0 B10R1.61 CS(=O)c1ccccc1F CSC011216808 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.61 NC(=O)c1cccnc1F CSC012002233 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.61 NC(=O)c1ccncc1F CSC000698873 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.61 NC(=O)c1ncccc1Cl CSC000099198 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 NC(=O)c1ncccc1F CSC009850871 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [1,0,0,0,0,0|1,0,0]=2 9 B9R1.6 CS(=O)c1ccccn1 CSC000064355 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.15 CNc1ccccc1Cl CSC000219374 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.15 CNc1ncccc1Br CSC000700899 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 COc1ccccc1Br CSC000174000 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.15 COc1ccccc1Cl CSC000169952 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.15 COc1ccccc1I CSC000210334 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.15 CSc1ccccc1Br CSC000230855 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.15 CSc1ccccc1Cl CSC000000335 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.15 CSc1ccccc1F CSC000000233 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.15 CSc1ccccc1O CSC011216402 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.53 CNc1cccnc1[N+](=O)[O-] CSC011381840 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.53 CNc1ncccc1[N+](=O)[O-] CSC000197359 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.53 COc1ccccc1C(=O)N CSC000162176 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.53 CSc1ccccc1C(=O)N CSC000162018 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.87 CS(=O)(=O)c1ccccc1Br CSC000751929 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.87 CS(=O)(=O)c1ccccc1Cl CSC000048123 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.156 Cc1cccc(c1C(=O)N)C CSC011218824 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.156 NC(=O)c1c(cccc1Br)F CSC011219063 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.156 NC(=O)c1c(cccc1Cl)Cl CSC011200855 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.156 NC(=O)c1c(cccc1Cl)F CSC000723611 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.156 NC(=O)c1c(cccc1O)O CSC011218739 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.156 NC(=O)c1c(cncc1Cl)Cl CSC009955450 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.159 Cc1c(cccc1C(=O)N)Br CSC012298201 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.159 Cc1c(cccc1C(=O)N)I CSC010003273 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.159 Cc1cccc(c1Br)C(=O)N CSC012356287 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.159 Cc1cccc(c1C)C(=O)N CSC000162285 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.159 NC(=O)c1cccc(c1Cl)Cl CSC000162245 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.159 NC(=O)c1cccc(c1Cl)F CSC011219509 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.159 NC(=O)c1cccc(c1F)Cl CSC011217061 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.159 NC(=O)c1cccc(c1F)F CSC011202323 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.166 Cc1cc(ccc1C(=O)N)Br CSC011327924 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.166 Cc1cc(ccc1C(=O)N)F CSC011997080 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.166 Cc1ccc(c(c1)C)C(=O)N CSC000162304 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)N CSC012178794 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.166 Cc1ccc(c(c1)F)C(=O)N CSC000686557 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.166 NC(=O)c1ccc(cc1Br)Br CSC012769498 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.166 NC(=O)c1ccc(cc1Br)Cl CSC012347284 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.166 NC(=O)c1ccc(cc1Cl)Cl CSC000162194 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.166 NC(=O)c1ccc(cc1Cl)F CSC000162332 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.166 NC(=O)c1ccc(cc1Cl)I CSC000060398 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.166 NC(=O)c1ccc(cc1F)Br CSC000216903 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.166 NC(=O)c1ccc(cc1F)Cl CSC000216909 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.166 NC(=O)c1ccc(cc1F)F CSC000162284 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.166 NC(=O)c1ccc(cc1O)Cl CSC000192836 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.166 NC(=O)c1ccc(cc1O)O CSC011933943 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.166 NC(=O)c1ncc(cc1F)F CSC000042384 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.167 Cc1ccc(c(c1)C(=O)N)C CSC000162255 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.167 Cc1ccc(c(c1)C(=O)N)F CSC011692772 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.167 Cc1ccc(c(c1)C(=O)N)O CSC000192840 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.167 Cc1ccc(cc1C(=O)N)F CSC000242012 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.167 NC(=O)c1cc(ccc1Br)Br CSC012339728 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.167 NC(=O)c1cc(ccc1Br)Cl CSC011227832 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.167 NC(=O)c1cc(ccc1Br)F CSC000206434 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.167 NC(=O)c1cc(ccc1Br)I CSC012352765 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.167 NC(=O)c1cc(ccc1Cl)Br CSC000162282 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.167 NC(=O)c1cc(ccc1Cl)Cl CSC000162246 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.167 NC(=O)c1cc(ccc1Cl)F CSC000034536 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.167 NC(=O)c1cc(ccc1Cl)I CSC009997440 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.167 NC(=O)c1cc(ccc1F)Br CSC000162119 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.167 NC(=O)c1cc(ccc1F)Cl CSC000216908 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.167 NC(=O)c1cc(ccc1I)Br CSC000162314 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.167 NC(=O)c1cc(ccc1I)Cl CSC000239382 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.167 NC(=O)c1cc(ccc1I)I CSC000060115 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.222 CNC(=O)c1ccccc1Br CSC000155073 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.222 CNC(=O)c1ccccc1C CSC000159864 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.222 CNC(=O)c1ccccc1Cl CSC000159797 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.222 CNC(=O)c1ccccc1Cl CSC000159797 [0,1,0,0,0,0|1,0,0]=2 76 B11R1.222 CNC(=O)c1ccccc1I CSC000155083 [0,1,0,0,0,0|1,0,0]=2 77 B11R1.222 CNC(=O)c1ccccc1O CSC000185920 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.222 CNC(=O)c1cccnc1C CSC011922290 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.222 CNC(=O)c1nccnc1N CSC000025198 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.222 COC(=O)c1ccccc1Cl CSC000150121 [0,1,0,0,0,0|1,0,0]=2 81 B11R1.222 COC(=O)c1ccccc1I CSC000148710 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.222 COC(=O)c1cccnc1C CSC011216498 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.222 COC(=O)c1cccnc1F CSC011934352 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.222 COC(=O)c1ccncc1Br CSC010008606 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.222 COC(=O)c1ccncc1C CSC011934321 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.222 COC(=O)c1ccncc1Cl CSC000699585 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.222 COC(=O)c1ccncc1F CSC000702545 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.222 COC(=O)c1cnccc1C CSC011999757 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.222 COC(=O)c1cnccc1Cl CSC012001583 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.222 COC(=O)c1ncccc1Br CSC011935214 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.222 COC(=O)c1ncccc1Cl CSC000093117 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.222 COC(=O)c1ncccc1F CSC000084157 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.222 COC(=O)c1nccnc1C CSC000090199 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.222 NNC(=O)c1ccccc1Cl CSC000186534 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.222 NNC(=O)c1ccccc1I CSC000190081 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.222 NNC(=O)c1ccccc1O CSC000186518 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.222 NNC(=O)c1nccnc1N CSC000012858 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.41 Cc1ccsc1C(=O)N CSC000162183 [0,0,0,0,1,0|3,0,0]=4 99 B9R1.41 Cc1sccc1C(=O)N CSC000068317 [0,0,0,0,1,0|3,0,0]=4 100 B9R1.41 NC(=O)c1sccc1Br CSC000239328 [0,0,0,0,1,0|3,0,0]=4 101 B9R1.41 NC(=O)c1sccc1Cl CSC011995880 [0,0,0,0,1,0|3,0,0]=4 102 B11R1.86 CC(=O)Nc1ccccc1Br CSC000153524 [0,0,0,0,0,1|1,0,0]=2 103 B11R1.86 CC(=O)Nc1ccccc1C CSC000153662 [0,0,0,0,0,1|1,0,0]=2 104 B11R1.86 CC(=O)Nc1ccccc1Cl CSC000153741 [0,0,0,0,0,1|1,0,0]=2 105 B11R1.86 CC(=O)Nc1ccccc1F CSC000154224 [0,0,0,0,0,1|1,0,0]=2 106 B11R1.86 CC(=O)Nc1ccccc1I CSC000154044 [0,0,0,0,0,1|1,0,0]=2 107 B11R1.86 CC(=O)Nc1ccncc1Br CSC012340662 [0,0,0,0,0,1|2,0,0]=3 108 B11R1.86 CC(=O)Nc1ncccc1C CSC000016773 [0,0,0,0,0,1|2,0,0]=3 109 B11R1.86 CC(=O)Nc1ncccc1O CSC000022013 [0,0,0,0,0,1|2,0,0]=3 110 B11R1.86 CC(=O)Oc1ccccc1C CSC000001913 [0,0,0,0,0,1|1,0,0]=2 111 B11R1.86 CC(=O)Oc1ccccc1F CSC000001835 [0,0,0,0,0,1|1,0,0]=2 112 B11R1.86 CC(C)Oc1ccccc1F CSC000173055 [0,0,0,0,0,1|2,0,1]=4 113 B11R1.86 Cc1ccccc1NC(=O)N CSC000181700 [0,0,0,0,0,1|2,0,0]=3 114 B11R1.86 NC(=O)Cc1ccccc1Cl CSC000162363 [0,0,0,0,0,1|2,0,0]=3 115 B11R1.86 NC(=O)Cc1ccccc1F CSC000162305 [0,0,0,0,0,1|2,0,0]=3 116 B11R1.86 NC(=O)Nc1ccccc1Br CSC000742221 [0,0,0,0,0,1|2,0,0]=3 117 B11R1.86 NC(=O)Nc1ccccc1Cl CSC000181701 [0,0,0,0,0,1|2,0,0]=3 118 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [1,1,0,0,0,0|1,0,0]=3 119 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [1,1,0,0,0,0|1,0,0]=3 120 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [1,1,0,0,0,0|1,0,0]=3 121 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [1,1,0,0,0,0|1,0,0]=3 123 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.13 NC(=O)c1ccc(cn1)Br CSC011219284 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.13 NC(=O)c1ccc(cn1)Cl CSC011834066 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.13 NC(=O)c1ccc(cn1)F CSC012180490 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.15 ONC(=O)c1cccnc1 CSC000190125 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.28 CS(=O)(=O)c1ccccc1 CSC000685546 [1,1,0,0,0,0|1,0,0]=3 130 B10R1.113 NC(=O)c1cc(ccn1)Cl CSC000229564 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.113 NC(=O)c1cccc(c1)Br CSC000162208 [1,1,0,0,0,0|1,0,0]=3 132 B10R1.113 NC(=O)c1cccc(c1)I CSC000162231 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.113 NC(=O)c1cccc(n1)F CSC011830463 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.113 NC(=O)c1cncc(c1)Br CSC000162242 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.113 NC(=O)c1cncc(c1)F CSC011996012 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.2 CNc1cccc(c1C)Cl CSC000220383 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.2 CNc1cccc(c1F)F CSC011410080 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.2 COc1cccc(c1Br)C CSC010191535 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.2 COc1cccc(c1C)Cl CSC000038763 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.2 COc1cccc(c1Cl)Cl CSC000005874 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.2 COc1cccc(c1F)C CSC012000584 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.2 COc1cccc(c1F)Cl CSC000035491 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.2 COc1cccc(c1F)F CSC000034306 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.2 COc1cccc(c1I)F CSC000041735 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.4 CCNc1ccccc1Cl CSC000219383 [1,1,0,0,0,0|1,0,1]=4 146 B10R1.4 CCOc1ccccc1Cl CSC000169953 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.4 CCOc1ccccc1F CSC000172994 [1,1,0,0,0,0|1,0,1]=4 148 B10R1.4 CCSc1ccccc1C CSC000053911 [1,1,0,0,0,0|1,0,1]=4 149 B10R1.4 CCSc1ccccc1Cl CSC000006683 [1,1,0,0,0,0|1,0,1]=4 150 B10R1.4 CSCc1ccccc1Br CSC000148299 [1,1,0,0,0,0|1,0,1]=4 151 B10R1.4 CSCc1ccccc1Cl CSC000051354 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.20 COc1ccccc1SC CSC000037525 [1,1,0,0,0,0|2,0,0]=4 153 B10R1.20 CSc1ccccc1C#N CSC011217975 [1,1,0,0,0,0|1,0,1]=4 154 B10R1.25 CNc1ccc(cc1C)Cl CSC011806183 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.25 CNc1ccc(cc1Cl)Cl CSC000220404 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.25 COc1ccc(cc1Br)Br CSC000170007 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.25 COc1ccc(cc1Br)C CSC000186399 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.25 COc1ccc(cc1Br)F CSC000171694 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.25 COc1ccc(cc1C)Br CSC011219705 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.25 COc1ccc(cc1C)Cl CSC000170507 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.25 COc1ccc(cc1C)F CSC011216167 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.25 COc1ccc(cc1Cl)Br CSC000149647 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.25 COc1ccc(cc1Cl)C CSC011933932 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.25 COc1ccc(cc1Cl)Cl CSC000170024 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.25 COc1ccc(cc1Cl)F CSC000170253 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.25 COc1ccc(cc1F)Cl CSC011218554 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.25 COc1ccc(cc1I)C CSC011263220 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.25 CSc1ccc(cc1C)C CSC000001076 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.25 CSc1ccc(cc1Cl)Cl CSC000076917 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.25 CSc1ccc(cc1F)F CSC000017874 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.30 COc1cc(ccc1Br)C CSC010200004 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.30 COc1cc(ccc1Br)Cl CSC009814061 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.30 COc1cc(ccc1C)Br CSC011830276 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.30 COc1cc(ccc1C)Cl CSC011219340 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.30 COc1cc(ccc1C)F CSC011219959 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.30 COc1cc(ccc1Cl)Br CSC000742348 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.30 COc1cc(ccc1Cl)C CSC000170852 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.30 COc1cc(ccc1Cl)Cl CSC000170754 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.30 COc1cc(ccc1F)Br CSC011934186 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.30 COc1cc(ccc1F)C CSC011217910 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.30 COc1cc(ccc1F)F CSC011214905 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.30 CSc1cc(ccc1C)C CSC000001074 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.30 CSc1cc(ccc1Cl)Cl CSC000001111 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.245 CNc1c(cccc1F)F CSC000220993 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.245 COc1c(cccc1Br)Br CSC009815442 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.245 COc1c(cccc1Cl)Cl CSC000006293 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.245 COc1c(cccc1Cl)F CSC000036530 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.245 COc1c(cccc1F)F CSC000031912 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.245 CSc1c(cccc1Cl)Cl CSC000000219 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.149 COC(=O)c1ccoc1Br CSC011935261 [0,1,0,0,1,0|2,0,0]=4 191 B10R1.149 COC(=O)c1ccoc1C CSC000198963 [0,1,0,0,1,0|2,0,0]=4 192 B10R1.149 COC(=O)c1ccsc1Br CSC009822520 [0,1,0,0,1,0|2,0,0]=4 193 B10R1.149 COC(=O)c1ccsc1C CSC012003538 [0,1,0,0,1,0|2,0,0]=4 194 B10R1.149 COC(=O)c1cocc1C CSC009857685 [0,1,0,0,1,0|2,0,0]=4 195 B10R1.149 COC(=O)c1cscc1Br CSC012351140 [0,1,0,0,1,0|2,0,0]=4 196 B10R1.149 COC(=O)c1sccc1Br CSC011218980 [0,1,0,0,1,0|2,0,0]=4 197 B10R1.149 COC(=O)c1sccc1C CSC000150764 [0,1,0,0,1,0|2,0,0]=4 198 B12R1.75 CC(=O)Nc1ccccc1C#N CSC000151996 [0,1,0,0,0,1|0,0,1]=3 199 B12R1.75 CC(=O)Oc1ccccc1C#N CSC000001326 [0,1,0,0,0,1|0,0,1]=3 200 B12R1.75 CCc1ccccc1NC(=O)C CSC000154698 [0,1,0,0,0,1|1,0,0]=3 201 B12R1.75 CCc1ccccc1NC(=O)N CSC011196910 [0,1,0,0,0,1|2,0,0]=4 202 B12R1.75 COc1ccccc1CC(=O)N CSC000162009 [0,1,0,0,0,1|2,0,0]=4 203 B12R1.75 COc1ccccc1OC(=O)C CSC000002000 [0,1,0,0,0,1|1,0,0]=3 204 B12R1.124 CN(C(=O)C)c1ccccc1C CSC012109126 [0,1,0,0,0,1|1,0,0]=3 205 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br CSC011252870 [0,1,0,0,0,1|1,0,0]=3 206 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl CSC012362533 [0,1,0,0,0,1|1,0,0]=3 207 B12R1.127 CC(=O)Nc1cc(ccc1C)Br CSC011344836 [0,1,0,0,0,1|1,0,0]=3 208 B12R1.127 CC(=O)Nc1cc(ccc1C)C CSC000152684 [0,1,0,0,0,1|1,0,0]=3 209 B12R1.127 CC(=O)Nc1cc(ccc1C)F CSC000155779 [0,1,0,0,0,1|1,0,0]=3 210 B12R1.127 CC(=O)Nc1cc(ccc1C)N CSC000740626 [0,1,0,0,0,1|1,0,0]=3 211 B12R1.127 CC(=O)Nc1cc(ccc1F)Br CSC011951791 [0,1,0,0,0,1|1,0,0]=3 212 B12R1.127 CC(=O)Nc1cc(ccc1F)F CSC000155522 [0,1,0,0,0,1|1,0,0]=3 213 B12R1.127 CC(=O)Nc1cc(ccc1O)Br CSC010005742 [0,1,0,0,0,1|1,0,0]=3 214 B12R1.127 CC(=O)Nc1cc(ccc1O)C CSC000035807 [0,1,0,0,0,1|1,0,0]=3 215 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl CSC000012038 [0,1,0,0,0,1|1,0,0]=3 216 B12R1.127 CC(=O)Oc1cc(ccc1C)C CSC000002421 [0,1,0,0,0,1|1,0,0]=3 217 B12R1.127 Cc1ccc(c(c1)CC(=O)N)C CSC011694954 [0,1,0,0,0,1|2,0,0]=4 218 B12R1.127 Cc1ccc(cc1NC(=O)N)Cl CSC000238962 [0,1,0,0,0,1|2,0,0]=4 219 B12R1.127 NC(=O)Nc1cc(ccc1Cl)Cl CSC011208874 [0,1,0,0,0,1|2,0,0]=4 220 B12R1.127 NC(=O)Nc1cc(ccc1F)F CSC011208891 [0,1,0,0,0,1|2,0,0]=4 221 B12R1.151 CS(=O)(=O)Cc1ccccc1F CSC000047419 [0,1,0,0,0,1|2,0,0]=4 222 B12R1.151 CS(=O)(=O)Nc1ccccc1Cl CSC000165637 [0,1,0,0,0,1|2,0,0]=4 223 B12R1.151 CS(=O)(=O)Nc1ccccc1F CSC000165704 [0,1,0,0,0,1|2,0,0]=4 224 B12R1.151 CS(=O)(=O)Nc1ccccc1I CSC000165667 [0,1,0,0,0,1|2,0,0]=4 225 B12R1.151 CS(=O)(=O)Nc1ccccc1O CSC000165779 [0,1,0,0,0,1|2,0,0]=4 226 B12R1.151 Cc1ccccc1NS(=O)(=O)C CSC000165619 [0,1,0,0,0,1|2,0,0]=4 227 B12R1.224 CC(=O)Nc1cccc(c1C)Br CSC011775766 [0,1,0,0,0,1|1,0,0]=3 228 B12R1.224 CC(=O)Nc1cccc(c1C)C CSC000153689 [0,1,0,0,0,1|1,0,0]=3 229 B12R1.224 CC(=O)Nc1cccc(c1C)N CSC000736503 [0,1,0,0,0,1|1,0,0]=3 230 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl CSC000155691 [0,1,0,0,0,1|1,0,0]=3 231 B12R1.224 CC(=O)Nc1cccc(c1F)Cl CSC000152519 [0,1,0,0,0,1|1,0,0]=3 232 B12R1.224 CC(=O)Nc1cccc(c1O)Cl CSC000117800 [0,1,0,0,0,1|1,0,0]=3 233 B12R1.224 Cc1c(cccc1NC(=O)N)Cl CSC000238989 [0,1,0,0,0,1|2,0,0]=4 234 B12R1.224 NC(=O)Nc1cccc(c1Cl)Cl CSC011238596 [0,1,0,0,0,1|2,0,0]=4 235 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br CSC000151919 [0,1,0,0,0,1|1,0,0]=3 236 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl CSC012022070 [0,1,0,0,0,1|1,0,0]=3 237 B12R1.233 CC(=O)Nc1ccc(cc1Br)F CSC011215554 [0,1,0,0,0,1|1,0,0]=3 238 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl CSC000154214 [0,1,0,0,0,1|1,0,0]=3 239 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br CSC000154779 [0,1,0,0,0,1|1,0,0]=3 240 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl CSC000154243 [0,1,0,0,0,1|1,0,0]=3 241 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F CSC000155642 [0,1,0,0,0,1|1,0,0]=3 242 B12R1.233 CC(=O)Nc1ccc(cc1F)C CSC000152019 [0,1,0,0,0,1|1,0,0]=3 243 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl CSC000155771 [0,1,0,0,0,1|1,0,0]=3 244 B12R1.233 CC(=O)Nc1ccc(cc1F)F CSC000155514 [0,1,0,0,0,1|1,0,0]=3 245 B12R1.233 CC(=O)Nc1ccc(cc1F)I CSC000027682 [0,1,0,0,0,1|1,0,0]=3 246 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl CSC010293595 [0,1,0,0,0,1|1,0,0]=3 247 B12R1.233 CC(=O)Nc1ncc(cc1Br)C CSC009816786 [0,1,0,0,0,1|2,0,0]=4 248 B12R1.233 CC(=O)Nc1ncc(cc1C)Br CSC011934169 [0,1,0,0,0,1|2,0,0]=4 249 B12R1.233 CC(=O)Nc1ncc(cc1C)Cl CSC009862376 [0,1,0,0,0,1|2,0,0]=4 250 B12R1.233 CC(=O)Nc1ncc(cc1C)I CSC000012997 [0,1,0,0,0,1|2,0,0]=4 251 B12R1.233 CC(=O)Nc1ncc(cc1Cl)Cl CSC000024117 [0,1,0,0,0,1|2,0,0]=4 252 B12R1.233 Cc1cc(ccc1NC(=O)N)Cl CSC011226012 [0,1,0,0,0,1|2,0,0]=4 253 B12R1.233 Cc1cc(ccc1NC(=O)N)F CSC000239003 [0,1,0,0,0,1|2,0,0]=4 254 B12R1.233 Cc1ccc(c(c1)Br)NC(=O)N CSC011208876 [0,1,0,0,0,1|2,0,0]=4 255 B12R1.233 Cc1ccc(c(c1)Cl)NC(=O)N CSC011248226 [0,1,0,0,0,1|2,0,0]=4 256 B12R1.233 NC(=O)Cc1ccc(cc1Br)F CSC010883721 [0,1,0,0,0,1|2,0,0]=4 257 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl CSC000162283 [0,1,0,0,0,1|2,0,0]=4 258 B12R1.233 NC(=O)Cc1ccc(cc1Cl)F CSC000034102 [0,1,0,0,0,1|2,0,0]=4 259 B12R1.233 NC(=O)Nc1ccc(cc1Cl)Cl CSC011208882 [0,1,0,0,0,1|2,0,0]=4 260 B12R1.233 NC(=O)Nc1ccc(cc1F)Br CSC011208892 [0,1,0,0,0,1|2,0,0]=4 261 B12R1.233 NC(=O)Nc1ccc(cc1F)F CSC000222808 [0,1,0,0,0,1|2,0,0]=4 262 B12R1.371 CCC(=O)Nc1ccccc1Br CSC000153536 [0,1,0,0,0,1|1,0,0]=3 263 B12R1.371 CCC(=O)Nc1ccccc1C CSC000153667 [0,1,0,0,0,1|1,0,0]=3 264 B12R1.371 CCC(=O)Nc1ccccc1Cl CSC000153746 [0,1,0,0,0,1|1,0,0]=3 265 B12R1.371 CCC(=O)Nc1ccccc1F CSC000154229 [0,1,0,0,0,1|1,0,0]=3 266 B12R1.371 CCC(=O)Nc1ccccc1I CSC000154056 [0,1,0,0,0,1|1,0,0]=3 267 B12R1.371 CCC(=O)Oc1ccccc1Cl CSC000001856 [0,1,0,0,0,1|1,0,0]=3 268 B12R1.371 CNC(=O)Cc1ccccc1Br CSC009816160 [0,1,0,0,0,1|1,0,0]=3 269 B12R1.371 CNC(=O)Cc1ccccc1C CSC000175625 [0,1,0,0,0,1|1,0,0]=3 270 B12R1.371 CNC(=O)Cc1ccccc1Cl CSC000159959 [0,1,0,0,0,1|1,0,0]=3 271 B12R1.371 CNC(=O)Cc1ccccc1F CSC000159918 [0,1,0,0,0,1|1,0,0]=3 272 B12R1.371 CNC(=O)Cc1ccccc1N CSC000738506 [0,1,0,0,0,1|0,0,0]=2 273 B12R1.371 CNC(=O)Nc1ccccc1C CSC000235315 [0,1,0,0,0,1|1,0,0]=3 274 B12R1.371 CNC(=O)Nc1ccccc1Cl CSC000178583 [0,1,0,0,0,1|1,0,0]=3 275 B12R1.371 CNC(=O)Nc1ncccc1C CSC000048767 [0,1,0,0,0,1|2,0,0]=4 276 B12R1.371 COC(=O)Cc1ccccc1Br CSC000699816 [0,1,0,0,0,1|1,0,0]=3 277 B12R1.371 COC(=O)Cc1ccccc1C CSC000175439 [0,1,0,0,0,1|1,0,0]=3 278 B12R1.371 COC(=O)Cc1ccccc1F CSC000149365 [0,1,0,0,0,1|1,0,0]=3 279 B12R1.371 COC(=O)Cc1ccccc1O CSC000758901 [0,1,0,0,0,1|1,0,0]=3 280 B12R1.371 Cc1ccccc1CC(=O)NN CSC000190038 [0,1,0,0,0,1|2,0,0]=4 281 B12R1.371 Cc1ccccc1CC(=O)NO CSC000190267 [0,1,0,0,0,1|2,0,0]=4 282 B12R1.371 Cc1ccccc1NC(=O)CN CSC000168393 [0,1,0,0,0,1|1,0,0]=3 283 B12R1.371 ClCC(=O)Nc1cccnc1Cl CSC000182560 [0,1,0,0,0,1|2,0,0]=4 284 B12R1.371 NCC(=O)Nc1ccccc1Cl CSC000168390 [0,1,0,0,0,1|1,0,0]=3 285 B12R1.371 NCC(=O)Nc1ccccc1F CSC000168463 [0,1,0,0,0,1|1,0,0]=3 286 B12R1.371 NNC(=O)Cc1ccccc1Cl CSC000189918 [0,1,0,0,0,1|2,0,0]=4 287 B12R1.371 NNC(=O)Cc1ccccc1F CSC000190036 [0,1,0,0,0,1|2,0,0]=4 288 B12R1.1009 CC(=O)Nc1c(cccc1C)C CSC000152485 [0,1,0,0,0,1|1,0,0]=3 289 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C CSC011996691 [0,1,0,0,0,1|1,0,0]=3 290 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F CSC012243075 [0,1,0,0,0,1|1,0,0]=3 291 B12R1.1009 CC(=O)Nc1c(cccc1F)F CSC000155699 [0,1,0,0,0,1|1,0,0]=3 292 B12R1.1009 CC(=O)Nc1c(cccc1O)C CSC000103797 [0,1,0,0,0,1|1,0,0]=3 293 B12R1.1009 CC(=O)Oc1c(cccc1C)C CSC000001954 [0,1,0,0,0,1|1,0,0]=3 294 B12R1.1009 CC(=O)Oc1c(cccc1Cl)Cl CSC000002155 [0,1,0,0,0,1|1,0,0]=3 295 B12R1.1009 Cc1cccc(c1NC(=O)N)C CSC011196911 [0,1,0,0,0,1|2,0,0]=4 296 B12R1.1009 Cc1cccc(c1NC(=O)N)Cl CSC012184704 [0,1,0,0,0,1|2,0,0]=4 297 B12R1.1009 NC(=O)Cc1c(cccc1Cl)F CSC000162243 [0,1,0,0,0,1|2,0,0]=4 298 B12R1.46 CNc1ccc(cc1C(=O)N)Cl CSC011619361 [0,2,0,0,0,0|1,0,0]=3 299 B12R1.46 CNc1ccc(cc1[N+](=O)[O-])Br CSC000752019 [0,2,0,0,0,0|2,0,0]=4 300 B12R1.46 COc1ccc(cc1C(=O)C)Br CSC000173343 [0,2,0,0,0,0|1,0,0]=3 301 B12R1.46 COc1ccc(cc1C(=O)N)Br CSC000215694 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.46 COc1ccc(cc1C(=O)N)Cl CSC000162310 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.57 CNc1cc(ccc1[N+](=O)[O-])Cl CSC000188764 [0,2,0,0,0,0|2,0,0]=4 304 B12R1.57 COc1cc(ccc1C(=O)C)Br CSC000709911 [0,2,0,0,0,0|1,0,0]=3 305 B12R1.57 COc1cc(ccc1C(=O)N)C CSC000026189 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.57 COc1cc(ccc1C(=O)N)Cl CSC011533113 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.76 COc1ccccc1S(=O)(=O)C CSC000021672 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.77 CNC(=O)c1ccccc1OC CSC000159813 [0,2,0,0,0,0|1,0,0]=3 309 B12R1.77 CNC(=O)c1ccccc1SC CSC000159722 [0,2,0,0,0,0|1,0,0]=3 310 B12R1.77 CNc1ccccc1C(=O)NN CSC000019922 [0,2,0,0,0,0|1,0,0]=3 311 B12R1.77 COC(=O)c1ccccc1OC CSC000150339 [0,2,0,0,0,0|1,0,0]=3 312 B12R1.77 COC(=O)c1ccccc1SC CSC000151494 [0,2,0,0,0,0|1,0,0]=3 313 B12R1.77 COC(=O)c1cccnc1OC CSC011203184 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.77 COC(=O)c1cccnc1SC CSC000149765 [0,2,0,0,0,0|2,0,0]=4 315 B12R1.77 COC(=O)c1ncccc1OC CSC011997691 [0,2,0,0,0,0|2,0,0]=4 316 B12R1.77 COc1ccccc1C(=O)NN CSC000189102 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.261 NC(=O)c1ccccc1[N+](=O)[O-] CSC000187317 [0,2,0,0,0,0|1,0,1]=4 318 B12R1.283 CCNc1ccccc1[N+](=O)[O-] CSC000156562 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.283 CCSc1ccccc1C(=O)N CSC000019821 [0,2,0,0,0,0|2,0,0]=4 320 B12R1.437 COc1cccc(c1C(=O)N)F CSC011218308 [0,2,0,0,0,0|2,0,0]=4 321 B12R1.126 CS(=O)(=O)c1ccc(cc1Cl)Cl CSC010008659 [0,2,0,0,0,0|2,0,0]=4 322 B12R1.126 CS(=O)(=O)c1ccc(cc1F)F CSC000048141 [0,2,0,0,0,0|2,0,0]=4 323 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)C CSC000048139 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.128 CS(=O)(=O)c1cc(ccc1Cl)Cl CSC000036291 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.128 CS(=O)(=O)c1cc(ccc1F)F CSC000041713 [0,2,0,0,0,0|2,0,0]=4 326 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)C)C CSC000048138 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.894 Cc1ccc(c(c1F)C(=O)N)F CSC011216796 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.894 NC(=O)c1c(ccc(c1F)F)F CSC000035597 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.894 NC(=O)c1c(ccc(c1F)O)F CSC009825046 [0,2,0,0,0,0|2,0,0]=4 330 B12R1.1000 Cc1cc(c(c(c1)C)C(=O)N)C CSC011200860 [0,2,0,0,0,0|2,0,0]=4 331 B12R1.1000 NC(=O)c1c(cc(cc1F)F)F CSC011218477 [0,2,0,0,0,0|2,0,0]=4 332 B12R1.3441 CNC(=O)c1c(cccc1Cl)Cl CSC011195916 [0,2,0,0,0,0|1,0,0]=3 333 B12R1.3441 CNC(=O)c1c(cccc1F)F CSC011195917 [0,2,0,0,0,0|1,0,0]=3 334 B12R1.3441 COC(=O)c1c(cccc1Br)C CSC010204206 [0,2,0,0,0,0|1,0,0]=3 335 B12R1.3441 COC(=O)c1c(cccc1Br)Cl CSC012340579 [0,2,0,0,0,0|1,0,0]=3 336 B12R1.3441 COC(=O)c1c(cccc1Br)N CSC010253892 [0,2,0,0,0,0|0,0,0]=2 337 B12R1.3441 COC(=O)c1c(cccc1C)C CSC011997366 [0,2,0,0,0,0|1,0,0]=3 338 B12R1.3441 COC(=O)c1c(cccc1Cl)Cl CSC000148928 [0,2,0,0,0,0|1,0,0]=3 339 B12R1.3441 COC(=O)c1c(cccc1F)F CSC000148932 [0,2,0,0,0,0|1,0,0]=3 340 B12R1.3441 COC(=O)c1c(cccc1F)O CSC011216559 [0,2,0,0,0,0|1,0,0]=3 341 B12R1.3441 COC(=O)c1c(cccc1I)C CSC010187551 [0,2,0,0,0,0|1,0,0]=3 342 B12R1.3441 COC(=O)c1c(cccc1I)F CSC010254406 [0,2,0,0,0,0|1,0,0]=3 343 B12R1.3441 NNC(=O)c1c(cccc1Cl)Cl CSC000189814 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.3441 NNC(=O)c1c(cccc1Cl)F CSC000189775 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.3441 NNC(=O)c1c(cccc1F)F CSC000189817 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.24 COC(=O)c1cccc(=O)n1C CSC000730068 [0,2,0,0,0,0|2,0,0]=4 347 B12R1.24 COC(=O)c1cccc(c1Br)C CSC012339457 [0,2,0,0,0,0|1,0,0]=3 348 B12R1.24 COC(=O)c1cccc(c1Br)F CSC012357630 [0,2,0,0,0,0|1,0,0]=3 349 B12R1.24 COC(=O)c1cccc(c1C)Br CSC012298220 [0,2,0,0,0,0|1,0,0]=3 350 B12R1.24 COC(=O)c1cccc(c1C)C CSC000149159 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.24 COC(=O)c1cccc(c1C)I CSC010168159 [0,2,0,0,0,0|1,0,0]=3 352 B12R1.24 COC(=O)c1cccc(c1C)O CSC011999632 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.24 COC(=O)c1cccc(c1Cl)Br CSC012349815 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.24 COC(=O)c1cccc(c1Cl)C CSC012002529 [0,2,0,0,0,0|1,0,0]=3 355 B12R1.24 COC(=O)c1cccc(c1Cl)Cl CSC000148926 [0,2,0,0,0,0|1,0,0]=3 356 B12R1.24 COC(=O)c1cccc(c1F)Br CSC012355674 [0,2,0,0,0,0|1,0,0]=3 357 B12R1.24 COC(=O)c1cccc(c1F)C CSC012001762 [0,2,0,0,0,0|1,0,0]=3 358 B12R1.24 COC(=O)c1cccc(c1F)Cl CSC011997369 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.24 COC(=O)c1cccc(c1F)F CSC011220063 [0,2,0,0,0,0|1,0,0]=3 360 B12R1.24 COC(=O)c1cccc(c1I)C CSC011294812 [0,2,0,0,0,0|1,0,0]=3 361 B12R1.24 COC(=O)c1cccc(c1I)F CSC010151095 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.24 COC(=O)c1cccc(c1N)Br CSC011356556 [0,2,0,0,0,0|0,0,0]=2 363 B12R1.24 COC(=O)c1cccc(c1N)Cl CSC011356568 [0,2,0,0,0,0|0,0,0]=2 364 B12R1.24 COC(=O)c1cccc(c1N)F CSC000707970 [0,2,0,0,0,0|0,0,0]=2 365 B12R1.24 COC(=O)c1cccc(c1N)I CSC000055437 [0,2,0,0,0,0|0,0,0]=2 366 B12R1.24 COC(=O)c1cccc(c1O)Br CSC009816214 [0,2,0,0,0,0|1,0,0]=3 367 B12R1.24 COC(=O)c1cccc(c1O)C CSC000149854 [0,2,0,0,0,0|1,0,0]=3 368 B12R1.24 COC(=O)c1ccnc(c1F)F CSC012662669 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.24 Cc1cccc(c1C)C(=O)NN CSC000189804 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.24 Cc1cccc(c1O)C(=O)NN CSC000193353 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.24 NNC(=O)c1cccc(c1Cl)Cl CSC000189813 [0,2,0,0,0,0|2,0,0]=4 372 B12R1.511 NC(=O)c1cc(cc(c1I)I)I CSC000162362 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.893 NC(=O)c1ccc(c(c1F)Cl)F CSC000081360 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.893 NC(=O)c1ccc(c(c1F)F)F CSC011216183 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.232 NC(=O)c1cc(c(cc1Cl)Cl)F CSC000223270 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.232 NC(=O)c1cc(c(cc1F)F)F CSC000036233 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.452 COc1ccc(c(c1)Br)C(=O)N CSC009815664 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.452 COc1ccc(c(c1)C)C(=O)N CSC009868328 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.452 COc1ccc(c(c1)F)C(=O)C CSC000211433 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.452 COc1ccc(c(c1)F)C(=O)N CSC000198184 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.1703 CNC(=O)c1ccc(cc1C)C CSC000159917 [0,2,0,0,0,0|1,0,0]=3 382 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br CSC011372354 [0,2,0,0,0,0|1,0,0]=3 383 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C CSC000188180 [0,2,0,0,0,0|1,0,0]=3 384 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl CSC000159828 [0,2,0,0,0,0|1,0,0]=3 385 B12R1.1703 CNC(=O)c1ccc(cc1Cl)N CSC000742945 [0,2,0,0,0,0|1,0,0]=3 386 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CSC000233932 [0,2,0,0,0,0|1,0,0]=3 387 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl CSC011190852 [0,2,0,0,0,0|1,0,0]=3 388 B12R1.1703 CNC(=O)c1ccc(cc1F)F CSC000159900 [0,2,0,0,0,0|1,0,0]=3 389 B12R1.1703 COC(=O)c1ccc(cc1Br)Br CSC012357387 [0,2,0,0,0,0|1,0,0]=3 390 B12R1.1703 COC(=O)c1ccc(cc1Br)C CSC012340597 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CSC012359205 [0,2,0,0,0,0|1,0,0]=3 392 B12R1.1703 COC(=O)c1ccc(cc1Br)F CSC000204356 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.1703 COC(=O)c1ccc(cc1C)C CSC000149307 [0,2,0,0,0,0|1,0,0]=3 394 B12R1.1703 COC(=O)c1ccc(cc1C)Cl CSC012000500 [0,2,0,0,0,0|1,0,0]=3 395 B12R1.1703 COC(=O)c1ccc(cc1C)F CSC011997371 [0,2,0,0,0,0|1,0,0]=3 396 B12R1.1703 COC(=O)c1ccc(cc1Cl)C CSC012179639 [0,2,0,0,0,0|1,0,0]=3 397 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl CSC000150782 [0,2,0,0,0,0|1,0,0]=3 398 B12R1.1703 COC(=O)c1ccc(cc1Cl)F CSC000149744 [0,2,0,0,0,0|1,0,0]=3 399 B12R1.1703 COC(=O)c1ccc(cc1Cl)I CSC000060724 [0,2,0,0,0,0|1,0,0]=3 400 B12R1.1703 COC(=O)c1ccc(cc1F)C CSC000697821 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.1703 COC(=O)c1ccc(cc1F)Cl CSC000216677 [0,2,0,0,0,0|1,0,0]=3 402 B12R1.1703 COC(=O)c1ccc(cc1F)F CSC000149155 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.1703 COC(=O)c1ccc(cc1F)I CSC010244672 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.1703 COC(=O)c1ccc(cc1F)N CSC000688129 [0,2,0,0,0,0|1,0,0]=3 405 B12R1.1703 COC(=O)c1ccc(cc1F)O CSC011999631 [0,2,0,0,0,0|1,0,0]=3 406 B12R1.1703 COC(=O)c1ccc(cc1N)Cl CSC000170103 [0,2,0,0,0,0|0,0,0]=2 407 B12R1.1703 COC(=O)c1ccc(cc1N)F CSC000740600 [0,2,0,0,0,0|0,0,0]=2 408 B12R1.1703 COC(=O)c1ccc(cc1N)I CSC010172136 [0,2,0,0,0,0|0,0,0]=2 409 B12R1.1703 COC(=O)c1ccc(cc1O)F CSC011216117 [0,2,0,0,0,0|1,0,0]=3 410 B12R1.1703 COC(=O)c1ncc(cc1F)F CSC000106392 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.1703 Cc1cc(ccc1C(=O)NN)Cl CSC011996896 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.1703 Cc1ccc(c(c1)C)C(=O)NN CSC000189823 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)NN CSC000187075 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN CSC000193368 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.1703 NNC(=O)c1ccc(cc1Br)F CSC000203923 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.1703 NNC(=O)c1ccc(cc1Cl)Br CSC000751675 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.1703 NNC(=O)c1ccc(cc1F)Br CSC009812619 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.1703 NNC(=O)c1ccc(cc1F)F CSC000189803 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.354 CNC(=O)c1cc(ccc1C)C CSC000159876 [0,2,0,0,0,0|1,0,0]=3 420 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br CSC000155089 [0,2,0,0,0,0|1,0,0]=3 421 B12R1.354 CNC(=O)c1cc(ccc1F)F CSC000194209 [0,2,0,0,0,0|1,0,0]=3 422 B12R1.354 CNC(=O)c1cc(ccc1I)Cl CSC011279454 [0,2,0,0,0,0|1,0,0]=3 423 B12R1.354 COC(=O)c1cc(ccc1Br)Br CSC011218029 [0,2,0,0,0,0|1,0,0]=3 424 B12R1.354 COC(=O)c1cc(ccc1Br)C CSC012339458 [0,2,0,0,0,0|1,0,0]=3 425 B12R1.354 COC(=O)c1cc(ccc1Br)Cl CSC011228367 [0,2,0,0,0,0|1,0,0]=3 426 B12R1.354 COC(=O)c1cc(ccc1Br)F CSC000205820 [0,2,0,0,0,0|1,0,0]=3 427 B12R1.354 COC(=O)c1cc(ccc1Br)I CSC012340073 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.354 COC(=O)c1cc(ccc1C)Br CSC000703529 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.354 COC(=O)c1cc(ccc1C)C CSC000148939 [0,2,0,0,0,0|1,0,0]=3 430 B12R1.354 COC(=O)c1cc(ccc1C)Cl CSC012000380 [0,2,0,0,0,0|1,0,0]=3 431 B12R1.354 COC(=O)c1cc(ccc1C)I CSC012360116 [0,2,0,0,0,0|1,0,0]=3 432 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CSC000149116 [0,2,0,0,0,0|1,0,0]=3 433 B12R1.354 COC(=O)c1cc(ccc1Cl)Cl CSC000148927 [0,2,0,0,0,0|1,0,0]=3 434 B12R1.354 COC(=O)c1cc(ccc1Cl)F CSC011997379 [0,2,0,0,0,0|1,0,0]=3 435 B12R1.354 COC(=O)c1cc(ccc1Cl)I CSC012353682 [0,2,0,0,0,0|1,0,0]=3 436 B12R1.354 COC(=O)c1cc(ccc1Cl)O CSC012001761 [0,2,0,0,0,0|1,0,0]=3 437 B12R1.354 COC(=O)c1cc(ccc1F)C CSC000703722 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.354 COC(=O)c1cc(ccc1F)F CSC000194029 [0,2,0,0,0,0|1,0,0]=3 439 B12R1.354 COC(=O)c1cc(ccc1F)I CSC012350775 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.354 COC(=O)c1cc(ccc1I)Br CSC000148213 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.354 COC(=O)c1cc(ccc1I)F CSC000058944 [0,2,0,0,0,0|1,0,0]=3 442 B12R1.354 COC(=O)c1cc(ccc1N)C CSC000216452 [0,2,0,0,0,0|0,0,0]=2 443 B12R1.354 COC(=O)c1cc(ccc1N)Cl CSC000172362 [0,2,0,0,0,0|0,0,0]=2 444 B12R1.354 COC(=O)c1cc(ccc1N)F CSC000173281 [0,2,0,0,0,0|0,0,0]=2 445 B12R1.354 COC(=O)c1cc(ccc1O)C CSC000216618 [0,2,0,0,0,0|1,0,0]=3 446 B12R1.354 COC(=O)c1cc(ccc1O)F CSC011219540 [0,2,0,0,0,0|1,0,0]=3 447 B12R1.354 COC(=O)c1cc(ccc1O)I CSC000149868 [0,2,0,0,0,0|1,0,0]=3 448 B12R1.354 COC(=O)c1cc(ccc1O)O CSC011203519 [0,2,0,0,0,0|1,0,0]=3 449 B12R1.354 COC(=O)c1cc(cnc1F)Br CSC010243567 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.354 Cc1ccc(c(c1)C(=O)NN)C CSC000189821 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.354 Cc1ccc(c(c1)C(=O)NN)O CSC000193374 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.354 NNC(=O)c1cc(ccc1Br)F CSC000205862 [0,2,0,0,0,0|2,0,0]=4 453 B12R1.354 NNC(=O)c1cc(ccc1Cl)Br CSC000189792 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.354 NNC(=O)c1cc(ccc1F)F CSC000194117 [0,2,0,0,0,0|2,0,0]=4 455 B12R1.354 NNC(=O)c1cc(ccc1O)Br CSC000193350 [0,2,0,0,0,0|2,0,0]=4 456 B12R1.453 COc1ccc(c(c1)C(=O)N)Br CSC000162014 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.308 CCNC(=O)c1ccccc1Br CSC000155173 [0,2,0,0,0,0|1,0,0]=3 458 B12R1.308 CCNC(=O)c1ccccc1C CSC000160149 [0,2,0,0,0,0|1,0,0]=3 459 B12R1.308 CCNC(=O)c1ccccc1Cl CSC000160087 [0,2,0,0,0,0|1,0,0]=3 460 B12R1.308 CCNC(=O)c1ccccc1F CSC000160117 [0,2,0,0,0,0|1,0,0]=3 461 B12R1.308 CCNC(=O)c1ccccc1I CSC000155181 [0,2,0,0,0,0|1,0,0]=3 462 B12R1.308 CCNC(=O)c1ccccc1N CSC000205978 [0,2,0,0,0,0|0,0,0]=2 463 B12R1.308 CCNC(=O)c1ccccc1O CSC000192205 [0,2,0,0,0,0|1,0,0]=3 464 B12R1.308 CCOC(=O)c1ccccc1Br CSC000169876 [0,2,0,0,0,0|1,0,0]=3 465 B12R1.308 CCOC(=O)c1ccccc1C CSC000170245 [0,2,0,0,0,0|1,0,0]=3 466 B12R1.308 CCOC(=O)c1ccccc1Cl CSC000169879 [0,2,0,0,0,0|1,0,0]=3 467 B12R1.308 CCOC(=O)c1ccccc1F CSC000170099 [0,2,0,0,0,0|1,0,0]=3 468 B12R1.308 CCOC(=O)c1ccccc1I CSC000170190 [0,2,0,0,0,0|1,0,0]=3 469 B12R1.308 CCOC(=O)c1ccccc1O CSC000169922 [0,2,0,0,0,0|1,0,0]=3 470 B12R1.308 CCOC(=O)c1cccnc1C CSC000750000 [0,2,0,0,0,0|2,0,0]=4 471 B12R1.308 CCOC(=O)c1ccncc1Br CSC010238393 [0,2,0,0,0,0|2,0,0]=4 472 B12R1.308 CCOC(=O)c1cnccc1C CSC000728538 [0,2,0,0,0,0|2,0,0]=4 473 B12R1.308 CCOC(=O)c1cnccc1Cl CSC000708780 [0,2,0,0,0,0|2,0,0]=4 474 B12R1.308 CCOC(=O)c1ncccc1C CSC000725470 [0,2,0,0,0,0|2,0,0]=4 475 B12R1.308 CCOC(=O)c1ncccc1F CSC000106390 [0,2,0,0,0,0|2,0,0]=4 476 B12R1.308 CCOC(=O)c1nccnc1N CSC000246222 [0,2,0,0,0,0|2,0,0]=4 477 B12R2.18 Cn1c2ccccc2oc1=O CSC000171226 [0,1,0,1,0,0|2,0,0]=4 478 B12R1.125 CC(=C)COc1ccccc1C CSC000171510 [0,0,0,0,0,2|2,0,0]=4 479 B12R1.125 CC(=C)CSc1ccccc1C CSC000053913 [0,0,0,0,0,2|2,0,0]=4 480 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [0,0,0,0,0,2|1,0,0]=3 481 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [0,0,0,0,0,2|1,0,0]=3 482 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [0,0,0,0,0,2|1,0,0]=3 483 B12R1.125 CC(=O)NCc1cnccc1C CSC013037028 [0,0,0,0,0,2|2,0,0]=4 484 B12R1.125 CC(=O)NNc1ccccc1C CSC015226515 [0,0,0,0,0,2|1,0,0]=3 485 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [0,0,0,0,0,2|1,0,0]=3 486 B12R1.125 CC(=O)OCc1ccncc1Cl CSC009843883 [0,0,0,0,0,2|2,0,0]=4 487 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [0,0,0,0,0,2|2,0,0]=4 488 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,0,0,0,0,2|2,0,0]=4 489 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,0,0,0,0,2|2,0,0]=4 490 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [0,0,0,0,0,2|2,0,0]=4 491 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [0,0,0,0,0,2|2,0,0]=4 492 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [0,0,0,0,0,2|2,0,0]=4 493 B12R1.125 NC(=O)NNc1ccccc1Cl CSC000022921 [0,0,0,0,0,2|2,0,0]=4 494 B12R1.125 OC(=O)COc1ccccc1F CSC000182486 [0,0,0,0,0,2|2,0,0]=4