0 B11R1.37 CCc1c(nc(cn1)C)CC TS09937 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.37 COc1c(cc(cn1)Br)CN TS89747 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.37 COc1c(cc(cn1)Br)CO TS87797 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.37 COc1c(cc(cn1)F)CO TS03311 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.37 COc1cc(cnc1OC)Br TS49352 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.37 Cc1ccc(c(c1)OC)OC TS41132 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.37 Cc1cnc(c(n1)C#N)C#N TS40159 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.20 CCc1c(nccn1)CC TS37039 [1,0,0,0,0,0|0,0,0]=1 8 B10R1.20 CCc1c(nccn1)OC TS06275 [1,0,0,0,0,0|1,0,0]=2 9 B10R1.20 CCc1c(nccn1)SC TS41416 [1,0,0,0,0,0|1,0,0]=2 10 B10R1.20 CCc1ccccc1CC TS36854 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.20 CCc1ccccc1OC TS06091 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.20 CCc1ccncc1CC TS36953 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.20 CNc1c(cccn1)CO TS00522 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.20 COc1c(cccn1)CN TS85674 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.20 COc1c(cccn1)CN TS86802 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.20 COc1c(cccn1)CO TS88118 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.20 COc1c(nncn1)CN TS92875 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.20 COc1cccnc1CN TS06271 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.20 COc1cccnc1CO TS08026 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.20 COc1cccnc1OC TS16354 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.20 CSc1c(cccn1)CCl TS50635 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.20 c1cc(c(nc1)CO)CO TS06365 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.25 CCc1c(cc(cn1)Br)N TS85926 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.25 CCc1c(nc(cn1)C)C TS37031 [1,0,0,0,0,0|0,0,0]=1 25 B10R1.25 CCc1ccc([nH]c1=O)C TS37106 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.25 CCc1ccc(cc1C)C TS36871 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.25 CCc1ccc(nc1N)C TS06103 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.25 Cc1c(ccc(n1)F)CO TS06581 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.25 Cc1c(ccc(n1)N)CN TS06202 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.25 Cc1c(ccc(n1)N)OC TS37202 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.25 Cc1cc(cnc1OC)Br TS85280 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.25 Cc1cc(cnc1OC)F TS39347 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.25 Cc1ccc(c(c1)C)CBr TS54162 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.25 Cc1ccc(c(c1)C)CCl TS41471 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.25 Cc1ccc(c(c1)C)CN TS06003 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.25 Cc1ccc(c(c1)C)CO TS37015 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.25 Cc1ccc(c(c1)C)OC TS06090 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.25 Cc1ccc(c(n1)Br)OC TS19318 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.25 Cc1ccc(c(n1)C)C=O TS00707 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.25 Cc1ccc(c(n1)C)CO TS06194 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.25 Cc1cnc(c(n1)C)SC TS41413 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.30 CCc1c(ccc(n1)C)O TS55310 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.30 CCc1cc(ccc1C)C TS05930 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.30 COc1c(ncc(n1)Br)N TS16991 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.30 Cc1c(cc(cn1)Br)OC TS19314 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.30 Cc1ccc(c(c1)CBr)C TS18767 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.30 Cc1ccc(c(c1)CCl)C TS41473 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.30 Cc1ccc(c(c1)CN)C TS36943 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.30 Cc1ccc(c(c1)CO)C TS06089 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.30 Cc1ccc(c(c1)OC)C TS37019 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.30 Cc1ccc(c(n1)CO)O TS06364 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.30 Cc1ccc(c(n1)OC)Br TS19322 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.30 Cc1ccc(c(n1)OC)F TS06578 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.30 Cc1ccc(c(n1)OC)N TS37184 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.30 Cc1ccc(c(n1)OC)N TS85455 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.57 Cc1ccc(c(c1)OC)C(C)C TS42786 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.78 CCc1ccc(c(c1)CC)CC TS42509 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.112 CCc1cc(ccc1NCC)Br TS52602 [0,1,0,0,0,0|3,0,0]=4 59 B12R2.24 Cc1ccc2c(c1)CCCC2 TS07265 [0,0,0,1,0,0|2,0,0]=3 60 B12R2.24 Cc1ccc2c(c1)CCCN2 TS46763 [0,0,0,1,0,0|3,0,0]=4 61 B12R2.24 Cc1ccc2c(c1)CCNC2 TS85130 [0,0,0,1,0,0|3,0,0]=4 62 B12R2.24 Cc1ccc2c(c1)CNCC2 TS15211 [0,0,0,1,0,0|3,0,0]=4 63 B12R2.24 Cc1ccc2c(c1)CNCC2 TS55689 [0,0,0,1,0,0|3,0,0]=4 64 B12R2.24 Cc1ccc2c(c1)NCCC2 TS15213 [0,0,0,1,0,0|3,0,0]=4 65 B12R2.24 Cc1ccc2c(n1)CCCC2 TS07372 [0,0,0,1,0,0|1,0,0]=2 66 B12R2.24 Cc1ccc2c(n1)NCCC2 TS40680 [0,0,0,1,0,0|2,0,0]=3 67 B12R2.24 Cc1ccc2c(n1)NCCO2 TS40874 [0,0,0,1,0,0|3,0,0]=4 68 B12R2.24 c1c(cnc2c1CCNC2)Br TS86787 [0,0,0,1,0,0|3,0,0]=4 69 B12R2.24 c1c(cnc2c1CNCC2)Br TS21456 [0,0,0,1,0,0|3,0,0]=4 70 B12R2.24 c1c(cnc2c1CNCC2)N TS94339 [0,0,0,1,0,0|3,0,0]=4 71 B12R2.24 c1c(cnc2c1CNCC2)O TS40878 [0,0,0,1,0,0|3,0,0]=4 72 B12R2.24 c1cc(nc2c1CNCC2)Cl TS00905 [0,0,0,1,0,0|3,0,0]=4 73 B12R2.24 c1cc2c(cc1N)CCCC2 TS40565 [0,0,0,1,0,0|3,0,0]=4 74 B12R2.24 c1cc2c(cc1O)CCCC2 TS16959 [0,0,0,1,0,0|3,0,0]=4 75 B12R2.24 c1cc2c(cc1O)CCCC2 TS94705 [0,0,0,1,0,0|3,0,0]=4 76 B12R2.132 c1cc(nc2c1CCC2O)Cl TS32913 [0,0,0,1,0,0|3,0,0]=4 77 B10R1.257 CCc1n[nH]c(=O)n1CC TS37494 [0,0,0,0,1,0|3,0,0]=4 78 B9R1.15 CCc1c(nccn1)C TS04922 [2,0,0,0,0,0|0,0,0]=2 79 B9R1.15 CCc1ccccc1C TS16337 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.15 CCc1cccnc1C TS32475 [2,0,0,0,0,0|1,0,0]=3 81 B9R1.15 COc1c(nccn1)Cl TS55197 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.15 COc1c(nccn1)N TS47372 [2,0,0,0,0,0|2,0,0]=4 83 B9R1.15 Cc1c(cccn1)CBr TS87803 [2,0,0,0,0,0|2,0,0]=4 84 B9R1.15 Cc1c(cccn1)CCl TS90028 [2,0,0,0,0,0|2,0,0]=4 85 B9R1.15 Cc1c(cccn1)CN TS32520 [2,0,0,0,0,0|2,0,0]=4 86 B9R1.15 Cc1c(cccn1)CO TS04969 [2,0,0,0,0,0|2,0,0]=4 87 B9R1.15 Cc1c(cccn1)OC TS04964 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.15 Cc1c(nccn1)C=O TS86293 [2,0,0,0,0,0|1,0,1]=4 89 B9R1.15 Cc1c(nccn1)CCl TS88673 [2,0,0,0,0,0|1,0,0]=3 90 B9R1.15 Cc1c(nccn1)CN TS92714 [2,0,0,0,0,0|1,0,0]=3 91 B9R1.15 Cc1c(nccn1)CO TS88558 [2,0,0,0,0,0|1,0,0]=3 92 B9R1.15 Cc1c(nccn1)OC TS55427 [2,0,0,0,0,0|1,0,0]=3 93 B9R1.15 Cc1c(nccn1)SC TS37401 [2,0,0,0,0,0|1,0,0]=3 94 B9R1.15 Cc1cccnc1CCl TS91176 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.15 Cc1cccnc1CN TS32513 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.15 Cc1cccnc1CO TS04977 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.15 Cc1cccnc1OC TS04965 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.15 c1cnc(c(n1)CCl)Cl TS88674 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.15 c1cnc(c(n1)CN)Cl TS49175 [2,0,0,0,0,0|2,0,0]=4 100 B9R1.15 c1cnc(c(n1)CN)Cl TS86197 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.15 c1cnc(c(n1)CO)Cl TS64972 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.1 CCc1ccc(nc1)C TS32477 [2,0,0,0,0,0|1,0,0]=3 103 B9R1.1 CCc1ccc(nc1)O TS04959 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.1 COc1cnc(cn1)Br TS08353 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.1 COc1cnc(cn1)Cl TS40268 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.1 COc1cnc(cn1)N TS47439 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.1 Cc1ccc(cn1)CN TS88042 [2,0,0,0,0,0|2,0,0]=4 108 B9R1.1 Cc1ccc(cn1)OC TS04979 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.1 Cc1ccc(nc1)CN TS08057 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.1 Cc1cnc(cn1)C#N TS01162 [2,0,0,0,0,0|1,0,1]=4 111 B9R1.1 Cc1cnc(cn1)C=C TS04818 [2,0,0,0,0,0|0,0,2]=4 112 B9R1.1 Cc1cnc(cn1)C=O TS88939 [2,0,0,0,0,0|1,0,1]=4 113 B9R1.1 Cc1cnc(cn1)CCl TS85706 [2,0,0,0,0,0|1,0,0]=3 114 B9R1.1 Cc1cnc(cn1)CN TS08244 [2,0,0,0,0,0|1,0,0]=3 115 B9R1.1 c1c(ncc(n1)Cl)CO TS88145 [2,0,0,0,0,0|2,0,0]=4 116 B9R1.69 Cc1c(nc(cn1)N)Br TS50644 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.69 Cc1c(nnc(n1)N)C TS05027 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.69 Cc1cc(c(nc1)C)Br TS48831 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.69 Cc1cc(c(nc1)C)C TS04868 [2,0,0,0,0,0|1,0,0]=3 120 B9R1.69 Cc1ccc(c(c1)C)C TS04828 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.69 Cc1ccc(c(n1)C)Br TS60331 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.69 Cc1ccc(c(n1)C)N TS39700 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.69 Cc1ccc(c(n1)C)O TS47319 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.69 Cc1ccc(nc1C)C TS04872 [2,0,0,0,0,0|1,0,0]=3 125 B9R1.69 Cc1ccc(nc1C)C TS26913 [2,0,0,0,0,0|1,0,0]=3 126 B9R1.69 Cc1ccc(nc1C)N TS04919 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.69 Cc1ccc(nc1N)C TS02606 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.69 Cc1cnc(c(n1)Br)N TS08280 [2,0,0,0,0,0|2,0,0]=4 129 B9R1.69 Cc1cnc(c(n1)C)C TS04917 [2,0,0,0,0,0|0,0,0]=2 130 B9R1.69 Cc1cnc(c(n1)C)N TS08856 [2,0,0,0,0,0|1,0,0]=3 131 B9R1.69 Cc1cnc(c(n1)Cl)C TS06805 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.2 CCc1cc(cnc1)Br TS91617 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.2 CCc1cccc(c1)C TS04835 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.2 CCc1cccc(n1)C TS32466 [2,0,0,0,0,0|1,0,0]=3 135 B9R1.2 CCc1cccc(n1)N TS60098 [2,0,0,0,0,0|2,0,0]=4 136 B9R1.2 COc1cncc(n1)Cl TS90325 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.2 Cc1cc(cnc1)CCl TS46377 [2,0,0,0,0,0|2,0,0]=4 138 B9R1.2 Cc1cc(cnc1)CO TS04972 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.2 Cc1cc(cnc1)OC TS04960 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.2 Cc1cccc(n1)CBr TS30360 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.2 Cc1cccc(n1)CBr TS48832 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.2 Cc1cccc(n1)CCl TS46378 [2,0,0,0,0,0|2,0,0]=4 143 B9R1.2 Cc1cccc(n1)CN TS01962 [2,0,0,0,0,0|2,0,0]=4 144 B9R1.2 Cc1cccc(n1)CO TS04961 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.2 Cc1cccc(n1)OC TS00087 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.2 c1c(nc(cn1)Cl)CN TS87934 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.2 c1c(nc(cn1)Cl)CO TS85795 [2,0,0,0,0,0|2,0,0]=4 148 B11R1.41 CCCc1c(nccn1)OC TS41162 [1,1,0,0,0,0|1,0,0]=3 149 B11R1.41 CCc1c(nccn1)OCC TS41156 [1,1,0,0,0,0|0,0,0]=2 150 B11R1.53 CC(C)c1c(nccn1)SC TS44909 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.53 CCc1c(nccn1)C(=O)C TS09880 [1,1,0,0,0,0|0,0,1]=3 152 B11R1.81 CCOc1ccc(nc1C)N TS03291 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.81 Cc1ccc(c(c1)C)CCN TS07611 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.81 Cc1ccc(c(c1)C)CCO TS40908 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.166 Cc1ccc(c(c1)C)C(C)O TS40893 [1,1,0,0,0,0|2,0,0]=4 156 B11R1.166 Cc1ccc(c(c1)C)[C@H](C)N TS07613 [1,1,0,0,0,0|2,0,0]=4 157 B11R1.166 Cc1cnc(c(n1)C)C(=O)C TS09884 [1,1,0,0,0,0|0,0,1]=3 158 B11R1.167 Cc1ccc(c(c1)C(C)O)C TS40905 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.167 Cc1ccc(c(c1)[C@H](C)N)C TS40774 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.182 Cc1ccc(c(c1)CCN)C TS07614 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.182 Cc1ccc(c(c1)CCO)C TS40917 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.280 CCc1ccc(c(c1)CC)C TS40685 [1,1,0,0,0,0|2,0,0]=4 163 B13R1.1249 CCCc1c(cc(cn1)CC)CC TS46334 [0,2,0,0,0,0|1,0,0]=3 164 B11R2.1 CC1CCc2c1nccn2 TS05914 [1,0,0,1,0,0|0,0,0]=2 165 B11R2.1 c1cc2c(nc1)C(CC2)O TS36915 [1,0,0,1,0,0|2,0,0]=4 166 B11R2.1 c1cc2c(nc1)CCC2N TS59726 [1,0,0,1,0,0|2,0,0]=4 167 B11R2.20 C1CCC2=C(C1)CC=CC2 TS36861 [1,0,0,1,0,0|2,0,0]=4 168 B11R2.20 c1cc2c(nc1)CCCC2 TS71334 [1,0,0,1,0,0|1,0,0]=3 169 B11R2.20 c1cc2c(nc1)CCCN2 TS05910 [1,0,0,1,0,0|2,0,0]=4 170 B11R2.20 c1cc2c(nc1)CCNC2 TS16957 [1,0,0,1,0,0|2,0,0]=4 171 B11R2.20 c1cc2c(nc1)CCNC2 TS94341 [1,0,0,1,0,0|2,0,0]=4 172 B11R2.20 c1cc2c(nc1)CNCC2 TS02254 [1,0,0,1,0,0|2,0,0]=4 173 B11R2.20 c1cc2c(nc1)CNCC2 TS86659 [1,0,0,1,0,0|2,0,0]=4 174 B11R2.20 c1cc2c(nc1)NCCC2 TS05909 [1,0,0,1,0,0|2,0,0]=4 175 B11R2.20 c1ccc2c(c1)CCCC2 TS36696 [1,0,0,1,0,0|2,0,0]=4 176 B11R2.20 c1ccc2c(c1)CCCC2 TS73725 [1,0,0,1,0,0|2,0,0]=4 177 B11R2.20 c1cnc2c(n1)CCCC2 TS71335 [1,0,0,1,0,0|0,0,0]=2 178 B11R2.36 c1c(cnc2c1CCC2)Br TS53949 [1,0,0,1,0,0|2,0,0]=4 179 B11R2.36 c1c(cnc2c1CCC2)N TS05911 [1,0,0,1,0,0|2,0,0]=4 180 B11R2.36 c1cc(nc2c1CCC2)Cl TS32914 [1,0,0,1,0,0|2,0,0]=4 181 B11R2.36 c1cc(nc2c1CCC2)O TS29456 [1,0,0,1,0,0|2,0,0]=4 182 B11R2.10 C1CCc2c(nc(s2)N)C1 TS41414 [0,0,0,1,1,0|2,0,0]=4 183 B11R2.10 C1CCc2c(nc(s2)N)C1 TS51217 [0,0,0,1,1,0|2,0,0]=4 184 B11R2.10 Cc1[nH]c2c(n1)CCNC2 TS01119 [0,0,0,1,1,0|1,0,1]=4 185 B11R2.10 Cc1nc2c(o1)CCNC2 TS37200 [0,0,0,1,1,0|2,0,0]=4 186 B11R2.10 Cc1nc2c(o1)CNCC2 TS37186 [0,0,0,1,1,0|2,0,0]=4 187 B11R2.10 Cc1nc2c(s1)CNCC2 TS25703 [0,0,0,1,1,0|2,0,0]=4 188 B11R2.10 Cc1nc2c(s1)CNCC2 TS70811 [0,0,0,1,1,0|2,0,0]=4 189 B13R2.57 CCc1ccc2c(c1)CCCC2 TS42206 [0,1,0,1,0,0|2,0,0]=4 190 B13R2.57 c1cc(nc2c1CCCN2)CN TS42606 [0,1,0,1,0,0|2,0,0]=4 191 B13R2.3683 Cc1ccc2c(c1)CCC(C2)C TS42209 [0,1,0,1,0,0|2,0,0]=4 192 B13R2.328 Cc1cc(c2c(c1)CCCC2)C TS42216 [0,1,0,1,0,0|2,0,0]=4 193 B13R2.155 CN1CCc2c(cc(cn2)N)C1 TS16960 [0,1,0,1,0,0|2,0,0]=4 194 B13R2.155 Cc1ccc2c(c1)CC(CC2)C TS42213 [0,1,0,1,0,0|2,0,0]=4 195 B9R1.22 CCn1c(cc(n1)C)C TS77178 [1,0,0,0,1,0|2,0,0]=4 196 B9R1.22 Cc1c(cn(n1)C)CN TS39971 [1,0,0,0,1,0|2,0,0]=4 197 B9R1.22 Cc1c(nc(o1)C)CCl TS07148 [1,0,0,0,1,0|2,0,0]=4 198 B9R1.22 Cc1c(sc(n1)C)CCl TS42364 [1,0,0,0,1,0|2,0,0]=4 199 B9R1.22 Cc1c(sc(n1)C)CN TS32752 [1,0,0,0,1,0|2,0,0]=4 200 B9R1.22 Cc1c(sc(n1)C)CO TS85103 [1,0,0,0,1,0|2,0,0]=4 201 B9R1.22 Cc1cc(c(o1)C)CN TS36058 [1,0,0,0,1,0|2,0,0]=4 202 B9R1.22 Cc1cc(n(n1)C)CCl TS07048 [1,0,0,0,1,0|2,0,0]=4 203 B9R1.22 Cc1cc(n(n1)C)CN TS05099 [1,0,0,0,1,0|2,0,0]=4 204 B9R1.22 Cc1cc(n(n1)C)CO TS36129 [1,0,0,0,1,0|2,0,0]=4 205 B9R1.22 Cc1cc(n(n1)C)NC TS36073 [1,0,0,0,1,0|2,0,0]=4 206 B9R1.132 CCn1c(c(cn1)N)C TS05095 [1,0,0,0,1,0|2,0,0]=4 207 B9R1.27 CCc1c(c[nH]c1C)C TS32587 [1,0,0,0,1,0|0,0,1]=3 208 B9R1.27 Cc1c(c(on1)C)CBr TS16287 [1,0,0,0,1,0|2,0,0]=4 209 B9R1.27 Cc1c(c(on1)C)CCl TS02603 [1,0,0,0,1,0|2,0,0]=4 210 B9R1.27 Cc1c(c(on1)C)CN TS65805 [1,0,0,0,1,0|2,0,0]=4