0 B9R1.6 CC(=O)c1ccccc1 T7446 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.6 CC(=O)c1cnccn1 T5596 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 C[C@H](O)c1ccccc1 T4784 [0,0,0,0,0,0|1,0,1]=2 3 B9R1.6 NC(=N)c1ccccc1 T8362 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 NC(=O)c1ccccc1 T6780 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.6 NC(=O)c1ccccn1 T6942 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 NC(=O)c1cccnc1 T0934 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 NC(=O)c1ccncc1 T0552 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 NC(=O)c1cnccn1 T1426 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 NC(=S)c1ccncc1 T1365 [0,0,0,0,0,0|2,1,0]=3 10 B9R1.6 O=C(C1=NC=CC=C1)O T0879L [0,0,0,0,0,0|1,0,0]=1 11 B9R1.6 OB(O)c1ccccc1 T30355 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.6 OC(=O)C1=CCCNC1 T7557 [0,0,0,0,0,0|1,0,3]=4 13 B9R1.6 OC(=O)C1=CCCNC1 TN1717 [0,0,0,0,0,0|1,0,3]=4 14 B9R1.6 OC(=O)C1=CCNCC1 T11684 [0,0,0,0,0,0|1,0,3]=4 15 B9R1.6 OC(=O)c1ccccc1 T0833 [0,0,0,0,0,0|0,0,0]=0 16 B9R1.6 OC(=O)c1ccccn1 T4850 [0,0,0,0,0,0|1,0,0]=1 17 B9R1.6 OC(=O)c1cccnc1 T0879 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.6 OC(=O)c1ccncc1 Fr13756 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 OC(=O)c1cnccn1 T0569 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 OP(=O)c1ccccc1 T20416 [0,0,0,0,0,0|1,0,0]=1 21 B9R1.6 [O-]C(=O)c1ccccc1 T8124 [0,0,0,0,0,0|0,0,1]=1 22 B9R1.6 [O-]C(=O)c1ccccn1 T4575 [0,0,0,0,0,0|1,0,1]=2 23 B8R1.2 NCc1ccccc1 TN3497 [1,0,0,0,0,0|1,0,1]=3 24 B8R1.2 NCc1cccnc1 T1581 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.2 O=Cc1ccccc1 TWO2659 [1,0,0,0,0,0|0,0,0]=1 26 B8R1.2 OCc1ccccc1 T0732 [1,0,0,0,0,0|0,0,1]=2 27 B8R1.2 OCc1ccccn1 T1112 [1,0,0,0,0,0|1,0,1]=3 28 B8R1.2 OCc1cccnc1 T1299 [1,0,0,0,0,0|1,0,1]=3 29 B10R1.13 CC(=O)c1ccc(C)cc1 T19137 [0,1,0,0,0,0|1,0,0]=2 30 B10R1.13 CC(=O)c1ccc(O)cc1 T3750 [0,1,0,0,0,0|1,0,0]=2 31 B10R1.13 Cc1ccc(cc1)C(N)N T35198 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.13 Cc1ccc(cc1)C(O)=O Fr14438 [0,1,0,0,0,0|0,0,0]=1 33 B10R1.13 NC(=O)c1ccc(N)nc1 T7545 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.13 NC(=O)c1ccc(O)cc1 TN3041 [0,1,0,0,0,0|1,0,0]=2 35 B10R1.13 Nc1ccc(cc1)C(O)=O T1311 [0,1,0,0,0,0|0,0,0]=1 36 B10R1.13 Nc1ccc(cn1)C(O)=O T7919 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.13 OC(=O)c1ccc(=O)[nH]c1 T4816 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.13 OC(=O)c1ccc(=O)oc1 T7962 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.13 OC(=O)c1ccc(O)cc1 T2989 [0,1,0,0,0,0|0,0,0]=1 40 B10R1.13 OC(=O)c1cnc(O)cn1 T10171 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.15 C=CC(=O)c1ccccc1 T20607 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.15 CC(NN)c1ccccc1 T33268 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.15 CCC(C1=CC=NC=C1)=O T20581 [0,1,0,0,0,0|2,0,0]=3 44 B10R1.15 CNC(=O)c1ccccc1 T12150 [0,1,0,0,0,0|1,0,0]=2 45 B10R1.15 CNC(=O)c1cccnc1 T5233 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.15 COC(=O)c1cccnc1 T5562 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.15 COC(c1ncccc1)=O T22220 [0,1,0,0,0,0|1,0,0]=2 48 B10R1.15 N#C[C@@H](c1ccccc1)O T9158 [0,1,0,0,0,0|1,0,1]=3 49 B10R1.15 NC(=NO)c1ccccn1 T20580 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.15 NCC(O)c1ccccc1 T4873 [0,1,0,0,0,0|1,0,1]=3 51 B10R1.15 NNC(=O)c1ccccn1 T1374 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.15 NNC(=O)c1cccnc1 T0664 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.15 NNC(=O)c1ccncc1 T0972 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.15 NNC(=S)c1ccccc1 T10513 [0,1,0,0,0,0|1,1,0]=3 55 B10R1.15 O=CC(=O)c1ccccc1 T38465 [0,1,0,0,0,0|0,0,1]=2 56 B10R1.15 OC(C=C)c1ccccc1 T50007 [0,1,0,0,0,0|1,0,1]=3 57 B10R1.15 OCC(O)c1ccccc1 T1346 [0,1,0,0,0,0|0,0,2]=3 58 B10R1.28 NS(=O)(=O)c1ccccc1 T6781 [0,1,0,0,0,0|1,0,1]=3 59 B10R1.28 OS(=O)(=O)c1ccccc1 T20417 [0,1,0,0,0,0|1,0,0]=2 60 B10R1.61 CC(=O)c1ccccc1C T36788 [0,1,0,0,0,0|1,0,0]=2 61 B10R1.61 CC(=O)c1ccccc1Cl T20449 [0,1,0,0,0,0|1,0,0]=2 62 B10R1.61 CC(=O)c1ccccc1O TCS1856 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.61 Cc1ccccc1C(O)=O T8068 [0,1,0,0,0,0|0,0,0]=1 64 B10R1.61 NC(=O)c1ccccc1O T0004 [0,1,0,0,0,0|1,0,0]=2 65 B10R1.61 NC(=O)c1nccnc1O T7785 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.61 OC(=O)c1ccccc1I T20881 [0,1,0,0,0,0|0,0,0]=1 67 B10R1.61 OC(=O)c1ccccc1O T0649 [0,1,0,0,0,0|0,0,0]=1 68 B10R1.61 OC(=O)c1ccccc1O T27597 [0,1,0,0,0,0|0,0,0]=1 69 B10R1.61 OC(=O)c1ncccc1O T5986 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.61 OC(=O)c1ncccc1S T12929 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.61 Oc1ccccc1C(S)=S T31535 [0,1,0,0,0,0|0,2,0]=3 72 B10R1.61 Oc1ccccc1C([O-])=O T0335 [0,1,0,0,0,0|0,0,1]=2 73 B10R1.61 Oc1ccccc1C([O-])=O T20668 [0,1,0,0,0,0|0,0,1]=2 74 B10R1.113 CC(=C)c1cccc(C)c1 T33400 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.113 CC(=O)c1cccc(O)c1 T20389 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.113 CC(C)c1cccc(C)c1 TN6950 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.113 CC(O)c1cccc(N)c1 T21106 [0,1,0,0,0,0|1,0,1]=3 78 B10R1.113 CN(C)c1cccc(C)c1 T21088 [0,1,0,0,0,0|3,0,0]=4 79 B10R1.113 C[n+]1cccc(c1)C(N)=O T4853 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.113 C[n+]1cccc(c1)C(O)=O T2927 [0,1,0,0,0,0|1,0,0]=2 81 B10R1.113 C[n+]1cccc(c1)C([O-])=O T2887 [0,1,0,0,0,0|1,0,1]=3 82 B10R1.113 Cc1cccc(c1)C(Cl)=O T7850 [0,1,0,0,0,0|1,0,0]=2 83 B10R1.113 Fc1cccc(c1)C(Cl)=O T21186 [0,1,0,0,0,0|1,0,0]=2 84 B10R1.113 NC(=O)c1ccc[n+]([O-])c1 T0617 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.113 NC(=O)c1cccc(F)c1 T21178 [0,1,0,0,0,0|1,0,0]=2 86 B10R1.113 NC(=O)c1cccc(I)c1 T21211 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.113 NC(=O)c1cccc(N)c1 T6329 [0,1,0,0,0,0|1,0,0]=2 88 B10R1.113 NC1CC(=CC=C1)C(O)=O T24080 [0,1,0,0,0,0|0,0,2]=3 89 B10R1.113 OC(=O)c1ccc[n+]([O-])c1 T0067 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.113 OC(=O)c1cccc(O)c1 T4840 [0,1,0,0,0,0|0,0,0]=1 91 B10R1.113 Oc1cccc(c1)C([O-])=O T21204 [0,1,0,0,0,0|0,0,1]=2 92 B10R1.113 [O-]C(=O)c1cccc(I)c1 T30402 [0,1,0,0,0,0|0,0,1]=2 93 B10R1.113 [O-][N+](=O)c1cccc(F)c1 T21175 [0,1,0,0,0,0|1,0,1]=3 94 B8R1.7 CC(=O)[c-]1cccc1 T20583 [0,0,0,0,1,0|1,0,1]=3 95 B8R1.7 CC(=O)c1cccs1 T29331 [0,0,0,0,1,0|2,0,0]=3 96 B8R1.7 CC(=O)c1nccs1 T8042 [0,0,0,0,1,0|3,0,0]=4 97 B8R1.7 OC(=O)c1cc[nH]n1 T7842 [0,0,0,0,1,0|2,0,0]=3 98 B8R1.7 OC(=O)c1ccc[nH]1 T4716 [0,0,0,0,1,0|1,0,0]=2 99 B8R1.7 OC(=O)c1ccco1 T5544 [0,0,0,0,1,0|1,0,0]=2 100 B8R1.7 OC(=O)c1ccoc1 T5277 [0,0,0,0,1,0|1,0,0]=2 101 B8R1.7 OC(=O)c1cnsc1 T4675 [0,0,0,0,1,0|2,0,0]=3 102 B8R1.7 OC(=O)c1nc[nH]n1 T1371 [0,0,0,0,1,0|3,0,0]=4 103 B10R1.18 C1=NC=CC=C1CC(O)=O T19128 [0,0,0,0,0,1|1,0,0]=2 104 B10R1.18 CC(=O)Oc1ccccc1 T0650 [0,0,0,0,0,1|1,0,0]=2 105 B10R1.18 CC(=S)Nc1ccccc1 T20263 [0,0,0,0,0,1|1,1,0]=3 106 B10R1.18 CC(N)Cc1ccccc1 T25082 [0,0,0,0,0,1|2,0,1]=4 107 B10R1.18 C[C@H](N)Cc1ccccc1 T31405L2 [0,0,0,0,0,1|2,0,1]=4 108 B10R1.18 OC(=O)Cc1cccnc1 T1366 [0,0,0,0,0,1|1,0,0]=2 109 B7R0.4 C/C=C/C=C/C(O)=O T8019 [1,0,1,0,0,0|0,0,1]=3 110 B7R0.4 C/C=C/C=C/C([O-])=O T4807 [1,0,1,0,0,0|0,0,2]=4 111 B7R1.3 Cc1ccccn1 T21323 [2,0,0,0,0,0|1,0,1]=4 112 B7R1.3 O=c1cccc[nH]1 T4805 [2,0,0,0,0,0|1,0,0]=3 113 B9R0.2 C/C=C/C=C/C=C/C(O)=O T33059 [0,1,1,0,0,0|0,0,0]=2 114 B9R0.55 OC(=O)/C=C/C=C/C(O)=O T7154 [0,1,1,0,0,0|1,0,0]=3 115 B9R0.55 OC(=O)/C=C/C=C\C(O)=O T5588 [0,1,1,0,0,0|1,0,0]=3 116 B9R1.1 CCc1ccc(O)cc1 T5883 [1,1,0,0,0,0|1,0,1]=4 117 B9R1.1 COc1ccc(F)cc1 T0528 [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 COc1ccc(O)cc1 T0501 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.1 NCc1ccc(O)cc1 T21095 [1,1,0,0,0,0|1,0,1]=4 120 B9R1.1 NNc1ccc(Cl)cc1 T3167 [1,1,0,0,0,0|2,0,0]=4 121 B9R1.1 OCc1ccc(O)cc1 T3752 [1,1,0,0,0,0|0,0,1]=3 122 B9R1.1 OCc1ccc(cn1)O T40502 [1,1,0,0,0,0|1,0,1]=4 123 B9R1.1 Oc1ccc(C=C)cc1 T13509 [1,1,0,0,0,0|1,0,0]=3 124 B9R1.1 Oc1ccc(C=O)cc1 T2S1814 [1,1,0,0,0,0|0,0,0]=2 125 B9R1.2 CCc1cccc(N)c1 T21169 [1,1,0,0,0,0|1,0,1]=4 126 B9R1.2 CCc1cccc(O)c1 T21170 [1,1,0,0,0,0|1,0,1]=4 127 B9R1.2 CNc1cccc(C)c1 T0557 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.2 COc1cccc(Br)c1 T21218 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.2 COc1cccc(C)c1 T21278 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.2 COc1cccc(O)c1 T20294 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.2 Cc1cccc(c1)[I]=O T32169 [1,1,0,0,0,0|1,0,0]=3 132 B9R1.2 ClCc1cccc(Cl)c1 T21091 [1,1,0,0,0,0|1,0,1]=4 133 B9R1.2 Fc1cccc(C=O)c1 T21180 [1,1,0,0,0,0|0,0,0]=2 134 B9R1.2 Fc1cccc(CCl)c1 T21179 [1,1,0,0,0,0|1,0,1]=4 135 B9R1.2 OCc1ccc[n+]([O-])c1 T0257 [1,1,0,0,0,0|1,0,1]=4 136 B9R1.2 OCc1cccc(I)c1 T21214 [1,1,0,0,0,0|0,0,1]=3 137 B9R1.2 OCc1cccc(O)c1 T4760 [1,1,0,0,0,0|0,0,1]=3 138 B9R1.2 Oc1cccc(C=O)c1 T4778 [1,1,0,0,0,0|0,0,0]=2 139 B9R1.8 CCOc1ccccc1 T19753 [1,1,0,0,0,0|1,0,1]=4 140 B9R1.8 CNCc1ccccc1 T8016 [1,1,0,0,0,0|1,0,1]=4 141 B9R1.8 NCCc1ccccc1 T2935 [1,1,0,0,0,0|1,0,1]=4 142 B9R1.8 NCCc1ccccc1 T7433 [1,1,0,0,0,0|1,0,1]=4 143 B9R1.8 O/N=C/c1ccccc1 T20350 [1,1,0,0,0,0|0,0,0]=2 144 B9R1.8 O=CCc1ccccc1 TCS1857 [1,1,0,0,0,0|0,0,0]=2 145 B9R1.8 OCCc1ccccc1 T0011 [1,1,0,0,0,0|0,0,1]=3 146 B9R1.8 OCCc1ccccn1 T0658 [1,1,0,0,0,0|1,0,1]=4 147 B9R1.15 COc1ccccc1O T1301 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.15 NCc1ccccc1O T41358 [1,1,0,0,0,0|1,0,1]=4 149 B9R1.15 OCc1ccccc1O T0311 [1,1,0,0,0,0|0,0,1]=3 150 B9R1.11 COC(=O)c1ccco1 T8022 [0,1,0,0,1,0|1,0,0]=3 151 B9R1.35 CC(=O)c1ccc(C)s1 T20602 [0,1,0,0,1,0|2,0,0]=4 152 B9R1.35 Cc1cc(n[nH]1)C(O)=O T7476 [0,1,0,0,1,0|2,0,0]=4 153 B9R1.41 CC(=O)c1occc1O T32217 [0,1,0,0,1,0|2,0,0]=4 154 B11R1.20 CC(=O)Nc1ccc(C)cc1 T33859 [0,1,0,0,0,1|1,0,0]=3 155 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [0,1,0,0,0,1|1,0,0]=3 156 B11R1.20 CC(=O)Oc1ccc(O)cc1 T8704 [0,1,0,0,0,1|1,0,0]=3 157 B11R1.20 NC(=O)Nc1ccc(Cl)cc1 T20454 [0,1,0,0,0,1|1,0,0]=3 158 B11R1.20 NC(Nc1ccc(cc1)Cl)=N T21703 [0,1,0,0,0,1|2,0,0]=4 159 B11R1.20 OC(=O)Cc1ccc(O)cc1 T3743 [0,1,0,0,0,1|0,0,0]=2 160 B11R1.36 CC(=O)C(=O)c1ccccc1 T7450 [0,1,0,0,0,1|1,0,0]=3 161 B11R1.36 CC(O)C(=O)c1ccccc1 T29353 [0,1,0,0,0,1|1,0,1]=4 162 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 TN4002 [0,1,0,0,0,1|1,0,1]=4 163 B11R1.36 NC(C(O)=O)c1ccccc1 T13485 [0,1,0,0,0,1|0,0,0]=2 164 B11R1.36 OC(=O)C(=C)c1ccccc1 T0629 [0,1,0,0,0,1|0,0,0]=2 165 B11R1.36 OC(=O)C(=O)c1ccccc1 T8025 [0,1,0,0,0,1|0,0,0]=2 166 B11R1.36 OC(=O)C(S)c1ccccc1 T26271 [0,1,0,0,0,1|0,0,0]=2 167 B11R1.36 OC(C(O)=O)c1ccccc1 T33320 [0,1,0,0,0,1|0,0,0]=2 168 B11R1.36 OC(C(O)=O)c1ccccc1 T4848 [0,1,0,0,0,1|0,0,0]=2 169 B11R1.36 OC(C([O-])=O)c1ccccc1 T30005 [0,1,0,0,0,1|0,0,1]=3 170 B11R1.36 O[C@@H](C(O)=O)c1ccccc1 T2S0122 [0,1,0,0,0,1|0,0,0]=2 171 B11R1.40 C/C(C=O)=C/c1ccccc1 T29898 [0,1,0,0,0,1|1,0,0]=3 172 B11R1.40 C=CC(Nc1ccccc1)=O T9322 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.86 OC(=O)Cc1ccccc1O T5308 [0,1,0,0,0,1|0,0,0]=2 174 B11R1.157 CC(=O)Nc1cccc(C)c1 T21117 [0,1,0,0,0,1|1,0,0]=3 175 B11R1.157 CC(=O)Nc1cccc(O)c1 T0914 [0,1,0,0,0,1|1,0,0]=3 176 B11R1.157 CC(=O)Oc1cccc(O)c1 T0339 [0,1,0,0,0,1|1,0,0]=3 177 B11R1.157 Cc1cccc(CC(O)=O)c1 T19409 [0,1,0,0,0,1|0,0,0]=2 178 B11R1.157 NC(=O)Nc1cccc(O)c1 T21201 [0,1,0,0,0,1|1,0,0]=3 179 B11R1.157 OC(=O)Cc1cccc(O)c1 T4829 [0,1,0,0,0,1|0,0,0]=2 180 B11R1.509 FS(=O)(=O)Cc1ccccc1 T0789 [0,1,0,0,0,1|1,0,1]=4 181 B11R1.3 COc1ccc(cc1)C(O)=O TCS0862 [0,2,0,0,0,0|0,0,0]=2 182 B11R1.3 COc1ccc(cn1)C(N)=O T8106 [0,2,0,0,0,0|2,0,0]=4 183 B11R1.3 NCc1ccc(cc1)C(O)=O T1252 [0,2,0,0,0,0|0,0,0]=2 184 B11R1.3 OC(=O)c1ccc(C=O)cc1 T1691 [0,2,0,0,0,0|0,0,0]=2 185 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O T19499 [0,2,0,0,0,0|1,0,0]=3 186 B11R1.19 Nc1ccc(cc1)S(N)(=O)=O T0123 [0,2,0,0,0,0|1,0,1]=4 187 B11R1.19 Nc1ccc(cc1)[SbH](O)(O)[O-] T34719 [0,2,0,0,0,0|1,0,1]=4 188 B11R1.19 Nc1ccc(cc1)[Sb](O)(O)=O T33637 [0,2,0,0,0,0|1,0,0]=3 189 B11R1.21 CC(=O)c1ccc(O)c(O)c1 T3734 [0,2,0,0,0,0|1,0,0]=3 190 B11R1.21 Cc1cc(ccc1O)C(O)=O T5298 [0,2,0,0,0,0|0,0,0]=2 191 B11R1.21 Cc1ccc(cc1C)C(O)=O T19115 [0,2,0,0,0,0|0,0,0]=2 192 B11R1.21 Cc1cnc(c[n+]1[O-])C(O)=O T1162 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.21 Cn1cc(ccc1=O)C(N)=O T8150 [0,2,0,0,0,0|2,0,0]=4 194 B11R1.21 Cn1cc(ccc1=O)C(O)=O T6981 [0,2,0,0,0,0|1,0,0]=3 195 B11R1.21 Nc1cc(ccc1O)C(O)=O T4770 [0,2,0,0,0,0|0,0,0]=2 196 B11R1.21 OC(=O)c1ccc(Br)c(O)c1 T7454 [0,2,0,0,0,0|0,0,0]=2 197 B11R1.21 OC(=O)c1ccc(O)c(O)c1 T0562 [0,2,0,0,0,0|0,0,0]=2 198 B11R1.21 Oc1ccc(cc1Cl)[N+]([O-])=O T9443 [0,2,0,0,0,0|1,0,1]=4 199 B11R1.22 C/C(=N\O)c1ccc(O)cc1 T10143 [0,2,0,0,0,0|1,0,0]=3 200 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [0,2,0,0,0,0|0,0,0]=2 201 B11R1.22 COC(=O)c1ccc(O)cn1 T40388 [0,2,0,0,0,0|1,0,0]=3 202 B11R1.22 Clc1ccc(cc1)C(=O)CBr T8908 [0,2,0,0,0,0|1,0,0]=3 203 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [0,2,0,0,0,0|1,0,1]=4 204 B11R1.22 NNC(=O)c1ccc(N)cc1 T26389 [0,2,0,0,0,0|1,0,0]=3 205 B11R1.22 Oc1ccc(cc1)C(=O)C=O T32102 [0,2,0,0,0,0|0,0,1]=3 206 B11R1.22 Oc1ccc(cc1)C(=O)CBr T7084 [0,2,0,0,0,0|1,0,0]=3 207 B11R1.166 CC(=O)c1ccc(C)cc1O Fr14298 [0,2,0,0,0,0|1,0,0]=3 208 B11R1.166 CC(=O)c1ccc(O)cc1O T3751 [0,2,0,0,0,0|1,0,0]=3 209 B11R1.166 Cc1cc(O)ccc1[N+]([O-])=O T21283 [0,2,0,0,0,0|1,0,1]=4 210 B11R1.166 Cc1ccc(C(O)=O)c(O)c1 T22225 [0,2,0,0,0,0|0,0,0]=2 211 B11R1.166 Nc1ccc(C(O)=O)c(O)c1 T0441 [0,2,0,0,0,0|0,0,0]=2 212 B11R1.166 Nc1ccc(C(O)=O)c(O)c1 T1296 [0,2,0,0,0,0|0,0,0]=2 213 B11R1.166 Nc1ccc(C([O-])=O)c(O)c1 T0020 [0,2,0,0,0,0|0,0,1]=3 214 B11R1.166 OC(=O)c1ccc(Cl)cc1O T0666 [0,2,0,0,0,0|0,0,0]=2 215 B11R1.166 OC(=O)c1ccc(O)cc1O T5890 [0,2,0,0,0,0|0,0,0]=2 216 B11R1.166 OC(=O)c1cnc(O)nc1O T4711 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.7 ClNS(=O)(=O)c1ccccc1 T30889 [0,2,0,0,0,0|1,0,1]=4 218 B11R1.12 NC/C(=C/Cl)c1ccccc1 T33265 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.16 CC(/C=N/O)c1ccccc1 T29369 [0,2,0,0,0,0|1,0,1]=4 220 B11R1.16 CCCC(=O)c1ccccc1 T20324 [0,2,0,0,0,0|1,0,0]=3 221 B11R1.16 CCOC(=O)c1ccccc1 TN4020 [0,2,0,0,0,0|0,0,0]=2 222 B11R1.16 ClCCC(=O)c1ccccc1 T1342 [0,2,0,0,0,0|1,0,0]=3 223 B11R1.16 OCNC(=O)c1cccnc1 T7869 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.16 [N-]=[N+]=NC(=O)c1cccnc1 T24533 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.23 CN(N=O)c1cccc(Cl)c1 T30065 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.23 CN(N=O)c1cccc(F)c1 T30066 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.23 COC(=O)c1cccc(O)c1 T33331 [0,2,0,0,0,0|0,0,0]=2 228 B11R1.23 COC(=O)c1cncc(C)c1 T0548 [0,2,0,0,0,0|1,0,0]=3 229 B11R1.23 NNC(=O)c1cccc(O)c1 T21202 [0,2,0,0,0,0|1,0,0]=3 230 B11R1.23 OC(C#N)c1cccc(O)c1 T33176 [0,2,0,0,0,0|1,0,1]=4 231 B11R1.222 CCC(=O)c1ccccc1O T20371 [0,2,0,0,0,0|1,0,0]=3 232 B11R1.222 COC(=O)c1ccccc1N TN1925 [0,2,0,0,0,0|0,0,0]=2 233 B11R1.222 COC(=O)c1ccccc1O T0399 [0,2,0,0,0,0|0,0,0]=2 234 B11R1.222 COC(=O)c1nccnc1N T22363 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.87 Cc1ccccc1S(N)(=O)=O T0571 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.87 Nc1ccccc1S(N)(=O)=O T2187 [0,2,0,0,0,0|1,0,1]=4 237 B11R1.87 Nc1ccccc1S(O)(=O)=O T4835 [0,2,0,0,0,0|1,0,0]=3 238 B11R1.155 CC(C)(O)c1cccc(Cl)c1 T30359 [0,2,0,0,0,0|1,0,1]=4 239 B11R1.155 ClS(=O)(=O)c1cccc(I)c1 T33391 [0,2,0,0,0,0|1,0,1]=4 240 B11R1.155 Nc1cccc(c1)S(O)(=O)=O T20858 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.155 Oc1cccc(c1)S(Cl)(=O)=O T33376 [0,2,0,0,0,0|1,0,1]=4 242 B11R1.155 Oc1cccc(c1)S(O)(=O)=O T33491 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.155 [O-]S(=O)(=O)c1cccc(I)c1 T30367 [0,2,0,0,0,0|1,0,1]=4 244 B11R1.53 COc1ccccc1C(O)=O T5874 [0,2,0,0,0,0|0,0,0]=2 245 B11R1.53 OC(=O)c1ccccc1C=O TN6514 [0,2,0,0,0,0|0,0,0]=2 246 B11R1.53 OCc1ccccc1C(O)=O T36787 [0,2,0,0,0,0|0,0,0]=2 247 B11R1.53 [O-][N+](=O)c1ccccc1C=O T29358 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.156 Cc1cccc(O)c1[N+]([O-])=O T21287 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.156 NC(=S)c1c(Cl)cccc1Cl T20919 [0,2,0,0,0,0|1,1,0]=4 250 B11R1.156 OC(=O)c1c(O)cccc1O T5873 [0,2,0,0,0,0|0,0,0]=2 251 B11R1.159 Cc1c(Cl)cccc1[N+]([O-])=O T20277 [0,2,0,0,0,0|1,0,1]=4 252 B11R1.159 Cc1cccc(C(O)=O)c1O T1423 [0,2,0,0,0,0|0,0,0]=2 253 B11R1.159 Cc1cccc(c1C)[N+]([O-])=O T33692 [0,2,0,0,0,0|1,0,1]=4 254 B11R1.159 Nc1c(O)cccc1C(O)=O T4707 [0,2,0,0,0,0|0,0,0]=2 255 B11R1.159 OC(=O)c1cccc(O)c1O T4810 [0,2,0,0,0,0|0,0,0]=2 256 B11R1.159 [O-][N+](=O)c1cccc(Cl)c1Cl T30354 [0,2,0,0,0,0|1,0,1]=4 257 B11R1.167 CC(=O)c1cc(O)ccc1O TCS2170 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.167 Nc1ccc(Cl)cc1C(O)=O T0567 [0,2,0,0,0,0|0,0,0]=2 259 B11R1.167 Nc1ccc(O)c(c1)C(O)=O T0646 [0,2,0,0,0,0|0,0,0]=2 260 B11R1.167 OC(=O)c1cc(O)ccc1O T2857 [0,2,0,0,0,0|0,0,0]=2 261 B11R1.167 OC(=O)c1nc(Cl)ccc1Cl T19953 [0,2,0,0,0,0|1,0,0]=3 262 B11R1.74 OC(=O)c1c[14c](=O)[nH]c(=O)[nH]1 T12325 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.74 OC(=O)c1cc(=O)[nH]c(=O)[nH]1 T0746 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.74 OC(=O)c1cc(=O)[nH]c(=O)[nH]1 T21194 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.74 OC(=O)c1cc(=O)[nH]c(=O)[nH]1 T27963 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.74 OC(=O)c1cc(=O)[nH]c(=O)[nH]1 T31267 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.74 OC(=O)c1cc(=O)[nH]c(=O)[nH]1 T5078 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.74 OC(=O)c1cc(O)cc(Cl)c1 T7482 [0,2,0,0,0,0|0,0,0]=2 269 B11R1.74 OC(=O)c1cc(O)cc(O)c1 T0570 [0,2,0,0,0,0|0,0,0]=2 270 B11R1.74 OC(=O)c1cc(O)nc(O)c1 T20863 [0,2,0,0,0,0|1,0,0]=3 271 B11R1.74 [O-][N+](=O)c1cc(Cl)cc(Cl)c1 T21144 [0,2,0,0,0,0|1,0,1]=4 272 B11R1.266 COc1cccc(c1)C(N)=O T7439 [0,2,0,0,0,0|1,0,0]=3 273 B11R1.266 COc1cccc(c1)C(O)=O T5982 [0,2,0,0,0,0|0,0,0]=2 274 B9R1.5 Oc1cccccc1=O T8087 [0,0,1,1,0,0|2,0,0]=4 275 B11R2.10 Nc1nc2ccccc2s1 T1347 [0,0,0,1,0,1|1,1,0]=4 276 B11R2.10 O=C1Cc2ccccc2N1 Fr16741 [0,0,0,1,0,1|1,0,0]=3 277 B11R2.10 O=c1[nH]c2ccccc2[nH]1 T0662 [0,0,0,1,0,1|1,0,0]=3 278 B11R2.10 O=c1[nH]c2ccccc2o1 T5572 [0,0,0,1,0,1|0,0,0]=2 279 B11R2.10 Sc1nc2ccccc2s1 T19856 [0,0,0,1,0,1|0,2,0]=4 280 B11R2.10 [S-]c1nc2ccccc2[nH]1 T21238 [0,0,0,1,0,1|1,1,0]=4 281 B11R2.1 Cc1c[nH]c2ccccc12 T5281 [0,1,0,1,0,0|2,0,0]=4 282 B11R2.1 O=C1CCc2ccccc12 T0564 [0,1,0,1,0,0|1,0,0]=3 283 B11R2.1 [O-][n+]1onc2ccccc12 T7977 [0,1,0,1,0,0|1,0,1]=4 284 B11R1.91 CC(=O)/C=C/c1ccccc1 TCS1554 [0,0,0,0,0,2|1,0,0]=3 285 B11R1.91 CC(=O)C=Cc1ccccc1 TN6993 [0,0,0,0,0,2|1,0,0]=3 286 B11R1.91 CC(=O)CCc1ccccc1 TCS1709 [0,0,0,0,0,2|1,0,0]=3 287 B11R1.91 CC(=O)COc1ccccc1 T25944 [0,0,0,0,0,2|1,0,0]=3 288 B11R1.91 CC(=O)NCc1ccccc1 T5924 [0,0,0,0,0,2|1,0,0]=3 289 B11R1.91 CC(=O)OCc1ccccc1 T5615 [0,0,0,0,0,2|1,0,0]=3 290 B11R1.91 CC(C)=NNc1ccccc1 T29585 [0,0,0,0,0,2|2,0,0]=4 291 B11R1.91 NC(=O)NCc1ccccc1 T21213 [0,0,0,0,0,2|1,0,0]=3 292 B11R1.91 NC(=O)N[Hg]c1ccccc1 T28402 [0,0,0,0,0,2|1,0,0]=3 293 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 T13669 [0,0,0,0,0,2|1,0,0]=3 294 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 T20050 [0,0,0,0,0,2|1,0,0]=3 295 B11R1.91 OC(=O)/C=C/c1ccccc1 T2740 [0,0,0,0,0,2|0,0,0]=2 296 B11R1.91 OC(=O)CCc1ccccc1 T3731 [0,0,0,0,0,2|0,0,0]=2 297 B11R1.91 OC(C=Cc1ccccc1)=O T5646 [0,0,0,0,0,2|0,0,0]=2