5594 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.1 C1=CC(=NC=C1Br)CO 8417 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.1 C1=CC(=NC=C1CCl)Cl 5674 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.1 C1=CC(=NC=C1Cl)NN 8116 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.1 C=CC1=CC=C(C=C1)N 6013 [1,0,0,0,0,0|1,0,2]=4 31 B9R1.1 CC1=CC=C(C=C1)C#N 6644 [1,0,0,0,0,0|1,0,2]=4 32 B9R1.1 CC1=CC=C(C=C1)CBr 9734 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.1 CC1=CC=C(C=C1)CN 9612 [1,0,0,0,0,0|1,0,0]=2 34 B9R1.1 COC1=CC=C(C=C1)Br 6813 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.1 COC1=CC=C(C=C1)F 5383 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.1 COC1=CC=C(C=C1)N 8631 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.1 COC1=CC=C(C=C1)S 8726 [1,0,0,0,0,0|1,1,0]=3 38 B9R1.1 COC1=NC=C(C=C1)Br 9358 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 COC1=NC=C(C=C1)Br 9555 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 COC1=NC=C(C=C1)Cl 9538 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 COC1=NC=C(C=C1)N 9999 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.1 CSC1=CC=C(C=C1)F 9086 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 C1=CC=C(C=C1)CCBr 10001 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.8 C1=CC=C(C=C1)CCBr 6001 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.8 C1=CC=C(C=C1)CON 10183 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.8 C1=CC=C(C=C1)[Se]C#N 6236 [1,0,0,0,0,0|1,0,2]=4 47 B9R1.8 C1=CC=NC(=C1)CCN 5251 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.8 C1=CC=NC(=C1)CCO 9142 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.8 CCCC1=CC=NC=C1 8669 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.8 c1cnccc1CCN A0195 [1,0,0,0,0,0|1,0,0]=2 51 B9R1.8 c1cnccc1CCN P0148 [1,0,0,0,0,0|1,0,0]=2 52 B11R1.1 C#CCOc1ccc(cc1)N A1659 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.1 CCCCC1=CC=C(C=C1)I 10271 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.20 C1=CC(=CC=C1CC(=O)O)Br 5312 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.20 C1=CC(=CC=C1CC(=O)O)F 9282 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.20 C1=CC(=CC=C1CC(=O)O)I 6666 [0,1,0,0,0,0|2,0,1]=4 57 B11R1.20 C1=CC(=CC=C1CC(=O)O)N 6676 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.20 C1=CC(=CC=C1N)OC(F)F 5637 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.20 C1=CC(=CC=C1NC(=S)N)F 8121 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.20 C1=CC(=CC=C1OC(F)F)Br 5636 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.20 C1=CC(=CC=C1OC(F)F)Cl 6686 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.20 C1=CC(=CC=C1OC(F)F)I 6213 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl 5593 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.20 CC(=O)Nc1ccc(cc1)O A0029 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.20 CC(C)OC1=CC=C(C=C1)Br 8626 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.20 CC(C)OC1=CC=C(C=C1)N 9611 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Br 5388 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Cl 8413 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 5562 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F 6515 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.22 C1=CC(=CC=C1C(=O)CBr)O 10265 [0,1,0,0,0,0|1,0,1]=3 72 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br 5721 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.22 C1=CC(=CC=C1C(=O)NN)F 8576 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.22 C1=CC(=CC=C1C(=O)NN)I 6553 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CC#N 10016 [0,1,0,0,0,0|1,0,2]=4 76 B11R1.81 C1=CC(=C(C=C1Cl)F)CC#N 5448 [0,1,0,0,0,0|1,0,2]=4 77 B11R1.81 C1=CC(=C(C=C1F)Br)CC#N 8531 [0,1,0,0,0,0|1,0,2]=4 78 B11R1.81 C1=CC(=C(C=C1F)F)CC#N 6215 [0,1,0,0,0,0|1,0,2]=4 79 B11R1.83 CCOC1=CC=C(C=C1)C=O 9437 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.83 COC1=CC=C(C=C1)CC#N 9711 [0,1,0,0,0,0|0,0,2]=3 81 B11R1.83 CSC1=CC=C(C=C1)CC#N 9479 [0,1,0,0,0,0|0,1,2]=4 82 B11R1.83 C\C=C\C1=CC=C(C=C1)OC 5527 [0,1,0,0,0,0|1,0,2]=4 83 B11R1.192 C1=CC(=C(C=C1CC#N)Cl)Cl 10129 [0,1,0,0,0,0|1,0,2]=4 84 B11R1.192 C1=CC(=C(C=C1CC#N)Cl)F 6261 [0,1,0,0,0,0|1,0,2]=4 85 B11R1.192 C1=CC(=C(C=C1CC#N)F)F 8936 [0,1,0,0,0,0|1,0,2]=4 86 B11R1.192 c1cc(c(cc1CC#N)F)Cl B0276 [0,1,0,0,0,0|1,0,2]=4 87 B11R2.36 C1=CC(=CC2=C1C=CN2)Br 10604 [0,0,0,1,0,0|1,0,2]=4 88 B11R2.36 C1=CC(=CC2=C1C=CN2)Br 6492 [0,0,0,1,0,0|1,0,2]=4 89 B11R2.36 C1=CC(=CC2=C1C=CN2)Cl 10638 [0,0,0,1,0,0|1,0,2]=4 90 B11R2.36 C1=CC(=CC2=C1C=CN2)F 10188 [0,0,0,1,0,0|1,0,2]=4 91 B11R2.36 C1=CC(=CC2=C1C=CN2)F 8532 [0,0,0,1,0,0|1,0,2]=4 92 B11R2.36 C1=CC2=C(C=C1Br)NN=C2 5089 [0,0,0,1,0,0|2,0,1]=4 93 B11R2.36 C1=CC2=C(C=C1N)NC=N2 9866 [0,0,0,1,0,0|2,0,1]=4 94 B11R2.36 C1CNC2=C1C=C(C=C2)Cl 9578 [0,0,0,1,0,0|3,0,0]=4 95 B11R2.36 C1OC2=C(O1)C=C(C=C2)N 9966 [0,0,0,1,0,0|3,0,0]=4 96 B11R2.36 CC1=CC2=C(C=C1)C=CN2 5403 [0,0,0,1,0,0|1,0,2]=4 97 B11R2.36 CC1=CC2=C(C=C1)C=CN2 6502 [0,0,0,1,0,0|1,0,2]=4 98 B11R2.36 c1cc2c(cc1F)CCN2 F1286 [0,0,0,1,0,0|3,0,0]=4 99 B8R1.2 C1=CC(=CN=C1)CCl 5990 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.2 C1=CC(=CN=C1)CN 10146 [2,0,0,0,0,0|1,0,0]=3 101 B8R1.2 C1=CC(=CN=C1)CO 8600 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.2 C1=CC=C(C=C1)NN 6820 [2,0,0,0,0,0|1,0,0]=3 103 B8R1.2 C1=CC=NC(=C1)CCl 10463 [2,0,0,0,0,0|2,0,0]=4 104 B8R1.2 C1=CC=NC(=C1)CN 5496 [2,0,0,0,0,0|1,0,0]=3 105 B8R1.2 C1=CN=CC=C1CCl 8451 [2,0,0,0,0,0|2,0,0]=4 106 B8R1.2 COC1=CC=CC=N1 9619 [2,0,0,0,0,0|2,0,0]=4 107 B8R1.2 COC1=CC=NC=C1 10117 [2,0,0,0,0,0|2,0,0]=4 108 B8R1.3 C1=CC(=CC=C1F)Br 6014 [2,0,0,0,0,0|2,0,0]=4 109 B8R1.3 C1=CC(=CC=C1F)Cl 9763 [2,0,0,0,0,0|2,0,0]=4 110 B8R1.3 C1=CC(=CC=C1F)F 10591 [2,0,0,0,0,0|2,0,0]=4 111 B8R1.3 C1=CC(=CC=C1N)Cl 6700 [2,0,0,0,0,0|1,0,0]=3 112 B8R1.3 C1=CC(=CC=C1N)F 5032 [2,0,0,0,0,0|1,0,0]=3 113 B8R1.3 C1=CC(=CC=C1N)I 8418 [2,0,0,0,0,0|1,0,0]=3 114 B8R1.3 C1=CC(=NC=C1Br)N 10514 [2,0,0,0,0,0|2,0,0]=4 115 B8R1.3 C1=CC(=NC=C1Cl)N 8218 [2,0,0,0,0,0|2,0,0]=4 116 B8R1.3 C1=CC(=NC=C1F)N 10320 [2,0,0,0,0,0|2,0,0]=4 117 B8R1.3 C1=CC(=NC=C1I)N 5110 [2,0,0,0,0,0|2,0,0]=4 118 B8R1.3 C1=CC(=NC=C1O)Br 10436 [2,0,0,0,0,0|2,0,0]=4 119 B8R1.3 C1=CC(=NC=C1O)Cl 9958 [2,0,0,0,0,0|2,0,0]=4 120 B8R1.3 CC1=CN=C(C=C1)Br 9393 [2,0,0,0,0,0|2,0,0]=4 121 B8R1.3 CC1=CN=C(C=C1)F 5449 [2,0,0,0,0,0|2,0,0]=4 122 B8R1.3 CC1=CNC(=O)C=C1 9951 [2,0,0,0,0,0|1,0,1]=4 123 B8R1.3 CC1=NC=C(C=C1)Br 5076 [2,0,0,0,0,0|2,0,0]=4 124 B8R1.3 CC1=NC=C(C=C1)N 10240 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.3 c1cc(ccc1F)Br B0238 [2,0,0,0,0,0|2,0,0]=4 126 B8R1.3 c1cc(ccc1N)F F0045 [2,0,0,0,0,0|1,0,0]=3 127 B10R1.3 C1=CC(=CC=C1CN)C#N C0297 [1,1,0,0,0,0|1,0,0]=3 128 B10R1.3 CCC1=CC=C(C=C1)C#C 10015 [1,1,0,0,0,0|1,0,0]=3 129 B10R1.3 COC1=CC=C(C=C1)C#C 9950 [1,1,0,0,0,0|0,0,2]=4 130 B10R1.3 COC1=CC=C(C=C1)C=O 8125 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.3 COC1=CC=C(C=C1)CN 8511 [1,1,0,0,0,0|0,0,0]=2 132 B10R1.13 B(C1=CC=C(C=C1)O)(O)O 6782 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl 8212 [1,1,0,0,0,0|1,0,1]=4 134 B10R1.13 C1=CC(=CC=C1C(=S)N)Cl 10635 [1,1,0,0,0,0|1,0,1]=4 135 B10R1.13 C1=CC(=CC=C1C(F)F)Br 6597 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.13 C1=CC(=CC=C1C(F)F)F 10624 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.13 CC(=O)C1=CC=C(C=C1)I 9277 [1,1,0,0,0,0|1,0,1]=4 138 B10R1.13 CC(=O)C1=CC=C(C=C1)O 8298 [1,1,0,0,0,0|0,0,1]=3 139 B10R1.13 CC(C1=CC=C(C=C1)F)O 6019 [1,1,0,0,0,0|1,0,0]=3 140 B10R1.13 CN(C)C1=CC=C(C=C1)F 10045 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.13 c1cc(ccc1[N+](=O)[O-])O N0023 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.25 C1=CC(=C(C=C1Br)F)CBr 6181 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.25 C1=CC(=C(C=C1Br)F)CN 8039 [1,1,0,0,0,0|1,0,0]=3 144 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN 9013 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.25 C1=CC(=C(C=C1Cl)F)CBr 5211 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.25 C1=CC(=C(C=C1Cl)F)CO 9790 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.25 C1=CC(=C(C=C1Cl)F)NN 5309 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.25 C1=CC(=C(C=C1F)Cl)CN 6194 [1,1,0,0,0,0|1,0,0]=3 149 B10R1.25 C1=CC(=C(C=C1F)F)CBr 10356 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.25 C1=CC(=C(C=C1F)F)CCl 10529 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.25 C1=CC(=C(C=C1F)F)CN 5064 [1,1,0,0,0,0|1,0,0]=3 152 B10R1.25 C1=CC(=C(C=C1F)F)CO 5619 [1,1,0,0,0,0|2,0,0]=4 153 B10R1.25 C1=CC(=C(C=C1F)F)NN 5631 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.25 C1=CC(=C(C=C1O)F)C#N 5126 [1,1,0,0,0,0|0,0,2]=4 155 B10R1.25 C1=CC(=C(C=C1O)O)C=O 10275 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.25 CC1=CC(=C(C=C1)OC)I 6862 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.25 COC1=C(C=C(C=C1)Br)O 6683 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.25 COC1=C(C=C(C=C1)Cl)Br 6521 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.25 COC1=C(C=C(C=C1)Cl)I 6532 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.25 COC1=C(C=C(C=C1)F)Br 6127 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.25 COC1=C(C=C(C=C1)F)Cl 9547 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.25 COC1=C(C=C(C=C1)F)F 5613 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.25 COC1=C(C=C(C=C1)F)O 6489 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.25 COC1=C(C=C(C=C1)N)Br 9331 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.25 COC1=C(C=C(C=C1)N)F 5654 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.25 COC1=C(C=C(C=C1)N)I 10230 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.25 Cc1cc(ccc1CN)F F0029 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.176 C1=CC(=C(C=C1C=O)F)O 9932 [1,1,0,0,0,0|1,0,1]=4 169 B10R1.176 C1=CC(=C(C=C1C=O)O)O 6767 [1,1,0,0,0,0|1,0,1]=4 170 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl 6739 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl 6576 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.176 C1=CC(=C(C=C1CCl)F)F 5398 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.176 C1=CC(=C(C=C1CN)Cl)F 8697 [1,1,0,0,0,0|1,0,0]=3 174 B10R1.176 C1=CC(=C(C=C1CO)Br)O 9541 [1,1,0,0,0,0|1,0,0]=3 175 B10R1.176 C1=CC(=C(C=C1CO)Cl)F 5350 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.176 C1=CC(=C(C=C1CO)F)Cl 6586 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.176 C1=CC(=C(C=C1CO)F)F 5618 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.176 CC1=C(C=C(C=C1)CBr)F 8915 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.176 CC1=C(C=C(C=C1)CN)C 6547 [1,1,0,0,0,0|1,0,0]=3 180 B10R1.176 CC1=C(C=C(C=C1)CN)F 8324 [1,1,0,0,0,0|1,0,0]=3 181 B10R1.176 CC1=C(C=C(C=C1)CO)F 8904 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.176 CC1=C(C=C(C=C1)OC)Cl 8676 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.176 CC1=C(C=CC(=C1)CBr)F 9893 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.176 CC1=C(C=CC(=C1)CN)F 8722 [1,1,0,0,0,0|1,0,0]=3 185 B10R1.176 COC1=CC(=C(C=C1)Br)F 5203 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.176 COC1=CC(=C(C=C1)Cl)Br 8084 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.176 COC1=CC(=C(C=C1)F)F 5159 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.176 COC1=CC(=C(C=C1)O)Br 8831 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.176 c1cc(c(cc1CN)F)Cl C0229 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.4 C1=CC=C(C(=C1)CC#N)F 5147 [1,1,0,0,0,0|0,0,2]=4 191 B10R1.4 C1=CC=C(C(=C1)CCN)Cl 6417 [1,1,0,0,0,0|0,0,0]=2 192 B10R1.4 C1=CC=C(C(=C1)CCO)F 5371 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.4 CCOC1=CC=CC=C1F 5372 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.10 C1=CC(=CC(=C1)Br)CCN 8847 [1,1,0,0,0,0|0,0,0]=2 195 B10R1.10 C1=CC(=CC(=C1)Cl)CCN 8166 [1,1,0,0,0,0|0,0,0]=2 196 B10R1.10 C1=CC(=CC(=C1)F)CC#N 9476 [1,1,0,0,0,0|0,0,2]=4 197 B10R1.10 CC1=CC(=CC=C1)CCO 8299 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.15 C1=CC=C(C=C1)C(=O)CN 5484 [1,1,0,0,0,0|0,0,1]=3 199 B10R1.15 CC(C#N)C1=CC=CC=C1 5998 [1,1,0,0,0,0|0,0,2]=4 200 B10R1.15 CC(CN)C1=CC=CC=C1 9559 [1,1,0,0,0,0|0,0,0]=2 201 B10R1.15 c1ccc(cc1)C(C[NH3+])O A1811 [1,1,0,0,0,0|0,0,1]=3 202 B10R1.17 C1=CC=C(C=C1)CN=C=S 6108 [1,1,0,0,0,0|1,0,1]=4 203 B10R1.17 CCNCC1=CC=NC=C1 8861 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.17 CNCCC1=CC=CC=N1 10522 [1,1,0,0,0,0|1,0,0]=3 205 B10R1.17 CNCCC1=CC=CC=N1 6724 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.18 C1=CC=C(C=C1)NC(=O)N 10186 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.18 C1=CC=C(C=C1)NC(=O)N 6814 [1,1,0,0,0,0|1,0,1]=4 208 B10R1.18 CC(C)NC1=CC=CC=C1 6823 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.1 CCCCCC1=CC=C(C=C1)Br 10574 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.1 CCCCCC1=CC=C(C=C1)Cl 6535 [0,2,0,0,0,0|2,0,0]=4 211 B12R1.16 CCCC(=O)C1=CC=C(C=C1)N 10375 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.21 C1=CC(=CC=C1CCC(=O)O)Cl 6857 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.21 C1=CC(=CC=C1CCC(=O)O)N 6107 [0,2,0,0,0,0|2,0,0]=4 214 B12R1.21 C1=CC(=CC=C1CCC(=O)O)O 10629 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.21 C1=CC(=CC=C1NCC(=O)O)O 5493 [0,2,0,0,0,0|1,0,1]=4 216 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N 9990 [0,2,0,0,0,0|1,0,1]=4 217 B12R1.21 c1cc(ccc1CCC(=O)O)Br B1115 [0,2,0,0,0,0|2,0,0]=4 218 B12R1.71 CCCCC1=CC=C(C=C1)C#C 9823 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.385 CC1=C(C=C(C=C1)NCCO)O 8141 [0,2,0,0,0,0|2,0,0]=4 220 B12R1.385 CCCCC1=CC(=C(C=C1)I)C 9757 [0,2,0,0,0,0|2,0,0]=4 221 B12R1.4 COC1=CC=C(C=C1)CC(=O)O 6794 [0,2,0,0,0,0|1,0,1]=4 222 B12R1.106 C1=CC(=CC=C1O)SC(F)(F)F 8203 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)O 8442 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.5 COC1=CC=C(C=C1)C(=O)CBr 9861 [0,2,0,0,0,0|1,0,1]=4 225 B12R1.367 C1=CC(=C(C=C1C(=O)CCl)O)O 8802 [0,2,0,0,0,0|1,0,1]=4 226 B12R1.1703 C1=CC(=C(C=C1O)O)C(=O)NN 9582 [0,2,0,0,0,0|1,0,1]=4 227 B12R1.113 B(C1=CC=C(C=C1)OCC)(O)O 8548 [0,2,0,0,0,0|2,0,0]=4 228 B12R1.113 CN(C)c1ccc(cc1)CCN A7891 [0,2,0,0,0,0|1,0,0]=3 229 B12R1.116 CCOC1=CC=C(C=C1)CC#N 8347 [0,2,0,0,0,0|0,0,2]=4 230 B10R2.7 c1ccc2c(c1)CCC2 I009 [1,0,0,1,0,0|1,0,0]=3 231 B10R2.7 c1ccc2c(c1)OCO2 B0143 [1,0,0,1,0,0|2,0,0]=4 232 B12R2.24 C1CCC2=C(C1)C=CC(=C2)O 10174 [0,1,0,1,0,0|1,0,0]=3 233 B12R2.132 C1CC(=O)C2=C1C=CC(=C2)F 9344 [0,1,0,1,0,0|2,0,0]=4 234 B12R2.132 CC1=CC2=C(CCC2=O)C=C1 5495 [0,1,0,1,0,0|2,0,0]=4 235 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 B1144 [0,1,0,1,0,0|2,0,0]=4 236 B12R2.44 COC1=CC2=C(C=C1)C=CN2 6603 [0,1,0,1,0,0|0,0,2]=4 237 B12R2.44 COC1=CC2=C(C=C1)C=CN2 8822 [0,1,0,1,0,0|0,0,2]=4 238 B8R1.8 C1=C(NC=N1)CCN 8849 [1,0,0,0,1,0|2,0,0]=4