0 B9R1.8 CNNc1ccccc1 LS10173 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.8 c1cc(cnc1)CC=O LS21221 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.8 c1ccc(cc1)CCN LS10634 [0,0,0,0,0,0|1,0,1]=2 3 B9R1.8 c1ccc(cc1)CCN LS10635 [0,0,0,0,0,0|1,0,1]=2 4 B9R1.8 c1ccc(cc1)CNO LS11836 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.8 c1ccc(cc1)CNO LS40338 [0,0,0,0,0,0|1,0,1]=2 6 B9R1.8 c1ccc(cc1)CON LS40003 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.8 c1ccc(cc1)[Se]C#N LS11775 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.8 c1ccnc(c1)CC#N LS20875 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.8 c1cnccc1CCN LS21103 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.2 C#Cc1ccccc1 LS10701 [1,0,0,0,0,0|0,0,2]=3 11 B8R1.2 CNc1cccnc1 LS20470 [1,0,0,0,0,0|2,0,1]=4 12 B8R1.2 c1cc(cnc1)C=O LS20485 [1,0,0,0,0,0|1,0,0]=2 13 B8R1.2 c1ccc(cc1)C=O LS41490 [1,0,0,0,0,0|0,0,0]=1 14 B8R1.2 c1ccc(cc1)CO LS41488 [1,0,0,0,0,0|0,0,1]=2 15 B8R1.2 c1cnc(cn1)CN LS20127 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.2 c1cnc(cn1)CN LS20128 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.2 c1cnccc1C=O LS20943 [1,0,0,0,0,0|1,0,0]=2 18 B8R1.2 c1cnccc1CN LS20857 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.2 c1cnccc1NN LS20045 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.1 Cc1ccc(cc1)CCN LS11229 [0,1,0,0,0,0|1,0,1]=3 21 B10R1.1 Cc1ccc(cc1)CCO LS11239 [0,1,0,0,0,0|0,0,2]=3 22 B10R1.1 c1cc(ccc1CC#N)Cl LS11213 [0,1,0,0,0,0|1,0,1]=3 23 B10R1.1 c1cc(ccc1CCN)Br LS11228 [0,1,0,0,0,0|1,0,1]=3 24 B10R1.1 c1cc(ccc1CCN)Cl LS11230 [0,1,0,0,0,0|1,0,1]=3 25 B10R1.1 c1cc(ccc1CCN)N LS10602 [0,1,0,0,0,0|1,0,1]=3 26 B10R1.1 c1cc(ccc1CCN)O LS11714 [0,1,0,0,0,0|1,0,1]=3 27 B10R1.1 c1cc(ccc1CCO)Br LS11249 [0,1,0,0,0,0|0,0,2]=3 28 B10R1.1 c1cc(ccc1CCO)Cl LS11400 [0,1,0,0,0,0|0,0,2]=3 29 B10R1.1 c1cc(ccc1CCO)F LS11241 [0,1,0,0,0,0|0,0,2]=3 30 B10R1.1 c1cc(ncc1CC#N)Cl LS20444 [0,1,0,0,0,0|2,0,1]=4 31 B10R1.4 C=CCc1ccccc1O LS11683 [0,1,0,0,0,0|1,0,0]=2 32 B10R1.4 CCOc1ccccc1Br LS10370 [0,1,0,0,0,0|2,0,1]=4 33 B10R1.4 Cc1ccccc1CCO LS11237 [0,1,0,0,0,0|0,0,2]=3 34 B10R1.4 c1ccc(c(c1)CCN)Br LS11226 [0,1,0,0,0,0|1,0,1]=3 35 B10R1.4 c1ccc(c(c1)CCN)Cl LS11231 [0,1,0,0,0,0|1,0,1]=3 36 B10R1.4 c1ccc(c(c1)CCO)Br LS11247 [0,1,0,0,0,0|0,0,2]=3 37 B10R1.4 c1ccc(c(c1)CCO)F LS11240 [0,1,0,0,0,0|0,0,2]=3 38 B10R1.4 c1ccc(c(c1)CNN)F LS10154 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.10 Cc1cccc(c1)CCO LS11238 [0,1,0,0,0,0|0,0,2]=3 40 B10R1.10 c1cc(cc(c1)Br)CCN LS11227 [0,1,0,0,0,0|1,0,1]=3 41 B10R1.10 c1cc(cc(c1)Br)CCO LS11248 [0,1,0,0,0,0|0,0,2]=3 42 B10R1.10 c1cc(cc(c1)Cl)CCN LS11232 [0,1,0,0,0,0|1,0,1]=3 43 B10R1.10 c1cc(cc(c1)F)CC#N LS10556 [0,1,0,0,0,0|1,0,1]=3 44 B10R1.15 CC(CN)c1ccccc1 LS10637 [0,1,0,0,0,0|1,0,1]=3 45 B10R1.15 CC(CN)c1ccccc1 LS10638 [0,1,0,0,0,0|1,0,1]=3 46 B10R1.15 CC[C@@H](c1ccccc1)N LS30125 [0,1,0,0,0,0|1,0,1]=3 47 B10R1.15 CC[C@H](c1ccccc1)N LS30175 [0,1,0,0,0,0|1,0,1]=3 48 B10R1.15 C[C@@H](CN)c1ccccc1 LS30174 [0,1,0,0,0,0|1,0,1]=3 49 B10R1.15 C[C@H](CN)c1ccccc1 LS30173 [0,1,0,0,0,0|1,0,1]=3 50 B10R1.15 c1ccc(cc1)C(=O)CBr LS11352 [0,1,0,0,0,0|1,0,2]=4 51 B10R1.15 c1ccc(cc1)C(=O)CCl LS11677 [0,1,0,0,0,0|1,0,2]=4 52 B10R1.15 c1ccc(cc1)C(=O)CO LS10613 [0,1,0,0,0,0|0,0,3]=4 53 B10R1.15 c1ccc(cc1)[C@@H](CO)N LS30212 [0,1,0,0,0,0|0,0,2]=3 54 B10R1.15 c1ccc(cc1)[C@@H](CO)O LS30263 [0,1,0,0,0,0|0,0,2]=3 55 B10R1.15 c1ccc(cc1)[C@H](CO)N LS30213 [0,1,0,0,0,0|0,0,2]=3 56 B10R1.15 c1ccc(cc1)[C@H](CO)O LS30264 [0,1,0,0,0,0|0,0,2]=3 57 B10R1.17 c1ccc(cc1)C#CC=O LS11729 [0,1,0,0,0,0|0,0,1]=2 58 B10R1.17 c1ccc(cc1)CN=C=S LS11773 [0,1,0,0,0,0|0,1,1]=3 59 B10R1.17 c1ccc(cc1)C[Se]C#N LS11776 [0,1,0,0,0,0|1,0,1]=3 60 B10R1.17 c1ccc(cc1)NCCN LS10740 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.18 B(Cc1ccccc1)(O)O LS10783 [0,1,0,0,0,0|1,0,1]=3 62 B10R1.18 CC(=O)Cc1ccncc1 LS00130 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.18 c1ccc(cc1)CC(=O)N LS11701 [0,1,0,0,0,0|0,0,0]=1 64 B10R2.7 c1cc2c(cc[nH]2)nc1 LS21035 [0,0,0,1,0,0|2,0,1]=4 65 B10R2.7 c1cc2c(nc1)NCC2 LS40389 [0,0,0,1,0,0|2,0,1]=4 66 B10R2.7 c1cc2cc[nH]c2nc1 LS21042 [0,0,0,1,0,0|2,0,1]=4 67 B10R2.7 c1ccc2c(c1)CC=C2 LS11754 [0,0,0,1,0,0|1,0,0]=2 68 B10R2.7 c1ccc2c(c1)CNC2 LS40329 [0,0,0,1,0,0|2,0,0]=3 69 B10R2.7 c1ccc2c(c1)OCO2 LS10418 [0,0,0,1,0,0|1,0,2]=4 70 B10R2.7 c1ccc2c(c1)ccs2 LS40109 [0,0,0,1,0,0|0,1,1]=3 71 B10R2.7 c1ccc2c(c1)cn[nH]2 LS20969 [0,0,0,1,0,0|2,0,1]=4 72 B10R2.7 c1ccc2c(c1)nsn2 LS41252 [0,0,0,1,0,0|3,0,0]=4 73 B8R1.8 c1cc(sc1)CC#N LS21115 [0,0,0,0,1,0|2,0,1]=4 74 B8R1.8 c1cc(sc1)CCN LS21113 [0,0,0,0,1,0|2,0,1]=4 75 B8R1.8 c1cc(sc1)CCO LS21112 [0,0,0,0,1,0|1,0,2]=4 76 B7R1.3 c1cc(cnc1)Br LS20426 [2,0,0,0,0,0|2,0,0]=4 77 B7R1.3 c1cc(cnc1)F LS20779 [2,0,0,0,0,0|2,0,0]=4 78 B7R1.3 c1cc[nH]c(=O)c1 LS41474 [2,0,0,0,0,0|1,0,0]=3 79 B7R1.3 c1ccnc(c1)Br LS20874 [2,0,0,0,0,0|2,0,0]=4 80 B7R1.3 c1ccnc(c1)F LS20778 [2,0,0,0,0,0|2,0,0]=4 81 B7R1.3 c1ccnc(c1)N LS20582 [2,0,0,0,0,0|2,0,0]=4 82 B7R1.3 c1cnccc1F LS40545 [2,0,0,0,0,0|2,0,0]=4 83 B7R1.3 c1cnccc1N LS20499 [2,0,0,0,0,0|2,0,0]=4 84 B7R1.3 c1cnccc1O LS21099 [2,0,0,0,0,0|1,0,1]=4 85 B9R1.1 C=Cc1ccc(cc1)Br LS11650 [1,1,0,0,0,0|0,0,1]=3 86 B9R1.1 C=Cc1ccc(cc1)Cl LS11649 [1,1,0,0,0,0|0,0,1]=3 87 B9R1.1 CCc1ccc(cc1)F LS11765 [1,1,0,0,0,0|0,0,1]=3 88 B9R1.1 CCc1ccc(cn1)Br LS21179 [1,1,0,0,0,0|1,0,1]=4 89 B9R1.1 COc1ccc(cc1)O LS10474 [1,1,0,0,0,0|1,0,1]=4 90 B9R1.1 COc1ccc(cc1)S LS11831 [1,1,0,0,0,0|1,0,1]=4 91 B9R1.1 Cc1ccc(cc1)C#C LS10578 [1,1,0,0,0,0|0,0,2]=4 92 B9R1.1 Cc1ccc(cc1)CBr LS11264 [1,1,0,0,0,0|1,0,0]=3 93 B9R1.1 Cc1ccc(cc1)CN LS11220 [1,1,0,0,0,0|1,0,0]=3 94 B9R1.1 Cc1ccc(cc1)CO LS11273 [1,1,0,0,0,0|0,0,1]=3 95 B9R1.1 c1cc(ccc1C#N)Br LS11574 [1,1,0,0,0,0|1,0,1]=4 96 B9R1.1 c1cc(ccc1C#N)F LS10440 [1,1,0,0,0,0|1,0,1]=4 97 B9R1.1 c1cc(ccc1C#N)N LS10115 [1,1,0,0,0,0|1,0,1]=4 98 B9R1.1 c1cc(ccc1C=O)Cl LS10198 [1,1,0,0,0,0|0,0,0]=2 99 B9R1.1 c1cc(ccc1CBr)Br LS11427 [1,1,0,0,0,0|1,0,0]=3 100 B9R1.1 c1cc(ccc1CBr)F LS10228 [1,1,0,0,0,0|1,0,0]=3 101 B9R1.1 c1cc(ccc1CBr)I LS11269 [1,1,0,0,0,0|1,0,0]=3 102 B9R1.1 c1cc(ccc1CCl)Cl LS11418 [1,1,0,0,0,0|1,0,0]=3 103 B9R1.1 c1cc(ccc1CO)I LS11275 [1,1,0,0,0,0|0,0,1]=3 104 B9R1.1 c1cc(ccc1CO)N LS10779 [1,1,0,0,0,0|0,0,1]=3 105 B9R1.1 c1cc(ccc1NN)F LS10358 [1,1,0,0,0,0|2,0,0]=4 106 B9R1.1 c1cc(ncc1Br)C=O LS20518 [1,1,0,0,0,0|1,0,0]=3 107 B9R1.1 c1cc(ncc1Br)CO LS20572 [1,1,0,0,0,0|1,0,1]=4 108 B9R1.1 c1cc(ncc1C=O)Br LS20544 [1,1,0,0,0,0|1,0,0]=3 109 B9R1.1 c1cc(ncc1C=O)Cl LS20242 [1,1,0,0,0,0|1,0,0]=3 110 B9R1.1 c1cc(ncc1CO)N LS40930 [1,1,0,0,0,0|1,0,1]=4 111 B9R1.1 c1cc(ncc1Cl)C=O LS20775 [1,1,0,0,0,0|1,0,0]=3 112 B9R1.2 C#Cc1cccc(c1)N LS10320 [1,1,0,0,0,0|0,0,2]=4 113 B9R1.2 C=Cc1cccc(c1)Br LS11651 [1,1,0,0,0,0|0,0,1]=3 114 B9R1.2 C=Cc1cccc(c1)Cl LS11652 [1,1,0,0,0,0|0,0,1]=3 115 B9R1.2 C=Cc1cccc(c1)F LS11648 [1,1,0,0,0,0|0,0,1]=3 116 B9R1.2 CNc1cccc(c1)Cl LS10187 [1,1,0,0,0,0|1,0,1]=4 117 B9R1.2 Cc1cccc(c1)C=O LS11853 [1,1,0,0,0,0|0,0,0]=2 118 B9R1.2 Cc1cccc(c1)CBr LS11263 [1,1,0,0,0,0|1,0,0]=3 119 B9R1.2 Cc1cccc(c1)CCl LS11215 [1,1,0,0,0,0|1,0,0]=3 120 B9R1.2 Cc1cccc(c1)CN LS11219 [1,1,0,0,0,0|1,0,0]=3 121 B9R1.2 Cc1cccc(n1)CO LS20207 [1,1,0,0,0,0|1,0,1]=4 122 B9R1.2 c1c(cncc1Br)C=O LS20038 [1,1,0,0,0,0|1,0,0]=3 123 B9R1.2 c1cc(cc(c1)Br)CN LS11217 [1,1,0,0,0,0|1,0,0]=3 124 B9R1.2 c1cc(cc(c1)F)CO LS11387 [1,1,0,0,0,0|0,0,1]=3 125 B9R1.2 c1cc(cc(c1)I)C=O LS10324 [1,1,0,0,0,0|0,0,0]=2 126 B9R1.2 c1cc(cc(c1)I)CBr LS11267 [1,1,0,0,0,0|1,0,0]=3 127 B9R1.2 c1cc(cc(c1)O)C=O LS10593 [1,1,0,0,0,0|0,0,0]=2 128 B9R1.2 c1cc(nc(c1)Cl)C=O LS20219 [1,1,0,0,0,0|1,0,0]=3 129 B9R1.2 c1cnc(cc1CO)N LS21015 [1,1,0,0,0,0|1,0,1]=4 130 B9R1.6 B(c1ccccc1)(O)O LS00011 [1,1,0,0,0,0|1,0,1]=4 131 B9R1.6 CC(=O)c1cccnc1 LS20960 [1,1,0,0,0,0|1,0,0]=3 132 B9R1.6 C[C@@H](c1ccccc1)N LS30171 [1,1,0,0,0,0|0,0,1]=3 133 B9R1.6 C[C@H](c1ccccc1)N LS30099 [1,1,0,0,0,0|0,0,1]=3 134 B9R1.6 c1cc(cnc1)C(=S)N LS40686 [1,1,0,0,0,0|1,1,0]=4 135 B9R1.6 c1ccc(cc1)C(=N)N LS10719 [1,1,0,0,0,0|1,0,0]=3 136 B9R1.6 c1ccc(cc1)C(=O)O LS41489 [1,1,0,0,0,0|0,0,0]=2 137 B9R1.6 c1ccc(cc1)C(=S)N LS10766 [1,1,0,0,0,0|0,1,0]=3 138 B9R1.6 c1ccnc(c1)C(=N)N LS21180 [1,1,0,0,0,0|2,0,0]=4 139 B9R1.6 c1cnc(cn1)C(=O)O LS20078 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.6 c1cnc(nc1)C(=O)O LS20267 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.6 c1cncnc1C(=O)O LS20389 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.15 C=Cc1ccccc1Br LS11653 [1,1,0,0,0,0|0,0,1]=3 143 B9R1.15 C=Cc1ccccc1Cl LS11654 [1,1,0,0,0,0|0,0,1]=3 144 B9R1.15 C=Cc1ccccc1F LS11647 [1,1,0,0,0,0|0,0,1]=3 145 B9R1.15 CNc1ccccc1Br LS11478 [1,1,0,0,0,0|1,0,1]=4 146 B9R1.15 CNc1ccccc1F LS10646 [1,1,0,0,0,0|1,0,1]=4 147 B9R1.15 CSc1ccccc1Br LS11369 [1,1,0,0,0,0|1,0,1]=4 148 B9R1.15 Cc1ccccc1C#C LS11393 [1,1,0,0,0,0|0,0,2]=4 149 B9R1.15 Cc1ccccc1C=O LS11852 [1,1,0,0,0,0|0,0,0]=2 150 B9R1.15 Cc1ccccc1CBr LS11262 [1,1,0,0,0,0|1,0,0]=3 151 B9R1.15 Cc1ccccc1CN LS11218 [1,1,0,0,0,0|1,0,0]=3 152 B9R1.15 Cc1ccccc1CO LS11274 [1,1,0,0,0,0|0,0,1]=3 153 B9R1.15 c1cc(c(nc1)C=O)O LS20166 [1,1,0,0,0,0|1,0,0]=3 154 B9R1.15 c1cc(c(nc1)CO)O LS20165 [1,1,0,0,0,0|1,0,1]=4 155 B9R1.15 c1cc(c(nc1)Cl)C=O LS20395 [1,1,0,0,0,0|1,0,0]=3 156 B9R1.15 c1cc(c(nc1)Cl)CO LS20227 [1,1,0,0,0,0|1,0,1]=4 157 B9R1.15 c1cc(c(nc1)N)C=O LS41434 [1,1,0,0,0,0|1,0,0]=3 158 B9R1.15 c1cc(c(nc1)N)CO LS41435 [1,1,0,0,0,0|1,0,1]=4 159 B9R1.15 c1cc(c(nc1)O)C=O LS21175 [1,1,0,0,0,0|1,0,0]=3 160 B9R1.15 c1ccc(c(c1)C#N)Br LS11428 [1,1,0,0,0,0|1,0,1]=4 161 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.15 c1ccc(c(c1)C=O)N LS10114 [1,1,0,0,0,0|0,0,0]=2 163 B9R1.15 c1ccc(c(c1)CBr)F LS11504 [1,1,0,0,0,0|1,0,0]=3 164 B9R1.15 c1ccc(c(c1)CBr)I LS11268 [1,1,0,0,0,0|1,0,0]=3 165 B9R1.15 c1ccc(c(c1)CN)Br LS11216 [1,1,0,0,0,0|1,0,0]=3 166 B9R1.15 c1ccc(c(c1)CO)F LS11270 [1,1,0,0,0,0|0,0,1]=3 167 B9R1.15 c1ccc(c(c1)CO)I LS11276 [1,1,0,0,0,0|0,0,1]=3 168 B9R1.15 c1ccc(c(c1)CO)N LS10594 [1,1,0,0,0,0|0,0,1]=3 169 B9R1.15 c1ccc(c(c1)NN)Br LS11826 [1,1,0,0,0,0|2,0,0]=4 170 B9R1.15 c1ccc(c(c1)NN)F LS11539 [1,1,0,0,0,0|2,0,0]=4 171 B9R1.15 c1cncc(c1C=O)Br LS20109 [1,1,0,0,0,0|1,0,0]=3 172 B9R1.13 c1c(nc[nH]1)CC(=O)O LS20933 [0,1,0,0,1,0|2,0,0]=4 173 B9R1.13 c1cc(oc1)CC(=O)O LS40055 [0,1,0,0,1,0|1,0,0]=3 174 B9R1.13 c1cc(sc1)CC(=O)Cl LS21114 [0,1,0,0,1,0|1,0,0]=3 175 B9R1.13 c1cc(sc1)CC(=O)O LS20649 [0,1,0,0,1,0|1,0,0]=3 176 B11R1.1 CCCCc1ccc(cc1)Br LS11195 [0,2,0,0,0,0|1,0,1]=4 177 B11R1.1 CNCCc1ccc(cc1)O LS10122 [0,2,0,0,0,0|1,0,1]=4 178 B11R1.1 c1cc(ccc1OCCBr)Cl LS10083 [0,2,0,0,0,0|1,0,1]=4 179 B11R1.20 CC(=O)Cc1ccc(cc1)Br LS11255 [0,2,0,0,0,0|0,0,0]=2 180 B11R1.20 CC(=O)Cc1ccc(cc1)Cl LS11258 [0,2,0,0,0,0|0,0,0]=2 181 B11R1.20 CC(=O)Cc1ccc(cc1)F LS11260 [0,2,0,0,0,0|0,0,0]=2 182 B11R1.20 CC(=O)Oc1ccc(cc1)F LS10377 [0,2,0,0,0,0|1,0,0]=3 183 B11R1.20 Cc1ccc(cc1)CC(=O)C LS11261 [0,2,0,0,0,0|0,0,0]=2 184 B11R1.20 Cc1ccc(cc1)NC(=O)C LS11875 [0,2,0,0,0,0|1,0,0]=3 185 B11R1.20 c1cc(ccc1CC(=O)N)O LS11370 [0,2,0,0,0,0|0,0,0]=2 186 B11R1.20 c1cc(ccc1CC(=O)O)Br LS10304 [0,2,0,0,0,0|0,0,0]=2 187 B11R1.20 c1cc(ccc1CC(=O)O)O LS10592 [0,2,0,0,0,0|0,0,0]=2 188 B11R1.22 c1cc(ccc1C(CN)O)O LS41256 [0,2,0,0,0,0|1,0,1]=4 189 B11R1.81 CNCc1ccc(cc1Cl)Cl LS10751 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.81 c1cc(c(cc1Cl)Cl)CCN LS11233 [0,2,0,0,0,0|1,0,1]=4 191 B11R1.81 c1cc(c(cc1Cl)Cl)CCO LS11244 [0,2,0,0,0,0|0,0,2]=4 192 B11R1.81 c1cc(c(cc1Cl)F)CC#N LS10623 [0,2,0,0,0,0|1,0,1]=4 193 B11R1.192 c1cc(c(cc1CCN)Cl)Cl LS11236 [0,2,0,0,0,0|1,0,1]=4 194 B11R1.192 c1cc(c(cc1CCO)Cl)Cl LS11246 [0,2,0,0,0,0|0,0,2]=4 195 B11R1.192 c1cc(c(cc1CCO)Cl)F LS11250 [0,2,0,0,0,0|0,0,2]=4 196 B11R1.13 Cc1c(cccc1F)N=C=O LS10694 [0,2,0,0,0,0|1,0,1]=4 197 B11R1.13 c1cc(c(c(c1)Cl)Cl)CCO LS11243 [0,2,0,0,0,0|0,0,2]=4 198 B11R1.41 COc1ccccc1CCO LS11834 [0,2,0,0,0,0|0,0,2]=4 199 B11R1.86 CC(=O)Cc1ccccc1Br LS11253 [0,2,0,0,0,0|0,0,0]=2 200 B11R1.86 CC(=O)Cc1ccccc1Cl LS11256 [0,2,0,0,0,0|0,0,0]=2 201 B11R1.86 CC(=O)Cc1ccccc1F LS11259 [0,2,0,0,0,0|0,0,0]=2 202 B11R1.86 c1ccc(c(c1)CC(=O)O)O LS10642 [0,2,0,0,0,0|0,0,0]=2 203 B11R1.605 c1cc(c(c(c1)Cl)CCN)Cl LS11234 [0,2,0,0,0,0|1,0,1]=4 204 B11R1.605 c1cc(c(c(c1)Cl)CCO)Cl LS11242 [0,2,0,0,0,0|0,0,2]=4 205 B11R1.605 c1cc(c(c(c1)Cl)CCO)F LS11251 [0,2,0,0,0,0|0,0,2]=4 206 B11R1.605 c1cc(c(c(c1)F)CCN)F LS11235 [0,2,0,0,0,0|1,0,1]=4 207 B11R1.605 c1nc(c(c(n1)Cl)CC=O)Cl LS20094 [0,2,0,0,0,0|2,0,0]=4 208 B11R1.34 c1c(cc(cc1Cl)Cl)CCO LS11245 [0,2,0,0,0,0|0,0,2]=4 209 B11R1.157 CC(=O)Cc1cccc(c1)Br LS11254 [0,2,0,0,0,0|0,0,0]=2 210 B11R1.157 CC(=O)Cc1cccc(c1)Cl LS11257 [0,2,0,0,0,0|0,0,0]=2 211 B11R1.157 CC(=O)Nc1cccc(n1)N LS20129 [0,2,0,0,0,0|2,0,0]=4 212 B11R1.7 C=CS(=O)(=O)c1ccccc1 LS11432 [0,2,0,0,0,0|2,0,0]=4 213 B11R1.12 CN[C@@H](CO)c1ccccc1 LS30211 [0,2,0,0,0,0|0,0,2]=4 214 B11R1.12 CN[C@H](CO)c1ccccc1 LS30210 [0,2,0,0,0,0|0,0,2]=4 215 B11R1.16 C[C@@H](c1ccccc1)N=C=O LS30276 [0,2,0,0,0,0|0,0,1]=3 216 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O LS30119 [0,2,0,0,0,0|1,0,1]=4 217 B11R1.36 CC(C)[C@H](c1ccccc1)O LS30202 [0,2,0,0,0,0|1,0,1]=4 218 B11R1.36 CC(c1ccccc1)C(=O)O LS10633 [0,2,0,0,0,0|0,0,0]=2 219 B11R1.36 C[C@H](c1ccccc1)C(=O)O LS30098 [0,2,0,0,0,0|0,0,0]=2 220 B11R1.36 c1ccc(cc1)C(C(=O)O)O LS00073 [0,2,0,0,0,0|0,0,0]=2 221 B11R1.28 c1ccc(cc1)CCCCO LS10545 [0,2,0,0,0,0|0,0,2]=4 222 B11R1.28 c1ccc(cc1)COCCO LS10494 [0,2,0,0,0,0|0,0,2]=4 223 B11R1.91 B(CCc1ccccc1)(O)O LS10785 [0,2,0,0,0,0|0,0,2]=4 224 B11R1.91 CC(=O)CCc1ccccc1 LS10597 [0,2,0,0,0,0|0,0,0]=2 225 B11R1.91 CC(CCc1ccccc1)N LS10632 [0,2,0,0,0,0|1,0,1]=4 226 B11R1.91 c1cc(cnc1)\C=C\C(=O)O LS20492 [0,2,0,0,0,0|1,0,1]=4 227 B11R1.91 c1ccc(cc1)COC(=O)N LS40379 [0,2,0,0,0,0|0,0,0]=2 228 B11R1.91 c1ccc(cc1)CSC(=N)N LS11866 [0,2,0,0,0,0|1,0,0]=3 229 B11R1.91 c1ccc(cc1)\C=C\C(=O)O LS00072 [0,2,0,0,0,0|0,0,1]=3 230 B11R1.509 CS(=O)(=O)Nc1ccccc1 LS40014 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.509 C[N+](C)(C)Cc1ccccc1 LS40342 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.509 C[N+](C)(C)Cc1ccccc1 LS41183 [0,2,0,0,0,0|2,0,0]=4 233 B11R2.36 c1cc(cc2c1cc[nH]2)Br LS20434 [0,1,0,1,0,0|1,0,1]=4 234 B11R2.36 c1cc(cc2c1cc[nH]2)Cl LS20474 [0,1,0,1,0,0|1,0,1]=4 235 B11R2.36 c1cc(cc2c1cc[nH]2)O LS20137 [0,1,0,1,0,0|1,0,1]=4 236 B11R2.36 c1cc(cc2c1ccs2)O LS21200 [0,1,0,1,0,0|0,1,1]=4 237 B11R2.36 c1cc2c(cc1Br)CCN2 LS20952 [0,1,0,1,0,0|1,0,1]=4 238 B11R2.36 c1cc2c(cc1Br)CCO2 LS40182 [0,1,0,1,0,0|0,0,2]=4 239 B11R2.36 c1cc2c(cc1Br)CNC2 LS20867 [0,1,0,1,0,0|2,0,0]=4 240 B11R2.36 c1cc2c(cc1Br)NCC2 LS20158 [0,1,0,1,0,0|1,0,1]=4 241 B11R2.36 c1cc2c(cc1Cl)CCN2 LS20157 [0,1,0,1,0,0|1,0,1]=4 242 B11R2.36 c1cc2c(cc1N)CCO2 LS40069 [0,1,0,1,0,0|0,0,2]=4 243 B11R2.36 c1cc2c(cc1N)CNC2 LS40052 [0,1,0,1,0,0|2,0,0]=4 244 B11R2.10 CC1=Cc2ccccc2C1 LS00050 [0,1,0,1,0,0|1,0,0]=3 245 B11R2.10 c1ccc2c(c1)CC(=O)O2 LS40288 [0,1,0,1,0,0|0,0,0]=2 246 B11R2.10 c1ccc2c(c1)CC(C2)N LS40608 [0,1,0,1,0,0|1,0,1]=4 247 B11R2.10 c1ccc2c(c1)CC(C2)O LS40651 [0,1,0,1,0,0|0,0,2]=4 248 B11R2.10 c1ccc2c(c1)[nH]c(n2)N LS11771 [0,1,0,1,0,0|2,0,0]=4 249 B11R2.10 c1ccc2c(c1)[nH]c(n2)S LS21164 [0,1,0,1,0,0|1,1,0]=4 250 B11R2.10 c1ccc2c(c1)nc(o2)S LS40249 [0,1,0,1,0,0|1,0,1]=4 251 B11R2.20 c1ccc2c(c1)CCCC2 LS40429 [0,1,0,1,0,0|1,0,1]=4 252 B11R2.20 c1ccc2c(c1)NCCO2 LS40407 [0,1,0,1,0,0|0,0,2]=4 253 B11R2.106 Cc1cccc2c1[nH]cc2 LS20946 [0,1,0,1,0,0|1,0,1]=4 254 B11R2.106 c1cc(c2c(c1)[nH]cn2)N LS40244 [0,1,0,1,0,0|2,0,0]=4 255 B11R2.106 c1cc(c2cc[nH]c2c1)N LS21193 [0,1,0,1,0,0|1,0,1]=4 256 B11R2.106 c1cc2c(c(c1)Br)CNC2 LS20869 [0,1,0,1,0,0|2,0,0]=4 257 B11R2.106 c1cc2c(cc[nH]2)c(c1)Cl LS00129 [0,1,0,1,0,0|1,0,1]=4 258 B11R2.106 c1cc2c(cc[nH]2)c(c1)F LS20629 [0,1,0,1,0,0|1,0,1]=4 259 B11R2.106 c1cc2c(ccs2)c(c1)Br LS20825 [0,1,0,1,0,0|0,1,1]=4 260 B11R2.1 c1cc2c(nc1)COC2=O LS41441 [0,1,0,1,0,0|1,0,0]=3 261 B11R2.1 c1ccc2c(c1)CCC2N LS40652 [0,1,0,1,0,0|1,0,1]=4 262 B11R2.1 c1ccc2c(c1)CC[C@H]2N LS30488 [0,1,0,1,0,0|1,0,1]=4 263 B11R2.40 c1ccc(cc1)C2(CC2)N LS10606 [0,1,0,1,0,0|1,0,1]=4 264 B7R1.1 c1c(nc[nH]1)C=O LS20992 [1,0,0,0,1,0|2,0,0]=4 265 B7R1.1 c1c(ncs1)C=O LS21128 [1,0,0,0,1,0|2,0,0]=4 266 B7R1.1 c1cc([nH]c1)C=O LS00119 [1,0,0,0,1,0|1,0,0]=3 267 B7R1.1 c1cc(sc1)C=O LS40350 [1,0,0,0,1,0|1,0,0]=3 268 B7R1.1 c1cc(sc1)CO LS20642 [1,0,0,0,1,0|1,0,1]=4 269 B7R1.1 c1cnc([nH]1)C=O LS20564 [1,0,0,0,1,0|2,0,0]=4 270 B7R1.1 c1csc(n1)C=O LS20580 [1,0,0,0,1,0|2,0,0]=4 271 B7R1.1 c1cscc1C=O LS20646 [1,0,0,0,1,0|1,0,0]=3