0 B11R1.16 C#CCC(N)C1=CC=CC=C1 2882AA [0,0,0,0,0,0|2,0,1]=3 1 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 1033AL [0,0,0,0,0,0|2,0,1]=3 2 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [0,0,0,0,0,0|2,0,0]=2 3 B11R1.16 CC(N=C=O)C1=CC=CC=C1 6171AD [0,0,0,0,0,0|3,0,0]=3 4 B11R1.16 CCCC(N)C1=CC=NC=C1 4969AJ [0,0,0,0,0,0|3,0,0]=3 5 B11R1.16 CCCC(N)C1=CN=CC=C1 4944AJ [0,0,0,0,0,0|3,0,0]=3 6 B11R1.16 CCCC(N)C1=NC=CC=C1 5079AC [0,0,0,0,0,0|3,0,0]=3 7 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [0,0,0,0,0,0|2,0,0]=2 8 B11R1.16 CN(CCN)C1=CC=CC=C1 5337AD [0,0,0,0,0,0|3,0,0]=3 9 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [0,0,0,0,0,0|0,0,0]=0 10 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [0,0,0,0,0,0|0,0,0]=0 11 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 6705AB [0,0,0,0,0,0|2,0,2]=4 12 B11R1.16 ClCCC(Br)C1=CC=CC=C1 V4390 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.16 N#CCC(N)C1=NC=CC=C1 Z9347 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [1,0,0,0,0,0|1,0,2]=4 15 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [1,0,0,0,0,0|1,0,2]=4 16 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [1,0,0,0,0,0|1,0,2]=4 17 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [1,0,0,0,0,0|2,0,1]=4 18 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [1,0,0,0,0,0|1,0,0]=2 19 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [1,0,0,0,0,0|1,0,0]=2 20 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [1,0,0,0,0,0|2,0,0]=3 21 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [1,0,0,0,0,0|2,0,0]=3 22 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [1,0,0,0,0,0|2,0,1]=4 23 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [1,0,0,0,0,0|1,0,0]=2 24 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [1,0,0,0,0,0|1,0,1]=3 25 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [1,0,0,0,0,0|2,0,0]=3 26 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [1,0,0,0,0,0|2,0,0]=3 27 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.15 NC(CO)C1=CC=NC=C1 1467AJ [1,0,0,0,0,0|3,0,0]=4 29 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [1,0,0,0,0,0|2,0,1]=4 30 B10R1.15 NCC(O)C1=CC=CC=N1 1453AJ [1,0,0,0,0,0|2,0,0]=3 31 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [1,0,0,0,0,0|2,0,0]=3 32 B10R1.15 NCC(O)C1=NC=CC=C1 9384AJ [1,0,0,0,0,0|2,0,0]=3 33 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [1,0,0,0,0,0|1,0,0]=2 34 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [1,0,0,0,0,0|2,0,1]=4 36 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.17 CCCCC1=CC=CN=C1 X7086 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.17 CCCCC1=NC=CC=C1 S413 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.17 CCNCC1=CC=CN=C1 Y5832 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.17 CNCCC1=CC=CN=C1 7424AH [1,0,0,0,0,0|1,0,0]=2 41 B10R1.17 CNCCC1=CC=NC=C1 5552AE [1,0,0,0,0,0|1,0,0]=2 42 B10R1.17 CNCCC1=CC=NC=C1 X8552 [1,0,0,0,0,0|1,0,0]=2 43 B10R1.17 CNCCC1=CN=CC=C1 6627AD [1,0,0,0,0,0|1,0,0]=2 44 B10R1.17 COCCC1=NC=CC=C1 4987AL [1,0,0,0,0,0|2,0,0]=3 45 B10R1.17 N#CCCC1=CC=CC=N1 1449AE [1,0,0,0,0,0|3,0,0]=4 46 B10R1.17 N#CCCC1=CC=NC=C1 2937AC [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 NCCCC1=CC=CC=N1 7820AA [1,0,0,0,0,0|3,0,0]=4 48 B10R1.17 NCCSC1=CC=CC=C1 6800AD [1,0,0,0,0,0|3,0,0]=4 49 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [1,0,0,0,0,0|3,0,0]=4 50 B10R1.17 OCCCC1=NC=CC=C1 5625AJ [1,0,0,0,0,0|3,0,0]=4 51 B12R1.3 CCN(CCCl)C1=CC=CC=C1 P899 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.3 CCN[C@H](CO)C1=CC=CC=C1 1422AA [0,1,0,0,0,0|2,0,0]=3 53 B12R1.16 BrCCC(Br)C1=CC=C(Br)C=C1 8745AB [0,1,0,0,0,0|3,0,0]=4 54 B12R1.16 CC1=CC=C([C@H](N)CCO)C=C1 1218AL [0,1,0,0,0,0|3,0,0]=4 55 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 O745 [0,1,0,0,0,0|1,0,0]=2 56 B12R1.16 ClC(CCBr)C1=CC=C(Br)C=C1 4041AB [0,1,0,0,0,0|3,0,0]=4 57 B12R1.16 ClC1=CC=C(C(Br)CCBr)C=C1 V4103 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.16 NC(CCO)C1=CC=C(Br)C=C1 5784AJ [0,1,0,0,0,0|3,0,0]=4 59 B12R1.16 NC(CCO)C1=CC=C(Cl)C=C1 W7847 [0,1,0,0,0,0|3,0,0]=4 60 B12R1.16 NC1=CC=C(C(N)CCO)C=C1 2347AL [0,1,0,0,0,0|3,0,0]=4 61 B12R1.16 NC1=CC=C([C@@H](N)CCO)C=C1 1318AL [0,1,0,0,0,0|3,0,0]=4 62 B12R1.16 N[C@@H](CCO)C1=CC=C(F)C=C1 1295AL [0,1,0,0,0,0|3,0,0]=4 63 B12R1.16 N[C@H](CCO)C1=CC=C(Br)C=C1 4351AH [0,1,0,0,0,0|3,0,0]=4 64 B12R1.17 CNCC(O)C1=CC(O)=CC=C1 7812AL [0,1,0,0,0,0|1,0,0]=2 65 B12R1.17 NC(CCO)C1=CC(F)=CC=C1 2346AL [0,1,0,0,0,0|3,0,0]=4 66 B12R1.17 NC(CCO)C1=CC(O)=CC=C1 2221AL [0,1,0,0,0,0|3,0,0]=4 67 B12R1.17 NC(CCO)C1=CC=CC(Br)=C1 2345AL [0,1,0,0,0,0|3,0,0]=4 68 B12R1.17 NC(CCO)C1=CC=CC(O)=C1 2190AL [0,1,0,0,0,0|3,0,0]=4 69 B12R1.17 N[C@@H](CCO)C1=CC=CC(F)=C1 1293AL [0,1,0,0,0,0|3,0,0]=4 70 B12R1.30 C[C@@H](NCCO)C1=CC=CC=C1 2547AC [0,1,0,0,0,0|2,0,0]=3 71 B12R1.30 O=CNCC(=O)C1=CC=CC=C1 1383AC [0,1,0,0,0,0|1,0,2]=4 72 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 3740AF [0,1,0,0,0,0|1,0,1]=3 73 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 W6216 [0,1,0,0,0,0|2,0,0]=3 74 B12R1.107 CC(C)CC(N)C1=NC=CC=C1 V7883 [0,1,0,0,0,0|3,0,0]=4 75 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 X9200 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.107 CC(C)NC(C)C1=CC=CC=C1 W4133 [0,1,0,0,0,0|2,0,0]=3 77 B12R1.107 CC(NC(N)=S)C1=CC=CC=C1 V7228 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.107 CN(C)C[C@@H](N)C1=CC=CC=C1 0890AC [0,1,0,0,0,0|1,0,0]=2 79 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 7718AL [0,1,0,0,0,0|2,0,1]=4 80 B12R1.308 NC(CCO)C1=C(Cl)C=CC=C1 9685AC [0,1,0,0,0,0|3,0,0]=4 81 B12R1.308 N[C@@H](CCO)C1=CC=CC=C1Cl 1292AL [0,1,0,0,0,0|3,0,0]=4 82 B12R2.2 C1=CC(C2CCCN2)=CC=N1 Q676 [0,0,0,1,0,0|3,0,0]=4 83 B12R2.2 C1=CC(C2CCNC2)=CC=N1 3704AC [0,0,0,1,0,0|1,0,0]=2 84 B12R2.2 C1=CC(C2CCNC2)=CC=N1 X4189 [0,0,0,1,0,0|1,0,0]=2 85 B12R2.2 C1=CC(C2CCNC2)=CN=C1 5164AH [0,0,0,1,0,0|1,0,0]=2 86 B12R2.2 C1=CC=C(C2CCCC2)C=C1 8394AE [0,0,0,1,0,0|1,0,0]=2 87 B12R2.2 C1=CC=C(N2CC=CC2)C=C1 0764AA [0,0,0,1,0,0|2,0,1]=4 88 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 9247AJ [0,0,0,1,0,0|2,0,0]=3 89 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 9228AJ [0,0,0,1,0,0|2,0,0]=3 90 B12R2.2 C1=CC=C([S+]2CCCC2)C=C1 0152AF [0,0,0,1,0,0|2,0,0]=3 91 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 8284AB [0,0,0,1,0,0|3,0,0]=4 92 B12R2.27 OCC1CC1C2=CC=CC=C2 9271AB [0,0,0,1,0,0|2,0,0]=3 93 B12R2.27 OC[C@H]1O[C@@H]1C2=CC=CC=C2 7395AJ [0,0,0,1,0,0|3,0,0]=4 94 B12R2.116 NC1(C2=CC=CC=C2)CCC1 8972AA [0,0,0,1,0,0|2,0,0]=3 95 B12R2.116 NC1(C2=CC=CC=C2)COC1 X3454 [0,0,0,1,0,0|2,0,0]=3 96 B12R2.116 OC1(C2=CC=CC=C2)COC1 8374AE [0,0,0,1,0,0|2,0,0]=3 97 B12R2.1081 CC1CNCC2=C1C=CC=C2 1997AA [0,0,0,1,0,0|0,0,0]=1 98 B12R2.1081 CC1CNCC2=C1C=CC=C2 Z3889 [0,0,0,1,0,0|0,0,0]=1 99 B12R2.1081 NC1CCCC2=C1N=CC=C2 Z4574 [0,0,0,1,0,0|3,0,0]=4 100 B12R2.1081 NC1CCCC2=CC=CC=C21 6757AB [0,0,0,1,0,0|2,0,0]=3 101 B12R2.1081 NC1CCCC2=CC=NC=C21 3016AJ [0,0,0,1,0,0|3,0,0]=4 102 B12R2.1081 NC1CCCC2=NC=CC=C21 5780AH [0,0,0,1,0,0|3,0,0]=4 103 B12R2.1081 NC1CCNC2=CC=CC=C21 1769AC [0,0,0,1,0,0|3,0,0]=4 104 B12R2.1081 NC1CCNC2=CC=CC=C21 2501AC [0,0,0,1,0,0|3,0,0]=4 105 B12R2.1081 NC1COCC2=C1C=CC=C2 2575AA [0,0,0,1,0,0|2,0,0]=3 106 B12R2.1081 NC1COCC2=C1C=CC=C2 W3221 [0,0,0,1,0,0|2,0,0]=3 107 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 B572 [0,0,0,1,0,0|2,0,0]=3 108 B12R2.1081 N[C@H]1CCCC2=C1N=CC=C2 4707AB [0,0,0,1,0,0|3,0,0]=4 109 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 2977AH [0,0,0,1,0,0|3,0,0]=4 110 B12R2.1081 OC1CCNC2=C1C=CC=C2 1766AB [0,0,0,1,0,0|3,0,0]=4 111 B12R2.1081 OC1COCC2=CC=CC=C21 0698AB [0,0,0,1,0,0|2,0,0]=3 112 B12R2.1081 O[C@@H]1CCCC2=CC=CC=C21 1543AB [0,0,0,1,0,0|2,0,0]=3 113 B12R2.2028 CN1N=C(Br)C2=CC=CC=C21 V2198 [0,0,0,1,0,0|2,0,1]=4 114 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 X6396 [0,0,0,1,0,0|2,0,0]=3 115 B12R2.2075 NC(C1=NC=CC=C1)C2CC2 X2985 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.2075 N[C@H](C1=CC=CC=C1)C2CC2 W8707 [0,0,0,1,0,0|2,0,0]=3 117 B12R2.2075 OC(C1=CN=CC=C1)C2CC2 6518AJ [0,0,0,1,0,0|3,0,0]=4 118 B10R1.11 CCCC(N)C1=CC=CS1 4090AE [0,0,0,0,1,0|3,0,0]=4 119 B12R1.32 CN(CC#N)CC1=CC=CC=C1 1817AL [0,0,0,0,0,1|3,0,0]=4 120 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [2,0,0,0,0,0|2,0,0]=4 122 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [2,0,0,0,0,0|2,0,0]=4 123 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [2,0,0,0,0,0|1,0,0]=3 124 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [2,0,0,0,0,0|1,0,0]=3 125 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [2,0,0,0,0,0|1,0,0]=3 126 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [2,0,0,0,0,0|1,0,0]=3 127 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [2,0,0,0,0,0|1,0,1]=4 128 B9R1.8 BrCCC1=CC=CC=N1 5125AB [2,0,0,0,0,0|2,0,0]=4 129 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [2,0,0,0,0,0|1,0,0]=3 130 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [2,0,0,0,0,0|1,0,0]=3 131 B9R1.8 CNCC1=CC=CC=C1 3855AD [2,0,0,0,0,0|0,0,0]=2 132 B9R1.8 CNCC1=CC=CC=N1 7146AD [2,0,0,0,0,0|1,0,0]=3 133 B9R1.8 CNCC1=CC=NC=N1 6023AD [2,0,0,0,0,0|2,0,0]=4 134 B9R1.8 CNCC1=NC=CC=N1 X8879 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.8 CNCC1=NC=CN=C1 X9439 [2,0,0,0,0,0|2,0,0]=4 136 B9R1.8 CNNC1=CC=CC=C1 V2456 [2,0,0,0,0,0|1,0,0]=3 137 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [2,0,0,0,0,0|0,0,2]=4 138 B9R1.8 ClCCC1=NC=CC=C1 X6257 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.8 NCCC1=CC=CN=C1 5033AC [2,0,0,0,0,0|1,0,0]=3 140 B9R1.8 NCCC1=CN=CC=N1 1878AJ [2,0,0,0,0,0|2,0,0]=4 141 B9R1.8 NCCC1=NC=CN=C1 Y9352 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.8 NNCC1=CC=CC=N1 4874AC [2,0,0,0,0,0|2,0,0]=4 143 B9R1.8 NOCC1=CC=CN=C1 7306AJ [2,0,0,0,0,0|2,0,0]=4 144 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 3361AA [1,1,0,0,0,0|0,0,2]=4 145 B11R1.7 CC(C)(CN)C1=CC=CC=C1 0879AB [1,1,0,0,0,0|0,0,0]=2 146 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [1,1,0,0,0,0|1,0,0]=3 147 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [1,1,0,0,0,0|0,0,0]=2 148 B11R1.7 CCC(F)(F)C1=CC=CC=C1 9060AE [1,1,0,0,0,0|1,0,0]=3 149 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 M421 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 Y7004 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.7 NCC(F)(F)C1=NC=CC=C1 2429AB [1,1,0,0,0,0|2,0,0]=4 152 B11R1.12 CCC(CC)C1=NC=CC=C1 5008AL [1,1,0,0,0,0|1,0,0]=3 153 B11R1.12 CCC(CN)C1=CC=CC=C1 V4239 [1,1,0,0,0,0|0,0,0]=2 154 B11R1.12 CCC(NC)C1=CC=CC=C1 8595AL [1,1,0,0,0,0|0,0,0]=2 155 B11R1.12 CCC(NN)C1=CC=CC=C1 8342AH [1,1,0,0,0,0|1,0,0]=3 156 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 3045AC [1,1,0,0,0,0|0,0,0]=2 157 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 7034AA [1,1,0,0,0,0|0,0,0]=2 158 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [1,1,0,0,0,0|0,0,2]=4 159 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [1,1,0,0,0,0|1,0,1]=4 160 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [1,1,0,0,0,0|1,0,0]=3 161 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [1,1,0,0,0,0|1,0,0]=3 162 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [1,1,0,0,0,0|1,0,1]=4 163 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [1,1,0,0,0,0|1,0,0]=3 164 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [1,1,0,0,0,0|1,0,0]=3 165 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [1,1,0,0,0,0|1,0,0]=3 166 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [1,1,0,0,0,0|1,0,0]=3 167 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [1,1,0,0,0,0|1,0,0]=3 168 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [1,1,0,0,0,0|2,0,0]=4 169 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [1,1,0,0,0,0|1,0,0]=3 170 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [1,1,0,0,0,0|1,0,0]=3 171 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [1,1,0,0,0,0|1,0,0]=3 172 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 2642AB [1,1,0,0,0,0|1,0,1]=4 173 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [1,1,0,0,0,0|0,0,0]=2 174 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [1,1,0,0,0,0|1,0,0]=3 175 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [1,1,0,0,0,0|2,0,0]=4 176 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [1,1,0,0,0,0|1,0,1]=4 177 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [1,1,0,0,0,0|1,0,0]=3 178 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [1,1,0,0,0,0|1,0,0]=3 179 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [1,1,0,0,0,0|1,0,0]=3 180 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [1,1,0,0,0,0|2,0,0]=4 181 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [1,1,0,0,0,0|2,0,0]=4 182 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.23 CC(CO)C1=CC=CC(=O)C1 W6317 [1,1,0,0,0,0|1,0,1]=4 184 B11R1.23 CC1=CC=CC(C(O)CN)=C1 7583AB [1,1,0,0,0,0|1,0,0]=3 185 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 2535AE [1,1,0,0,0,0|1,0,0]=3 186 B11R1.23 CCC(N)C1=CC(N)=CC=C1 1913AJ [1,1,0,0,0,0|1,0,0]=3 187 B11R1.23 CCC(N)C1=NC=CC(C)=C1 9648AC [1,1,0,0,0,0|2,0,0]=4 188 B11R1.23 CCS(=O)C1=CC(Br)=CC=C1 V3491 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 X9176 [1,1,0,0,0,0|1,0,0]=3 190 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 9082AH [1,1,0,0,0,0|1,0,0]=3 191 B11R1.23 CNC(=O)C1=CC(Cl)=CC=C1 8051AJ [1,1,0,0,0,0|1,0,1]=4 192 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 2288AJ [1,1,0,0,0,0|1,0,1]=4 193 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 3155AH [1,1,0,0,0,0|2,0,0]=4 194 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 9285AB [1,1,0,0,0,0|1,0,1]=4 195 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 5755AC [1,1,0,0,0,0|1,0,1]=4 196 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 V2280 [1,1,0,0,0,0|1,0,1]=4 197 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 2712AC [1,1,0,0,0,0|1,0,0]=3 198 B11R1.23 NCC(O)C1=CC(F)=CC=C1 5405AB [1,1,0,0,0,0|1,0,0]=3 199 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 N836 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.23 OCC(Cl)C1=CC=CC(Cl)=C1 2029AL [1,1,0,0,0,0|2,0,0]=4 201 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 6985AA [1,1,0,0,0,0|2,0,0]=4 203 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [1,1,0,0,0,0|1,0,1]=4 204 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [1,1,0,0,0,0|1,0,0]=3 205 B11R1.36 CC(C)C(N)C1=CC=CC=N1 9319AH [1,1,0,0,0,0|2,0,0]=4 206 B11R1.36 CC(C)C(N)C1=CC=NC=C1 1775AJ [1,1,0,0,0,0|2,0,0]=4 207 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [1,1,0,0,0,0|1,0,0]=3 208 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [1,1,0,0,0,0|1,0,1]=4 209 B11R1.222 CC1=CC=CC=C1C(=O)CN X6576 [1,1,0,0,0,0|1,0,1]=4 210 B11R1.222 CC[C@@H](N)C1=CC=CC=C1C W8813 [1,1,0,0,0,0|1,0,0]=3 211 B11R1.222 CC[C@H](N)C1=CC=CC=C1Cl W8965 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [1,1,0,0,0,0|1,0,0]=3 213 B11R1.222 NCC(O)C1=CC=CC=C1F 3587AB [1,1,0,0,0,0|1,0,0]=3 214 B11R1.1 BrCCCC1=CC=C(Br)C=C1 Y4633 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [1,1,0,0,0,0|1,0,1]=4 216 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [1,1,0,0,0,0|2,0,0]=4 218 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [1,1,0,0,0,0|2,0,0]=4 219 B11R1.1 CCNCC1=CC=C(N)C=C1 7272AJ [1,1,0,0,0,0|2,0,0]=4 220 B11R1.1 CCNCC1=CC=C(O)C=C1 6053AJ [1,1,0,0,0,0|2,0,0]=4 221 B11R1.1 CCOCC1=CC=C(O)C=C1 Z4904 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.1 CNCCC1=CC=C(Br)C=C1 V7496 [1,1,0,0,0,0|0,0,0]=2 223 B11R1.1 CN\N=N\C1=CC=C(C)C=C1 4909AL [1,1,0,0,0,0|2,0,0]=4 224 B11R1.1 COCCC1=CC=C(Br)C=C1 V6879 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.1 COCOC1=CC=C(Br)C=C1 V4696 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.1 ClCCCC1=CC=C(Br)C=C1 Y9960 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.1 FC1=CC=C(CCCBr)C=C1 V4639 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.1 NCCCC1=CC=C(Cl)C=C1 9748AA [1,1,0,0,0,0|2,0,0]=4 229 B11R1.1 NCCCC1=CC=C(F)C=C1 3289AD [1,1,0,0,0,0|2,0,0]=4 230 B11R1.1 NCCCC1=CC=C(F)C=C1 7357AC [1,1,0,0,0,0|2,0,0]=4 231 B11R1.1 NCCCC1=CC=C(N)C=C1 9266AB [1,1,0,0,0,0|2,0,0]=4 232 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [1,1,0,0,0,0|2,0,0]=4 233 B11R1.1 OCCCC1=CC=C(F)C=C1 V7380 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.17 C=CCCC1=C(Br)C=CC=C1 8652AE [1,1,0,0,0,0|1,0,1]=4 235 B11R1.17 CCCNC1=C(Cl)C=CC=C1 5500AE [1,1,0,0,0,0|2,0,0]=4 236 B11R1.17 CCNCC1=C(O)C=CC=C1 5372AJ [1,1,0,0,0,0|2,0,0]=4 237 B11R1.17 CCSCC1=CC=CC=C1Br V9925 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.17 CNCCC1=C(F)C=CC=C1 4862AJ [1,1,0,0,0,0|0,0,0]=2 239 B11R1.17 ClC1=CC=CC=C1CCCBr V6557 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.17 FC1=CC=CC=C1CCCBr Z9473 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.17 N#CCCC1=C(N)C=CC=C1 8000AB [1,1,0,0,0,0|2,0,0]=4 242 B11R1.24 C=CCCC1=CC=CC(Cl)=C1 2995AF [1,1,0,0,0,0|1,0,1]=4 243 B11R1.24 CC1=CC(CCCO)=CC=C1 3205AH [1,1,0,0,0,0|2,0,0]=4 244 B11R1.24 CCCNC1=CC(C)=CC=C1 4247AD [1,1,0,0,0,0|2,0,0]=4 245 B11R1.24 CCCNC1=CC(Cl)=CC=C1 9833AD [1,1,0,0,0,0|2,0,0]=4 246 B11R1.24 CNCCC1=CC(C)=CC=C1 V2677 [1,1,0,0,0,0|0,0,0]=2 247 B11R1.24 CNCCC1=CC=CC(Cl)=C1 V6388 [1,1,0,0,0,0|0,0,0]=2 248 B11R1.24 CNCCC1=CC=CC(F)=C1 V6333 [1,1,0,0,0,0|0,0,0]=2 249 B11R1.24 ClC1=CC(CCCBr)=CC=C1 V8963 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.24 O=CCCC1=CC=CC(Cl)=C1 3971AD [1,1,0,0,0,0|2,0,0]=4 251 B11R1.24 O=CCCC1=CC=CC(F)=C1 1852AB [1,1,0,0,0,0|2,0,0]=4 252 B11R1.24 OCCCC1=CC(O)=CC=C1 W3104 [1,1,0,0,0,0|2,0,0]=4 253 B11R1.24 OCCCC1=CC=CC(Cl)=C1 V4535 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.28 CNCCCC1=CC=CC=C1 1600AB [1,1,0,0,0,0|0,0,0]=2 255 B11R1.28 CNCCCC1=CC=CC=C1 3594AL [1,1,0,0,0,0|0,0,0]=2 256 B11R1.28 CNCCCC1=CC=CC=N1 7821AA [1,1,0,0,0,0|1,0,0]=3 257 B11R1.28 ClCCCOC1=CC=CC=C1 0684AE [1,1,0,0,0,0|2,0,0]=4 258 B11R1.28 ClCCNCC1=CC=CC=C1 3046AE [1,1,0,0,0,0|2,0,0]=4 259 B11R1.28 ClCCNCC1=CC=CC=C1 7007AE [1,1,0,0,0,0|2,0,0]=4 260 B11R1.28 ClCCOCC1=CC=CC=C1 8862AA [1,1,0,0,0,0|2,0,0]=4 261 B11R1.28 N#CCNCC1=CC=CC=C1 3124AB [1,1,0,0,0,0|2,0,0]=4 262 B11R1.28 NOCOCC1=CC=CC=C1 2357AF [1,1,0,0,0,0|2,0,0]=4 263 B11R1.28 OCCCCC1=CC=CN=C1 5963AJ [1,1,0,0,0,0|2,0,0]=4 264 B11R1.28 OCCCCC1=CC=NC=C1 5977AJ [1,1,0,0,0,0|2,0,0]=4 265 B11R1.28 OCCCCC1=NC=CC=C1 6014AJ [1,1,0,0,0,0|2,0,0]=4 266 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [1,1,0,0,0,0|1,0,1]=4 267 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [1,1,0,0,0,0|2,0,0]=4 268 B11R1.40 CNC(=O)CC1=CN=CC=C1 8304AC [1,1,0,0,0,0|1,0,1]=4 269 B11R1.40 CNC(=S)NC1=CC=CC=C1 S792 [1,1,0,0,0,0|1,0,1]=4 270 B11R1.40 CNC(C)CC1=NC=CN=C1 3718AF [1,1,0,0,0,0|2,0,0]=4 271 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [1,1,0,0,0,0|2,0,0]=4 272 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [1,1,0,0,0,0|2,0,0]=4 273 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [1,1,0,0,0,0|2,0,0]=4 274 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [1,1,0,0,0,0|2,0,0]=4 275 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [1,1,0,0,0,0|2,0,0]=4 276 B11R1.29 CNCCC(O)C1=CC=CS1 2706AA [0,1,0,0,1,0|2,0,0]=4 277 B13R1.19 CNCC(=O)NC1=CC=C(C)C=C1 7364AE [0,1,0,0,0,1|1,0,1]=4 278 B13R1.19 COCC(C)OC1=CC=C(N)C=C1 7881AE [0,1,0,0,0,1|1,0,0]=3 279 B13R1.20 CNCC(=O)NC1=CC(C)=CC=C1 2385AD [0,1,0,0,0,1|1,0,1]=4 280 B13R1.44 CN(CCCN)CC1=CC=CC=C1 0502AA [0,1,0,0,0,1|2,0,0]=4 281 B13R1.44 CN(CCCN)CC1=CC=CC=C1 6729AA [0,1,0,0,0,1|2,0,0]=4 282 B13R1.135 CC(OC1=CC=CC=C1)C(=O)NN 4839AE [0,1,0,0,0,1|1,0,1]=4 283 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 2851AD [0,1,0,0,0,1|1,0,1]=4 284 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 7143AA [0,1,0,0,0,1|1,0,1]=4 285 B13R1.470 CNCC(=O)NC1=CC=CC=C1C 8085AC [0,1,0,0,0,1|1,0,1]=4 286 B13R1.26 COC(CCC#N)C1=CC=CC=C1 8550AE [0,2,0,0,0,0|1,0,1]=4 287 B13R1.532 CCC(C(=O)NN)C1=CC=CC=C1 1395AE [0,2,0,0,0,0|1,0,1]=4 288 B13R1.532 CCC(C(=O)OC)C1=CC=CC=C1 1460AB [0,2,0,0,0,0|1,0,1]=4 289 B13R1.532 COC(=O)C(CN)C1=CC=CC=C1 7007AJ [0,2,0,0,0,0|1,0,1]=4 290 B13R1.713 CC(=O)N[C@@H](CO)C1=CC=CC=C1 7509AH [0,2,0,0,0,0|2,0,0]=4 291 B13R1.713 CNC(CN(C)C)C1=CC=CC=C1 4473AH [0,2,0,0,0,0|0,0,0]=2 292 B13R1.466 CNCC(=O)C1=CC(O)=C(O)C=C1 Q759 [0,2,0,0,0,0|1,0,1]=4 293 B13R1.466 CNCC(O)C1=CC=C(O)C(O)=C1 X0382 [0,2,0,0,0,0|1,0,0]=3 294 B13R1.11 CC(NC(=O)CBr)C1=CC=CC=C1 8397AE [0,2,0,0,0,0|2,0,0]=4 295 B13R1.11 COC(=O)C[C@@H](N)C1=CC=CC=C1 3493AL [0,2,0,0,0,0|2,0,0]=4 296 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 B603 [0,2,0,0,0,0|2,0,0]=4 297 B13R1.11 C[C@@H](NC(=O)CCl)C1=CC=CC=C1 2062AL [0,2,0,0,0,0|2,0,0]=4 298 B13R1.24 CC(NCCC#N)C1=CC=CC=C1 8981AC [0,2,0,0,0,0|1,0,1]=4 299 B13R1.24 CC(NCCCN)C1=CC=CC=C1 4863AE [0,2,0,0,0,0|1,0,0]=3 300 B13R1.45 CN(C)CCC(Cl)C1=CC=CC=C1 8635AH [0,2,0,0,0,0|1,0,0]=3 301 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 6102AC [0,2,0,0,0,0|1,0,0]=3 302 B13R1.45 CN(C)CC[C@@H](O)C1=CC=CC=C1 3422AD [0,2,0,0,0,0|1,0,0]=3 303 B13R1.122 CNCCS(=O)(=O)C1=CC=CC=C1 4175AH [0,2,0,0,0,0|2,0,0]=4 304 B13R1.152 CN(C)C(=O)[C@@H](N)C1=CC=CC=C1 1732AE [0,2,0,0,0,0|1,0,1]=4 305 B13R1.708 COC(=O)C(C)(N)C1=CC=CC=C1 Y6237 [0,2,0,0,0,0|1,0,1]=4 306 B13R1.347 CC(O)CC(C)(C)C1=CC=CC=C1 0439AB [0,2,0,0,0,0|1,0,0]=3 307 B11R2.1 NC1CCC2=C1N=CC=C2 9677AA [1,0,0,1,0,0|2,0,0]=4 308 B11R2.1 NC1CCC2=CC=CN=C21 3374AJ [1,0,0,1,0,0|2,0,0]=4 309 B11R2.1 NC1COC2=CC=CC=C21 4904AH [1,0,0,1,0,0|2,0,0]=4 310 B11R2.1 N[C@H]1COC2=C1C=CC=C2 1110AL [1,0,0,1,0,0|2,0,0]=4 311 B11R2.1 O[C@H]1CCC2=CC=CN=C21 4628AC [1,0,0,1,0,0|2,0,0]=4 312 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [1,0,0,1,0,0|0,0,0]=2 313 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [1,0,0,1,0,0|0,0,0]=2 314 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [1,0,0,1,0,0|0,0,0]=2 315 B11R2.40 NC1(C2=CN=CC=C2)CC1 6906AB [1,0,0,1,0,0|2,0,0]=4 316 B11R2.40 NC1(C2=NC=CC=C2)CC1 6037AB [1,0,0,1,0,0|2,0,0]=4 317 B11R2.20 C1=CC2=C(C=C1)CNNC2 5003AJ [1,0,0,1,0,0|1,0,0]=3 318 B11R2.20 C1=CC2=C(C=N1)CCNC2 W5369 [1,0,0,1,0,0|1,0,0]=3 319 B11R2.20 C1=CC2=C(CCNC2)N=C1 W8563 [1,0,0,1,0,0|1,0,0]=3 320 B11R2.20 C1=CC2=C(CNCC2)N=C1 6451AA [1,0,0,1,0,0|1,0,0]=3 321 B11R2.20 C1=CC2=C(CNCC2)N=C1 Z4098 [1,0,0,1,0,0|1,0,0]=3 322 B11R2.20 C1=CC=C2CCN=CC2=C1 3596AB [1,0,0,1,0,0|0,0,2]=4 323 B11R2.20 C1=NC=C2CCNCC2=C1 9567AH [1,0,0,1,0,0|1,0,0]=3 324 B11R2.20 C1=NC=NC2=C1CNCC2 W4126 [1,0,0,1,0,0|2,0,0]=4 325 B11R2.20 C1=NC=NC2=C1CNCC2 W4399 [1,0,0,1,0,0|2,0,0]=4 326 B13R2.15 OC1CCCC1C2=CC=CC=C2 2167AL [0,0,0,1,0,1|2,0,0]=4 327 B13R2.26 CNCC1=CC2=CC=CC=C2S1 Y4223 [0,0,0,1,0,1|0,0,2]=4 328 B13R2.26 CNCC1=NC2=CC=CC=C2S1 5904AD [0,0,0,1,0,1|1,0,1]=4 329 B13R2.26 CNCC1CC2=C(C=CC=C2)O1 8442AH [0,0,0,1,0,1|0,0,0]=2 330 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 2369AL [0,0,0,1,0,1|2,0,0]=4 331 B13R2.64 C1=CC=C(NC2CCNC2)C=C1 5926AD [0,0,0,1,0,1|0,0,0]=2 332 B13R2.64 C1=CC=C(O[C@H]2CCNC2)N=C1 9119AH [0,0,0,1,0,1|1,0,0]=3 333 B13R2.1 NCCC1CNC2=C1C=CC=C2 X9777 [0,1,0,1,0,0|2,0,0]=4 334 B13R2.3 C1=CC(C2CCCCN2)=CC=N1 V3318 [0,1,0,1,0,0|2,0,0]=4 335 B13R2.3 C1=CC(C2CCCNC2)=NC=N1 0141AD [0,1,0,1,0,0|2,0,0]=4 336 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 H332 [0,1,0,1,0,0|0,0,1]=3 337 B13R2.3 C1=CC=C(C2=CCOCC2)C=C1 Y8690 [0,1,0,1,0,0|1,0,1]=4 338 B13R2.3 C1=CC=C(C2CCCCN2)N=C1 4891AD [0,1,0,1,0,0|2,0,0]=4 339 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 W4163 [0,1,0,1,0,0|0,0,0]=2 340 B13R2.3 C1=CC=C(C2CNCCO2)C=C1 Y5355 [0,1,0,1,0,0|0,0,0]=2 341 B13R2.3 C1=CC=C(C2CSCCN2)C=C1 W3091 [0,1,0,1,0,0|1,0,0]=3 342 B13R2.3 C1=CC=C([C@@H]2CCCCN2)N=C1 0333AQ [0,1,0,1,0,0|2,0,0]=4 343 B13R2.3 C1=CC=C([C@@H]2COCCN2)C=C1 1581AC [0,1,0,1,0,0|1,0,0]=3 344 B13R2.3 C1=CC=C([C@H]2CCCCN2)C=C1 X3798 [0,1,0,1,0,0|1,0,0]=3 345 B13R2.3 C1=CC=C([C@H]2CCCCN2)N=C1 0328AQ [0,1,0,1,0,0|2,0,0]=4 346 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 W6259 [0,1,0,1,0,0|0,0,0]=2 347 B13R2.3 C1=CC=C([C@H]2CNCCO2)C=C1 1584AC [0,1,0,1,0,0|0,0,0]=2 348 B13R2.3 C1=CC=C([C@H]2COCCN2)C=C1 5326AC [0,1,0,1,0,0|1,0,0]=3 349 B13R2.3 C1=CN=C(C2CCCNC2)C=C1 5578AB [0,1,0,1,0,0|1,0,0]=3 350 B13R2.3 C1=CN=CC(C2CNCCN2)=C1 4882AH [0,1,0,1,0,0|1,0,0]=3 351 B13R2.3 C1=CN=CC(C2CNCCO2)=C1 4881AH [0,1,0,1,0,0|1,0,0]=3 352 B13R2.3 C1=CN=CC(N2CCNCC2)=C1 X8542 [0,1,0,1,0,0|2,0,0]=4 353 B13R2.1613 CCC1NCCC2=C1C=CC=C2 0911AA [0,1,0,1,0,0|2,0,0]=4 354 B13R2.1613 NCC1CCCC2=C1C=CC=C2 4700AJ [0,1,0,1,0,0|1,0,0]=3 355 B13R2.1613 NCC1CCCC2=C1C=CC=C2 9578AH [0,1,0,1,0,0|1,0,0]=3 356 B13R2.1613 NCC1CCCC2=CC=CC=C21 8301AH [0,1,0,1,0,0|1,0,0]=3 357 B13R2.1613 NCC1OCCC2=CC=CC=C21 6452AD [0,1,0,1,0,0|2,0,0]=4 358 B13R2.2539 NCC1(C2=CC=CC=C2)CCC1 2925AF [0,1,0,1,0,0|1,0,0]=3 359 B13R2.2539 NCC1(C2=CC=CC=C2)CCC1 V4290 [0,1,0,1,0,0|1,0,0]=3 360 B13R2.2539 OCC1(C2=CC=CC=C2)COC1 Y7108 [0,1,0,1,0,0|1,0,0]=3 361 B13R2.2931 CN1C=C(CN)C2=CC=CC=C21 0594AQ [0,1,0,1,0,0|0,0,2]=4 362 B13R2.2931 CN1C=C(CO)C2=CC=CC=C21 1025AL [0,1,0,1,0,0|0,0,2]=4 363 B13R2.2931 CN1N=C(CCl)C2=C1C=CC=C2 Y7665 [0,1,0,1,0,0|1,0,1]=4 364 B13R2.2931 CN1N=C(CN)C2=C1C=CC=C2 W8185 [0,1,0,1,0,0|1,0,1]=4 365 B13R2.2931 CN1N=C(CN)C2=C1C=CC=C2 Y7024 [0,1,0,1,0,0|1,0,1]=4 366 B13R2.12 BrC1=CC=C(C2CCCN2)C=C1 1158AJ [0,1,0,1,0,0|2,0,0]=4 367 B13R2.12 BrC1=CC=C(C2CCNC2)C=C1 3126AA [0,1,0,1,0,0|0,0,0]=2 368 B13R2.12 ClC1=CC=C(C2CCNC2)C=C1 3541AA [0,1,0,1,0,0|0,0,0]=2 369 B13R2.12 FC1=CC=C(C2CCNC2)C=C1 1995AJ [0,1,0,1,0,0|0,0,0]=2 370 B13R2.12 FC1=CC=C([C@@H]2CCCN2)C=C1 3069AB [0,1,0,1,0,0|2,0,0]=4 371 B13R2.12 FC1=CC=C([C@H]2CCCN2)C=C1 3068AB [0,1,0,1,0,0|2,0,0]=4 372 B13R2.12 NC1=CC=C(N2CCCC2)C=C1 5939AJ [0,1,0,1,0,0|2,0,0]=4 373 B13R2.12 NC1=CC=C(N2CCCC2)C=C1 W3557 [0,1,0,1,0,0|2,0,0]=4 374 B13R2.147 OC1CC(C2=CC=C(Br)C=C2)C1 5654AJ [0,1,0,1,0,0|2,0,0]=4 375 B13R2.520 N[C@H](C1=CC=C(F)C=C1)C2CC2 X9412 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.520 OC(C1=CC=C(Br)C=C1)C2CC2 8428AE [0,1,0,1,0,0|2,0,0]=4 377 B13R2.2986 NC1(C2=CC=C(Br)C=C2)CCC1 X9377 [0,1,0,1,0,0|2,0,0]=4 378 B13R2.5179 NC1CCCC2=C1C=CC(Br)=C2 6114AA [0,1,0,1,0,0|2,0,0]=4 379 B13R2.5187 CC1=NN(C)C2=C1C=CC(N)=C2 Z6811 [0,1,0,1,0,0|1,0,1]=4 380 B13R2.13 BrC1=CC=CC([C@@H]2CCCN2)=C1 1081AL [0,1,0,1,0,0|2,0,0]=4 381 B13R2.13 BrC1=CC=CC([C@H]2CCCN2)=C1 1073AL [0,1,0,1,0,0|2,0,0]=4 382 B13R2.13 ClC1=CC(C2CCNC2)=CC=C1 1870AA [0,1,0,1,0,0|0,0,0]=2 383 B13R2.13 ClC1=CC([C@@H]2CCCN2)=CC=C1 8569AH [0,1,0,1,0,0|2,0,0]=4 384 B13R2.13 FC1=CC(C2CCCN2)=CC=C1 Q590 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 4837AJ [0,1,0,1,0,0|2,0,0]=4 386 B13R2.13 FC1=CC([C@H]2CCCN2)=CC=C1 4802AJ [0,1,0,1,0,0|2,0,0]=4 387 B13R2.13 FC1=CC([C@H]2CCCN2)=CC=C1 X6111 [0,1,0,1,0,0|2,0,0]=4 388 B13R2.13 FC1=CC=CC([C@H]2CCCN2)=C1 4801AJ [0,1,0,1,0,0|2,0,0]=4 389 B13R2.13 NC1=CC=CC(N2CCCC2)=C1 Y7126 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.162 CN1CCCC2=C1C=C(N)C=C2 W9559 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.162 CN1CCCC2=C1C=C(N)C=C2 Y6168 [0,1,0,1,0,0|2,0,0]=4 392 B13R2.162 N[C@H]1CCCC2=CC=C(Br)C=C21 9200AH [0,1,0,1,0,0|2,0,0]=4 393 B13R2.162 OC1=CC2=C(C=C1)CNCC2O 5768AC [0,1,0,1,0,0|1,0,0]=3 394 B13R2.342 NC1CCCC2=C(Br)C=CC=C21 2885AL [0,1,0,1,0,0|2,0,0]=4 395 B13R2.342 N[C@H]1CCCC2=C(Cl)C=CC=C21 8405AH [0,1,0,1,0,0|2,0,0]=4 396 B13R2.3018 NC1(C2=CC(Br)=CC=C2)CCC1 4414AA [0,1,0,1,0,0|2,0,0]=4 397 B13R2.223 BrC1(C2=CC=CC=C2)C=CCC1 V7219 [0,1,0,1,0,0|1,0,1]=4 398 B13R2.223 OC1(C2=CC=CC=C2)CCNC1 5379AH [0,1,0,1,0,0|0,0,0]=2 399 B13R2.5252 NC1CCCNC2=CC=CC=C21 1337AJ [0,1,0,1,0,0|2,0,0]=4 400 B13R2.8137 NC(C1=CC=CC=C1)C2CCC2 6578AJ [0,1,0,1,0,0|2,0,0]=4 401 B13R2.32 NC1C2=C(C=CC=C2)CCC1O 0730AA [0,1,0,1,0,0|2,0,0]=4 402 B13R2.32 NC1CCC2=CC=CC=C2C1O 0733AA [0,1,0,1,0,0|2,0,0]=4 403 B13R2.3063 CC(O)(C1=CC=CC=C1)C2CC2 1617AL [0,1,0,1,0,0|1,0,0]=3 404 B13R2.3122 CC1(C)CCNC2=CC=CC=C21 2555AJ [0,1,0,1,0,0|2,0,0]=4 405 B13R2.3122 CC1(C)CNCC2=CC=CC=C21 2308AC [0,1,0,1,0,0|0,0,0]=2 406 B13R2.3122 CC1(C)NCCC2=CC=CC=C21 5722AB [0,1,0,1,0,0|2,0,0]=4 407 B13R2.12159 CC1=CC(C)(C)C2=C1C=CC=C2 1053AB [0,1,0,1,0,0|1,0,1]=4 408 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 6031AC [0,1,0,1,0,0|2,0,0]=4 409 B13R2.18 BrC1=CC=CC=C1C2CCCN2 X9751 [0,1,0,1,0,0|2,0,0]=4 410 B13R2.18 BrC1=CC=CC=C1N2CCCC2 V8540 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.18 ClC1=CC=CC=C1C2CCNC2 4243AC [0,1,0,1,0,0|0,0,0]=2 412 B13R2.18 FC1=CC=CC=C1C2CCNC2 6131AC [0,1,0,1,0,0|0,0,0]=2 413 B13R2.18 NC1=CC=CC=C1N2CCCC2 V4377 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.3097 N[C@H](C1=C(F)C=CC=C1)C2CC2 2971AC [0,1,0,1,0,0|2,0,0]=4 415 B13R3.1962 [C@@H]12CC[C@@H](N1)C3=C2C=CC=C3 3032AH [0,0,0,2,0,0|2,0,0]=4 416 B9R1.12 CCCCC1=CC=CO1 5552AL [1,0,0,0,1,0|2,0,0]=4 417 B9R1.12 CNCCC1=CNN=C1 4405AF [1,0,0,0,1,0|2,0,0]=4 418 B13R1.42 CCCC(C)NCC1=CC=CC=C1 6762AE [0,0,0,0,0,2|1,0,0]=3 419 B13R1.42 CNCC(O)COC1=CC=CC=C1 2455AE [0,0,0,0,0,2|1,0,0]=3