0 B10R1.25 CCc1ccc(cc1Br)N CM10376 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.25 CCc1ccc(cc1Cl)N CM10383 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.25 COc1ccc(cc1Br)F CM11629 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.25 COc1ccc(cc1Cl)F CM11675 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.25 COc1ccc(cc1F)Br CM11639 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.25 COc1ccc(cc1F)N CM11578 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.25 COc1ccc(cc1F)O CM10878 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.25 COc1ccc(cc1I)N CM11589 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.25 COc1ccc(cc1N)F CM10389 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.25 COc1ccc(cc1N)I CM11585 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.25 Cc1cc(ccc1C#N)Br CM12985 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.25 Cc1cc(ccc1C#N)F CM13094 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.25 Cc1cc(ccc1C#N)O CM10086 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.25 Cc1cc(ccc1C=O)F CM11974 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.25 Cc1cc(ccc1C=O)O CM11992 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.25 Cc1cc(ccc1CN)Br CM10182 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.25 Cc1cc(ccc1CN)O CM10123 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.25 Cc1cc(ccc1CO)Br CM13303 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.25 Cc1cc(ccc1OC)N CM11595 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.25 Cc1ccc(c(c1)Cl)NN CM13797 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.25 Cc1ccc(c(c1)Cl)OC CM10214 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.25 Cc1ccc(c(c1)F)C#N CM13088 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.25 Cc1ccc(c(c1)F)C=O CM11969 [0,0,0,0,0,0|1,0,0]=1 23 B10R1.25 Cc1ccc(c(c1)N)C#N CM12931 [0,0,0,0,0,0|2,0,1]=3 24 B10R1.25 Cc1ccc(c(n1)Cl)C#N CM14028 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.25 c1cc(c(cc1Br)Br)C=O CM11917 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.25 c1cc(c(cc1Br)Br)CO CM13345 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.25 c1cc(c(cc1Br)Cl)C#N CM12952 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.25 c1cc(c(cc1Br)Cl)C=O CM11829 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.25 c1cc(c(cc1Br)F)C#N CM12968 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.25 c1cc(c(cc1Br)F)C=O CM11842 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.25 c1cc(c(cc1Br)F)CN CM13516 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.25 c1cc(c(cc1Br)O)C=O CM11853 [0,0,0,0,0,0|1,0,0]=1 33 B10R1.25 c1cc(c(cc1Br)O)CO CM13296 [0,0,0,0,0,0|1,0,2]=3 34 B10R1.25 c1cc(c(cc1Cl)Cl)CBr CM13347 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.25 c1cc(c(cc1Cl)F)C#N CM13005 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.25 c1cc(c(cc1Cl)F)C=O CM11881 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.25 c1cc(c(cc1Cl)F)CN CM13522 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.25 c1cc(c(cc1Cl)O)C#N CM13012 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.25 c1cc(c(cc1Cl)O)C=O CM11886 [0,0,0,0,0,0|1,0,0]=1 40 B10R1.25 c1cc(c(cc1F)Br)C#N CM12962 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.25 c1cc(c(cc1F)Br)C=O CM11837 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.25 c1cc(c(cc1F)Br)CBr CM13278 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.25 c1cc(c(cc1F)Cl)C#N CM13001 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.25 c1cc(c(cc1F)Cl)C=O CM11876 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.25 c1cc(c(cc1F)Cl)NN CM13793 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.25 c1cc(c(cc1F)F)C#N CM13038 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.25 c1cc(c(cc1F)F)C=O CM11929 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.25 c1cc(c(cc1F)F)CBr CM13360 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.25 c1cc(c(cc1F)F)CCl CM13359 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.25 c1cc(c(cc1F)F)CN CM13533 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.25 c1cc(c(cc1F)F)CO CM13356 [0,0,0,0,0,0|2,0,2]=4 52 B10R1.25 c1cc(c(cc1F)N)C=O CM11825 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.25 c1cc(c(cc1F)O)C=O CM11951 [0,0,0,0,0,0|1,0,0]=1 54 B10R1.25 c1cc(c(cc1I)F)C#N CM13073 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.25 c1cc(c(cc1I)F)C=O CM11953 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.25 c1cc(c(cc1N)F)C#N CM12923 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.25 c1cc(c(cc1N)O)C#N CM10121 [0,0,0,0,0,0|2,0,1]=3 58 B10R1.25 c1cc(c(cc1O)Br)C=O CM10868 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.25 c1cc(c(cc1O)Cl)C#N CM13007 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.25 c1cc(c(cc1O)Cl)C=O CM10154 [0,0,0,0,0,0|2,0,0]=2 61 B10R1.25 c1cc(c(cc1O)F)C#N CM13068 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.25 c1cc(c(cc1O)F)C=O CM11947 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.25 c1cc(c(cc1O)I)C=O CM10867 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.25 c1cc(c(cc1O)O)C#N CM14137 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.25 c1cc(nc(c1C=O)Br)Br CM10104 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.1 C=Cc1ccc(nc1)Br CM10147 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CCc1ccc(cc1)F CM10050 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.1 CNc1ccc(cc1)I CM11495 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.1 COc1ccc(cc1)F CM11749 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.1 Cc1ccc(nc1)C#N CM10108 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.1 c1c(cnc(n1)N)C=O CM10089 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.1 c1cc(ccc1C#N)Cl CM12995 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.1 c1cc(ccc1C#N)I CM13127 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.1 c1cc(ccc1C=O)F CM11946 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.1 c1cc(ccc1C=O)I CM11996 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.1 c1cc(ccc1CCl)F CM13407 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.1 c1cc(ccc1CO)F CM13405 [1,0,0,0,0,0|1,0,2]=4 78 B9R1.1 c1cc(ccc1CO)N CM13264 [1,0,0,0,0,0|1,0,2]=4 79 B9R1.1 c1cc(ccc1NN)F CM13799 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 c1cc(ncc1C=O)Br CM13843 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 CSc1ccccc1I CM11822 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.15 Cc1ccncc1C=O CM10260 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.15 c1ccc(c(c1)C#N)F CM13066 [1,0,0,0,0,0|2,0,1]=4 84 B9R1.15 c1ccc(c(c1)C#N)I CM13126 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.15 c1ccc(c(c1)C=O)I CM11995 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.15 c1ccc(c(c1)CBr)Cl CM13308 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.15 c1ccc(c(c1)CCl)F CM13406 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.15 c1ccc(c(c1)CN)F CM13538 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.15 c1ccc(c(c1)NN)Br CM13792 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.15 c1cncc(c1O)C#N CM10064 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.69 Cc1cc(c(nc1)F)I CM10099 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.69 Cc1cc(ccc1Br)Br CM13950 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.69 Cc1cc(ccc1Br)I CM13933 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.69 Cc1cc(ccc1Cl)I CM13944 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.69 Cc1cc(ccc1F)N CM11467 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.69 Cc1cc(ccc1F)O CM11763 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.69 Cc1cc(ccc1N)Br CM11319 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.69 Cc1cc(ccc1O)F CM11762 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.69 Cc1ccc(c(c1)Cl)N CM11376 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.69 Cc1ccc(c(c1)Cl)O CM10213 [1,0,0,0,0,0|1,0,1]=3 104 B9R1.69 Cc1ccc(c(c1)F)Br CM13929 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.69 Cc1ccc(c(c1)F)F CM13957 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.69 Cc1ccc(c(c1)F)N CM11463 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.69 Cc1ccc(c(c1)I)N CM11496 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.69 Cc1ccc(c(c1)N)I CM11497 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.69 Cc1ccc(c(c1)O)Br CM10472 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.69 Cc1ccc(c(c1)O)F CM11758 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.69 Cc1ccc(cc1Br)N CM11318 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.69 Cc1ccc(cc1Br)O CM10192 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.69 Cc1ccc(cc1C)F CM12256 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.69 Cc1ccc(cc1Cl)F CM13940 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.69 Cc1ccc(cc1F)Br CM13928 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.69 Cc1ccc(cc1F)Cl CM13941 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.69 Cc1ccc(cc1F)F CM13955 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.69 Cc1ccc(cc1F)I CM13959 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.69 Cc1ccc(cc1F)N CM11465 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.69 Cc1ccc(cc1N)O CM11593 [1,0,0,0,0,0|2,0,1]=4 122 B9R1.69 Cc1ccc(cc1O)F CM11764 [1,0,0,0,0,0|1,0,1]=3 123 B9R1.69 Cc1ccc(cc1O)N CM11597 [1,0,0,0,0,0|1,0,1]=3 124 B9R1.69 Cc1ccc(cc1O)O CM10187 [1,0,0,0,0,0|1,0,1]=3 125 B9R1.69 Cn1cc(ccc1=O)N CM10159 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.69 c1cc(c(cc1Br)Br)Br CM12296 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.69 c1cc(c(cc1Br)Br)F CM12188 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.69 c1cc(c(cc1Br)Cl)Cl CM12198 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.69 c1cc(c(cc1Br)Cl)F CM12043 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.69 c1cc(c(cc1Br)Cl)I CM12047 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.69 c1cc(c(cc1Br)Cl)N CM11270 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.69 c1cc(c(cc1Br)F)N CM11303 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.69 c1cc(c(cc1Br)F)S CM11814 [1,0,0,0,0,0|2,1,0]=4 134 B9R1.69 c1cc(c(cc1Br)I)N CM11314 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.69 c1cc(c(cc1Br)I)O CM11650 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.69 c1cc(c(cc1Br)N)Cl CM11272 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.69 c1cc(c(cc1Br)N)F CM11305 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.69 c1cc(c(cc1Br)N)N CM10015 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.69 c1cc(c(cc1Br)N)O CM11544 [1,0,0,0,0,0|2,0,1]=4 140 B9R1.69 c1cc(c(cc1Br)O)Br CM11709 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.69 c1cc(c(cc1Br)O)Cl CM11610 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.69 c1cc(c(cc1Br)O)F CM11642 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.69 c1cc(c(cc1Br)O)N CM11546 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.69 c1cc(c(cc1Cl)Br)Cl CM12040 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.69 c1cc(c(cc1Cl)Br)I CM12048 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.69 c1cc(c(cc1Cl)F)Br CM12045 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.69 c1cc(c(cc1Cl)F)N CM11363 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.69 c1cc(c(cc1Cl)F)O CM11681 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.69 c1cc(c(cc1Cl)I)N CM11374 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.69 c1cc(c(cc1Cl)I)O CM11689 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.69 c1cc(c(cc1Cl)N)Br CM11267 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.69 c1cc(c(cc1Cl)N)F CM11366 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.69 c1cc(c(cc1Cl)N)I CM11375 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.69 c1cc(c(cc1Cl)N)N CM12157 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.69 c1cc(c(cc1Cl)O)I CM11692 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.69 c1cc(c(cc1F)Br)Br CM12189 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.69 c1cc(c(cc1F)Br)I CM12088 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.69 c1cc(c(cc1F)Br)N CM11299 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.69 c1cc(c(cc1F)Br)O CM11628 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.69 c1cc(c(cc1F)Cl)N CM11358 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.69 c1cc(c(cc1F)Cl)S CM11816 [1,0,0,0,0,0|2,1,0]=4 162 B9R1.69 c1cc(c(cc1F)F)Cl CM12215 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.69 c1cc(c(cc1F)F)F CM12302 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.69 c1cc(c(cc1F)F)I CM12221 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.69 c1cc(c(cc1F)F)N CM11420 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.69 c1cc(c(cc1F)F)O CM11724 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.69 c1cc(c(cc1F)F)S CM11819 [1,0,0,0,0,0|2,1,0]=4 168 B9R1.69 c1cc(c(cc1F)I)Cl CM12140 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.69 c1cc(c(cc1F)I)N CM11458 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.69 c1cc(c(cc1F)I)O CM10851 [1,0,0,0,0,0|2,0,1]=4 171 B9R1.69 c1cc(c(cc1F)N)Br CM11300 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.69 c1cc(c(cc1F)N)Cl CM11359 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.69 c1cc(c(cc1F)N)F CM11421 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.69 c1cc(c(cc1F)N)I CM11459 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.69 c1cc(c(cc1F)N)N CM12165 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.69 c1cc(c(cc1F)N)O CM11571 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.69 c1cc(c(cc1F)O)Cl CM11677 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.69 c1cc(c(cc1F)O)F CM11725 [1,0,0,0,0,0|2,0,0]=3 179 B9R1.69 c1cc(c(cc1F)O)I CM10850 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.69 c1cc(c(cc1F)O)N CM11573 [1,0,0,0,0,0|2,0,0]=3 181 B9R1.69 c1cc(c(cc1I)Br)N CM11313 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.69 c1cc(c(cc1I)Br)O CM10644 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.69 c1cc(c(cc1I)Cl)Cl CM12204 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.69 c1cc(c(cc1I)Cl)F CM12139 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.69 c1cc(c(cc1I)F)Cl CM12141 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.69 c1cc(c(cc1I)F)N CM11454 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.69 c1cc(c(cc1I)F)O CM11751 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.69 c1cc(c(cc1I)N)N CM12168 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.69 c1cc(c(cc1I)O)I CM10916 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.69 c1cc(c(cc1N)Br)N CM12156 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.69 c1cc(c(cc1N)Cl)Br CM11271 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.69 c1cc(c(cc1N)F)Br CM11304 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.69 c1cc(c(cc1N)F)Cl CM11365 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.69 c1cc(c(cc1N)F)F CM11423 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.69 c1cc(c(cc1N)F)I CM10918 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.69 c1cc(c(cc1N)F)O CM11579 [1,0,0,0,0,0|2,0,1]=4 197 B9R1.69 c1cc(c(cc1N)N)Br CM12155 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.69 c1cc(c(cc1N)N)F CM12166 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.69 c1cc(c(cc1N)O)Cl CM11559 [1,0,0,0,0,0|2,0,0]=3 200 B9R1.69 c1cc(c(cc1O)Br)Cl CM11607 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.69 c1cc(c(cc1O)Br)F CM11636 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.69 c1cc(c(cc1O)Cl)Br CM10223 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.69 c1cc(c(cc1O)Cl)I CM10112 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.69 c1cc(c(cc1O)Cl)N CM11558 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.69 c1cc(c(cc1O)Cl)N CM14377 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.69 c1cc(c(cc1O)F)Br CM11641 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.69 c1cc(c(cc1O)F)Cl CM10877 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.69 c1cc(c(cc1O)F)F CM11728 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.69 c1cc(c(cc1O)F)I CM10646 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.69 c1cc(c(cc1O)F)N CM11581 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.69 c1cc(c(cc1O)I)Cl CM11690 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.69 c1cc(c(cc1O)N)F CM11577 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.69 c1cc(c(cc1O)O)Br CM14332 [1,0,0,0,0,0|2,0,0]=3 214 B9R1.69 c1cc(c(cc1O)O)F CM11778 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.69 c1cc(c(cc1O)O)N CM10297 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.69 c1cc(c(cc1S)Cl)F CM11817 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.69 c1cc(c(cc1S)F)F CM11820 [1,0,0,0,0,0|3,0,0]=4 218 B11R1.37 CCc1cc(ccc1C=O)O CM10866 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.37 COc1c(ccc(n1)F)C=O CM10674 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.37 COc1cc(ccc1C#N)Br CM10855 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.37 COc1cc(ccc1C#N)O CM10236 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.37 COc1cc(ccc1C=O)Cl CM11892 [0,1,0,0,0,0|1,0,0]=2 223 B11R1.37 COc1cc(ccc1C=O)F CM11965 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.37 COc1cc(ccc1C=O)O CM10220 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.37 COc1ccc(cc1CO)Br CM13299 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.37 COc1ccc(cc1CO)F CM13414 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.37 COc1ccc(cc1OC)F CM12244 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.37 COc1ccc(cc1OC)O CM11739 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.37 Cc1ccc(c(c1)C#N)C=O CM10508 [0,1,0,0,0,0|1,0,0]=2 230 B11R1.37 Cc1ccc(c(c1)OC)C#N CM13131 [0,1,0,0,0,0|1,0,1]=3 231 B11R1.37 c1cc(c(cc1F)CO)C#N CM13335 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.81 c1cc(c(cc1F)F)N=C=O CM13767 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.166 CC(=O)c1ccc(cc1Br)N CM11122 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl CM11180 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.166 CC(=O)c1ccc(cc1Cl)F CM11158 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.166 CC(=O)c1ccc(cc1Cl)O CM11165 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.166 CC(=O)c1ccc(cc1F)Br CM11145 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.166 CC(=O)c1ccc(cc1F)Cl CM11163 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.166 CC(=O)c1ccc(cc1N)F CM10552 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.166 CC(=O)c1ccc(cc1O)Br CM14016 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.166 CC(=O)c1ccc(cc1O)Cl CM14015 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.166 CC(=O)c1ccc(cc1O)F CM14014 [0,1,0,0,0,0|1,0,0]=2 243 B11R1.166 CC(=O)c1ccc(cc1O)N CM11128 [0,1,0,0,0,0|1,0,0]=2 244 B11R1.166 Cc1cc(ccc1C(=O)O)F CM12767 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F CM13968 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.166 Cc1ccc(c(c1)C)C(=O)O CM10965 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.166 Cc1ccc(c(c1)C)C(F)F CM12252 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O CM12591 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.166 Cc1ccc(c(c1)F)C(=O)O CM10021 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] CM13964 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.166 Cc1ccc(c(c1)N)C(=O)O CM12428 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.166 Cc1ccc(c(n1)C)[N+](=O)[O-] CM14042 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.166 c1cc(c(cc1Br)Br)C(=O)N CM13171 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O CM12636 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.166 c1cc(c(cc1Br)F)C(=O)O CM12499 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] CM12095 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.166 c1cc(c(cc1Br)I)[N+](=O)[O-] CM12104 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.166 c1cc(c(cc1Br)N)C(=O)O CM12349 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.166 c1cc(c(cc1Br)N)[N+](=O)[O-] CM11327 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.166 c1cc(c(cc1Br)O)C(=O)O CM12513 [0,1,0,0,0,0|1,0,0]=2 261 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] CM11665 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O CM12458 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O CM12577 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.166 c1cc(c(cc1Cl)F)[N+](=O)[O-] CM12146 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N CM13164 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O CM12359 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.166 c1cc(c(cc1Cl)N)[N+](=O)[O-] CM11382 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O CM12585 [0,1,0,0,0,0|1,0,0]=2 269 B11R1.166 c1cc(c(cc1F)Br)C(=O)O CM12488 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] CM12090 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] CM12143 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.166 c1cc(c(cc1F)F)C(=O)O CM12655 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.166 c1cc(c(cc1F)N)C(=O)O CM12396 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] CM11481 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.166 c1cc(c(cc1F)O)C(=O)O CM10955 [0,1,0,0,0,0|1,0,0]=2 276 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] CM11775 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.166 c1cc(c(cc1I)F)C(=O)O CM12733 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.166 c1cc(c(cc1I)F)[N+](=O)[O-] CM10226 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.166 c1cc(c(cc1N)Br)[N+](=O)[O-] CM11324 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O CM12361 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.166 c1cc(c(cc1N)F)C(=O)O CM12405 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.166 c1cc(c(cc1O)Cl)[N+](=O)[O-] CM11695 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] CM11771 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.166 c1cc(c(cc1O)I)C(=O)O CM10163 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.166 c1cc(c(cc1O)O)[N+](=O)[O-] CM10296 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.277 COc1cc(c(cc1O)F)Br CM11643 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.277 Cc1cc(c(cc1Br)F)C=O CM11849 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.277 Cc1cc(c(cc1C=O)F)Br CM11850 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.277 Cc1cc(c(cc1Cl)C)C=O CM11874 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.277 Cc1cc(c(cc1F)Br)C=O CM11846 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.277 Cc1cc(c(cc1F)C#N)Br CM12972 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.277 Cc1cc(c(cc1F)C=O)Br CM11848 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.277 Cc1cc(c(cc1F)C=O)O CM10065 [0,1,0,0,0,0|0,0,0]=1 294 B11R1.277 Cc1cc(c(cc1O)C)C=O CM10049 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.277 c1c(c(cc(c1Cl)F)F)C=O CM11871 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.277 c1c(c(cc(c1F)Br)F)C=O CM11834 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.277 c1c(c(cc(c1F)Cl)Cl)C=O CM11919 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.277 c1c(c(cc(c1F)F)Cl)C=O CM11869 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.277 c1c(c(cc(c1F)F)F)C=O CM12013 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.277 c1c(c(cc(c1F)F)O)C#N CM13046 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.277 c1c(c(cc(c1F)F)O)C=O CM11935 [0,1,0,0,0,0|1,0,0]=2 302 B11R1.277 c1c(c(cc(c1F)O)F)C=O CM10227 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.277 c1c(c(cc(c1O)Br)F)C=O CM10066 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.278 Cc1c(ccc(c1F)F)C=O CM11009 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.278 c1cc(c(c(c1C=O)F)F)Br CM11833 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.278 c1cc(c(c(c1C=O)F)F)F CM12010 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.278 c1cc(c(c(c1C=O)F)F)I CM11936 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.278 c1cc(c(c(c1C=O)F)O)F CM11934 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.279 COc1ccc(c(c1)Br)C=O CM11856 [0,1,0,0,0,0|1,0,0]=2 310 B11R1.279 COc1ccc(c(c1)Cl)C=O CM10194 [0,1,0,0,0,0|1,0,0]=2 311 B11R1.279 COc1ccc(c(c1)F)C#N CM13080 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.279 COc1ccc(c(c1)F)C=O CM11960 [0,1,0,0,0,0|1,0,0]=2 313 B11R1.279 COc1ccc(c(c1)F)CCl CM13409 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.279 COc1ccc(c(c1)F)NN CM13800 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.279 COc1ccc(c(c1)F)OC CM12240 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.279 COc1ccc(c(c1)I)C#N CM10164 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.279 COc1ccc(c(c1)O)OC CM10473 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.279 COc1ccc(c(n1)F)C=O CM10676 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.279 COc1ccc(cc1O)C=O CM13992 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.279 CSc1ncc(c(n1)N)C=O CM14425 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.279 c1cc(c(cc1C#N)Br)C=O CM10650 [0,1,0,0,0,0|1,0,1]=3 322 B11R1.464 Cc1cc(c(c(c1)C)OC)C CM11812 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.464 Cc1cc(c(c(c1)O)C=O)C CM11944 [0,1,0,0,0,0|0,0,0]=1 324 B11R1.464 Cc1cc(cc(c1C=O)Br)F CM10076 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.464 Cc1cc(cc(c1C=O)C)F CM11942 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.464 Cc1cc(cc(c1C=O)C)O CM11943 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.464 Cc1cc(nc(c1CN)O)C CM11020 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.464 c1c(cc(c(c1Cl)C=O)Cl)Br CM10267 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.464 c1c(cc(c(c1Cl)C=O)Cl)O CM11924 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.464 c1c(cc(c(c1F)C=O)Cl)Cl CM11920 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.464 c1c(cc(c(c1F)C=O)F)Br CM11835 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.464 c1c(cc(c(c1F)C=O)F)Cl CM10912 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.464 c1c(cc(c(c1F)C=O)F)F CM12014 [0,1,0,0,0,0|2,0,0]=3 334 B11R2.36 Cc1ccc2c(c1)cco2 CM10745 [0,0,0,1,0,0|3,0,0]=4 335 B11R2.36 Cc1ccc2ccsc2c1 CM10722 [0,0,0,1,0,0|1,1,0]=3 336 B11R2.36 c1cc(cc2c1cc[nH]2)F CM13607 [0,0,0,1,0,0|3,0,0]=4 337 B11R2.36 c1cc(cc2c1cco2)Br CM10729 [0,0,0,1,0,0|2,0,0]=3 338 B11R2.36 c1cc(cc2c1cco2)O CM10757 [0,0,0,1,0,0|2,0,0]=3 339 B11R2.36 c1cc(cc2c1ccs2)Br CM10504 [0,0,0,1,0,0|2,1,0]=4 340 B11R2.36 c1cc2c(cc1Br)OCC2 CM10763 [0,0,0,1,0,0|2,0,1]=4 341 B9R1.132 c1c(c(c(s1)C=O)Br)Br CM10705 [0,0,0,0,1,0|3,0,0]=4 342 B8R1.3 Cc1ccc(=O)[nH]n1 CM11032 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.3 Cc1ccc(cn1)N CM14483 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.3 c1cc(ccc1Br)Br CM12170 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.3 c1cc(ccc1Br)I CM12101 [2,0,0,0,0,0|2,0,0]=4 346 B8R1.3 c1cc(ccc1I)I CM12236 [2,0,0,0,0,0|2,0,0]=4 347 B8R1.3 c1cc(ccc1O)F CM11750 [2,0,0,0,0,0|1,0,1]=4 348 B8R1.5 c1cc(c(nc1)O)F CM10987 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.5 c1ccc(c(c1)F)Cl CM12138 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.5 c1ccc(c(c1)I)I CM12234 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.5 c1ccc(c(c1)N)Br CM11265 [2,0,0,0,0,0|2,0,0]=4 352 B8R1.5 c1ccc(c(c1)N)I CM11493 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.4 Cc1cccc(n1)Br CM14044 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.4 c1c(cncc1Br)O CM14470 [2,0,0,0,0,0|2,0,0]=4 355 B8R1.4 c1c(cncc1Cl)O CM10662 [2,0,0,0,0,0|2,0,0]=4 356 B8R1.4 c1c(cncc1F)O CM10665 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.4 c1c(cncc1O)O CM10452 [2,0,0,0,0,0|2,0,0]=4 358 B8R1.4 c1cc(cc(c1)Br)Br CM12169 [2,0,0,0,0,0|2,0,0]=4 359 B8R1.4 c1cc(cc(c1)Br)Cl CM12036 [2,0,0,0,0,0|2,0,0]=4 360 B8R1.4 c1cc(cc(c1)Br)N CM10037 [2,0,0,0,0,0|2,0,0]=4 361 B8R1.4 c1cc(cc(c1)F)N CM11453 [2,0,0,0,0,0|2,0,0]=4 362 B8R1.4 c1cc(cc(c1)F)O CM11748 [2,0,0,0,0,0|1,0,0]=3 363 B8R1.4 c1cc(cc(c1)I)Br CM12100 [2,0,0,0,0,0|2,0,0]=4 364 B8R1.4 c1cc(cc(c1)I)I CM12235 [2,0,0,0,0,0|2,0,0]=4 365 B8R1.4 c1cc(nc(c1)Br)O CM10270 [2,0,0,0,0,0|2,0,0]=4 366 B8R1.4 c1cnc(cc1I)O CM10195 [2,0,0,0,0,0|2,0,0]=4 367 B8R1.4 c1cnc(cc1O)Br CM10678 [2,0,0,0,0,0|2,0,0]=4 368 B10R1.1 Cc1ccc(cc1)CC#N CM13728 [1,1,0,0,0,0|1,0,1]=4 369 B10R1.1 c1cc(ccc1N=C=O)F CM13772 [1,1,0,0,0,0|1,0,1]=4 370 B10R1.3 CSc1ccc(cc1)CN CM13545 [1,1,0,0,0,0|1,0,1]=4 371 B10R1.3 c1cc(ccc1CN)C#N CM12929 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.3 c1cc(ccc1CO)CBr CM13301 [1,1,0,0,0,0|0,0,2]=4 373 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,1,0,0,0,0|1,0,0]=3 376 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,1,0,0,0,0|1,0,0]=3 377 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,1,0,0,0,0|0,0,0]=2 379 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,1,0,0,0,0|0,0,0]=2 380 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [1,1,0,0,0,0|1,0,0]=3 384 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br CM12110 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.13 c1cc(ccc1[N+](=O)[O-])F CM12273 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.13 c1cc(ncc1C(=O)O)N CM10961 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.176 Cc1cc(ccc1Cl)C=O CM11897 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.176 Cc1cc(ccc1O)C=O CM11993 [1,1,0,0,0,0|1,0,0]=3 393 B10R1.176 Cc1cc(cnc1O)C=O CM10161 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.176 Cc1ccc(cc1Br)OC CM11656 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.176 Cc1ccc(cc1C)C=O CM11941 [1,1,0,0,0,0|0,0,0]=2 396 B10R1.176 Cc1ccc(cc1Cl)CN CM13525 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.176 Cc1ccc(cc1F)C#N CM13092 [1,1,0,0,0,0|1,0,1]=4 398 B10R1.176 Cc1ccc(cc1F)C=O CM11972 [1,1,0,0,0,0|0,0,0]=2 399 B10R1.176 Cc1ccc(cc1F)OC CM11761 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.176 Cc1ccc(cc1N)OC CM11592 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.176 c1cc(c(cc1C=O)Br)O CM11852 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.176 c1cc(c(cc1C=O)Cl)F CM11879 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.176 c1cc(c(cc1C=O)F)Br CM11843 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.176 c1cc(c(cc1C=O)F)Cl CM11882 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.176 c1cc(c(cc1C=O)F)F CM11932 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.176 c1cc(c(cc1C=O)F)I CM11955 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.176 c1cc(c(cc1C=O)F)O CM11950 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.176 c1cc(c(cc1C=O)I)Br CM10864 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.176 c1cc(c(cc1C=O)I)Cl CM10865 [1,1,0,0,0,0|1,0,0]=3 410 B10R1.176 c1cc(c(cc1C=O)I)F CM10860 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.176 c1cc(c(cc1C=O)I)I CM10863 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.176 c1cc(c(cc1C=O)O)Br CM11854 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.176 c1cc(c(cc1C=O)O)O CM13991 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.2 CCc1cccc(c1O)Cl CM10496 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.2 COc1cccc(c1O)Cl CM10886 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.2 COc1cccc(c1O)F CM11754 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.2 Cc1c(cccc1Cl)C=O CM11895 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.2 Cc1c(cccc1F)C=O CM11971 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.2 Cc1c(ccnc1C=O)Br CM10400 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.2 Cc1cccc(c1Cl)C=O CM11894 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.2 Cc1cccc(c1F)C=O CM11968 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.2 c1cc(c(c(c1)Br)Br)C=O CM14314 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.2 c1cc(c(c(c1)Br)F)C=O CM11840 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.2 c1cc(c(c(c1)Br)O)C=O CM11851 [1,1,0,0,0,0|0,0,0]=2 425 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O CM10328 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.2 c1cc(c(c(c1)Cl)F)C=O CM11878 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.2 c1cc(c(c(c1)Cl)O)C#N CM10555 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.2 c1cc(c(c(c1)Cl)O)C=O CM11885 [1,1,0,0,0,0|0,0,0]=2 429 B10R1.2 c1cc(c(c(c1)F)Cl)C=O CM11875 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.2 c1cc(c(c(c1)F)F)C=O CM10129 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.2 c1cc(c(c(c1)F)I)C=O CM11954 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.2 c1cc(c(c(c1)F)O)C=O CM10374 [1,1,0,0,0,0|0,0,0]=2 433 B10R1.2 c1cc(c(c(c1)N)O)C#N CM10899 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.2 c1cc(c(c(c1)O)F)C=O CM10470 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.2 c1cc(c(c(c1)O)O)C#N CM10875 [1,1,0,0,0,0|1,0,1]=4 436 B10R1.4 c1ccc(c(c1)C=NO)F CM12025 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.20 COc1ccccc1CCl CM13440 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.20 COc1ccccc1NN CM13803 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.20 c1ccc(c(c1)CO)CO CM13268 [1,1,0,0,0,0|0,0,2]=4 440 B10R1.30 COc1cc(ccc1O)N CM10211 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.30 Cc1ccc(c(c1)C#N)O CM10144 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.30 Cc1ccc(c(c1)C=O)F CM11970 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.30 Cc1ccc(cc1C=O)Br CM11858 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.30 Cc1ccc(cc1C=O)F CM11975 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.30 c1cc(c(cc1Br)C=O)Cl CM11830 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.30 c1cc(c(cc1Br)C=O)F CM11844 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.30 c1cc(c(cc1Br)C=O)I CM11855 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.30 c1cc(c(cc1Cl)C=O)Br CM14485 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.30 c1cc(c(cc1Cl)C=O)N CM11824 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.30 c1cc(c(cc1F)C=O)Br CM11838 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.30 c1cc(c(cc1F)C=O)Cl CM11877 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.30 c1cc(c(cc1F)C=O)F CM11930 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.30 c1cc(c(cc1F)C=O)I CM11958 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.30 c1cc(c(cc1F)C=O)O CM11952 [1,1,0,0,0,0|0,0,0]=2 455 B10R1.30 c1cc(c(cc1O)C=O)F CM10372 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.61 CC(=O)c1ccccc1Br CM11134 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.61 CC(=O)c1ccccc1I CM11218 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.61 c1ccc(c(c1)C(=O)N)I CM13180 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F CM12272 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.61 c1cncc(c1Br)C(=O)O CM14036 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.245 C=Cc1c(cccc1F)F CM13492 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.245 CCc1c(cccc1O)N CM10920 [1,1,0,0,0,0|1,0,1]=4 465 B10R1.245 COc1c(cccc1Br)O CM10876 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.245 COc1c(cccc1Cl)O CM10468 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.245 CSc1c(cccc1Br)O CM10097 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.245 Cc1cccc(c1C=O)C CM11940 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.245 Cc1cccc(c1C=O)O CM10373 [1,1,0,0,0,0|0,0,0]=2 470 B10R1.245 c1cc(c(c(c1)Br)C#N)O CM12977 [1,1,0,0,0,0|1,0,1]=4 471 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl CM10551 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.245 c1cc(c(c(c1)Br)C=O)F CM11839 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.245 c1cc(c(c(c1)Cl)C#N)O CM13009 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.245 c1cc(c(c(c1)Cl)C=O)O CM11884 [1,1,0,0,0,0|0,0,0]=2 475 B10R1.245 c1cc(c(c(c1)F)C=O)F CM11931 [1,1,0,0,0,0|1,0,0]=3 476 B10R1.245 c1cc(c(c(c1)F)C=O)O CM10484 [1,1,0,0,0,0|0,0,0]=2 477 B10R1.245 c1cnc(c(c1Cl)C=O)Cl CM10668 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.245 c1cnc(c(c1I)C=O)Cl CM10358 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.22 C1=C(C(=O)C(=CC1=O)Cl)Cl CM11061 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.22 Cc1cc(c(c(c1)Br)N)C CM11291 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.22 Cc1cc(c(c(c1)C)Br)C CM12328 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.22 Cc1cc(c(c(c1)C)F)C CM12330 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.22 Cc1cc(c(c(c1)C)N)C CM11540 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.22 Cc1cc(c(c(c1)C)O)C CM11813 [1,1,0,0,0,0|1,0,1]=4 485 B10R1.22 Cc1cc(c(c(c1)Cl)N)Cl CM11411 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.22 Cc1cc(c(c(c1)F)F)F CM13976 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.22 Cc1cc(c(c(c1)N)N)C CM12162 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.22 Cc1cc(c(c(c1)N)O)C CM11568 [1,1,0,0,0,0|1,0,1]=4 489 B10R1.22 c1c(cc(c(c1O)Cl)F)F CM11670 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.22 c1c(cc(c(c1O)F)F)Br CM11625 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.22 c1c(cc(c(c1O)F)F)F CM11806 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.22 c1c(cc(c(c1O)O)F)Cl CM11680 [1,1,0,0,0,0|1,0,1]=4 493 B10R1.118 Cc1cc(c(cc1Br)Br)Br CM13973 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.118 Cc1cc(c(cc1Br)Br)C CM12185 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.118 Cc1cc(c(cc1Br)F)N CM11308 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.118 Cc1cc(c(cc1C)Cl)N CM11354 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.118 Cc1cc(c(cc1C)F)C CM12329 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.118 Cc1cc(c(cc1C)N)N CM12163 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.118 Cc1cc(c(cc1Cl)Cl)S CM11818 [1,1,0,0,0,0|1,1,0]=4 500 B10R1.118 Cc1cc(c(cc1Cl)F)N CM11369 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.118 Cc1cc(c(cc1F)Br)Cl CM13925 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.118 Cc1cc(c(cc1F)Br)O CM10067 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.118 Cc1cc(c(cc1F)Cl)N CM11368 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.118 Cc1cc(c(cc1F)I)N CM11460 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.118 Cc1cc(c(cc1F)N)N CM12926 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.118 Cc1cc(c(cc1N)Br)F CM11309 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.118 Cc1cc(c(cc1O)F)F CM11731 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.118 Cc1cc(c(cc1O)N)Cl CM10972 [1,1,0,0,0,0|1,0,1]=4 509 B10R1.118 c1c(c(cc(c1Cl)Br)Cl)O CM14331 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.118 c1c(c(cc(c1Cl)Cl)Cl)O CM11803 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.118 c1c(c(cc(c1F)F)Br)O CM11617 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.118 c1c(c(cc(c1O)Cl)F)N CM11560 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.119 Cc1ccc(c(c1Br)C)N CM11292 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.119 Cc1ccc(c(c1F)F)F CM13975 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.119 Cc1ccc(c(c1N)C)Br CM11293 [1,1,0,0,0,0|2,0,0]=4 516 B12R1.46 CC(C)c1cc(ccc1C=O)O CM10871 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])C=O CM12002 [0,2,0,0,0,0|0,0,1]=3 518 B12R1.46 c1cc(c(cc1Br)[N+](=O)[O-])C=O CM11861 [0,2,0,0,0,0|1,0,1]=4 519 B12R1.46 c1cc(c(cc1Cl)[N+](=O)[O-])C=O CM14010 [0,2,0,0,0,0|1,0,1]=4 520 B12R1.46 c1cc(c(cc1F)[N+](=O)[O-])C=O CM11981 [0,2,0,0,0,0|1,0,1]=4 521 B12R1.57 COc1c(ccc(n1)F)C(=O)O CM10675 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.57 COc1cc(ccc1C(=O)O)F CM12752 [0,2,0,0,0,0|1,0,0]=3 523 B12R1.57 COc1cc(ccc1C(=O)O)O CM10237 [0,2,0,0,0,0|1,0,0]=3 524 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br CM11664 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl CM11697 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F CM11774 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] CM11790 [0,2,0,0,0,0|1,0,0]=3 528 B12R1.57 c1cc(c(cc1Cl)CO)[N+](=O)[O-] CM13328 [0,2,0,0,0,0|2,0,0]=4 529 B12R1.78 COc1cc(ccc1C=O)C#N CM11916 [0,2,0,0,0,0|0,0,1]=3 530 B12R1.78 COc1ccc(c(c1)C#N)C=O CM10827 [0,2,0,0,0,0|1,0,0]=3 531 B12R1.78 COc1ccc(cc1OC)CCl CM10937 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.78 COc1ccc(cc1OC)CO CM13395 [0,2,0,0,0,0|2,0,0]=4 533 B12R1.234 COc1cc(cc(c1C=O)F)Cl CM10913 [0,2,0,0,0,0|1,0,0]=3 534 B12R1.448 COc1cc(c(cc1C=O)F)F CM11937 [0,2,0,0,0,0|1,0,0]=3 535 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O CM13655 [0,2,0,0,0,0|2,0,0]=4 536 B12R1.233 c1cc(c(cc1Cl)F)CC(=O)O CM13670 [0,2,0,0,0,0|2,0,0]=4 537 B12R1.233 c1cc(c(cc1F)F)CC(=O)O CM13690 [0,2,0,0,0,0|2,0,0]=4 538 B12R1.233 c1cc(c(cc1N)F)CC(=O)O CM13648 [0,2,0,0,0,0|2,0,0]=4 539 B12R1.1703 CCC(=O)c1ccc(cc1F)Br CM10141 [0,2,0,0,0,0|2,0,0]=4 540 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CM13187 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.1703 CNC(=O)c1ccc(cc1F)I CM13186 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CM12459 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.1703 COC(=O)c1ccc(cc1Br)F CM12487 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.1703 COC(=O)c1ccc(cc1Cl)Br CM12464 [0,2,0,0,0,0|2,0,0]=4 545 B12R1.1703 COC(=O)c1ccc(cc1Cl)N CM12362 [0,2,0,0,0,0|2,0,0]=4 546 B12R1.1703 COC(=O)c1ccc(cc1F)Br CM12498 [0,2,0,0,0,0|2,0,0]=4 547 B12R1.1703 COC(=O)c1ccc(cc1F)F CM12656 [0,2,0,0,0,0|2,0,0]=4 548 B12R1.1703 COC(=O)c1ccc(cc1F)I CM12732 [0,2,0,0,0,0|2,0,0]=4 549 B12R1.1703 COC(=O)c1ccc(cc1F)N CM12404 [0,2,0,0,0,0|2,0,0]=4 550 B12R1.1703 COC(=O)c1ccc(cc1F)O CM12714 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.1703 COC(=O)c1ccc(cc1N)Br CM12348 [0,2,0,0,0,0|2,0,0]=4 552 B12R1.1703 COC(=O)c1ccc(cc1N)F CM12395 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.1703 COC(=O)c1ccc(cc1O)F CM12722 [0,2,0,0,0,0|1,0,0]=3 554 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F CM11140 [0,2,0,0,0,0|2,0,0]=4 555 B12R1.232 CC(=O)c1cc(c(cc1F)F)F CM11233 [0,2,0,0,0,0|2,0,0]=4 556 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)O CM12509 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C CM10198 [0,2,0,0,0,0|1,0,0]=3 558 B12R1.232 Cc1cc(c(cc1C)N)C(=O)O CM12386 [0,2,0,0,0,0|1,0,0]=3 559 B12R1.232 Cc1cc(c(cc1C)[N+](=O)[O-])N CM11448 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.232 Cc1cc(c(cc1Cl)[N+](=O)[O-])F CM13942 [0,2,0,0,0,0|2,0,0]=4 561 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)O CM12506 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.232 Cc1cc(c(cc1F)C(=O)O)Br CM12508 [0,2,0,0,0,0|1,0,0]=3 563 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O CM12804 [0,2,0,0,0,0|0,0,0]=2 564 B12R1.232 Cc1cc(c(cc1N)[N+](=O)[O-])C CM11446 [0,2,0,0,0,0|2,0,0]=4 565 B12R1.232 Cc1cc(c(cc1N)[N+](=O)[O-])F CM11471 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.232 Cc1cc(c(cc1O)C(=O)O)F CM12728 [0,2,0,0,0,0|1,0,0]=3 567 B12R1.232 Cc1cc(c(cc1[N+](=O)[O-])Br)C CM12084 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.232 c1c(c(cc(c1Br)Br)N)C(=O)O CM12366 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.232 c1c(c(cc(c1Br)Cl)F)C(=O)O CM12468 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O CM12368 [0,2,0,0,0,0|2,0,0]=4 571 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O CM12570 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O CM12467 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.232 c1c(c(cc(c1F)Br)F)C(=O)O CM12480 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)Cl CM12645 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O CM12644 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)Cl CM12569 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O CM12568 [0,2,0,0,0,0|2,0,0]=4 578 B12R1.232 c1c(c(cc(c1F)F)Br)C(=O)O CM12477 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.232 c1c(c(cc(c1F)F)Cl)C(=O)O CM12562 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)Cl CM12881 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O CM12880 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)[O-] CM12879 [0,2,0,0,0,0|2,0,0]=4 583 B12R1.232 c1c(c(cc(c1F)F)N)C(=O)O CM12375 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.232 c1c(c(cc(c1N)Cl)Cl)C(=O)O CM12371 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.452 CC(=O)c1ccc(cc1F)OC CM11202 [0,2,0,0,0,0|1,0,0]=3 586 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl CM12745 [0,2,0,0,0,0|1,0,0]=3 587 B12R1.452 COc1ccc(c(c1)F)C(=O)O CM12744 [0,2,0,0,0,0|1,0,0]=3 588 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] CM11769 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] CM11785 [0,2,0,0,0,0|2,0,0]=4 590 B12R1.452 COc1ccc(c(c1)N)C(=O)O CM12421 [0,2,0,0,0,0|1,0,0]=3 591 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] CM11786 [0,2,0,0,0,0|1,0,0]=3 592 B12R1.452 COc1ccc(c(n1)F)C(=O)O CM10677 [0,2,0,0,0,0|2,0,0]=4 593 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])CO CM13446 [0,2,0,0,0,0|2,0,0]=4 594 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])OC CM11787 [0,2,0,0,0,0|2,0,0]=4 595 B12R1.452 c1cc(c(cc1C#N)F)C(=O)O CM12621 [0,2,0,0,0,0|1,0,1]=4 596 B12R1.452 c1cc(c(cc1CBr)F)[N+](=O)[O-] CM13425 [0,2,0,0,0,0|2,0,0]=4 597 B12R1.893 CC(=O)c1ccc(c(c1F)F)F CM11230 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CM12387 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.893 Cc1ccc(c(c1C)N)C(=O)O CM12384 [0,2,0,0,0,0|1,0,0]=3 600 B12R1.893 Cc1ccc(c(c1F)C)[N+](=O)[O-] CM12261 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.893 c1cc(c(c(c1C(=O)Cl)F)F)F CM12873 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.893 c1cc(c(c(c1C(=O)O)Br)F)F CM12473 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.893 c1cc(c(c(c1C(=O)O)Cl)Cl)F CM12643 [0,2,0,0,0,0|2,0,0]=4 604 B12R1.893 c1cc(c(c(c1C(=O)O)F)Cl)F CM12565 [0,2,0,0,0,0|2,0,0]=4 605 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br CM12479 [0,2,0,0,0,0|2,0,0]=4 606 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)F CM12872 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N CM12380 [0,2,0,0,0,0|2,0,0]=4 608 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)O CM12668 [0,2,0,0,0,0|2,0,0]=4 609 B12R1.893 c1cc(c(c(c1C(=O)O)F)O)F CM12670 [0,2,0,0,0,0|2,0,0]=4 610 B12R1.893 c1cc(c(c(c1C(=O)O)N)F)F CM12372 [0,2,0,0,0,0|2,0,0]=4 611 B12R1.893 c1cc(c(c(c1C(=O)O)O)F)F CM12673 [0,2,0,0,0,0|1,0,0]=3 612 B12R1.893 c1cc(c(c(c1C(=O)[O-])F)F)F CM12871 [0,2,0,0,0,0|2,0,0]=4 613 B12R1.1000 CC(=O)c1c(cc(cc1F)F)F CM11234 [0,2,0,0,0,0|2,0,0]=4 614 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C CM10102 [0,2,0,0,0,0|0,0,0]=2 615 B12R1.1000 Cc1cc(cc(c1C(=O)O)Br)F CM12507 [0,2,0,0,0,0|2,0,0]=4 616 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)F CM12704 [0,2,0,0,0,0|2,0,0]=4 617 B12R1.1000 Cc1cc(cc(c1C(=O)O)F)Br CM12510 [0,2,0,0,0,0|2,0,0]=4 618 B12R1.1000 c1c(cc(c(c1F)C(=O)Cl)F)F CM12883 [0,2,0,0,0,0|2,0,0]=4 619 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)Cl CM12646 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)F CM12564 [0,2,0,0,0,0|2,0,0]=4 621 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br CM12481 [0,2,0,0,0,0|2,0,0]=4 622 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)F CM12882 [0,2,0,0,0,0|2,0,0]=4 623 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)O CM12672 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.1000 c1c(cc(c(c1N)C(=O)O)F)F CM12376 [0,2,0,0,0,0|2,0,0]=4 625 B12R1.1000 c1c(cc(c(c1O)[N+](=O)[O-])F)F CM11736 [0,2,0,0,0,0|2,0,0]=4 626 B12R1.14 c1c(c(c(c(c1F)F)F)F)C=O CM12009 [0,2,0,0,0,0|2,0,0]=4 627 B12R1.98 c1c(c(c(c(c1Br)F)F)C=O)F CM11862 [0,2,0,0,0,0|2,0,0]=4 628 B12R1.98 c1c(c(c(c(c1F)Cl)F)C=O)F CM11900 [0,2,0,0,0,0|2,0,0]=4 629 B12R1.653 COc1ccc(c(c1O)Cl)C=O CM11887 [0,2,0,0,0,0|1,0,0]=3 630 B12R1.48 c1cc(c(cc1C(=O)O)Br)C=O CM10116 [0,2,0,0,0,0|1,0,1]=4 631 B12R1.48 c1cc(c(cc1[N+](=O)[O-])F)C=O CM11976 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.48 c1cc(c(cc1[N+](=O)[O-])O)C=O CM10349 [0,2,0,0,0,0|1,0,0]=3 633 B12R1.301 COc1cc(c(c(c1)Cl)C=O)Cl CM11926 [0,2,0,0,0,0|1,0,0]=3 634 B12R1.301 COc1cc(c(c(c1)F)C=O)F CM11938 [0,2,0,0,0,0|1,0,0]=3 635 B12R1.301 c1c(cc(c(c1Cl)C=O)Cl)C#N CM11910 [0,2,0,0,0,0|1,0,1]=4 636 B12R1.301 c1c(cc(c(c1F)C=O)F)C#N CM11911 [0,2,0,0,0,0|1,0,1]=4 637 B12R2.612 c1cc2c(cc1Br)CCC2=O CM14359 [0,1,0,1,0,0|2,0,0]=4 638 B12R2.612 c1cc2c(cc1Br)OCC2=O CM10487 [0,1,0,1,0,0|1,0,0]=3 639 B12R2.612 c1cc2c(cc1Br)onc2Cl CM10126 [0,1,0,1,0,0|2,0,0]=4 640 B12R2.612 c1cc2c(cc1Cl)OCC2=O CM10772 [0,1,0,1,0,0|1,0,0]=3 641 B12R2.612 c1cc2c(cc1Cl)onc2O CM13873 [0,1,0,1,0,0|1,0,1]=4 642 B12R2.612 c1cc2c(cc1F)CCC2=O CM14361 [0,1,0,1,0,0|2,0,0]=4 643 B12R2.612 c1cc2c(cc1O)OCC2=O CM10744 [0,1,0,1,0,0|1,0,0]=3 644 B12R2.246 Cc1cc2ccoc2c(c1)Br CM10743 [0,1,0,1,0,0|2,0,0]=4 645 B12R2.246 c1c(cc(c2c1[nH]nc2)O)Cl CM10816 [0,1,0,1,0,0|2,0,0]=4 646 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 CM14289 [0,1,0,1,0,0|2,0,0]=4 647 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 CM14364 [0,1,0,1,0,0|2,0,0]=4 648 B12R2.606 c1cc2c(cc1F)NC(=O)C2 CM14302 [0,1,0,1,0,0|2,0,0]=4 649 B12R2.82 c1cc(c(c2c1cco2)Br)F CM10735 [0,1,0,1,0,0|2,0,0]=4 650 B12R2.44 c1cc(cc2c1cco2)C#N CM10742 [0,1,0,1,0,0|1,0,1]=4 651 B12R2.44 c1cc(cc2c1cco2)C=O CM10731 [0,1,0,1,0,0|1,0,1]=4 652 B8R1.11 c1csc(c1C=O)Br CM10421 [1,0,0,0,1,0|2,0,0]=4