0 B10R2.7 c1cc2c(cc[nH]2)nc1 LS21035 [0,0,0,0,0,0|1,0,0]=1 1 B10R2.7 c1cc2c(nc1)NCC2 LS40389 [0,0,0,0,0,0|1,0,2]=3 2 B10R2.7 c1cc2cc[nH]c2nc1 LS21042 [0,0,0,0,0,0|1,0,0]=1 3 B10R2.7 c1cc2nccn2nc1 LS40935 [0,0,0,0,0,0|2,0,1]=3 4 B10R2.7 c1ccc2c(c1)CC=C2 LS11754 [0,0,0,0,0,0|1,0,0]=1 5 B10R2.7 c1ccc2c(c1)CNC2 LS40329 [0,0,0,0,0,0|2,0,1]=3 6 B10R2.7 c1ccc2c(c1)OCO2 LS10418 [0,0,0,0,0,0|2,0,1]=3 7 B10R2.7 c1ccc2c(c1)ccs2 LS40109 [0,0,0,0,0,0|1,0,0]=1 8 B10R2.7 c1ccc2c(c1)cn[nH]2 LS20969 [0,0,0,0,0,0|1,0,0]=1 9 B10R2.7 c1ccc2c(c1)nsn2 LS41252 [0,0,0,0,0,0|2,0,1]=3 10 B10R2.7 c1cnc-2[nH]cncc12 LS40963 [0,0,0,0,0,0|2,0,1]=3 11 B11R2.1 c1c(c2cncnc2[nH]1)I LS40983 [0,1,0,0,0,0|2,0,0]=3 12 B11R2.1 c1cc2c(c[nH]c2nc1)Br LS40010 [0,1,0,0,0,0|1,0,0]=2 13 B11R2.1 c1cc2c(nc1)COC2=O LS41441 [0,1,0,0,0,0|3,0,0]=4 14 B11R2.1 c1ccc2c(c1)CCC2N LS40652 [0,1,0,0,0,0|1,0,2]=4 15 B11R2.1 c1ccc2c(c1)CC[C@H]2N LS30488 [0,1,0,0,0,0|1,0,2]=4 16 B11R2.10 CC1=Cc2ccccc2C1 LS00050 [0,1,0,0,0,0|1,0,0]=2 17 B11R2.10 c1ccc2c(c1)CC(=O)O2 LS40288 [0,1,0,0,0,0|1,0,1]=3 18 B11R2.10 c1ccc2c(c1)CC(C2)N LS40608 [0,1,0,0,0,0|1,0,2]=4 19 B11R2.10 c1ccc2c(c1)CC(C2)O LS40651 [0,1,0,0,0,0|1,0,2]=4 20 B11R2.10 c1ccc2c(c1)[nH]c(n2)N LS11771 [0,1,0,0,0,0|1,0,0]=2 21 B11R2.10 c1ccc2c(c1)[nH]c(n2)S LS21164 [0,1,0,0,0,0|1,0,0]=2 22 B11R2.10 c1ccc2c(c1)nc(o2)S LS40249 [0,1,0,0,0,0|1,0,1]=3 23 B11R2.36 Cc1ccc2c(c1)cn[nH]2 LS20968 [0,1,0,0,0,0|1,0,0]=2 24 B11R2.36 c1c2cn[nH]c2cnc1Br LS40097 [0,1,0,0,0,0|2,0,0]=3 25 B11R2.36 c1c[nH]c2c1cc(cn2)Br LS00010 [0,1,0,0,0,0|1,0,0]=2 26 B11R2.36 c1c[nH]c2c1cc(cn2)Cl LS20805 [0,1,0,0,0,0|1,0,0]=2 27 B11R2.36 c1c[nH]c2c1nc(cn2)Cl LS40853 [0,1,0,0,0,0|2,0,0]=3 28 B11R2.36 c1cc(cc2c1cc[nH]2)Br LS20434 [0,1,0,0,0,0|0,0,0]=1 29 B11R2.36 c1cc(cc2c1cc[nH]2)Cl LS20474 [0,1,0,0,0,0|0,0,0]=1 30 B11R2.36 c1cc(cc2c1cc[nH]2)O LS20137 [0,1,0,0,0,0|0,0,0]=1 31 B11R2.36 c1cc(cc2c1ccs2)O LS21200 [0,1,0,0,0,0|1,0,0]=2 32 B11R2.36 c1cc(nc2c1cc[nH]2)Br LS40890 [0,1,0,0,0,0|1,0,0]=2 33 B11R2.36 c1cc(nc2c1cc[nH]2)Cl LS20806 [0,1,0,0,0,0|1,0,0]=2 34 B11R2.36 c1cc(nc2c1cc[nH]2)F LS40390 [0,1,0,0,0,0|1,0,0]=2 35 B11R2.36 c1cc2c(cc1Br)CCN2 LS20952 [0,1,0,0,0,0|0,0,2]=3 36 B11R2.36 c1cc2c(cc1Br)CCO2 LS40182 [0,1,0,0,0,0|1,0,2]=4 37 B11R2.36 c1cc2c(cc1Br)CNC2 LS20867 [0,1,0,0,0,0|2,0,1]=4 38 B11R2.36 c1cc2c(cc1Br)NCC2 LS20158 [0,1,0,0,0,0|0,0,2]=3 39 B11R2.36 c1cc2c(cc1Cl)CCN2 LS20157 [0,1,0,0,0,0|0,0,2]=3 40 B11R2.36 c1cc2c(cc1N)CCO2 LS40069 [0,1,0,0,0,0|1,0,2]=4 41 B11R2.36 c1cc2c(cc1N)CNC2 LS40052 [0,1,0,0,0,0|2,0,1]=4 42 B11R2.36 c1cc2c(cc1O)cn[nH]2 LS20975 [0,1,0,0,0,0|1,0,0]=2 43 B11R2.36 c1cc2cn[nH]c2cc1I LS21119 [0,1,0,0,0,0|1,0,0]=2 44 B11R2.36 c1cc2ncnn2cc1Br LS40145 [0,1,0,0,0,0|2,0,1]=4 45 B11R2.36 c1cc2ncnn2cc1I LS40901 [0,1,0,0,0,0|2,0,1]=4 46 B11R2.36 c1cn2ccnc2cc1Br LS40857 [0,1,0,0,0,0|1,0,1]=3 47 B11R2.106 Cc1cccc2c1[nH]cc2 LS20946 [0,1,0,0,0,0|0,0,0]=1 48 B11R2.106 c1[nH]c2c(n1)ncnc2Br LS20606 [0,1,0,0,0,0|3,0,0]=4 49 B11R2.106 c1[nH]c2c(n1)ncnc2Cl LS20605 [0,1,0,0,0,0|3,0,0]=4 50 B11R2.106 c1[nH]c2c(n1)ncnc2F LS20604 [0,1,0,0,0,0|3,0,0]=4 51 B11R2.106 c1[nH]c2c(n1)ncnc2I LS20607 [0,1,0,0,0,0|3,0,0]=4 52 B11R2.106 c1[nH]c2c(n1)ncnc2S LS20858 [0,1,0,0,0,0|3,0,0]=4 53 B11R2.106 c1[nH]c2c(n1)ncnc2S LS40548 [0,1,0,0,0,0|3,0,0]=4 54 B11R2.106 c1c[nH]c2c1c(ccn2)Br LS20490 [0,1,0,0,0,0|1,0,0]=2 55 B11R2.106 c1c[nH]c2c1c(ccn2)Cl LS40318 [0,1,0,0,0,0|1,0,0]=2 56 B11R2.106 c1c[nH]c2c1c(ccn2)F LS40896 [0,1,0,0,0,0|1,0,0]=2 57 B11R2.106 c1c[nH]c2c1c(ncn2)N LS40962 [0,1,0,0,0,0|2,0,0]=3 58 B11R2.106 c1c[nH]c2c1c(ncn2)O LS40213 [0,1,0,0,0,0|2,0,0]=3 59 B11R2.106 c1c[nH]c2c1ncnc2Cl LS40093 [0,1,0,0,0,0|2,0,0]=3 60 B11R2.106 c1cc(c2c(c1)[nH]cn2)N LS40244 [0,1,0,0,0,0|1,0,0]=2 61 B11R2.106 c1cc(c2cc[nH]c2c1)N LS21193 [0,1,0,0,0,0|0,0,0]=1 62 B11R2.106 c1cc2c(c(c1)Br)CNC2 LS20869 [0,1,0,0,0,0|2,0,1]=4 63 B11R2.106 c1cc2c(c(c1)I)OCO2 LS40633 [0,1,0,0,0,0|2,0,1]=4 64 B11R2.106 c1cc2c(cc[nH]2)c(c1)Cl LS00129 [0,1,0,0,0,0|0,0,0]=1 65 B11R2.106 c1cc2c(cc[nH]2)c(c1)F LS20629 [0,1,0,0,0,0|0,0,0]=1 66 B11R2.106 c1cc2c(ccs2)c(c1)Br LS20825 [0,1,0,0,0,0|1,0,0]=2 67 B11R2.106 c1cc2c(cn[nH]2)c(c1)Br LS20792 [0,1,0,0,0,0|1,0,0]=2 68 B11R2.106 c1cc2c(cn[nH]2)c(c1)F LS20965 [0,1,0,0,0,0|1,0,0]=2 69 B11R2.106 c1cc2cc[nH]c2[n+](c1)[O-] LS20800 [0,1,0,0,0,0|1,0,0]=2 70 B11R2.106 c1cnc-2[nH]cnc(c12)Cl LS40282 [0,1,0,0,0,0|2,0,1]=4 71 B9R1.8 CNNc1ccccc1 LS10173 [0,0,1,0,0,0|1,0,1]=3 72 B9R1.8 c1cc(cnc1)CC=O LS21221 [0,0,1,0,0,0|2,0,1]=4 73 B9R1.8 c1ccc(cc1)CCN LS10634 [0,0,1,0,0,0|0,0,2]=3 74 B9R1.8 c1ccc(cc1)CCN LS10635 [0,0,1,0,0,0|0,0,2]=3 75 B9R1.8 c1ccc(cc1)CNO LS11836 [0,0,1,0,0,0|2,0,1]=4 76 B9R1.8 c1ccc(cc1)CNO LS40338 [0,0,1,0,0,0|2,0,1]=4 77 B9R1.8 c1ccc(cc1)CON LS40003 [0,0,1,0,0,0|1,0,1]=3 78 B9R1.8 c1ccc(cc1)[Se]C#N LS11775 [0,0,1,0,0,0|1,0,2]=4 79 B9R1.8 c1cnccc1CCN LS21103 [0,0,1,0,0,0|1,0,2]=4 80 B9R1.15 C=Cc1ccccc1Br LS11653 [0,0,1,0,0,0|1,0,0]=2 81 B9R1.15 C=Cc1ccccc1Cl LS11654 [0,0,1,0,0,0|1,0,0]=2 82 B9R1.15 C=Cc1ccccc1F LS11647 [0,0,1,0,0,0|1,0,0]=2 83 B9R1.15 CNc1ccccc1Br LS11478 [0,0,1,0,0,0|1,0,1]=3 84 B9R1.15 CNc1ccccc1F LS10646 [0,0,1,0,0,0|1,0,1]=3 85 B9R1.15 CSc1ccccc1Br LS11369 [0,0,1,0,0,0|2,0,1]=4 86 B9R1.15 Cc1ccccc1C#C LS11393 [0,0,1,0,0,0|1,0,2]=4 87 B9R1.15 Cc1ccccc1C=O LS11852 [0,0,1,0,0,0|2,0,0]=3 88 B9R1.15 Cc1ccccc1CBr LS11262 [0,0,1,0,0,0|2,0,1]=4 89 B9R1.15 Cc1ccccc1CN LS11218 [0,0,1,0,0,0|2,0,1]=4 90 B9R1.15 Cc1ccccc1CO LS11274 [0,0,1,0,0,0|2,0,1]=4 91 B9R1.15 c1cc(c(nc1)C=O)O LS20166 [0,0,1,0,0,0|3,0,0]=4 92 B9R1.15 c1cc(c(nc1)Cl)C=O LS20395 [0,0,1,0,0,0|3,0,0]=4 93 B9R1.15 c1cc(c(nc1)N)C#N LS20375 [0,0,1,0,0,0|2,0,1]=4 94 B9R1.15 c1cc(c(nc1)N)C=O LS41434 [0,0,1,0,0,0|2,0,0]=3 95 B9R1.15 c1cc(c(nc1)N)CO LS41435 [0,0,1,0,0,0|2,0,1]=4 96 B9R1.15 c1cc(c(nc1)O)C=O LS21175 [0,0,1,0,0,0|3,0,0]=4 97 B9R1.15 c1ccc(c(c1)C#N)Br LS11428 [0,0,1,0,0,0|2,0,1]=4 98 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [0,0,1,0,0,0|2,0,1]=4 99 B9R1.15 c1ccc(c(c1)C=O)N LS10114 [0,0,1,0,0,0|1,0,0]=2 100 B9R1.15 c1ccc(c(c1)CBr)F LS11504 [0,0,1,0,0,0|2,0,1]=4 101 B9R1.15 c1ccc(c(c1)CBr)I LS11268 [0,0,1,0,0,0|2,0,1]=4 102 B9R1.15 c1ccc(c(c1)CN)Br LS11216 [0,0,1,0,0,0|2,0,1]=4 103 B9R1.15 c1ccc(c(c1)CO)F LS11270 [0,0,1,0,0,0|2,0,1]=4 104 B9R1.15 c1ccc(c(c1)CO)I LS11276 [0,0,1,0,0,0|2,0,1]=4 105 B9R1.15 c1ccc(c(c1)CO)N LS10594 [0,0,1,0,0,0|1,0,1]=3 106 B9R1.15 c1ccc(c(c1)NN)Br LS11826 [0,0,1,0,0,0|2,0,0]=3 107 B9R1.15 c1ccc(c(c1)NN)F LS11539 [0,0,1,0,0,0|2,0,0]=3 108 B9R1.15 c1cncc(c1C=O)Br LS20109 [0,0,1,0,0,0|3,0,0]=4 109 B11R2.20 c1ccc2c(c1)CCCC2 LS40429 [0,0,0,0,0,1|1,0,2]=4 110 B11R2.20 c1ccc2c(c1)NCCO2 LS40407 [0,0,0,0,0,1|0,0,2]=3 111 B8R1.2 C#Cc1ccccc1 LS10701 [1,0,1,0,0,0|0,0,2]=4 112 B8R1.2 CNc1cccnc1 LS20470 [1,0,1,0,0,0|1,0,1]=4 113 B8R1.2 c1cc(cnc1)C=O LS20485 [1,0,1,0,0,0|2,0,0]=4 114 B8R1.2 c1ccc(cc1)C=O LS41490 [1,0,1,0,0,0|1,0,0]=3 115 B8R1.2 c1ccc(cc1)CO LS41488 [1,0,1,0,0,0|1,0,1]=4 116 B8R1.2 c1cnccc1C=O LS20943 [1,0,1,0,0,0|2,0,0]=4 117 B8R1.2 c1cnccc1CN LS20857 [1,0,1,0,0,0|1,0,1]=4 118 B8R1.2 c1cnccc1NN LS20045 [1,0,1,0,0,0|2,0,0]=4 119 B8R1.5 Cc1ccccc1Cl LS11417 [1,0,1,0,0,0|1,0,1]=4 120 B8R1.5 Cc1cccnc1N LS20579 [1,0,1,0,0,0|1,0,1]=4 121 B8R1.5 Cc1ccncc1N LS20500 [1,0,1,0,0,0|1,0,1]=4 122 B8R1.5 c1cc(c(nc1)Br)N LS20186 [1,0,1,0,0,0|2,0,0]=4 123 B8R1.5 c1cc(c(nc1)I)N LS20187 [1,0,1,0,0,0|2,0,0]=4 124 B8R1.5 c1cc(c(nc1)N)Br LS20925 [1,0,1,0,0,0|2,0,0]=4 125 B8R1.5 c1cc(c(nc1)N)F LS20418 [1,0,1,0,0,0|2,0,0]=4 126 B8R1.5 c1cc(c(nc1)N)N LS20494 [1,0,1,0,0,0|2,0,0]=4 127 B8R1.5 c1ccc(c(c1)Br)Br LS11475 [1,0,1,0,0,0|2,0,0]=4 128 B8R1.5 c1ccc(c(c1)Br)I LS10473 [1,0,1,0,0,0|2,0,0]=4 129 B8R1.5 c1ccc(c(c1)Cl)I LS10577 [1,0,1,0,0,0|2,0,0]=4 130 B8R1.5 c1ccc(c(c1)N)Br LS11448 [1,0,1,0,0,0|1,0,0]=3 131 B8R1.5 c1ccc(c(c1)N)Cl LS11568 [1,0,1,0,0,0|1,0,0]=3 132 B8R1.5 c1ccc(c(c1)N)I LS10537 [1,0,1,0,0,0|1,0,0]=3 133 B8R1.5 c1ccc(c(c1)O)Br LS11447 [1,0,1,0,0,0|2,0,0]=4 134 B8R1.5 c1ccc(c(c1)O)F LS10471 [1,0,1,0,0,0|2,0,0]=4 135 B8R1.5 c1ccc(c(c1)O)I LS00004 [1,0,1,0,0,0|2,0,0]=4 136 B8R1.5 c1cncc(c1N)F LS20317 [1,0,1,0,0,0|2,0,0]=4 137 B8R1.5 c1cncc(c1N)N LS00018 [1,0,1,0,0,0|2,0,0]=4 138 B10R1.1 Cc1ccc(cc1)CCN LS11229 [0,1,1,0,0,0|0,0,2]=4 139 B10R1.1 c1cc(ccc1CCN)Br LS11228 [0,1,1,0,0,0|0,0,2]=4 140 B10R1.1 c1cc(ccc1CCN)Cl LS11230 [0,1,1,0,0,0|0,0,2]=4 141 B10R1.1 c1cc(ccc1CCN)N LS10602 [0,1,1,0,0,0|0,0,2]=4 142 B10R1.1 c1cc(ccc1CCN)O LS11714 [0,1,1,0,0,0|0,0,2]=4 143 B10R1.4 C=CCc1ccccc1O LS11683 [0,1,1,0,0,0|1,0,0]=3 144 B10R1.4 c1ccc(c(c1)CCN)Br LS11226 [0,1,1,0,0,0|0,0,2]=4 145 B10R1.4 c1ccc(c(c1)CCN)Cl LS11231 [0,1,1,0,0,0|0,0,2]=4 146 B10R1.4 c1ccc(c(c1)CNN)F LS10154 [0,1,1,0,0,0|1,0,1]=4 147 B10R1.10 c1cc(cc(c1)Br)CCN LS11227 [0,1,1,0,0,0|0,0,2]=4 148 B10R1.10 c1cc(cc(c1)Cl)CCN LS11232 [0,1,1,0,0,0|0,0,2]=4 149 B10R1.15 CC(CN)c1ccccc1 LS10637 [0,1,1,0,0,0|0,0,2]=4 150 B10R1.15 CC(CN)c1ccccc1 LS10638 [0,1,1,0,0,0|0,0,2]=4 151 B10R1.15 C[C@@H](CN)c1ccccc1 LS30174 [0,1,1,0,0,0|0,0,2]=4 152 B10R1.15 C[C@H](CN)c1ccccc1 LS30173 [0,1,1,0,0,0|0,0,2]=4 153 B10R1.15 c1ccc(cc1)C(=O)CBr LS11352 [0,1,1,0,0,0|1,0,1]=4 154 B10R1.15 c1ccc(cc1)C(=O)CCl LS11677 [0,1,1,0,0,0|1,0,1]=4 155 B10R1.15 c1ccc(cc1)C(=O)CO LS10613 [0,1,1,0,0,0|1,0,1]=4 156 B10R1.17 c1ccc(cc1)C#CC=O LS11729 [0,1,1,0,0,0|1,0,1]=4 157 B10R1.17 c1ccc(cc1)NCCN LS10740 [0,1,1,0,0,0|0,0,2]=4 158 B10R1.18 c1ccc(cc1)CC(=O)N LS11701 [0,1,1,0,0,0|0,0,1]=3 159 B10R1.66 c1cc(sc1)\C=C\C(=O)O LS20822 [0,1,1,0,0,0|2,0,0]=4 160 B10R1.2 Cc1c(cccc1F)C=O LS10501 [0,1,1,0,0,0|2,0,0]=4 161 B10R1.2 Cc1cccc(c1F)C=O LS10502 [0,1,1,0,0,0|2,0,0]=4 162 B10R1.2 c1cc(c(c(c1)Br)F)C=O LS11298 [0,1,1,0,0,0|2,0,0]=4 163 B10R1.2 c1cc(c(c(c1)Cl)F)C=O LS10517 [0,1,1,0,0,0|2,0,0]=4 164 B10R1.2 c1cc(c(c(c1)Cl)O)C=O LS10135 [0,1,1,0,0,0|2,0,0]=4 165 B10R1.2 c1cc(c(c(c1)F)Br)C=O LS10514 [0,1,1,0,0,0|2,0,0]=4 166 B10R1.2 c1cc(c(c(c1)F)Cl)C=O LS10544 [0,1,1,0,0,0|2,0,0]=4 167 B10R1.2 c1cc(c(c(c1)F)F)C=O LS10508 [0,1,1,0,0,0|2,0,0]=4 168 B10R1.2 c1cc(c(c(c1)F)I)C=O LS10507 [0,1,1,0,0,0|2,0,0]=4 169 B10R1.2 c1cc(c(c(c1)F)O)C=O LS10305 [0,1,1,0,0,0|2,0,0]=4 170 B10R1.2 c1cc(c(c(c1)O)O)C=O LS10648 [0,1,1,0,0,0|2,0,0]=4 171 B10R1.20 CCc1ccccc1C=O LS00084 [0,1,1,0,0,0|1,0,1]=4 172 B10R1.20 c1ccc(c(c1)C=O)C=O LS11855 [0,1,1,0,0,0|2,0,0]=4 173 B10R1.25 Cc1cc(ccc1C=O)F LS10500 [0,1,1,0,0,0|2,0,0]=4 174 B10R1.25 Cc1cc(ccc1C=O)O LS11394 [0,1,1,0,0,0|2,0,0]=4 175 B10R1.25 c1cc(c(cc1Br)F)C=O LS10657 [0,1,1,0,0,0|2,0,0]=4 176 B10R1.25 c1cc(c(cc1Br)O)C=O LS10088 [0,1,1,0,0,0|2,0,0]=4 177 B10R1.25 c1cc(c(cc1Cl)Br)C=O LS10197 [0,1,1,0,0,0|2,0,0]=4 178 B10R1.25 c1cc(c(cc1Cl)F)C=O LS10509 [0,1,1,0,0,0|2,0,0]=4 179 B10R1.25 c1cc(c(cc1Cl)N)C#N LS11442 [0,1,1,0,0,0|1,0,1]=4 180 B10R1.25 c1cc(c(cc1Cl)O)C=O LS11382 [0,1,1,0,0,0|2,0,0]=4 181 B10R1.25 c1cc(c(cc1F)Br)C=O LS10393 [0,1,1,0,0,0|2,0,0]=4 182 B10R1.25 c1cc(c(cc1F)Cl)C=O LS11829 [0,1,1,0,0,0|2,0,0]=4 183 B10R1.25 c1cc(c(cc1F)O)C=O LS10219 [0,1,1,0,0,0|2,0,0]=4 184 B10R1.25 c1cc(c(cc1O)Cl)C=O LS11740 [0,1,1,0,0,0|2,0,0]=4 185 B10R1.30 COc1cc(ccc1N)Br LS10476 [0,1,1,0,0,0|1,0,1]=4 186 B10R1.30 COc1cc(ccc1N)I LS10552 [0,1,1,0,0,0|1,0,1]=4 187 B10R1.30 Cc1ccc(c(c1)C=O)Br LS10095 [0,1,1,0,0,0|2,0,0]=4 188 B10R1.30 c1cc(c(cc1Br)C=O)F LS10392 [0,1,1,0,0,0|2,0,0]=4 189 B10R1.30 c1cc(c(cc1Br)C=O)O LS10727 [0,1,1,0,0,0|2,0,0]=4 190 B10R1.30 c1cc(c(cc1Br)NN)Br LS11316 [0,1,1,0,0,0|2,0,0]=4 191 B10R1.30 c1cc(c(cc1Cl)C=O)N LS10227 [0,1,1,0,0,0|1,0,0]=3 192 B10R1.30 c1cc(c(cc1Cl)C=O)O LS11289 [0,1,1,0,0,0|2,0,0]=4 193 B10R1.30 c1cc(c(cc1Cl)NN)F LS10281 [0,1,1,0,0,0|2,0,0]=4 194 B10R1.30 c1cc(c(cc1F)C=O)Br LS10513 [0,1,1,0,0,0|2,0,0]=4 195 B10R1.30 c1cc(c(cc1F)C=O)O LS10505 [0,1,1,0,0,0|2,0,0]=4 196 B10R1.30 c1cc(c(cc1I)C=O)O LS11783 [0,1,1,0,0,0|2,0,0]=4 197 B10R1.30 c1cc(c(cc1O)C=O)F LS10101 [0,1,1,0,0,0|2,0,0]=4 198 B10R1.61 B(c1ccccc1N)(O)O LS10787 [0,1,1,0,0,0|2,0,0]=4 199 B10R1.61 CC(=O)c1ccccc1N LS10731 [0,1,1,0,0,0|0,0,1]=3 200 B10R1.61 CC(=O)c1ccccc1O LS10607 [0,1,1,0,0,0|1,0,1]=4 201 B10R1.61 CN(C)c1ccccc1Br LS10558 [0,1,1,0,0,0|1,0,1]=4 202 B10R1.61 CN(C)c1ccccc1Cl LS10168 [0,1,1,0,0,0|1,0,1]=4 203 B10R1.61 CN(C)c1ccccc1F LS10242 [0,1,1,0,0,0|1,0,1]=4 204 B10R1.61 Cc1ccccc1C(=O)O LS10119 [0,1,1,0,0,0|2,0,0]=4 205 B10R1.61 c1cc(c(nc1)C(=O)O)N LS00020 [0,1,1,0,0,0|2,0,0]=4 206 B10R1.61 c1cc(c(nc1)N)C(=O)O LS20530 [0,1,1,0,0,0|2,0,0]=4 207 B10R1.61 c1ccc(c(c1)C(=O)N)N LS11473 [0,1,1,0,0,0|1,0,0]=3 208 B10R1.61 c1ccc(c(c1)C(=O)O)Br LS10336 [0,1,1,0,0,0|2,0,0]=4 209 B10R1.61 c1ccc(c(c1)C(=O)O)Cl LS10675 [0,1,1,0,0,0|2,0,0]=4 210 B10R1.61 c1ccc(c(c1)C(=O)O)I LS00003 [0,1,1,0,0,0|2,0,0]=4 211 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] LS11572 [0,1,1,0,0,0|2,0,0]=4 212 B10R1.61 c1cncc(c1C(=O)O)N LS20439 [0,1,1,0,0,0|2,0,0]=4 213 B10R1.245 COc1c(cccc1F)N LS10380 [0,1,1,0,0,0|1,0,1]=4 214 B10R1.245 c1cc(c(c(c1)Br)C#N)N LS10151 [0,1,1,0,0,0|1,0,1]=4 215 B10R1.245 c1cc(c(c(c1)Br)C=O)F LS11299 [0,1,1,0,0,0|2,0,0]=4 216 B10R1.245 c1cc(c(c(c1)Br)C=O)O LS11634 [0,1,1,0,0,0|2,0,0]=4 217 B10R1.245 c1cc(c(c(c1)Cl)C#N)N LS11438 [0,1,1,0,0,0|1,0,1]=4 218 B10R1.245 c1cc(c(c(c1)Cl)C=O)Cl LS11436 [0,1,1,0,0,0|2,0,0]=4 219 B10R1.245 c1cc(c(c(c1)Cl)C=O)O LS11631 [0,1,1,0,0,0|2,0,0]=4 220 B10R1.245 c1cc(c(c(c1)F)C=O)O LS10645 [0,1,1,0,0,0|2,0,0]=4 221 B12R2.24 Cc1ccc2c(c1)nccn2 LS20082 [0,1,0,0,0,1|0,0,1]=3 222 B12R2.24 Cc1ccc2ccccc2n1 LS20882 [0,1,0,0,0,1|0,0,1]=3 223 B12R2.24 c1cc2c(nc1)NC(=O)CO2 LS40780 [0,1,0,0,0,1|1,0,1]=4 224 B12R2.24 c1cc2cc(ccc2nc1)Br LS20107 [0,1,0,0,0,1|0,0,1]=3 225 B12R2.24 c1cc2cc(ccc2nc1)Br LS20924 [0,1,0,0,0,1|0,0,1]=3 226 B12R2.24 c1cc2cc(ccc2nc1)N LS20703 [0,1,0,0,0,1|0,0,1]=3 227 B12R2.24 c1cc2cc(ccc2nc1)O LS20702 [0,1,0,0,0,1|0,0,1]=3 228 B12R2.24 c1cc2ccc(cc2nc1)Br LS20471 [0,1,0,0,0,1|0,0,1]=3 229 B12R2.24 c1cc2cnccc2cc1Br LS20209 [0,1,0,0,0,1|0,0,1]=3 230 B12R2.24 c1cc2cncnc2cc1Cl LS21137 [0,1,0,0,0,1|0,0,1]=3 231 B12R2.24 c1ccc2c(c1)CCC(=O)C2 LS41173 [0,1,0,0,0,1|1,0,1]=4 232 B12R2.24 c1ccc2c(c1)NC(=O)CO2 LS40207 [0,1,0,0,0,1|0,0,1]=3 233 B12R2.24 c1ccc2cc(ccc2c1)Br LS20581 [0,1,0,0,0,1|1,0,0]=3 234 B12R2.24 c1ccc2cnc(cc2c1)Cl LS20460 [0,1,0,0,0,1|0,0,1]=3 235 B12R2.24 c1ccc2cnc(cc2c1)N LS20125 [0,1,0,0,0,1|0,0,1]=3 236 B12R2.1081 CC1c2ccccc2CCN1 LS21138 [0,1,0,0,0,1|0,0,2]=4 237 B12R2.1081 c1cc2c(cc[nH]c2=O)nc1 LS40892 [0,1,0,0,0,1|1,0,0]=3 238 B12R2.1081 c1cc2c(cccn2)c(c1)Br LS21041 [0,1,0,0,0,1|0,0,1]=3 239 B12R2.1081 c1cc2cnccc2c(c1)Br LS20772 [0,1,0,0,0,1|0,0,1]=3 240 B12R2.1081 c1cc2cnccc2c(c1)N LS21163 [0,1,0,0,0,1|0,0,1]=3 241 B12R2.1081 c1ccc2c(c1)c(=O)[nH]nn2 LS41926 [0,1,0,0,0,1|1,0,1]=4 242 B12R2.1081 c1ccc2c(c1)c(ccn2)Br LS20196 [0,1,0,0,0,1|0,0,1]=3 243 B12R2.1081 c1ccc2c(c1)c(ccn2)O LS21125 [0,1,0,0,0,1|0,0,1]=3 244 B12R2.1081 c1ccc2c(c1)c(ncn2)Cl LS21169 [0,1,0,0,0,1|0,0,1]=3 245 B12R2.1081 c1ccc2c(c1)cccc2Br LS11682 [0,1,0,0,0,1|1,0,0]=3 246 B12R2.1081 c1ccc2c(c1)cccc2F LS11687 [0,1,0,0,0,1|1,0,0]=3 247 B12R2.1081 c1ccc2c(c1)cccc2N LS41003 [0,1,0,0,0,1|1,0,0]=3 248 B12R2.1081 c1ccc2c(c1)ccnc2Cl LS20934 [0,1,0,0,0,1|0,0,1]=3 249 B12R2.1 c1ccc2c(c1)c(c[nH]2)CO LS20980 [0,2,0,0,0,0|0,0,0]=2 250 B12R2.1 c1ccc2c(c1)c(n[nH]2)C=O LS21172 [0,2,0,0,0,0|1,0,0]=3 251 B12R2.18 CC1Cc2ccccc2N1N LS20139 [0,2,0,0,0,0|0,0,2]=4 252 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 LS21014 [0,2,0,0,0,0|0,0,0]=2 253 B12R2.132 Cc1c2cc(ccc2[nH]n1)Br LS20149 [0,2,0,0,0,0|1,0,0]=3 254 B12R2.196 c1c(c2c([nH]1)c(ncn2)Cl)Br LS40855 [0,2,0,0,0,0|2,0,0]=4 255 B12R2.196 c1cc2c(c(c1)O)CCC2=O LS40238 [0,2,0,0,0,0|1,0,1]=4 256 B12R2.203 c1c(c2c([nH]1)ncnc2Cl)I LS40960 [0,2,0,0,0,0|2,0,0]=4 257 B12R2.612 c1cc2c(cc1Br)COC2=O LS40024 [0,2,0,0,0,0|2,0,0]=4 258 B12R2.612 c1cc2c(cc1Br)[nH]nc2N LS40886 [0,2,0,0,0,0|1,0,0]=3 259 B12R2.612 c1cc2c(cc1Cl)CCC2=O LS00023 [0,2,0,0,0,0|1,0,1]=4 260 B12R2.612 c1cc2c(cc1Cl)onc2O LS40223 [0,2,0,0,0,0|2,0,0]=4 261 B12R2.612 c1cc2c(cc1F)CCC2=O LS20516 [0,2,0,0,0,0|1,0,1]=4 262 B12R2.612 c1cc2c(cc1O)CCC2=O LS40251 [0,2,0,0,0,0|1,0,1]=4 263 B12R2.612 c1cc2c(cc1O)OCC2=O LS21028 [0,2,0,0,0,0|1,0,1]=4 264 B12R2.2028 c1ccc2c(c1)C(OC2=O)Br LS40549 [0,2,0,0,0,0|2,0,0]=4 265 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 LS40252 [0,2,0,0,0,0|0,0,1]=3 266 B12R2.202 c1cnc2c(c1Br)CC(=O)N2 LS40860 [0,2,0,0,0,0|1,0,1]=4 267 B12R2.606 Cc1cc2cc(ccc2[nH]1)Cl LS20088 [0,2,0,0,0,0|0,0,0]=2 268 B12R2.606 Cc1cc2cc(ccc2[nH]1)F LS20450 [0,2,0,0,0,0|0,0,0]=2 269 B12R2.606 c1cc(nc2c1CC(=O)N2)Cl LS40092 [0,2,0,0,0,0|1,0,1]=4 270 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 LS40256 [0,2,0,0,0,0|0,0,1]=3 271 B12R2.606 c1cc2c(cc1F)CC(=O)N2 LS20430 [0,2,0,0,0,0|0,0,1]=3 272 B12R2.606 c1cc2c(cc1F)NC(=O)C2 LS21155 [0,2,0,0,0,0|0,0,1]=3 273 B12R2.606 c1cc2c(cc1O)sc(n2)N LS40043 [0,2,0,0,0,0|1,0,1]=4 274 B12R2.44 CCc1ccc2c(c1)cc[nH]2 LS20080 [0,2,0,0,0,0|0,0,0]=2 275 B12R2.44 COc1ccc2c(c1)NCC2 LS20156 [0,2,0,0,0,0|0,0,2]=4 276 B12R2.44 COc1ccc2c(c1)cc[nH]2 LS20135 [0,2,0,0,0,0|0,0,0]=2 277 B12R2.44 COc1ccc2cc[nH]c2c1 LS20429 [0,2,0,0,0,0|0,0,0]=2 278 B12R2.44 c1c[nH]c2c1cc(cn2)C#N LS20801 [0,2,0,0,0,0|1,0,0]=3 279 B12R2.44 c1cc(cc2c1cc[nH]2)C#N LS20300 [0,2,0,0,0,0|0,0,0]=2 280 B12R2.44 c1cc(nc2c1cc[nH]2)C#N LS20802 [0,2,0,0,0,0|1,0,0]=3 281 B12R2.44 c1cc2c(cco2)cc1C=O LS40181 [0,2,0,0,0,0|1,0,0]=3 282 B12R2.82 Cc1c(ccc2c1[nH]cc2)F LS20154 [0,2,0,0,0,0|0,0,0]=2 283 B12R2.82 c1c[nH]c2c1c(c(cn2)Br)Cl LS20804 [0,2,0,0,0,0|1,0,0]=3 284 B12R2.100 c1c[nH]c2c1cc(c(c2)O)O LS20632 [0,2,0,0,0,0|0,0,0]=2 285 B12R2.246 c1c[nH]c2c1c(cc(c2)F)F LS20302 [0,2,0,0,0,0|0,0,0]=2 286 B12R2.246 c1c[nH]c2c1c(nc(c2)Cl)Cl LS21135 [0,2,0,0,0,0|1,0,0]=3 287 B12R2.246 c1c[nH]c2c1cc(cc2F)F LS20955 [0,2,0,0,0,0|0,0,0]=2 288 B12R2.246 c1c[nH]c2c1nc(nc2Cl)Cl LS40315 [0,2,0,0,0,0|2,0,0]=4 289 B12R2.221 Cc1ccc(c2c1CC=C2)C LS40269 [0,2,0,0,0,0|1,0,0]=3 290 B12R2.221 c1cc(c2c(c1F)cc[nH]2)F LS20301 [0,2,0,0,0,0|0,0,0]=2 291 B12R2.315 COc1cccc2c1cc[nH]2 LS21192 [0,2,0,0,0,0|0,0,0]=2 292 B12R2.315 c1c[nH]c2c1c(ccn2)C#N LS20803 [0,2,0,0,0,0|1,0,0]=3 293 B12R2.315 c1cc(c2cc[nH]c2c1)C#N LS20475 [0,2,0,0,0,0|0,0,0]=2 294 B12R2.315 c1cc2c(c(c1)C#N)NCC2 LS20568 [0,2,0,0,0,0|0,0,2]=4 295 B12R2.315 c1cc2cc[nH]c2c(c1)C#N LS20017 [0,2,0,0,0,0|0,0,0]=2 296 B12R2.315 c1cc2cc[nH]c2c(c1)C=O LS20476 [0,2,0,0,0,0|0,0,0]=2