0 B10R1.113 NC(=O)c1cc(ccn1)Cl CSC000229564 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.113 NC(=O)c1cccc(c1)Br CSC000162208 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.113 NC(=O)c1cccc(c1)I CSC000162231 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.113 NC(=O)c1cccc(n1)F CSC011830463 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.113 NC(=O)c1cncc(c1)Br CSC000162242 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 NC(=O)c1cncc(c1)F CSC011996012 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.2 CNc1cccc(c1)Cl CSC000220044 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.2 CNc1cccc(c1)I CSC000221217 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.2 COc1cccc(c1)Br CSC000170001 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.2 COc1cccc(c1)Cl CSC000170018 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.2 COc1cccc(c1)I CSC000171673 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.2 CSc1cccc(c1)Br CSC011215954 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.2 CSc1cccc(c1)Cl CSC000033908 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.2 CSc1cccc(c1)F CSC000067534 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [1,0,0,0,0,0|1,0,0]=2 15 B9R1.6 CS(=O)c1ccccn1 CSC000064355 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.21 Cc1cc(ccc1Br)C(=O)N CSC011218126 [0,1,0,0,0,0|1,0,0]=2 17 B11R1.21 Cc1cc(ccc1F)C(=O)N CSC011217366 [0,1,0,0,0,0|1,0,0]=2 18 B11R1.21 Cc1ccc(cc1Br)C(=O)N CSC000186401 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.21 Cc1ccc(cc1C)C(=O)N CSC000162321 [0,1,0,0,0,0|1,0,0]=2 20 B11R1.21 Cc1ccc(cc1Cl)C(=O)N CSC011219532 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.21 Cc1ccc(cc1F)C(=O)N CSC000216902 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.21 Cc1ccc(cc1I)C(=O)N CSC000012956 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.21 NC(=O)c1ccc(c(c1)Br)Cl CSC012357840 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.21 NC(=O)c1ccc(c(c1)Br)F CSC011202321 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Br CSC012348002 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.21 NC(=O)c1ccc(c(c1)Cl)Cl CSC000162198 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.21 NC(=O)c1ccc(c(c1)Cl)F CSC011216305 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.21 NC(=O)c1ccc(c(c1)Cl)I CSC012348003 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.21 NC(=O)c1ccc(c(c1)F)Br CSC000686215 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.21 NC(=O)c1ccc(c(c1)F)Cl CSC011202322 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.21 NC(=O)c1ccc(c(c1)F)F CSC000194243 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.23 CNC(=O)c1cccc(c1)Br CSC000155082 [0,1,0,0,0,0|1,0,0]=2 33 B11R1.23 CNC(=O)c1cccc(c1)C CSC000159928 [0,1,0,0,0,0|0,0,0]=1 34 B11R1.23 CNC(=O)c1cccc(c1)Cl CSC000159822 [0,1,0,0,0,0|1,0,0]=2 35 B11R1.23 CNC(=O)c1cccc(c1)F CSC000159920 [0,1,0,0,0,0|1,0,0]=2 36 B11R1.23 CNC(=O)c1cccc(c1)I CSC000155084 [0,1,0,0,0,0|1,0,0]=2 37 B11R1.23 CNC(=O)c1cccc(c1)O CSC000159807 [0,1,0,0,0,0|1,0,0]=2 38 B11R1.23 CNC(=O)c1cncc(c1)Br CSC000155086 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.23 COC(=O)c1cc[nH]c(=O)c1 CSC011935111 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.23 COC(=O)c1cccc(c1)Br CSC000148679 [0,1,0,0,0,0|1,0,0]=2 41 B11R1.23 COC(=O)c1cccc(c1)C CSC000149472 [0,1,0,0,0,0|0,0,0]=1 42 B11R1.23 COC(=O)c1cccc(c1)Cl CSC000150768 [0,1,0,0,0,0|1,0,0]=2 43 B11R1.23 COC(=O)c1cccc(c1)F CSC000148988 [0,1,0,0,0,0|1,0,0]=2 44 B11R1.23 COC(=O)c1cccc(c1)I CSC000148848 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.23 COC(=O)c1cccc(c1)O CSC000150331 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.23 COC(=O)c1cccc(n1)C CSC000741576 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.23 COC(=O)c1cccc(n1)F CSC000724373 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.23 COC(=O)c1ccnc(c1)C CSC012001301 [0,1,0,0,0,0|1,0,0]=2 49 B11R1.23 COC(=O)c1ccnc(c1)F CSC011581676 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.23 COC(=O)c1ccnc(n1)C CSC000054160 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.23 COC(=O)c1cncc(c1)Br CSC000148912 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.23 COC(=O)c1cncc(c1)Br CSC000148912 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.23 COC(=O)c1cncc(c1)F CSC000698520 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.23 COC(=O)c1cncc(c1)O CSC000687108 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.23 Cc1cccc(c1)C(=O)NN CSC000189845 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.23 Cc1nccc(n1)C(=O)NN CSC000053180 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.23 NNC(=O)c1cc(ccn1)Cl CSC000017052 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.23 NNC(=O)c1cccc(c1)Br CSC000189783 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.23 NNC(=O)c1cccc(c1)F CSC000189798 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.23 NNC(=O)c1cccc(c1)I CSC000186306 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.23 NNC(=O)c1cncc(c1)Br CSC000189809 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.74 Cc1cc(cc(c1)C(=O)N)C CSC000162256 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.74 Cc1cc(cc(c1)C(=O)N)F CSC011217717 [0,1,0,0,0,0|1,0,0]=2 64 B11R1.74 NC(=O)c1cc(cc(c1)Br)Br CSC011216256 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.74 NC(=O)c1cc(cc(c1)Cl)Cl CSC000162247 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.74 NC(=O)c1cc(cc(c1)Cl)F CSC000080068 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.74 NC(=O)c1cc(cc(c1)F)F CSC000162007 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.155 CS(=O)(=O)c1cccc(c1)Br CSC009815773 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.155 CS(=O)(=O)c1cccc(c1)Cl CSC000059038 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.155 CS(=O)(=O)c1cccc(c1)F CSC012002675 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.155 NS(=O)(=O)c1cccc(c1)Br CSC000164563 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.159 Cc1c(cccc1C(=O)N)Br CSC012298201 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.159 Cc1c(cccc1C(=O)N)I CSC010003273 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.159 Cc1cccc(c1Br)C(=O)N CSC012356287 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.159 Cc1cccc(c1C)C(=O)N CSC000162285 [0,1,0,0,0,0|1,0,0]=2 76 B11R1.159 Cn1cccc(c1=O)[N+](=O)[O-] CSC000059228 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.159 NC(=O)c1cccc(c1Cl)Cl CSC000162245 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.159 NC(=O)c1cccc(c1Cl)F CSC011219509 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.159 NC(=O)c1cccc(c1F)Cl CSC011217061 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.159 NC(=O)c1cccc(c1F)F CSC011202323 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.167 Cc1ccc(c(c1)C(=O)N)C CSC000162255 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.167 Cc1ccc(c(c1)C(=O)N)F CSC011692772 [0,1,0,0,0,0|1,0,0]=2 83 B11R1.167 Cc1ccc(c(c1)C(=O)N)O CSC000192840 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.167 Cc1ccc(cc1C(=O)N)F CSC000242012 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.167 NC(=O)c1cc(ccc1Br)Br CSC012339728 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.167 NC(=O)c1cc(ccc1Br)Cl CSC011227832 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.167 NC(=O)c1cc(ccc1Br)F CSC000206434 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.167 NC(=O)c1cc(ccc1Br)I CSC012352765 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.167 NC(=O)c1cc(ccc1Cl)Br CSC000162282 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.167 NC(=O)c1cc(ccc1Cl)Cl CSC000162246 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.167 NC(=O)c1cc(ccc1Cl)F CSC000034536 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.167 NC(=O)c1cc(ccc1Cl)I CSC009997440 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.167 NC(=O)c1cc(ccc1F)Br CSC000162119 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.167 NC(=O)c1cc(ccc1F)Cl CSC000216908 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.167 NC(=O)c1cc(ccc1I)Br CSC000162314 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.167 NC(=O)c1cc(ccc1I)Cl CSC000239382 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.167 NC(=O)c1cc(ccc1I)I CSC000060115 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.266 COc1cccc(c1)[N+](=O)[O-] CSC000006736 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.266 CSc1cccc(c1)[N+](=O)[O-] CSC000061305 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.35 Cc1csc(c1)C(=O)N CSC000068353 [0,0,0,0,1,0|2,0,0]=3 101 B9R1.35 NC(=O)c1cc(c[nH]1)Br CSC000229580 [0,0,0,0,1,0|3,0,0]=4 102 B9R1.35 NC(=O)c1cc(cs1)Br CSC009812991 [0,0,0,0,1,0|3,0,0]=4 103 B9R1.35 NC(=O)c1ccc(o1)Br CSC000162236 [0,0,0,0,1,0|3,0,0]=4 104 B9R1.35 NC(=O)c1ccc(s1)Cl CSC000162217 [0,0,0,0,1,0|3,0,0]=4 105 B9R1.41 Cc1ccsc1C(=O)N CSC000162183 [0,0,0,0,1,0|2,0,0]=3 106 B9R1.41 Cc1sccc1C(=O)N CSC000068317 [0,0,0,0,1,0|2,0,0]=3 107 B9R1.41 NC(=O)c1sccc1Br CSC000239328 [0,0,0,0,1,0|3,0,0]=4 108 B9R1.41 NC(=O)c1sccc1Cl CSC011995880 [0,0,0,0,1,0|3,0,0]=4 109 B11R1.157 CC(=O)Nc1cc(ccn1)Br CSC012362434 [0,0,0,0,0,1|2,0,0]=3 110 B11R1.157 CC(=O)Nc1cc(ccn1)C CSC000016760 [0,0,0,0,0,1|1,0,0]=2 111 B11R1.157 CC(=O)Nc1cc(ccn1)Cl CSC011996789 [0,0,0,0,0,1|2,0,0]=3 112 B11R1.157 CC(=O)Nc1cccc(c1)Br CSC000153616 [0,0,0,0,0,1|1,0,0]=2 113 B11R1.157 CC(=O)Nc1cccc(c1)C CSC000153650 [0,0,0,0,0,1|0,0,0]=1 114 B11R1.157 CC(=O)Nc1cccc(c1)F CSC000153968 [0,0,0,0,0,1|1,0,0]=2 115 B11R1.157 CC(=O)Nc1cccc(n1)F CSC012002399 [0,0,0,0,0,1|2,0,0]=3 116 B11R1.157 CC(=O)Nc1ccnc(c1)C CSC000199137 [0,0,0,0,0,1|1,0,0]=2 117 B11R1.157 CC(=O)Oc1cccc(c1)Br CSC009811612 [0,0,0,0,0,1|1,0,0]=2 118 B11R1.157 CC(=O)Oc1cccc(c1)C CSC000001900 [0,0,0,0,0,1|0,0,0]=1 119 B11R1.157 CC(=O)Oc1cccc(c1)Cl CSC000001977 [0,0,0,0,0,1|1,0,0]=2 120 B11R1.157 CC(=O)Oc1cccc(c1)F CSC000002014 [0,0,0,0,0,1|1,0,0]=2 121 B11R1.157 CC(C)Oc1cccc(c1)F CSC000170039 [0,0,0,0,0,1|2,0,1]=4 122 B11R1.157 CC(C)Sc1cccc(c1)Br CSC009815759 [0,0,0,0,0,1|2,0,1]=4 123 B11R1.157 CC(C)Sc1cccc(c1)Cl CSC000059006 [0,0,0,0,0,1|2,0,1]=4 124 B11R1.157 Cc1cccc(c1)NC(=O)N CSC000181699 [0,0,0,0,0,1|1,0,0]=2 125 B11R1.157 NC(=O)Cc1cccc(c1)Br CSC011586816 [0,0,0,0,0,1|2,0,0]=3 126 B11R1.157 NC(=O)Cc1cccc(c1)Cl CSC011690632 [0,0,0,0,0,1|2,0,0]=3 127 B11R1.157 NC(=O)Cc1cccc(c1)F CSC000162360 [0,0,0,0,0,1|2,0,0]=3 128 B11R1.157 NC(=O)Cc1cccc(c1)N CSC011690101 [0,0,0,0,0,1|2,0,0]=3 129 B11R1.157 NC(=O)Nc1cccc(c1)Br CSC000238923 [0,0,0,0,0,1|2,0,0]=3 130 B10R1.2 CNc1cccc(c1C)Cl CSC000220383 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.2 CNc1cccc(c1F)F CSC011410080 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.2 COc1cccc(c1Br)C CSC010191535 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.2 COc1cccc(c1C)Cl CSC000038763 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.2 COc1cccc(c1Cl)Cl CSC000005874 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.2 COc1cccc(c1F)C CSC012000584 [1,1,0,0,0,0|1,0,0]=3 136 B10R1.2 COc1cccc(c1F)Cl CSC000035491 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.2 COc1cccc(c1F)F CSC000034306 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.2 COc1cccc(c1I)F CSC000041735 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.8 CNc1cc(cc(c1)F)F CSC011233154 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.8 COc1cc(cc(c1)Br)Cl CSC010232472 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.8 COc1cc(cc(c1)Br)F CSC011934182 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.8 COc1cc(cc(c1)Cl)Cl CSC000006878 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.8 COc1cc(cc(c1)Cl)F CSC000035575 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.8 COc1cc(cc(c1)F)F CSC000763127 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.10 CCOc1cccc(c1)Cl CSC000170019 [1,1,0,0,0,0|1,0,1]=4 146 B10R1.10 CCOc1cccc(c1)F CSC000170038 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.10 CCSc1cccc(c1)C CSC000055746 [1,1,0,0,0,0|0,0,1]=3 148 B10R1.10 CCSc1cccc(c1)Cl CSC000059004 [1,1,0,0,0,0|1,0,1]=4 149 B10R1.10 CCSc1cccc(c1)F CSC000106542 [1,1,0,0,0,0|1,0,1]=4 150 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [1,1,0,0,0,0|1,0,1]=4 151 B10R1.10 CSCc1cccc(c1)F CSC000053058 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.30 COc1cc(ccc1Br)C CSC010200004 [1,1,0,0,0,0|1,0,0]=3 153 B10R1.30 COc1cc(ccc1Br)Cl CSC009814061 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.30 COc1cc(ccc1C)Br CSC011830276 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.30 COc1cc(ccc1C)Cl CSC011219340 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.30 COc1cc(ccc1C)F CSC011219959 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.30 COc1cc(ccc1Cl)Br CSC000742348 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.30 COc1cc(ccc1Cl)C CSC000170852 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.30 COc1cc(ccc1Cl)Cl CSC000170754 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.30 COc1cc(ccc1F)Br CSC011934186 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.30 COc1cc(ccc1F)C CSC011217910 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.30 COc1cc(ccc1F)F CSC011214905 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.30 CSc1cc(ccc1C)C CSC000001074 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.30 CSc1cc(ccc1Cl)Cl CSC000001111 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.172 COc1cccc(c1)SC CSC000044647 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.176 CNc1ccc(c(c1)Cl)C CSC000220120 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.176 CNc1ccc(c(c1)Cl)Cl CSC000219944 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.176 CNc1ccc(c(c1)F)Br CSC012285320 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.176 COc1ccc(c(c1)Br)C CSC012349166 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.176 COc1ccc(c(c1)Br)Cl CSC011290771 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.176 COc1ccc(c(c1)Br)I CSC012349170 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.176 COc1ccc(c(c1)C)Br CSC000759875 [1,1,0,0,0,0|1,0,0]=3 173 B10R1.176 COc1ccc(c(c1)C)Cl CSC000170508 [1,1,0,0,0,0|1,0,0]=3 174 B10R1.176 COc1ccc(c(c1)C)F CSC011217415 [1,1,0,0,0,0|1,0,0]=3 175 B10R1.176 COc1ccc(c(c1)Cl)Br CSC000730603 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.176 COc1ccc(c(c1)Cl)C CSC000021920 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.176 COc1ccc(c(c1)Cl)Cl CSC000170311 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.176 COc1ccc(c(c1)Cl)F CSC000006738 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.176 COc1ccc(c(c1)F)Br CSC000753793 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.176 COc1ccc(c(c1)F)C CSC011218487 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.176 COc1ccc(c(c1)F)Cl CSC011215935 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.176 COc1ccc(c(c1)F)F CSC000038840 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.176 CSc1ccc(c(c1)C)C CSC000001060 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.176 CSc1ccc(c(c1)Cl)Cl CSC000116842 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.176 CSc1ccc(c(c1)Cl)F CSC000021471 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [1,1,0,0,0,0|1,0,0]=3 187 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [1,1,0,0,0,0|1,0,0]=3 188 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [1,1,0,0,0,0|1,0,0]=3 191 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.13 NC(=O)c1ccc(cn1)Br CSC011219284 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.13 NC(=O)c1ccc(cn1)Cl CSC011834066 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.13 NC(=O)c1ccc(cn1)F CSC012180490 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.15 ONC(=O)c1cccnc1 CSC000190125 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.28 CS(=O)(=O)c1ccccc1 CSC000685546 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.61 CS(=O)c1ccccc1F CSC011216808 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [1,1,0,0,0,0|1,0,0]=3 201 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [1,1,0,0,0,0|1,0,0]=3 202 B10R1.61 NC(=O)c1cccnc1F CSC012002233 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.61 NC(=O)c1ccncc1F CSC000698873 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.61 NC(=O)c1ncccc1Cl CSC000099198 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.61 NC(=O)c1ncccc1F CSC009850871 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.14 CNC(=O)c1cc(on1)C CSC000159738 [0,1,0,0,1,0|2,0,0]=4 207 B10R1.14 CNC(=O)c1ccc(s1)Br CSC000155069 [0,1,0,0,1,0|2,0,0]=4 208 B10R1.14 CNC(=O)c1coc(n1)C CSC000144003 [0,1,0,0,1,0|2,0,0]=4 209 B10R1.14 COC(=O)c1cc(c[nH]1)Br CSC000205823 [0,1,0,0,1,0|2,0,0]=4 210 B10R1.14 COC(=O)c1cc(c[nH]1)F CSC000100949 [0,1,0,0,1,0|2,0,0]=4 211 B10R1.14 COC(=O)c1cc(co1)Br CSC009992624 [0,1,0,0,1,0|2,0,0]=4 212 B10R1.14 COC(=O)c1cc(cs1)Br CSC009815473 [0,1,0,0,1,0|2,0,0]=4 213 B10R1.14 COC(=O)c1cc(cs1)C CSC000040733 [0,1,0,0,1,0|1,0,0]=3 214 B10R1.14 COC(=O)c1cc(no1)C CSC000204421 [0,1,0,0,1,0|2,0,0]=4 215 B10R1.14 COC(=O)c1ccc(o1)C CSC000151062 [0,1,0,0,1,0|1,0,0]=3 216 B10R1.14 COC(=O)c1ccc(o1)Cl CSC000191419 [0,1,0,0,1,0|2,0,0]=4 217 B10R1.14 COC(=O)c1ccc(s1)Br CSC000148107 [0,1,0,0,1,0|2,0,0]=4 218 B10R1.14 COC(=O)c1ccc(s1)C CSC000150765 [0,1,0,0,1,0|1,0,0]=3 219 B10R1.14 COC(=O)c1ccc(s1)Cl CSC000148076 [0,1,0,0,1,0|2,0,0]=4 220 B10R1.14 COC(=O)c1ccn(n1)C CSC000698609 [0,1,0,0,1,0|2,0,0]=4 221 B10R1.14 COC(=O)c1cn(cn1)C CSC000752664 [0,1,0,0,1,0|2,0,0]=4 222 B10R1.14 COC(=O)c1coc(c1)C CSC012017277 [0,1,0,0,1,0|1,0,0]=3 223 B10R1.14 COC(=O)c1coc(n1)C CSC000067300 [0,1,0,0,1,0|2,0,0]=4 224 B10R1.14 COC(=O)c1csc(c1)Br CSC000692058 [0,1,0,0,1,0|2,0,0]=4 225 B10R1.14 COC(=O)c1nc(cs1)C CSC000087785 [0,1,0,0,1,0|2,0,0]=4 226 B10R1.14 Cc1ccc(o1)C(=O)NN CSC000189940 [0,1,0,0,1,0|2,0,0]=4 227 B10R1.14 Cc1ccc(s1)C(=O)NN CSC000189777 [0,1,0,0,1,0|2,0,0]=4 228 B10R1.59 CC(=O)c1nc(sc1C)C CSC000008397 [0,1,0,0,1,0|2,0,0]=4 229 B10R1.194 Cc1csc(c1Cl)C(=O)N CSC011996362 [0,1,0,0,1,0|2,0,0]=4 230 B10R1.39 COc1ccsc1C(=O)N CSC000752662 [0,1,0,0,1,0|2,0,0]=4 231 B10R1.149 COC(=O)c1ccoc1Br CSC011935261 [0,1,0,0,1,0|2,0,0]=4 232 B10R1.149 COC(=O)c1ccoc1C CSC000198963 [0,1,0,0,1,0|1,0,0]=3 233 B10R1.149 COC(=O)c1ccsc1Br CSC009822520 [0,1,0,0,1,0|2,0,0]=4 234 B10R1.149 COC(=O)c1ccsc1C CSC012003538 [0,1,0,0,1,0|1,0,0]=3 235 B10R1.149 COC(=O)c1cn[nH]c1C CSC011998119 [0,1,0,0,1,0|2,0,0]=4 236 B10R1.149 COC(=O)c1cocc1C CSC009857685 [0,1,0,0,1,0|1,0,0]=3 237 B10R1.149 COC(=O)c1cscc1Br CSC012351140 [0,1,0,0,1,0|2,0,0]=4 238 B10R1.149 COC(=O)c1csnc1C CSC000106640 [0,1,0,0,1,0|2,0,0]=4 239 B10R1.149 COC(=O)c1ncoc1C CSC000063398 [0,1,0,0,1,0|2,0,0]=4 240 B10R1.149 COC(=O)c1oncc1C CSC012003539 [0,1,0,0,1,0|2,0,0]=4 241 B10R1.149 COC(=O)c1sccc1Br CSC011218980 [0,1,0,0,1,0|2,0,0]=4 242 B10R1.149 COC(=O)c1sccc1C CSC000150764 [0,1,0,0,1,0|1,0,0]=3 243 B10R1.149 COC(=O)c1scnc1C CSC011302605 [0,1,0,0,1,0|2,0,0]=4 244 B10R1.149 Cc1ccoc1C(=O)NN CSC000217430 [0,1,0,0,1,0|2,0,0]=4 245 B10R1.149 Cc1ccsc1C(=O)NN CSC000189776 [0,1,0,0,1,0|2,0,0]=4 246 B12R1.19 CC(=O)Nc1cc(c(cn1)Br)C CSC011934553 [0,1,0,0,0,1|1,0,0]=3 247 B12R1.19 CC(=O)Nc1cc(c(cn1)I)C CSC010130682 [0,1,0,0,0,1|1,0,0]=3 248 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F CSC012348134 [0,1,0,0,0,1|1,0,0]=3 249 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C CSC000153705 [0,1,0,0,0,1|0,0,0]=2 250 B12R1.19 CC(=O)Nc1ccc(c(c1)C)N CSC011203061 [0,1,0,0,0,1|0,0,0]=2 251 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O CSC012186693 [0,1,0,0,0,1|0,0,0]=2 252 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br CSC000187747 [0,1,0,0,0,1|1,0,0]=3 253 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F CSC000155749 [0,1,0,0,0,1|1,0,0]=3 254 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O CSC011215158 [0,1,0,0,0,1|1,0,0]=3 255 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br CSC011219590 [0,1,0,0,0,1|1,0,0]=3 256 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F CSC000155707 [0,1,0,0,0,1|1,0,0]=3 257 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C CSC000154840 [0,1,0,0,0,1|1,0,0]=3 258 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C CSC012148147 [0,1,0,0,0,1|1,0,0]=3 259 B12R1.19 CC(=O)Nc1ccc(c(n1)C)Br CSC000187074 [0,1,0,0,0,1|1,0,0]=3 260 B12R1.19 CC(=O)Oc1ccc(c(c1)C)C CSC000002428 [0,1,0,0,0,1|0,0,0]=2 261 B12R1.19 CC(=O)Oc1ccc(c(c1)Cl)Cl CSC000002395 [0,1,0,0,0,1|1,0,0]=3 262 B12R1.19 CC(=O)Oc1ccc(c(c1)F)Cl CSC010725880 [0,1,0,0,0,1|1,0,0]=3 263 B12R1.19 CC(C)Oc1ccc(c(c1)C)Br CSC012344556 [0,1,0,0,0,1|1,0,1]=4 264 B12R1.19 Cc1ccc(cc1C)CC(=O)N CSC000162019 [0,1,0,0,0,1|1,0,0]=3 265 B12R1.19 Cc1ccc(cc1Cl)NC(=O)N CSC000222810 [0,1,0,0,0,1|2,0,0]=4 266 B12R1.19 Cc1ccc(cc1F)NC(=O)N CSC000238967 [0,1,0,0,0,1|2,0,0]=4 267 B12R1.19 NC(=O)Nc1ccc(c(c1)Cl)Cl CSC000222805 [0,1,0,0,0,1|2,0,0]=4 268 B12R1.19 NC(=O)Nc1ccc(c(c1)Cl)F CSC000238935 [0,1,0,0,0,1|2,0,0]=4 269 B12R1.19 NC(=O)Nc1ccc(c(c1)F)Cl CSC000717728 [0,1,0,0,0,1|2,0,0]=4 270 B12R1.19 NC(=O)Nc1ccc(c(c1)F)F CSC000239066 [0,1,0,0,0,1|2,0,0]=4 271 B12R1.50 CCC(=O)Nc1cccc(c1)Br CSC000153628 [0,1,0,0,0,1|1,0,0]=3 272 B12R1.50 CCC(=O)Nc1cccc(c1)C CSC000153655 [0,1,0,0,0,1|0,0,0]=2 273 B12R1.50 CCC(=O)Nc1cccc(c1)Cl CSC000153961 [0,1,0,0,0,1|1,0,0]=3 274 B12R1.50 CCC(=O)Nc1cccc(c1)F CSC000153973 [0,1,0,0,0,1|1,0,0]=3 275 B12R1.50 CCC(=O)Nc1cccc(c1)O CSC000158609 [0,1,0,0,0,1|1,0,0]=3 276 B12R1.50 CNC(=O)Cc1cccc(c1)Br CSC011714096 [0,1,0,0,0,1|1,0,0]=3 277 B12R1.50 CNC(=O)Cc1cccc(c1)Cl CSC011795159 [0,1,0,0,0,1|1,0,0]=3 278 B12R1.50 CNC(=O)Cc1cccc(c1)F CSC000159957 [0,1,0,0,0,1|1,0,0]=3 279 B12R1.50 CNC(=O)Nc1cccc(c1)Br CSC000235173 [0,1,0,0,0,1|1,0,0]=3 280 B12R1.50 CNC(=O)Nc1cccc(c1)C CSC000178579 [0,1,0,0,0,1|0,0,0]=2 281 B12R1.50 CNC(=O)Nc1cccc(c1)Cl CSC000178564 [0,1,0,0,0,1|1,0,0]=3 282 B12R1.50 CNC(=O)Nc1cccc(c1)F CSC000235183 [0,1,0,0,0,1|1,0,0]=3 283 B12R1.50 COC(=O)Cc1cccc(c1)Br CSC000699549 [0,1,0,0,0,1|1,0,0]=3 284 B12R1.50 COC(=O)Cc1cccc(c1)C CSC011661688 [0,1,0,0,0,1|0,0,0]=2 285 B12R1.50 COC(=O)Cc1cccc(c1)Cl CSC011690634 [0,1,0,0,0,1|1,0,0]=3 286 B12R1.50 COC(=O)Cc1cccc(c1)F CSC000151121 [0,1,0,0,0,1|1,0,0]=3 287 B12R1.50 Cc1cccc(c1)NC(=O)CN CSC000168384 [0,1,0,0,0,1|0,0,0]=2 288 B12R1.50 Cc1cccc(c1)NC(=O)CO CSC000749660 [0,1,0,0,0,1|0,0,0]=2 289 B12R1.50 NCC(=O)Nc1cccc(c1)Br CSC000168392 [0,1,0,0,0,1|1,0,0]=3 290 B12R1.50 NCC(=O)Nc1cccc(c1)Cl CSC000168427 [0,1,0,0,0,1|1,0,0]=3 291 B12R1.50 NCC(=O)Nc1cccc(c1)F CSC000168492 [0,1,0,0,0,1|1,0,0]=3 292 B12R1.50 NNC(=O)Cc1cccc(c1)Cl CSC011203430 [0,1,0,0,0,1|2,0,0]=4 293 B12R1.50 NNC(=O)Cc1cccc(c1)F CSC000189928 [0,1,0,0,0,1|2,0,0]=4 294 B12R1.50 NNC(=O)Nc1cccc(c1)Cl CSC000752571 [0,1,0,0,0,1|2,0,0]=4 295 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C CSC000155763 [0,1,0,0,0,1|0,0,0]=2 296 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl CSC000154935 [0,1,0,0,0,1|1,0,0]=3 297 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F CSC000234079 [0,1,0,0,0,1|1,0,0]=3 298 B12R1.101 CC(=O)Nc1nc(cc(n1)C)C CSC000011661 [0,1,0,0,0,1|2,0,0]=4 299 B12R1.101 CC(=O)Oc1cc(cc(c1)C)C CSC000002434 [0,1,0,0,0,1|0,0,0]=2 300 B12R1.101 Cc1cc(cc(c1)NC(=O)N)C CSC000239040 [0,1,0,0,0,1|1,0,0]=3 301 B12R1.101 NC(=O)Nc1cc(cc(c1)Cl)Cl CSC000238990 [0,1,0,0,0,1|2,0,0]=4 302 B12R1.119 CS(=O)(=O)Cc1cccc(c1)Br CSC009814643 [0,1,0,0,0,1|2,0,0]=4 303 B12R1.119 CS(=O)(=O)Cc1cccc(c1)F CSC000047429 [0,1,0,0,0,1|2,0,0]=4 304 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Br CSC000165606 [0,1,0,0,0,1|2,0,0]=4 305 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Br CSC000165606 [0,1,0,0,0,1|2,0,0]=4 306 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Cl CSC000165652 [0,1,0,0,0,1|2,0,0]=4 307 B12R1.119 CS(=O)(=O)Nc1cccc(c1)F CSC000165654 [0,1,0,0,0,1|2,0,0]=4 308 B12R1.119 Cc1cccc(c1)NS(=O)(=O)C CSC000165610 [0,1,0,0,0,1|1,0,0]=3 309 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br CSC011252870 [0,1,0,0,0,1|1,0,0]=3 310 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl CSC012362533 [0,1,0,0,0,1|1,0,0]=3 311 B12R1.127 CC(=O)Nc1cc(ccc1C)Br CSC011344836 [0,1,0,0,0,1|1,0,0]=3 312 B12R1.127 CC(=O)Nc1cc(ccc1C)C CSC000152684 [0,1,0,0,0,1|0,0,0]=2 313 B12R1.127 CC(=O)Nc1cc(ccc1C)F CSC000155779 [0,1,0,0,0,1|1,0,0]=3 314 B12R1.127 CC(=O)Nc1cc(ccc1C)N CSC000740626 [0,1,0,0,0,1|1,0,0]=3 315 B12R1.127 CC(=O)Nc1cc(ccc1F)Br CSC011951791 [0,1,0,0,0,1|1,0,0]=3 316 B12R1.127 CC(=O)Nc1cc(ccc1F)F CSC000155522 [0,1,0,0,0,1|1,0,0]=3 317 B12R1.127 CC(=O)Nc1cc(ccc1O)Br CSC010005742 [0,1,0,0,0,1|1,0,0]=3 318 B12R1.127 CC(=O)Nc1cc(ccc1O)C CSC000035807 [0,1,0,0,0,1|0,0,0]=2 319 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl CSC000012038 [0,1,0,0,0,1|1,0,0]=3 320 B12R1.127 CC(=O)Oc1cc(ccc1C)C CSC000002421 [0,1,0,0,0,1|0,0,0]=2 321 B12R1.127 CC(C)Sc1cc(ccc1C)C CSC000006291 [0,1,0,0,0,1|1,0,1]=4 322 B12R1.127 Cc1ccc(c(c1)CC(=O)N)C CSC011694954 [0,1,0,0,0,1|1,0,0]=3 323 B12R1.127 Cc1ccc(cc1NC(=O)N)Cl CSC000238962 [0,1,0,0,0,1|2,0,0]=4 324 B12R1.127 NC(=O)Nc1cc(ccc1Cl)Cl CSC011208874 [0,1,0,0,0,1|2,0,0]=4 325 B12R1.127 NC(=O)Nc1cc(ccc1F)F CSC011208891 [0,1,0,0,0,1|2,0,0]=4 326 B12R1.224 CC(=O)Nc1cccc(c1C)Br CSC011775766 [0,1,0,0,0,1|1,0,0]=3 327 B12R1.224 CC(=O)Nc1cccc(c1C)C CSC000153689 [0,1,0,0,0,1|0,0,0]=2 328 B12R1.224 CC(=O)Nc1cccc(c1C)N CSC000736503 [0,1,0,0,0,1|1,0,0]=3 329 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl CSC000155691 [0,1,0,0,0,1|1,0,0]=3 330 B12R1.224 CC(=O)Nc1cccc(c1F)Cl CSC000152519 [0,1,0,0,0,1|1,0,0]=3 331 B12R1.224 CC(=O)Nc1cccc(c1O)Cl CSC000117800 [0,1,0,0,0,1|1,0,0]=3 332 B12R1.224 Cc1c(cccc1NC(=O)N)Cl CSC000238989 [0,1,0,0,0,1|2,0,0]=4 333 B12R1.224 NC(=O)Nc1cccc(c1Cl)Cl CSC011238596 [0,1,0,0,0,1|2,0,0]=4 334 B12R1.438 CC(=O)Nc1cccc(c1)C#N CSC000152054 [0,1,0,0,0,1|0,0,1]=3 335 B12R1.438 CC(=O)Oc1cccc(c1)C#N CSC000001303 [0,1,0,0,0,1|0,0,1]=3 336 B12R1.438 CCc1cccc(c1)NC(=O)N CSC000239041 [0,1,0,0,0,1|1,0,0]=3 337 B12R1.438 COc1cccc(c1)CC(=O)N CSC000162345 [0,1,0,0,0,1|1,0,0]=3 338 B12R1.438 COc1cccc(c1)NC(=O)N CSC000238924 [0,1,0,0,0,1|1,0,0]=3 339 B12R1.438 COc1cccc(c1)OC(=O)C CSC000001337 [0,1,0,0,0,1|0,0,0]=2 340 B12R1.438 CSc1cccc(c1)NC(=O)C CSC000153993 [0,1,0,0,0,1|0,0,0]=2 341 B12R1.438 CSc1cccc(c1)NC(=O)N CSC000238926 [0,1,0,0,0,1|1,0,0]=3 342 B12R1.23 CS(=O)(=O)c1ccc(c(c1)Cl)Cl CSC000010133 [0,2,0,0,0,0|2,0,0]=4 343 B12R1.23 CS(=O)(=O)c1ccc(c(c1)Cl)F CSC000048130 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.23 Cc1ccc(cc1C)S(=O)(=O)C CSC000048137 [0,2,0,0,0,0|1,0,0]=3 345 B12R1.48 COc1ccc(cc1Br)C(=O)N CSC000206422 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.48 COc1ccc(cc1C)C(=O)C CSC000693588 [0,2,0,0,0,0|0,0,0]=2 347 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] CSC000068493 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.48 COc1ccc(cc1I)C(=O)N CSC010363828 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] CSC011708256 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] CSC011218782 [0,2,0,0,0,0|2,0,0]=4 351 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] CSC000038251 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] CSC011217944 [0,2,0,0,0,0|2,0,0]=4 353 B12R1.232 NC(=O)c1cc(c(cc1Cl)Cl)F CSC000223270 [0,2,0,0,0,0|2,0,0]=4 354 B12R1.232 NC(=O)c1cc(c(cc1F)F)F CSC000036233 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F CSC012359898 [0,2,0,0,0,0|1,0,0]=3 356 B12R1.367 CNC(=O)c1ccc(c(c1)C)C CSC000159929 [0,2,0,0,0,0|0,0,0]=2 357 B12R1.367 CNC(=O)c1ccc(c(c1)C)N CSC000739472 [0,2,0,0,0,0|0,0,0]=2 358 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl CSC000159832 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.367 CNC(=O)c1ccc(c(c1)F)F CSC000194207 [0,2,0,0,0,0|1,0,0]=3 360 B12R1.367 CNC(=O)c1ccc(c(c1)N)C CSC000737617 [0,2,0,0,0,0|1,0,0]=3 361 B12R1.367 COC(=O)c1ccc(=O)n(c1)C CSC000054066 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.367 COC(=O)c1ccc(=O)n(n1)C CSC011315517 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.367 COC(=O)c1ccc(c(c1)Br)Cl CSC012356255 [0,2,0,0,0,0|1,0,0]=3 364 B12R1.367 COC(=O)c1ccc(c(c1)Br)F CSC000722584 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CSC011294788 [0,2,0,0,0,0|1,0,0]=3 366 B12R1.367 COC(=O)c1ccc(c(c1)C)Br CSC011215878 [0,2,0,0,0,0|0,0,0]=2 367 B12R1.367 COC(=O)c1ccc(c(c1)C)C CSC000149473 [0,2,0,0,0,0|0,0,0]=2 368 B12R1.367 COC(=O)c1ccc(c(c1)C)Cl CSC011217186 [0,2,0,0,0,0|0,0,0]=2 369 B12R1.367 COC(=O)c1ccc(c(c1)C)F CSC000698631 [0,2,0,0,0,0|0,0,0]=2 370 B12R1.367 COC(=O)c1ccc(c(c1)C)O CSC011997373 [0,2,0,0,0,0|0,0,0]=2 371 B12R1.367 COC(=O)c1ccc(c(c1)Cl)Br CSC012359697 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.367 COC(=O)c1ccc(c(c1)Cl)C CSC011219533 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.367 COC(=O)c1ccc(c(c1)Cl)F CSC011997363 [0,2,0,0,0,0|1,0,0]=3 374 B12R1.367 COC(=O)c1ccc(c(c1)Cl)I CSC012356344 [0,2,0,0,0,0|1,0,0]=3 375 B12R1.367 COC(=O)c1ccc(c(c1)Cl)N CSC000704683 [0,2,0,0,0,0|1,0,0]=3 376 B12R1.367 COC(=O)c1ccc(c(c1)F)Br CSC000703229 [0,2,0,0,0,0|1,0,0]=3 377 B12R1.367 COC(=O)c1ccc(c(c1)F)C CSC000216653 [0,2,0,0,0,0|1,0,0]=3 378 B12R1.367 COC(=O)c1ccc(c(c1)F)Cl CSC011216032 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.367 COC(=O)c1ccc(c(c1)F)F CSC000194019 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.367 COC(=O)c1ccc(c(c1)F)I CSC000062896 [0,2,0,0,0,0|1,0,0]=3 381 B12R1.367 COC(=O)c1ccc(c(c1)I)C CSC011218856 [0,2,0,0,0,0|1,0,0]=3 382 B12R1.367 COC(=O)c1ccc(c(c1)I)Cl CSC011294800 [0,2,0,0,0,0|1,0,0]=3 383 B12R1.367 COC(=O)c1ccc(c(c1)I)F CSC012361652 [0,2,0,0,0,0|1,0,0]=3 384 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CSC011450966 [0,2,0,0,0,0|1,0,0]=3 385 B12R1.367 COC(=O)c1ccc(c(c1)N)I CSC011290891 [0,2,0,0,0,0|1,0,0]=3 386 B12R1.367 COC(=O)c1ccc(c(c1)O)Br CSC011934688 [0,2,0,0,0,0|1,0,0]=3 387 B12R1.367 COC(=O)c1ccc(c(c1)O)C CSC000736511 [0,2,0,0,0,0|1,0,0]=3 388 B12R1.367 COC(=O)c1ccn(c(=O)c1)C CSC011315524 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.367 Cc1ccc(cc1Br)C(=O)NN CSC000188075 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.367 Cc1ccc(cc1C)C(=O)NN CSC000189846 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.367 Cc1ccc(cc1Cl)C(=O)NN CSC011823865 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.367 NNC(=O)c1ccc(c(c1)Br)Cl CSC011219835 [0,2,0,0,0,0|2,0,0]=4 393 B12R1.367 NNC(=O)c1ccc(c(c1)Cl)Br CSC011217245 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.367 NNC(=O)c1ccc(c(c1)Cl)Cl CSC000187931 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.367 NNC(=O)c1ccc(c(c1)F)F CSC000194116 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.893 NC(=O)c1ccc(c(c1F)Cl)F CSC000081360 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.893 NC(=O)c1ccc(c(c1F)F)F CSC011216183 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.1005 Cc1cc(cc(c1F)C)C(=O)N CSC000084231 [0,2,0,0,0,0|1,0,0]=3 399 B12R1.1005 NC(=O)c1cc(c(c(c1)Br)O)Br CSC009813171 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.1005 NC(=O)c1cc(c(c(c1)F)F)F CSC011219797 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.10 CCS(=O)(=O)c1cccc(c1)Br CSC009815775 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br CSC000165148 [0,2,0,0,0,0|2,0,0]=4 403 B12R1.17 CCNC(=O)c1cc(ccn1)Cl CSC000194128 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.17 CCNC(=O)c1cccc(c1)Br CSC000155180 [0,2,0,0,0,0|1,0,0]=3 405 B12R1.17 CCNC(=O)c1cccc(c1)C CSC000160206 [0,2,0,0,0,0|0,0,0]=2 406 B12R1.17 CCNC(=O)c1cccc(c1)Cl CSC000160110 [0,2,0,0,0,0|1,0,0]=3 407 B12R1.17 CCNC(=O)c1cccc(c1)F CSC000160200 [0,2,0,0,0,0|1,0,0]=3 408 B12R1.17 CCNC(=O)c1cccc(c1)I CSC000155182 [0,2,0,0,0,0|1,0,0]=3 409 B12R1.17 CCNC(=O)c1cccc(c1)N CSC000181407 [0,2,0,0,0,0|1,0,0]=3 410 B12R1.17 CCOC(=O)c1cccc(c1)Br CSC000170152 [0,2,0,0,0,0|1,0,0]=3 411 B12R1.17 CCOC(=O)c1cccc(c1)C CSC000170498 [0,2,0,0,0,0|0,0,0]=2 412 B12R1.17 CCOC(=O)c1cccc(c1)Cl CSC000170058 [0,2,0,0,0,0|1,0,0]=3 413 B12R1.17 CCOC(=O)c1cccc(c1)F CSC000170323 [0,2,0,0,0,0|1,0,0]=3 414 B12R1.17 CCOC(=O)c1cccc(c1)I CSC000170211 [0,2,0,0,0,0|1,0,0]=3 415 B12R1.17 CCOC(=O)c1cccc(c1)O CSC000169910 [0,2,0,0,0,0|1,0,0]=3 416 B12R1.17 CCOC(=O)c1ccnc(c1)C CSC011935281 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.17 CCOC(=O)c1cncc(c1)Br CSC000170250 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.17 CCOC(=O)c1cncc(c1)F CSC012017147 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.17 CCOC(=O)c1cncc(c1)O CSC000185702 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.24 COC(=O)c1cccc(=O)n1C CSC000730068 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.24 COC(=O)c1cccc(c1Br)C CSC012339457 [0,2,0,0,0,0|0,0,0]=2 422 B12R1.24 COC(=O)c1cccc(c1Br)F CSC012357630 [0,2,0,0,0,0|1,0,0]=3 423 B12R1.24 COC(=O)c1cccc(c1C)Br CSC012298220 [0,2,0,0,0,0|1,0,0]=3 424 B12R1.24 COC(=O)c1cccc(c1C)C CSC000149159 [0,2,0,0,0,0|0,0,0]=2 425 B12R1.24 COC(=O)c1cccc(c1C)I CSC010168159 [0,2,0,0,0,0|1,0,0]=3 426 B12R1.24 COC(=O)c1cccc(c1C)O CSC011999632 [0,2,0,0,0,0|1,0,0]=3 427 B12R1.24 COC(=O)c1cccc(c1Cl)Br CSC012349815 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.24 COC(=O)c1cccc(c1Cl)C CSC012002529 [0,2,0,0,0,0|0,0,0]=2 429 B12R1.24 COC(=O)c1cccc(c1Cl)Cl CSC000148926 [0,2,0,0,0,0|1,0,0]=3 430 B12R1.24 COC(=O)c1cccc(c1F)Br CSC012355674 [0,2,0,0,0,0|1,0,0]=3 431 B12R1.24 COC(=O)c1cccc(c1F)C CSC012001762 [0,2,0,0,0,0|0,0,0]=2 432 B12R1.24 COC(=O)c1cccc(c1F)Cl CSC011997369 [0,2,0,0,0,0|1,0,0]=3 433 B12R1.24 COC(=O)c1cccc(c1F)F CSC011220063 [0,2,0,0,0,0|1,0,0]=3 434 B12R1.24 COC(=O)c1cccc(c1I)C CSC011294812 [0,2,0,0,0,0|0,0,0]=2 435 B12R1.24 COC(=O)c1cccc(c1I)F CSC010151095 [0,2,0,0,0,0|1,0,0]=3 436 B12R1.24 COC(=O)c1cccc(c1N)Br CSC011356556 [0,2,0,0,0,0|1,0,0]=3 437 B12R1.24 COC(=O)c1cccc(c1N)Cl CSC011356568 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.24 COC(=O)c1cccc(c1N)F CSC000707970 [0,2,0,0,0,0|1,0,0]=3 439 B12R1.24 COC(=O)c1cccc(c1N)I CSC000055437 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.24 COC(=O)c1cccc(c1O)Br CSC009816214 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.24 COC(=O)c1cccc(c1O)C CSC000149854 [0,2,0,0,0,0|0,0,0]=2 442 B12R1.24 COC(=O)c1ccnc(c1F)F CSC012662669 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.24 Cc1cccc(c1C)C(=O)NN CSC000189804 [0,2,0,0,0,0|1,0,0]=3 444 B12R1.24 Cc1cccc(c1O)C(=O)NN CSC000193353 [0,2,0,0,0,0|1,0,0]=3 445 B12R1.24 NNC(=O)c1cccc(c1Cl)Cl CSC000189813 [0,2,0,0,0,0|2,0,0]=4 446 B12R1.354 CNC(=O)c1cc(ccc1C)C CSC000159876 [0,2,0,0,0,0|0,0,0]=2 447 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br CSC000155089 [0,2,0,0,0,0|1,0,0]=3 448 B12R1.354 CNC(=O)c1cc(ccc1F)F CSC000194209 [0,2,0,0,0,0|1,0,0]=3 449 B12R1.354 CNC(=O)c1cc(ccc1I)Cl CSC011279454 [0,2,0,0,0,0|1,0,0]=3 450 B12R1.354 COC(=O)c1cc(ccc1Br)Br CSC011218029 [0,2,0,0,0,0|1,0,0]=3 451 B12R1.354 COC(=O)c1cc(ccc1Br)C CSC012339458 [0,2,0,0,0,0|0,0,0]=2 452 B12R1.354 COC(=O)c1cc(ccc1Br)Cl CSC011228367 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.354 COC(=O)c1cc(ccc1Br)F CSC000205820 [0,2,0,0,0,0|1,0,0]=3 454 B12R1.354 COC(=O)c1cc(ccc1Br)I CSC012340073 [0,2,0,0,0,0|1,0,0]=3 455 B12R1.354 COC(=O)c1cc(ccc1C)Br CSC000703529 [0,2,0,0,0,0|1,0,0]=3 456 B12R1.354 COC(=O)c1cc(ccc1C)C CSC000148939 [0,2,0,0,0,0|0,0,0]=2 457 B12R1.354 COC(=O)c1cc(ccc1C)Cl CSC012000380 [0,2,0,0,0,0|1,0,0]=3 458 B12R1.354 COC(=O)c1cc(ccc1C)I CSC012360116 [0,2,0,0,0,0|1,0,0]=3 459 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CSC000149116 [0,2,0,0,0,0|1,0,0]=3 460 B12R1.354 COC(=O)c1cc(ccc1Cl)Cl CSC000148927 [0,2,0,0,0,0|1,0,0]=3 461 B12R1.354 COC(=O)c1cc(ccc1Cl)F CSC011997379 [0,2,0,0,0,0|1,0,0]=3 462 B12R1.354 COC(=O)c1cc(ccc1Cl)I CSC012353682 [0,2,0,0,0,0|1,0,0]=3 463 B12R1.354 COC(=O)c1cc(ccc1Cl)O CSC012001761 [0,2,0,0,0,0|1,0,0]=3 464 B12R1.354 COC(=O)c1cc(ccc1F)C CSC000703722 [0,2,0,0,0,0|0,0,0]=2 465 B12R1.354 COC(=O)c1cc(ccc1F)F CSC000194029 [0,2,0,0,0,0|1,0,0]=3 466 B12R1.354 COC(=O)c1cc(ccc1F)I CSC012350775 [0,2,0,0,0,0|1,0,0]=3 467 B12R1.354 COC(=O)c1cc(ccc1I)Br CSC000148213 [0,2,0,0,0,0|1,0,0]=3 468 B12R1.354 COC(=O)c1cc(ccc1I)F CSC000058944 [0,2,0,0,0,0|1,0,0]=3 469 B12R1.354 COC(=O)c1cc(ccc1N)C CSC000216452 [0,2,0,0,0,0|0,0,0]=2 470 B12R1.354 COC(=O)c1cc(ccc1N)Cl CSC000172362 [0,2,0,0,0,0|1,0,0]=3 471 B12R1.354 COC(=O)c1cc(ccc1N)F CSC000173281 [0,2,0,0,0,0|1,0,0]=3 472 B12R1.354 COC(=O)c1cc(ccc1O)C CSC000216618 [0,2,0,0,0,0|0,0,0]=2 473 B12R1.354 COC(=O)c1cc(ccc1O)F CSC011219540 [0,2,0,0,0,0|1,0,0]=3 474 B12R1.354 COC(=O)c1cc(ccc1O)I CSC000149868 [0,2,0,0,0,0|1,0,0]=3 475 B12R1.354 COC(=O)c1cc(ccc1O)O CSC011203519 [0,2,0,0,0,0|1,0,0]=3 476 B12R1.354 COC(=O)c1cc(cnc1F)Br CSC010243567 [0,2,0,0,0,0|2,0,0]=4 477 B12R1.354 Cc1ccc(c(c1)C(=O)NN)C CSC000189821 [0,2,0,0,0,0|1,0,0]=3 478 B12R1.354 Cc1ccc(c(c1)C(=O)NN)O CSC000193374 [0,2,0,0,0,0|1,0,0]=3 479 B12R1.354 NNC(=O)c1cc(ccc1Br)F CSC000205862 [0,2,0,0,0,0|2,0,0]=4 480 B12R1.354 NNC(=O)c1cc(ccc1Cl)Br CSC000189792 [0,2,0,0,0,0|2,0,0]=4 481 B12R1.354 NNC(=O)c1cc(ccc1F)F CSC000194117 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.354 NNC(=O)c1cc(ccc1O)Br CSC000193350 [0,2,0,0,0,0|2,0,0]=4 483 B12R1.358 CNC(=O)c1cc(cc(c1)Cl)Cl CSC000159869 [0,2,0,0,0,0|1,0,0]=3 484 B12R1.358 CNC(=O)c1cc(cc(c1)F)F CSC000159711 [0,2,0,0,0,0|1,0,0]=3 485 B12R1.358 COC(=O)c1cc(cc(c1)Br)Br CSC011216377 [0,2,0,0,0,0|1,0,0]=3 486 B12R1.358 COC(=O)c1cc(cc(c1)Br)C CSC012359405 [0,2,0,0,0,0|0,0,0]=2 487 B12R1.358 COC(=O)c1cc(cc(c1)Br)Cl CSC012353713 [0,2,0,0,0,0|1,0,0]=3 488 B12R1.358 COC(=O)c1cc(cc(c1)Br)N CSC011794265 [0,2,0,0,0,0|1,0,0]=3 489 B12R1.358 COC(=O)c1cc(cc(c1)Br)O CSC000696291 [0,2,0,0,0,0|1,0,0]=3 490 B12R1.358 COC(=O)c1cc(cc(c1)Cl)F CSC011997378 [0,2,0,0,0,0|1,0,0]=3 491 B12R1.358 COC(=O)c1cc(cc(c1)F)F CSC000151266 [0,2,0,0,0,0|1,0,0]=3 492 B12R1.358 COC(=O)c1cc(cc(c1)I)N CSC000693439 [0,2,0,0,0,0|1,0,0]=3 493 B12R1.358 COC(=O)c1cc(cc(c1)O)O CSC000211728 [0,2,0,0,0,0|1,0,0]=3 494 B12R1.358 COC(=O)c1cc(nc(c1)O)C CSC015345939 [0,2,0,0,0,0|1,0,0]=3 495 B12R1.358 Cc1cc(cc(c1)C(=O)NN)C CSC000189822 [0,2,0,0,0,0|1,0,0]=3 496 B12R1.358 NNC(=O)c1cc(cc(c1)Cl)Cl CSC000189815 [0,2,0,0,0,0|2,0,0]=4 497 B12R1.358 NNC(=O)c1cc(cc(c1)F)F CSC000189945 [0,2,0,0,0,0|2,0,0]=4 498 B12R1.435 CCc1cccc(n1)C(=O)OC CSC009857250 [0,2,0,0,0,0|1,0,0]=3 499 B12R1.435 CNC(=O)c1cccc(c1)OC CSC000159855 [0,2,0,0,0,0|0,0,0]=2 500 B12R1.435 COC(=O)c1cc(ccn1)OC CSC000066548 [0,2,0,0,0,0|1,0,0]=3 501 B12R1.435 COC(=O)c1cccc(c1)C#N CSC000151112 [0,2,0,0,0,0|0,0,1]=3 502 B12R1.435 COC(=O)c1cccc(c1)OC CSC000148714 [0,2,0,0,0,0|0,0,0]=2 503 B12R1.435 COC(=O)c1cccc(c1)SC CSC009884918 [0,2,0,0,0,0|0,0,0]=2 504 B12R1.435 COC(=O)c1cccc(n1)C#N CSC000085285 [0,2,0,0,0,0|1,0,1]=4 505 B12R1.435 COC(=O)c1cncc(n1)OC CSC011996600 [0,2,0,0,0,0|2,0,0]=4 506 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])F CSC000687468 [0,2,0,0,0,0|2,0,0]=4 507 B12R1.511 NC(=O)c1cc(cc(c1I)I)I CSC000162362 [0,2,0,0,0,0|2,0,0]=4 508 B12R1.128 CS(=O)(=O)c1cc(ccc1Cl)Cl CSC000036291 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.128 CS(=O)(=O)c1cc(ccc1F)F CSC000041713 [0,2,0,0,0,0|2,0,0]=4 510 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)C)C CSC000048138 [0,2,0,0,0,0|1,0,0]=3 511 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)N)F CSC000730503 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.228 Cc1cccc(c1Br)S(=O)(=O)N CSC012348303 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.436 COc1cccc(c1)S(=O)(=O)C CSC000048133 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] CSC000032247 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.894 Cc1ccc(c(c1F)C(=O)N)F CSC011216796 [0,2,0,0,0,0|1,0,0]=3 516 B12R1.894 NC(=O)c1c(ccc(c1F)F)F CSC000035597 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.894 NC(=O)c1c(ccc(c1F)O)F CSC009825046 [0,2,0,0,0,0|2,0,0]=4 518 B12R1.46 CNc1ccc(cc1C(=O)N)Cl CSC011619361 [0,2,0,0,0,0|2,0,0]=4 519 B12R1.46 COc1ccc(cc1C(=O)C)Br CSC000173343 [0,2,0,0,0,0|1,0,0]=3 520 B12R1.46 COc1ccc(cc1C(=O)N)Br CSC000215694 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.46 COc1ccc(cc1C(=O)N)Cl CSC000162310 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C CSC000016935 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.453 COc1ccc(c(c1)C(=O)N)Br CSC000162014 [0,2,0,0,0,0|1,0,0]=3 524 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])C CSC000042805 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Cl CSC000181342 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.258 CN(C)c1cccc(c1)C(=O)N CSC000162253 [0,2,0,0,0,0|1,0,0]=3 527 B12R1.258 NC(=O)c1cccc(c1)[N+](=O)[O-] CSC000162157 [0,2,0,0,0,0|2,0,0]=4 528 B12R1.279 CCNc1cccc(c1)[N+](=O)[O-] CSC011211226 [0,2,0,0,0,0|2,0,0]=4 529 B12R1.279 CCOc1cccc(c1)C(=O)N CSC000027222 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.279 CCOc1cccc(c1)C(C)O CSC011305084 [0,2,0,0,0,0|0,0,2]=4 531 B12R1.279 CCOc1cccc(c1)[N+](=O)[O-] CSC000006681 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.279 CSCc1cccc(c1)[N+](=O)[O-] CSC016203871 [0,2,0,0,0,0|2,0,0]=4 533 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [1,0,0,0,0,1|1,0,0]=3 534 B12R1.226 CC(=O)NCc1cccc(c1)C CSC011222369 [0,0,0,0,0,2|0,0,0]=2 535 B12R1.226 NC(=O)COc1cccc(c1)Cl CSC000150646 [0,0,0,0,0,2|2,0,0]=4 536 B12R1.226 NC(=O)NCc1cccc(c1)Cl CSC000238944 [0,0,0,0,0,2|2,0,0]=4