0 B10R1.15 C=CC(=O)c1ccccc1 T20607 [0,0,0,0,0,0|0,0,2]=2 1 B10R1.15 CC(NN)c1ccccc1 T33268 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 CCC(C1=CC=NC=C1)=O T20581 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.15 CNC(=O)c1ccccc1 T12150 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.15 CNC(=O)c1cccnc1 T5233 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.15 COC(=O)c1cccnc1 T5562 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.15 COC(c1ncccc1)=O T22220 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.15 N#C[C@@H](c1ccccc1)O T9158 [0,0,0,0,0,0|1,0,3]=4 8 B10R1.15 NC(=NO)c1ccccn1 T20580 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.15 NCC(O)c1ccccc1 T4873 [0,0,0,0,0,0|1,0,2]=3 10 B10R1.15 NNC(=O)c1ccccn1 T1374 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.15 NNC(=O)c1cccnc1 T0664 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.15 NNC(=O)c1ccncc1 T0972 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.15 NNC(=S)c1ccccc1 T10513 [0,0,0,0,0,0|2,1,0]=3 14 B10R1.15 O=CC(=O)c1ccccc1 T38465 [0,0,0,0,0,0|1,0,1]=2 15 B10R1.15 OC(C=C)c1ccccc1 T50007 [0,0,0,0,0,0|0,0,4]=4 16 B10R1.15 OCC(O)c1ccccc1 T1346 [0,0,0,0,0,0|1,0,2]=3 17 B9R1.6 CC(=O)c1ccccc1 T7446 [1,0,0,0,0,0|0,0,0]=1 18 B9R1.6 CC(=O)c1cnccn1 T5596 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.6 C[C@H](O)c1ccccc1 T4784 [1,0,0,0,0,0|0,0,2]=3 20 B9R1.6 NC(=N)c1ccccc1 T8362 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.6 NC(=O)c1ccccc1 T6780 [1,0,0,0,0,0|1,0,0]=2 22 B9R1.6 NC(=O)c1ccccn1 T6942 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.6 NC(=O)c1cccnc1 T0934 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.6 NC(=O)c1ccncc1 T0552 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.6 NC(=O)c1cnccn1 T1426 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.6 NC(=S)c1ccncc1 T1365 [1,0,0,0,0,0|2,1,0]=4 27 B9R1.6 O=C(C1=NC=CC=C1)O T0879L [1,0,0,0,0,0|2,0,0]=3 28 B9R1.6 OB(O)c1ccccc1 T30355 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.6 OC(=O)c1ccccc1 T0833 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.6 OC(=O)c1ccccn1 T4850 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.6 OC(=O)c1cccnc1 T0879 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.6 OC(=O)c1ccncc1 Fr13756 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.6 OC(=O)c1cnccn1 T0569 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.6 OP(=O)c1ccccc1 T20416 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.6 [O-]C(=O)c1ccccc1 T8124 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.6 [O-]C(=O)c1ccccn1 T4575 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 CCOc1ccccc1 T19753 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.8 CNCc1ccccc1 T8016 [1,0,0,0,0,0|1,0,1]=3 39 B9R1.8 NCCc1ccccc1 T2935 [1,0,0,0,0,0|1,0,1]=3 40 B9R1.8 NCCc1ccccc1 T7433 [1,0,0,0,0,0|1,0,1]=3 41 B9R1.8 NCCc1ccccn1 T22501 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.8 O/N=C/c1ccccc1 T20350 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 O=CCc1ccccc1 TCS1857 [1,0,0,0,0,0|1,0,2]=4 44 B9R1.8 OCCc1ccccc1 T0011 [1,0,0,0,0,0|1,0,1]=3 45 B9R1.8 OCCc1ccccn1 T0658 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.7 ClNS(=O)(=O)c1ccccc1 T30889 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.12 NC/C(=C/Cl)c1ccccc1 T33265 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.16 CCCC(=O)c1ccccc1 T20324 [0,1,0,0,0,0|0,0,0]=1 49 B11R1.16 CCOC(=O)c1ccccc1 TN4020 [0,1,0,0,0,0|0,0,0]=1 50 B11R1.16 ClCCC(=O)c1ccccc1 T1342 [0,1,0,0,0,0|0,0,0]=1 51 B11R1.16 OCNC(=O)c1cccnc1 T7869 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.16 [N-]=[N+]=NC(=O)c1cccnc1 T24533 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.22 C/C(=N\O)c1ccc(O)cc1 T10143 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.22 CCC(C)c1ccc(O)cc1 T12515 [0,1,0,0,0,0|1,0,1]=3 55 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.22 COC(=O)c1ccc(O)cn1 T40388 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.22 Clc1ccc(cc1)C(=O)CBr T8908 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [0,1,0,0,0,0|1,0,2]=4 59 B11R1.22 NNC(=O)c1ccc(N)cc1 T26389 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.22 Oc1ccc(cc1)C(=O)C=O T32102 [0,1,0,0,0,0|1,0,1]=3 61 B11R1.22 Oc1ccc(cc1)C(=O)CBr T7084 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.23 COC(=O)c1cccc(O)c1 T33331 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.23 COC(=O)c1cncc(C)c1 T0548 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.23 NNC(=O)c1cccc(O)c1 T21202 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.36 CC(=O)C(=O)c1ccccc1 T7450 [0,1,0,0,0,0|0,0,1]=2 66 B11R1.36 CC(O)C(=O)c1ccccc1 T29353 [0,1,0,0,0,0|0,0,0]=1 67 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 TN4002 [0,1,0,0,0,0|0,0,2]=3 68 B11R1.36 OC(=O)C(=C)c1ccccc1 T0629 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.36 OC(=O)C(=O)c1ccccc1 T8025 [0,1,0,0,0,0|1,0,1]=3 70 B11R1.222 CCC(=O)c1ccccc1O T20371 [0,1,0,0,0,0|0,0,0]=1 71 B11R1.222 COC(=O)c1ccccc1N TN1925 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.222 COC(=O)c1ccccc1O T0399 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.222 COC(=O)c1nccnc1N T22363 [0,1,0,0,0,0|3,0,0]=4 74 B11R2.1 Cc1c[nH]c2ccccc12 T5281 [0,0,0,1,0,0|2,0,1]=4 75 B11R2.1 O=C1CCc2ccccc12 T0564 [0,0,0,1,0,0|0,0,0]=1 76 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T1025 [0,0,0,1,0,0|2,0,1]=4 77 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T7942 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.11 COC(=O)c1ccco1 T8022 [0,0,0,0,1,0|2,0,0]=3 79 B11R1.40 C/C(C=O)=C/c1ccccc1 T29898 [0,0,0,0,0,1|2,0,1]=4 80 B11R1.40 C=CC(Nc1ccccc1)=O T9322 [0,0,0,0,0,1|0,0,2]=3 81 B8R1.2 NCc1ccccc1 TN3497 [2,0,0,0,0,0|1,0,0]=3 82 B8R1.2 NCc1cccnc1 T1581 [2,0,0,0,0,0|2,0,0]=4 83 B8R1.2 O=Cc1ccccc1 TWO2659 [2,0,0,0,0,0|0,0,0]=2 84 B8R1.2 OCc1ccccc1 T0732 [2,0,0,0,0,0|1,0,0]=3 85 B8R1.2 OCc1ccccn1 T1112 [2,0,0,0,0,0|2,0,0]=4 86 B8R1.2 OCc1cccnc1 T1299 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.13 CC(=O)c1ccc(C)cc1 T19137 [1,1,0,0,0,0|0,0,0]=2 88 B10R1.13 CC(=O)c1ccc(O)cc1 T3750 [1,1,0,0,0,0|0,0,0]=2 89 B10R1.13 Cc1ccc(cc1)C(O)=O Fr14438 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.13 NC(=O)c1ccc(N)nc1 T7545 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.13 NC(=O)c1ccc(O)cc1 TN3041 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.13 Nc1ccc(cc1)C(O)=O T1311 [1,1,0,0,0,0|1,0,0]=3 93 B10R1.13 Nc1ccc(cn1)C(O)=O T7919 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.13 OC(=O)c1ccc(=O)[nH]c1 T4816 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.13 OC(=O)c1ccc(=O)oc1 T7962 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.13 OC(=O)c1ccc(O)cc1 T2989 [1,1,0,0,0,0|1,0,0]=3 97 B10R1.28 NS(=O)(=O)c1ccccc1 T6781 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.28 OS(=O)(=O)c1ccccc1 T20417 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.61 CC(=O)c1ccccc1C T36788 [1,1,0,0,0,0|0,0,0]=2 100 B10R1.61 CC(=O)c1ccccc1Cl T20449 [1,1,0,0,0,0|0,0,0]=2 101 B10R1.61 CC(=O)c1ccccc1O TCS1856 [1,1,0,0,0,0|0,0,0]=2 102 B10R1.61 Cc1ccccc1C(O)=O T8068 [1,1,0,0,0,0|1,0,0]=3 103 B10R1.61 NC(=O)c1ccccc1O T0004 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.61 OC(=O)c1ccccc1I T20881 [1,1,0,0,0,0|1,0,0]=3 105 B10R1.61 OC(=O)c1ccccc1O T0649 [1,1,0,0,0,0|1,0,0]=3 106 B10R1.61 OC(=O)c1ccccc1O T27597 [1,1,0,0,0,0|1,0,0]=3 107 B10R1.61 OC(=O)c1ncccc1O T5986 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.61 OC(=O)c1ncccc1S T12929 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.61 Oc1ccccc1C(S)=S T31535 [1,1,0,0,0,0|1,1,0]=4 110 B10R1.61 Oc1ccccc1C([O-])=O T0335 [1,1,0,0,0,0|1,0,0]=3 111 B10R1.61 Oc1ccccc1C([O-])=O T20668 [1,1,0,0,0,0|1,0,0]=3 112 B10R1.113 CC(=C)c1cccc(C)c1 T33400 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.113 CC(=O)c1cccc(O)c1 T20389 [1,1,0,0,0,0|0,0,0]=2 114 B10R1.113 CC(C)c1cccc(C)c1 TN6950 [1,1,0,0,0,0|1,0,1]=4 115 B10R1.113 CC(O)c1cccc(N)c1 T21106 [1,1,0,0,0,0|0,0,2]=4 116 B10R1.113 CN(C)c1cccc(C)c1 T21088 [1,1,0,0,0,0|2,0,0]=4 117 B10R1.113 C[n+]1cccc(c1)C(N)=O T4853 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.113 C[n+]1cccc(c1)C(O)=O T2927 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.113 C[n+]1cccc(c1)C([O-])=O T2887 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.113 Cc1cccc(c1)C(Cl)=O T7850 [1,1,0,0,0,0|1,0,0]=3 121 B10R1.113 Fc1cccc(c1)C(Cl)=O T21186 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.113 NC(=O)c1ccc[n+]([O-])c1 T0617 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.113 NC(=O)c1cccc(F)c1 T21178 [1,1,0,0,0,0|1,0,0]=3 124 B10R1.113 NC(=O)c1cccc(I)c1 T21211 [1,1,0,0,0,0|1,0,0]=3 125 B10R1.113 NC(=O)c1cccc(N)c1 T6329 [1,1,0,0,0,0|1,0,0]=3 126 B10R1.113 OC(=O)c1ccc[n+]([O-])c1 T0067 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.113 OC(=O)c1cccc(O)c1 T4840 [1,1,0,0,0,0|1,0,0]=3 128 B10R1.113 Oc1cccc(c1)C([O-])=O T21204 [1,1,0,0,0,0|1,0,0]=3 129 B10R1.113 [O-]C(=O)c1cccc(I)c1 T30402 [1,1,0,0,0,0|1,0,0]=3 130 B10R1.113 [O-][N+](=O)c1cccc(F)c1 T21175 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|1,0,1]=4 133 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|1,0,1]=4 134 B10R1.1 c1cc(ccc1CCN)O T3095 [1,1,0,0,0,0|1,0,1]=4 135 B10R1.4 CCOc1ccccc1Br T20308 [1,1,0,0,0,0|1,0,0]=3 136 B10R1.4 CSCc1ccccc1O T33357 [1,1,0,0,0,0|1,0,1]=4 137 B10R1.4 O/N=C/c1ccccc1O T20346 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.10 CCOc1cccc(O)c1 T20297 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.10 NCCc1cccc(O)c1 T11937 [1,1,0,0,0,0|1,0,1]=4 140 B10R1.10 NCCc1cccc(O)c1 T11937L [1,1,0,0,0,0|1,0,1]=4 141 B10R1.17 CCOCc1ccccc1 T36790 [1,1,0,0,0,0|0,0,1]=3 142 B10R1.17 CNCCc1ccccn1 T0246 [1,1,0,0,0,0|1,0,1]=4 143 B10R1.17 CNCCc1ccccn1 T0246L [1,1,0,0,0,0|1,0,1]=4 144 B10R1.17 CNCCc1ccccn1 T4195 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.17 NNCCc1ccccc1 T12441 [1,1,0,0,0,0|1,0,1]=4 146 B10R1.17 NNCCc1ccccc1 T50010 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.17 O=C/C=C/c1ccccc1 T3S1553 [1,1,0,0,0,0|0,0,2]=4 148 B10R1.17 O=CC=Cc1ccccc1 T4S1551 [1,1,0,0,0,0|0,0,2]=4 149 B10R1.17 O=CCCc1ccccc1 T20312 [1,1,0,0,0,0|0,0,2]=4 150 B10R1.17 OC/C=C/c1ccccc1 TN2982 [1,1,0,0,0,0|0,0,1]=3 151 B10R1.17 OCC=Cc1ccccc1 T5S1550 [1,1,0,0,0,0|0,0,1]=3 152 B10R1.17 OCCCc1ccccc1 T3754 [1,1,0,0,0,0|0,0,1]=3 153 B10R1.17 OCCOc1ccccc1 T20293 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.18 CC(=O)Oc1ccccc1 T0650 [1,1,0,0,0,0|1,0,1]=4 155 B10R1.18 CC(=S)Nc1ccccc1 T20263 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.18 CC(N)Cc1ccccc1 T25082 [1,1,0,0,0,0|0,0,1]=3 157 B10R1.18 C[C@H](N)Cc1ccccc1 T31405L2 [1,1,0,0,0,0|0,0,1]=3 158 B10R1.11 CCCC(=O)c1cccs1 T20377 [0,1,0,0,1,0|1,0,0]=3 159 B12R1.32 CCCC(=O)Oc1ccccc1 T25946 [0,1,0,0,0,1|0,0,0]=2 160 B12R1.32 CCOC(=O)Cc1ccccc1 T19317 [0,1,0,0,0,1|0,0,0]=2 161 B12R1.43 OC(=O)C(=O)Cc1ccccc1 T5251 [0,1,0,0,0,1|1,0,1]=4 162 B12R1.43 OC(=O)C(=O)Nc1ccccc1 T33837 [0,1,0,0,0,1|1,0,1]=4 163 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 T4891 [0,1,0,0,0,1|1,0,1]=4 164 B12R1.49 CCC(=O)Nc1ccc(O)cc1 T19140 [0,1,0,0,0,1|0,0,0]=2 165 B12R1.49 COC(=O)Cc1ccc(O)cc1 TN1436 [0,1,0,0,0,1|1,0,0]=3 166 B12R1.50 CCC(=O)Nc1cccc(O)c1 T34153 [0,1,0,0,0,1|0,0,0]=2 167 B12R1.50 CNC(=O)Oc1cccc(C)c1 T21216 [0,1,0,0,0,1|1,0,0]=3 168 B12R1.50 CSC(=O)Nc1cccc(O)c1 T30736 [0,1,0,0,0,1|1,0,0]=3 169 B12R1.50 O=C(NC1=CC=CC(C)=C1)CO T29382 [0,1,0,0,0,1|1,0,0]=3 170 B12R1.10 CC[N+](C)(C)c1cccc(O)c1 T5855 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.478 CCC(C(O)=O)c1ccccc1 T0631 [0,2,0,0,0,0|0,0,1]=3 172 B12R1.16 C(c1ccc(cc1)O)(CNC)O T6688 [0,2,0,0,0,0|0,0,2]=4 173 B12R1.16 CCCC(=O)c1ccc(F)cc1 T3679 [0,2,0,0,0,0|0,0,0]=2 174 B12R1.16 CCOC(=O)c1ccc(N)cc1 T0924 [0,2,0,0,0,0|0,0,0]=2 175 B12R1.16 CCOC(=O)c1ccc(N)cc1 T6782 [0,2,0,0,0,0|0,0,0]=2 176 B12R1.16 CCOC(=O)c1ccc(O)cc1 T0834 [0,2,0,0,0,0|0,0,0]=2 177 B12R1.16 CNCC(O)c1ccc(O)cc1 T1287 [0,2,0,0,0,0|0,0,2]=4 178 B12R1.16 OCCC(=O)c1ccc(O)cc1 TN5924 [0,2,0,0,0,0|0,0,0]=2 179 B12R1.17 CCOC(=O)c1cccc(O)c1 T20469 [0,2,0,0,0,0|0,0,0]=2 180 B12R1.17 CCOC(c1cc(N)ccc1)=O T21483 [0,2,0,0,0,0|0,0,0]=2 181 B12R1.17 CNCC(O)c1cccc(O)c1 T0453L [0,2,0,0,0,0|0,0,2]=4 182 B12R1.17 CNC[C@H](O)c1cccc(O)c1 T0453 [0,2,0,0,0,0|0,0,2]=4 183 B12R1.17 CNC[C@H](O)c1cccc(O)c1 T17310 [0,2,0,0,0,0|0,0,2]=4 184 B12R1.30 CCCCC(O)c1ccccc1 T0857 [0,2,0,0,0,0|0,0,2]=4 185 B12R1.107 CC(=O)CC(=O)c1ccccc1 T20345 [0,2,0,0,0,0|0,0,0]=2 186 B12R1.107 CC(C)CC(=O)c1ccccc1 T20363 [0,2,0,0,0,0|0,0,0]=2 187 B12R1.107 CC(C)OC(=O)c1ccccc1 T32225 [0,2,0,0,0,0|0,0,0]=2 188 B12R1.107 CS(=O)CC(=O)c1ccccn1 T33841 [0,2,0,0,0,0|1,0,0]=3 189 B12R1.308 CCOC(=O)c1ccccc1O TN1625 [0,2,0,0,0,0|0,0,0]=2 190 B12R1.308 NCCC(=O)c1ccccc1N T32431 [0,2,0,0,0,0|0,0,0]=2 191 B12R1.5 COC(=O)c1ccc(OC)cc1 T20257 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.5 COc1ccc(cc1)C(=O)CBr T7541 [0,2,0,0,0,0|1,0,0]=3 193 B12R1.367 COC(=O)c1cc(O)c(O)cc1 T1368 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.367 ONC(=O)c1ccc(O)c(O)c1 T7525 [0,2,0,0,0,0|2,0,0]=4 195 B12R1.1703 COC(=O)c1ccc(O)cc1O TN6707 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.225 CC(N)C(C)c1cccc(Cl)c1 T33976 [0,2,0,0,0,0|1,0,1]=4 197 B12R1.225 CC(N)C(O)c1cccc(O)c1 T0279L2 [0,2,0,0,0,0|0,0,2]=4 198 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 T0279 [0,2,0,0,0,0|0,0,2]=4 199 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 T0279L [0,2,0,0,0,0|0,0,2]=4 200 B12R1.358 COC(=O)c1cc(O)cc(O)c1 T1355 [0,2,0,0,0,0|1,0,0]=3 201 B12R1.564 CC(C)(C)C(=O)c1ccccc1 T20369 [0,2,0,0,0,0|0,0,0]=2 202 B12R1.564 C[C@H](c1ccccc1)C(C)(C)N T25935 [0,2,0,0,0,0|1,0,1]=4 203 B12R1.77 CNc1ccccc1C(OC)=O TN6731 [0,2,0,0,0,0|1,0,0]=3 204 B12R1.3441 COC(=O)c1c(O)cccc1O TN4525 [0,2,0,0,0,0|1,0,0]=3 205 B12R1.3441 COC(c1c(Cl)cccc1Cl)=O T22362 [0,2,0,0,0,0|1,0,0]=3 206 B10R1.172 CCc1cccc(C=C)c1 T34728 [0,0,1,1,0,0|1,0,0]=3 207 B10R1.172 CCc1cccc(C=O)c1 T21173 [0,0,1,1,0,0|2,0,0]=4 208 B10R2.7 C1Cc2ccccc2O1 Fr14127 [1,0,0,1,0,0|1,0,0]=3 209 B10R2.7 c1[nH]nc2ccccc12 T2192 [1,0,0,1,0,0|2,0,0]=4 210 B10R2.7 c1cc2ccccc2[nH]1 T4799 [1,0,0,1,0,0|1,0,1]=4 211 B12R2.18 CC1C(=O)Nc2ccccc12 T0538 [0,0,0,1,0,1|0,0,0]=2 212 B12R2.18 O=C1Nc2ccccc2C1=O T6862 [0,0,0,1,0,1|1,0,1]=4 213 B12R2.24 CC1CCc2ccccc2N1 T20448 [0,0,0,1,0,1|1,0,1]=4 214 B12R2.24 O=C1CCc2ccccc2C1 T0660 [0,0,0,1,0,1|0,0,0]=2 215 B12R2.24 O=C1CCc2ccccc2O1 T2S0300 [0,0,0,1,0,1|0,0,0]=2 216 B12R2.24 O=c1ccc2ccccc2o1 T0775 [0,0,0,1,0,1|0,0,2]=4 217 B12R2.1 NCc1c[nH]c2ccccc12 T19373 [0,1,0,1,0,0|2,0,0]=4 218 B12R2.1 O=Cc1c[nH]c2ccccc12 T8105 [0,1,0,1,0,0|1,0,1]=4 219 B12R2.1 O=Cc1coc2ccccc12 T7973 [0,1,0,1,0,0|1,0,1]=4 220 B12R2.1 OCc1c[nH]c2ccccc12 T2947 [0,1,0,1,0,0|2,0,0]=4 221 B12R2.2 C1CN=C(C1)c2cccnc2 T7671 [0,1,0,1,0,0|2,0,0]=4 222 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T19999 [0,1,0,1,0,0|0,0,2]=4 223 B12R2.612 Clc1ccc2c(c1)s[nH]c2=O T20972 [0,1,0,1,0,0|2,0,0]=4 224 B12R2.612 Fc1ccc2c(c1)s[nH]c2=O T5601 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.7 CC(=O)[c-]1cccc1 T20583 [1,0,0,0,1,0|0,0,1]=3 226 B8R1.7 CC(=O)c1cccs1 T29331 [1,0,0,0,1,0|1,0,0]=3 227 B8R1.7 CC(=O)c1nccs1 T8042 [1,0,0,0,1,0|2,0,0]=4 228 B8R1.7 OC(=O)c1ccc[nH]1 T4716 [1,0,0,0,1,0|2,0,0]=4 229 B8R1.7 OC(=O)c1ccco1 T5544 [1,0,0,0,1,0|2,0,0]=4 230 B8R1.7 OC(=O)c1ccoc1 T5277 [1,0,0,0,1,0|2,0,0]=4 231 B12R1.27 CCC(=O)O[Hg]c1ccccc1 T34024 [0,0,0,0,0,2|0,0,0]=2 232 B12R1.27 COC(=O)/C=C/c1ccccc1 T5552 [0,0,0,0,0,2|1,0,0]=3 233 B12R1.27 COC(=O)C=Cc1ccccc1 TN6703 [0,0,0,0,0,2|1,0,0]=3 234 B12R1.27 COC(=O)CCc1ccccc1 T9513 [0,0,0,0,0,2|1,0,0]=3