0 B11R1.166 CC(=O)c1ccc(cc1Br)N CM11122 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl CM11180 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 CC(=O)c1ccc(cc1Cl)F CM11158 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 CC(=O)c1ccc(cc1Cl)O CM11165 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 CC(=O)c1ccc(cc1F)Br CM11145 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 CC(=O)c1ccc(cc1F)Cl CM11163 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 CC(=O)c1ccc(cc1N)F CM10552 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 CC(=O)c1ccc(cc1O)Br CM14016 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.166 CC(=O)c1ccc(cc1O)Cl CM14015 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.166 CC(=O)c1ccc(cc1O)F CM14014 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.166 CC(=O)c1ccc(cc1O)N CM11128 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.166 Cc1ccc(c(c1)C)C(=O)O CM10965 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.166 Cc1ccc(c(c1)C)C(F)F CM12252 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O CM12591 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.166 Cc1ccc(c(c1)F)C(=O)O CM10021 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] CM13964 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.166 Cc1ccc(c(c1)N)C(=O)O CM12428 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.166 c1cc(c(cc1Br)O)C(=O)O CM12513 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] CM11665 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O CM12585 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.166 c1cc(c(cc1F)O)C(=O)O CM10955 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] CM11775 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.166 c1cc(c(cc1O)O)[N+](=O)[O-] CM10296 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.13 CC(C)c1ncc(cn1)Br CM10687 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.13 CC(c1ccc(cc1)Cl)N CM13559 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.13 CN(C)c1ccc(cc1)Cl CM11355 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.13 CN(C)c1ccc(cc1)O CM10392 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,0,0,0,0,0|1,0,1]=3 32 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.13 c1cc(ccc1C(F)F)Br CM12065 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.25 CCc1ccc(cc1Br)N CM10376 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.25 CCc1ccc(cc1Cl)N CM10383 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.25 COc1ccc(cc1Br)F CM11629 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.25 COc1ccc(cc1Cl)F CM11675 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.25 COc1ccc(cc1F)Br CM11639 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.25 COc1ccc(cc1F)N CM11578 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.25 COc1ccc(cc1F)O CM10878 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.25 COc1ccc(cc1I)N CM11589 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.25 COc1ccc(cc1N)F CM10389 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.25 COc1ccc(cc1N)I CM11585 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.25 Cc1cc(ccc1CN)Br CM10182 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.25 Cc1cc(ccc1CN)O CM10123 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.25 Cc1cc(ccc1CO)Br CM13303 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.25 Cc1cc(ccc1OC)N CM11595 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.25 Cc1ccc(c(c1)Cl)NN CM13797 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.25 Cc1ccc(c(c1)Cl)OC CM10214 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.25 Cc1ccc(c(c1)F)C#N CM13088 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.25 Cc1ccc(c(c1)F)C=O CM11969 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.25 Cc1ccc(c(c1)N)C#N CM12931 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.25 c1cc(c(cc1Br)Br)CO CM13345 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.25 c1cc(c(cc1Br)F)CN CM13516 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.25 c1cc(c(cc1Br)O)C=O CM11853 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.25 c1cc(c(cc1Br)O)CO CM13296 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.25 c1cc(c(cc1Cl)Cl)CBr CM13347 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.25 c1cc(c(cc1Cl)F)CN CM13522 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.25 c1cc(c(cc1Cl)O)C#N CM13012 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.25 c1cc(c(cc1Cl)O)C=O CM11886 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.25 c1cc(c(cc1F)Br)CBr CM13278 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.25 c1cc(c(cc1F)F)CBr CM13360 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.25 c1cc(c(cc1F)F)CCl CM13359 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.25 c1cc(c(cc1F)F)CN CM13533 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.25 c1cc(c(cc1F)F)CO CM13356 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.25 c1cc(c(cc1F)O)C=O CM11951 [1,0,0,0,0,0|2,0,1]=4 67 B10R1.25 c1cc(c(cc1N)O)C#N CM10121 [1,0,0,0,0,0|2,0,1]=4 68 B10R1.25 c1cc(c(cc1O)O)C#N CM14137 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.61 CC(=O)c1ccccc1Br CM11134 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.61 CC(=O)c1ccccc1I CM11218 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.61 CC(C)c1ccccc1Br CM12111 [1,0,0,0,0,0|1,0,0]=2 72 B10R1.61 CN(C)c1ccccc1F CM11439 [1,0,0,0,0,0|2,0,0]=3 73 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] CM11790 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.126 Cc1ccc(c(c1)Cl)C(F)(F)F CM13227 [0,1,0,0,0,0|3,0,0]=4 75 B12R1.126 c1cc(c(cc1F)O)C(F)(F)F CM11782 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O CM12804 [0,1,0,0,0,0|2,0,1]=4 77 B12R1.452 CC(=O)c1ccc(cc1F)OC CM11202 [0,1,0,0,0,0|2,0,1]=4 78 B12R1.452 CN(C)c1ccc(cc1F)C#N CM10896 [0,1,0,0,0,0|2,0,1]=4 79 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] CM11786 [0,1,0,0,0,0|3,0,0]=4 80 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C CM10102 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.1703 COC(=O)c1ccc(cc1O)F CM12722 [0,1,0,0,0,0|2,0,1]=4 82 B12R2.612 c1cc2c(cc1Br)OCC2=O CM10487 [0,0,0,1,0,0|2,0,1]=4 83 B12R2.612 c1cc2c(cc1Cl)OCC2=O CM10772 [0,0,0,1,0,0|2,0,1]=4 84 B12R2.612 c1cc2c(cc1O)OCC2=O CM10744 [0,0,0,1,0,0|2,0,1]=4 85 B9R1.1 CCc1ccc(cc1)F CM10050 [2,0,0,0,0,0|1,0,0]=3 86 B9R1.1 CCc1ccc(cn1)Br CM10444 [2,0,0,0,0,0|2,0,0]=4 87 B9R1.1 CNc1ccc(cc1)I CM11495 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.1 COc1ccc(cc1)F CM11749 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.1 c1cc(ccc1CCl)F CM13407 [2,0,0,0,0,0|2,0,0]=4 90 B9R1.1 c1cc(ccc1CO)F CM13405 [2,0,0,0,0,0|2,0,0]=4 91 B9R1.1 c1cc(ccc1CO)N CM13264 [2,0,0,0,0,0|2,0,0]=4 92 B9R1.15 CCc1c(cccn1)Br CM10670 [2,0,0,0,0,0|2,0,0]=4 93 B9R1.15 CSc1ccccc1I CM11822 [2,0,0,0,0,0|2,0,0]=4 94 B9R1.15 c1ccc(c(c1)CBr)Cl CM13308 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.15 c1ccc(c(c1)CCl)F CM13406 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.15 c1ccc(c(c1)CN)F CM13538 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [2,0,0,0,0,0|1,0,0]=3 98 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [2,0,0,0,0,0|2,0,0]=4 100 B9R1.69 Cc1ccc(c(c1)Cl)N CM11376 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.69 Cc1ccc(c(c1)Cl)O CM10213 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.69 Cc1ccc(c(c1)F)Br CM13929 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.69 Cc1ccc(c(c1)F)F CM13957 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.69 Cc1ccc(c(c1)F)N CM11463 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.69 Cc1ccc(c(c1)I)N CM11496 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.69 Cc1ccc(c(c1)N)I CM11497 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.69 Cc1ccc(c(c1)O)Br CM10472 [2,0,0,0,0,0|1,0,0]=3 108 B9R1.69 Cc1ccc(c(c1)O)F CM11758 [2,0,0,0,0,0|1,0,0]=3 109 B9R1.69 Cc1ccc(cc1Br)N CM11318 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.69 Cc1ccc(cc1Br)O CM10192 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.69 Cc1ccc(cc1C)F CM12256 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.69 Cc1ccc(cc1Cl)F CM13940 [2,0,0,0,0,0|2,0,0]=4 114 B9R1.69 Cc1ccc(cc1F)Br CM13928 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.69 Cc1ccc(cc1F)Cl CM13941 [2,0,0,0,0,0|2,0,0]=4 116 B9R1.69 Cc1ccc(cc1F)F CM13955 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.69 Cc1ccc(cc1F)I CM13959 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.69 Cc1ccc(cc1F)N CM11465 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.69 Cc1ccc(cc1N)O CM11593 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.69 Cc1ccc(cc1O)F CM11764 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.69 Cc1ccc(cc1O)N CM11597 [2,0,0,0,0,0|1,0,0]=3 122 B9R1.69 Cc1ccc(cc1O)O CM10187 [2,0,0,0,0,0|1,0,0]=3 123 B9R1.69 c1cc(c(cc1Br)O)Br CM11709 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.69 c1cc(c(cc1Br)O)Cl CM11610 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.69 c1cc(c(cc1Br)O)F CM11642 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.69 c1cc(c(cc1Br)O)N CM11546 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.69 c1cc(c(cc1Cl)O)I CM11692 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.69 c1cc(c(cc1F)O)Cl CM11677 [2,0,0,0,0,0|2,0,0]=4 129 B9R1.69 c1cc(c(cc1F)O)F CM11725 [2,0,0,0,0,0|2,0,0]=4 130 B9R1.69 c1cc(c(cc1F)O)I CM10850 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.69 c1cc(c(cc1F)O)N CM11573 [2,0,0,0,0,0|2,0,0]=4 132 B9R1.69 c1cc(c(cc1I)O)I CM10916 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.69 c1cc(c(cc1N)O)Cl CM11559 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.69 c1cc(c(cc1O)O)Br CM14332 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.69 c1cc(c(cc1O)O)F CM11778 [2,0,0,0,0,0|2,0,0]=4 136 B9R1.69 c1cc(c(cc1O)O)N CM10297 [2,0,0,0,0,0|2,0,0]=4 137 B11R1.3 CN(C)c1ccc(cc1)OC CM11444 [1,1,0,0,0,0|1,0,0]=3 138 B11R1.19 CC(C)(C)c1ccc(cc1)I CM12102 [1,1,0,0,0,0|1,0,0]=3 139 B11R1.19 C[Si](C)(C)c1ccc(cc1)F CM12331 [1,1,0,0,0,0|1,1,0]=4 140 B11R1.19 Cc1ccc(cc1)C(F)(F)F CM13257 [1,1,0,0,0,0|2,0,0]=4 141 B11R1.21 CN(C)c1ccc(c(c1)F)I CM10922 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.21 Cc1ccc(cc1N)C(C)C CM11504 [1,1,0,0,0,0|0,0,0]=2 143 B11R1.22 c1cc(ccc1C(CO)O)Br CM10185 [1,1,0,0,0,0|2,0,0]=4 144 B11R1.37 COc1ccc(cc1CO)Br CM13299 [1,1,0,0,0,0|2,0,0]=4 145 B11R1.37 COc1ccc(cc1CO)F CM13414 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.37 COc1ccc(cc1OC)F CM12244 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.37 COc1ccc(cc1OC)O CM11739 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.37 Cc1ccc(c(c1)OC)C#N CM13131 [1,1,0,0,0,0|1,0,1]=4 149 B11R1.277 COc1cc(c(cc1O)F)Br CM11643 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.277 Cc1cc(c(cc1F)C=O)O CM10065 [1,1,0,0,0,0|1,0,1]=4 151 B11R1.279 COc1ccc(c(c1)F)CCl CM13409 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.279 COc1ccc(c(c1)F)OC CM12240 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.279 COc1ccc(c(c1)O)OC CM10473 [1,1,0,0,0,0|1,0,0]=3 154 B11R1.279 COc1ccc(cc1O)C=O CM13992 [1,1,0,0,0,0|1,0,1]=4 155 B11R1.464 Cc1cc(c(c(c1)C)OC)C CM11812 [1,1,0,0,0,0|2,0,0]=4 156 B11R1.464 Cc1cc(c(c(c1)O)C=O)C CM11944 [1,1,0,0,0,0|1,0,1]=4 157 B11R1.464 Cc1cc(nc(c1CN)O)C CM11020 [1,1,0,0,0,0|2,0,0]=4 158 B11R1.53 CC(C)c1ccccc1C=O CM10477 [1,1,0,0,0,0|0,0,1]=3 159 B11R1.87 CC(C)(C)c1ccccc1N CM11343 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.87 Cc1ccccc1C(C)(C)C CM12039 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.87 c1ccc(c(c1)C(F)(F)F)O CM11808 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.156 CC(=O)c1c(cccc1F)O CM11199 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.156 CC(C)c1c(cccc1O)N CM10168 [1,1,0,0,0,0|0,0,0]=2 164 B11R1.159 CC(C)c1cccc(c1F)O CM10381 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.159 CC(C)c1cccc(c1O)Cl CM10891 [1,1,0,0,0,0|0,0,0]=2 166 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.167 CC(C)c1cc(ccc1O)Cl CM10119 [1,1,0,0,0,0|0,0,0]=2 168 B11R1.222 CCC(C)c1ccccc1N CM11342 [1,1,0,0,0,0|1,0,0]=3 169 B13R1.165 CN(C)c1ccc(cc1C(=O)O)N CM12373 [0,2,0,0,0,0|2,0,0]=4 170 B13R1.165 Cc1ccc(c(c1)[N+](=O)[O-])C(C)C CM13971 [0,2,0,0,0,0|0,0,1]=3 171 B13R1.120 CC(C)c1ccc(cc1Br)[N+](=O)[O-] CM12119 [0,2,0,0,0,0|2,0,0]=4 172 B11R2.34 c1cc(ncc1C2CC2)Br CM10127 [1,0,0,1,0,0|2,0,0]=4 173 B11R2.36 c1cc2c(cc1Br)OCC2 CM10763 [1,0,0,1,0,0|1,0,0]=3 174 B11R1.20 CC(C)Cc1ccc(cc1)Br CM12109 [1,0,0,0,0,1|1,0,0]=3 175 B11R1.20 CC(C)Oc1ccc(cc1)N CM11503 [1,0,0,0,0,1|1,0,0]=3