0 B12R1.21 C=C(Cl)CCC1=CC=C(Cl)C=C1 8896AE [0,0,0,0,0,0|2,0,1]=3 1 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 2186AC [0,0,0,0,0,0|0,0,0]=0 2 B12R1.21 CC(=O)CCC1=CC=C(Cl)C=C1 1146AE [0,0,0,0,0,0|1,0,0]=1 3 B12R1.21 CC(=O)NCC1=CC=C(Cl)N=C1 5859AD [0,0,0,0,0,0|3,0,0]=3 4 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 0915AF [0,0,0,0,0,0|2,0,0]=2 5 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 8152AA [0,0,0,0,0,0|1,0,2]=3 6 B12R1.21 CC(C)NCC1=CC=C(N)C=C1 7280AJ [0,0,0,0,0,0|3,0,1]=4 7 B12R1.21 CC(O)CCC1=CC=C(O)C=C1 6197AL [0,0,0,0,0,0|1,0,2]=3 8 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7457AD [0,0,0,0,0,0|2,0,0]=2 9 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7458AD [0,0,0,0,0,0|2,0,0]=2 10 B12R1.21 CC1=CC=C(NNC(N)=S)C=C1 9022AE [0,0,0,0,0,0|3,1,0]=4 11 B12R1.21 CC1=CC=C(NNC(N)=S)C=C1 9023AE [0,0,0,0,0,0|3,1,0]=4 12 B12R1.21 CC1=CC=C(OCC(C)O)C=C1 4293AL [0,0,0,0,0,0|1,0,2]=3 13 B12R1.21 CC1=CC=C(\C=C\C(=O)Cl)C=C1 3924AD [0,0,0,0,0,0|1,0,2]=3 14 B12R1.21 C[C@H](O)CCC1=CC=C(O)C=C1 9964AJ [0,0,0,0,0,0|1,0,2]=3 15 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 6319AE [0,0,0,0,0,0|4,0,0]=4 16 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 0097AE [0,0,0,0,0,0|4,0,0]=4 17 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 1170AJ [0,0,0,0,0,0|4,0,0]=4 18 B12R1.21 NC(=[NH2+])SCC1=CC=C(Br)C=C1 AMTEC010 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.21 NC(=[NH2+])SCC1=CC=C(F)C=C1 AMTEC009 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 W4673 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.21 NC1=CC=C(SCC(=O)O)C=C1 8075AF [0,0,0,0,0,0|3,0,0]=3 22 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 7761AB [0,0,0,0,0,0|2,0,2]=4 23 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Cl)C=C1 4346AF [0,0,0,0,0,0|2,0,2]=4 24 B12R1.21 O=C(O)C=CC1=CC=C(S)C=C1 2914AB [0,0,0,0,0,0|2,0,2]=4 25 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 O075 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 8063AF [0,0,0,0,0,0|3,0,0]=3 27 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [1,0,0,0,0,0|0,0,1]=2 28 B11R1.1 C=CCOC1=CC=C(N)C=C1 5430AD [1,0,0,0,0,0|2,0,1]=4 29 B11R1.1 CC1=CC=C(CN=[N+]=[N-])C=C1 5559AD [1,0,0,0,0,0|3,0,0]=4 30 B11R1.1 CC1=CC=C(NCCO)C=C1 9296AD [1,0,0,0,0,0|1,0,2]=4 31 B11R1.1 CC1=CC=C(OCCBr)C=C1 V3999 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.1 CC1=CC=C(OCCCl)C=C1 7057AD [1,0,0,0,0,0|2,0,1]=4 33 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [1,0,0,0,0,0|0,0,1]=2 34 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [1,0,0,0,0,0|2,0,1]=4 35 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [1,0,0,0,0,0|1,0,1]=3 36 B11R1.1 CCNCC1=CC=C(N)C=C1 7272AJ [1,0,0,0,0,0|2,0,1]=4 37 B11R1.1 CCNCC1=CC=C(O)C=C1 6053AJ [1,0,0,0,0,0|2,0,1]=4 38 B11R1.1 CNCCC1=CC=C(Br)C=C1 V7496 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.1 CNCCC1=CC=C(N)C=C1 X8249 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.1 CN\N=N\C1=CC=C(C)C=C1 4909AL [1,0,0,0,0,0|3,0,0]=4 41 B11R1.1 ClCCCC1=CC=C(Br)C=C1 Y9960 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.1 FC1=CC=C(CCCBr)C=C1 V4639 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.1 NC1=CC=C(CCCO)C=C1 7207AA [1,0,0,0,0,0|1,0,2]=4 44 B11R1.1 NCCCC1=CC=C(F)C=C1 3289AD [1,0,0,0,0,0|2,0,1]=4 45 B11R1.1 NCCCC1=CC=C(F)C=C1 7357AC [1,0,0,0,0,0|2,0,1]=4 46 B11R1.1 NCCCC1=CC=C(N)C=C1 9266AB [1,0,0,0,0,0|2,0,1]=4 47 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 3648AL [1,0,0,0,0,0|2,0,0]=3 48 B11R1.1 OCCCC1=CC=C(F)C=C1 V7380 [1,0,0,0,0,0|1,0,2]=4 49 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [1,0,0,0,0,0|2,0,0]=3 50 B11R1.91 CC(=O)COC1=CC=CC=C1 X5334 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.91 CC(=O)OCC1=CC=NC=C1 N216 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [1,0,0,0,0,0|2,0,1]=4 53 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [1,0,0,0,0,0|2,0,1]=4 54 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [1,0,0,0,0,0|2,0,0]=3 55 B11R1.91 N=C(N)CSC1=CC=CC=C1 0460AF [1,0,0,0,0,0|3,0,0]=4 56 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [1,0,0,0,0,0|2,0,0]=3 57 B11R1.91 NC(=[NH2+])SCC1=CC=CC=C1 AMTEC014 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.91 NC(N)=NCC1=CC=CC=C1 7568AD [1,0,0,0,0,0|3,0,0]=4 59 B11R1.91 O=C(Cl)CSC1=CC=NC=C1 E582 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.91 O=C(O)CCC1=NC=CC=N1 6060AB [1,0,0,0,0,0|3,0,0]=4 61 B11R1.91 O=C(O)COC1=CN=CC=C1 1038AF [1,0,0,0,0,0|3,0,0]=4 62 B11R1.91 O=C(O)CSC1=NC=CC=C1 7051AC [1,0,0,0,0,0|3,0,0]=4 63 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 8155AF [1,0,0,0,0,0|1,0,2]=4 64 B13R1.3 CC(C)COC1=CC=C(CN)C=C1 1350AL [0,1,0,0,0,0|2,0,1]=4 65 B13R1.3 CCC1=CC=C(\C=C\C(=O)O)C=C1 9197AD [0,1,0,0,0,0|1,0,2]=4 66 B13R1.3 COC1=CC=C(C#CC(=O)O)C=C1 1270AB [0,1,0,0,0,0|1,0,2]=4 67 B13R1.3 COC1=CC=C(CCC(N)=O)C=C1 Z2631 [0,1,0,0,0,0|1,0,0]=2 68 B13R1.3 COC1=CC=C(CSC(N)=[NH2+])C=C1 AMTEC006 [0,1,0,0,0,0|3,0,0]=4 69 B13R1.3 COC1=CC=C(OCC(=N)N)C=C1 G949 [0,1,0,0,0,0|3,0,0]=4 70 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 7597AE [0,1,0,0,0,0|2,0,1]=4 71 B13R1.3 COC1=CC=C(OCC(C)O)C=C1 4291AL [0,1,0,0,0,0|1,0,2]=4 72 B13R1.3 COC1=CC=C(\C=C\C(C)=O)C=C1 6135AC [0,1,0,0,0,0|0,0,2]=3 73 B13R1.3 NC(=O)COC1=CC=C(C=O)C=C1 6397AA [0,1,0,0,0,0|2,0,1]=4 74 B13R1.14 CCC(C)NCC1=CC=C(C)C=C1 8083AC [0,1,0,0,0,0|2,0,1]=4 75 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 8453AE [0,1,0,0,0,0|1,0,0]=2 76 B13R1.14 CNC(=O)COC1=CC=C(Br)C=C1 3881AC [0,1,0,0,0,0|2,0,0]=3 77 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 V4964 [0,1,0,0,0,0|1,0,0]=2 78 B13R1.14 COC(=O)COC1=CC=C(O)C=C1 8383AE [0,1,0,0,0,0|2,0,0]=3 79 B13R1.14 COC(=O)COC1=NC=C(Br)C=C1 6929AJ [0,1,0,0,0,0|3,0,0]=4 80 B13R1.14 NNC(=O)CCC1=CC=C(O)C=C1 Y9740 [0,1,0,0,0,0|2,0,0]=3 81 B13R1.14 NNC(=O)CNC1=CC=C(Cl)C=C1 8021AD [0,1,0,0,0,0|3,0,0]=4 82 B13R1.14 NNC(=O)CNC1=CC=C(F)C=C1 8527AE [0,1,0,0,0,0|3,0,0]=4 83 B13R1.14 NNC(=O)CSC1=CC=C(Cl)C=C1 9203AE [0,1,0,0,0,0|3,0,0]=4 84 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 2650AE [0,1,0,0,0,0|0,0,1]=2 85 B13R1.132 CC(=O)CC(=O)C1=CC=C(F)C=C1 1434AL [0,1,0,0,0,0|1,0,1]=3 86 B13R1.132 CC(=O)N[C@@H](C)C1=NC=C(F)C=C1 Y6480 [0,1,0,0,0,0|3,0,0]=4 87 B13R1.132 NC(=O)CC(N)C1=CC=C(F)C=C1 9513AE [0,1,0,0,0,0|2,0,0]=3 88 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 X9801 [0,1,0,0,0,0|2,0,0]=3 89 B13R1.133 CC(CC1=CC=C(Cl)C=C1)C(=O)O 7328AC [0,1,0,0,0,0|2,0,0]=3 90 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O 0111AE [0,1,0,0,0,0|3,0,0]=4 91 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O X6269 [0,1,0,0,0,0|3,0,0]=4 92 B13R1.133 C[C@H](OC1=CC=C(O)C=C1)C(=O)O V2122 [0,1,0,0,0,0|3,0,0]=4 93 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O 7300AA [0,1,0,0,0,0|2,0,0]=3 94 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 C107 [0,1,0,0,0,0|2,0,1]=4 95 B13R1.133 O=C(O)C(F)CC1=CC=C(O)C=C1 7683AB [0,1,0,0,0,0|2,0,0]=3 96 B13R1.164 CC1=C(CCC(=O)O)C=CC(F)=C1 X3493 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.164 CC1=C(OCC(=O)O)C=CC(Br)=C1 8298AE [0,1,0,0,0,0|3,0,0]=4 98 B13R1.164 CC1=CC(Br)=C(OCC(=O)O)C=C1 8414AD [0,1,0,0,0,0|2,0,0]=3 99 B13R1.164 CC1=CC=C(OCC(=O)O)C(Cl)=C1 8490AH [0,1,0,0,0,0|2,0,0]=3 100 B13R1.164 NC(=O)CCC1=CC=C(Br)C=C1F Z9673 [0,1,0,0,0,0|2,0,0]=3 101 B13R1.164 O=C(O)CCC1=C(F)C=C(Cl)C=C1 9037AA [0,1,0,0,0,0|2,0,0]=3 102 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1Br W3815 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.164 O=C(O)COC1=CC=C(Cl)C=C1Cl V1520 [0,1,0,0,0,0|3,0,0]=4 104 B13R1.511 CC(=O)CCC1=CC=C(O)C(O)=C1 W1951 [0,1,0,0,0,0|1,0,0]=2 105 B13R1.511 CC1=C(C)C=C(\C=C\C(=O)O)C=C1 6546AE [0,1,0,0,0,0|1,0,2]=4 106 B13R1.511 CC1=CC(OCC(=O)O)=CC=C1Br 2864AF [0,1,0,0,0,0|3,0,0]=4 107 B13R1.511 CC1=CC(OCC(=O)O)=CC=C1Cl 6151AE [0,1,0,0,0,0|3,0,0]=4 108 B13R1.511 CC1=CC=C(CCC(=O)O)C=C1N 1957AJ [0,1,0,0,0,0|1,0,0]=2 109 B13R1.511 NC1=C(O)C=CC(CCC(=O)O)=C1 5105AC [0,1,0,0,0,0|2,0,0]=3 110 B13R1.511 O=C(O)COC1=CC(Cl)=C(F)C=C1 0415AE [0,1,0,0,0,0|3,0,0]=4 111 B13R1.512 O=S(=O)(Cl)CCC1=CC=C(Cl)C=C1 9442AE [0,1,0,0,0,0|3,0,0]=4 112 B13R1.512 O=S(=O)(Cl)CCC1=CC=C(F)C=C1 2744AE [0,1,0,0,0,0|3,0,0]=4 113 B13R1.512 O=S(=O)(O)CCC1=CC=C(F)C=C1 9512AE [0,1,0,0,0,0|3,0,0]=4 114 B13R2.147 OC1CC(C2=CC=C(Br)C=C2)C1 5654AJ [0,0,0,1,0,0|1,0,2]=4 115 B13R2.155 CC1=CC2=NC(C)=CC=C2C=C1 5835AC [0,0,0,1,0,0|1,0,2]=4 116 B13R2.155 CC1=CC=C2C=CC(=O)NC2=C1 5491AB [0,0,0,1,0,0|1,0,2]=4 117 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 6027AE [0,0,0,1,0,0|1,0,2]=4 118 B13R2.155 NC1=CC2=C(C=C1)NCC(=O)N2 1975AB [0,0,0,1,0,0|3,0,0]=4 119 B13R2.155 NC1CCC2=C(C=C(Cl)C=C2)C1 9774AB [0,0,0,1,0,0|2,0,1]=4 120 B13R2.155 NC1CCC2=CC=C(Br)C=C2C1 3658AJ [0,0,0,1,0,0|2,0,1]=4 121 B13R2.155 NC1CCC2=CC=C(Br)C=C2C1 9026AF [0,0,0,1,0,0|2,0,1]=4 122 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)C1 9025AF [0,0,0,1,0,0|1,0,0]=2 123 B13R2.155 O=C1CNC2=C(C=C(Br)C=C2)N1 Z6385 [0,0,0,1,0,0|3,0,0]=4 124 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)C1 Z4519 [0,0,0,1,0,0|2,0,0]=3 125 B13R2.527 CC1=CC=C(NCC2CC2)C=C1 1510AE [0,0,0,1,0,0|2,0,1]=4 126 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,0,0,0,1,0|3,0,0]=4 127 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,0,0,0,1,0|2,0,0]=3 128 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N473 [0,0,0,0,1,0|3,0,0]=4 129 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,0,0,0,1,0|2,0,1]=4 130 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,0,0,0,1,0|2,0,0]=3 131 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,0,0,0,1,0|3,0,0]=4 132 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [0,0,0,0,1,0|1,0,2]=4 133 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,0,0,0,1,0|3,0,0]=4 134 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [0,0,0,0,1,0|3,0,0]=4 135 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [0,0,0,0,1,0|3,0,0]=4 136 B11R1.75 CC1=CC=C(CCC(=O)O)S1 2246AL [0,0,0,0,1,0|2,0,0]=3 137 B11R1.75 CC1=CN(CCC(=O)O)N=C1 4635AE [0,0,0,0,1,0|3,0,0]=4 138 B13R1.513 CC(C)CCOC1=CC=C(N)C=C1 4820AE [0,0,0,0,0,1|2,0,1]=4 139 B13R1.513 CC1=CC=C(SCCC(=O)O)C=C1 4035AD [0,0,0,0,0,1|1,0,0]=2 140 B13R1.513 CN(C)CCCC1=CC=C(N)C=C1 3207AE [0,0,0,0,0,1|3,0,0]=4 141 B13R1.513 CN(C)CCOC1=CC=C(Cl)C=C1 1714AB [0,0,0,0,0,1|3,0,0]=4 142 B10R1.1 BrC1=CC=C(CCI)C=C1 3237AC [2,0,0,0,0,0|2,0,0]=4 143 B10R1.1 C=CCC1=CC=C(Br)C=C1 7818AD [2,0,0,0,0,0|1,0,1]=4 144 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [2,0,0,0,0,0|1,0,1]=4 145 B10R1.1 C=CCC1=CC=C(F)C=C1 0990AQ [2,0,0,0,0,0|1,0,1]=4 146 B10R1.1 CC1=CC=C(CCO)C=C1 X8365 [2,0,0,0,0,0|0,0,1]=3 147 B10R1.1 CC1=CC=C(NC=O)C=C1 6608AL [2,0,0,0,0,0|1,0,0]=3 148 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [2,0,0,0,0,0|0,0,0]=2 149 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [2,0,0,0,0,0|1,0,0]=3 150 B10R1.1 CCNC1=CC=C(C)C=C1 U343 [2,0,0,0,0,0|1,0,0]=3 151 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [2,0,0,0,0,0|2,0,0]=4 152 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [2,0,0,0,0,0|2,0,0]=4 153 B10R1.1 CNCC1=CC=C(O)C=C1 6057AJ [2,0,0,0,0,0|2,0,0]=4 154 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [2,0,0,0,0,0|2,0,0]=4 155 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [2,0,0,0,0,0|2,0,0]=4 156 B10R1.17 CCCCC1=CC=NC=C1 Y9365 [2,0,0,0,0,0|1,0,1]=4 157 B10R1.17 CCCCC1=NC=CC=C1 S413 [2,0,0,0,0,0|1,0,1]=4 158 B10R1.17 CNCCC1=CC=NC=C1 5552AE [2,0,0,0,0,0|2,0,0]=4 159 B10R1.17 CNCCC1=CC=NC=C1 5553AE [2,0,0,0,0,0|2,0,0]=4 160 B10R1.17 CNCCC1=CC=NC=C1 X8552 [2,0,0,0,0,0|2,0,0]=4 161 B10R1.17 O=CCOC1=CC=CC=C1 0811AB [2,0,0,0,0,0|1,0,0]=3 162 B10R1.17 O=CNNC1=CC=CC=C1 9369AB [2,0,0,0,0,0|2,0,0]=4 163 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 Z6329 [2,0,0,0,0,0|1,0,1]=4 164 B12R1.1 CC1=CC=C(OCCCN)C=C1 4537AE [1,1,0,0,0,0|1,0,1]=4 165 B12R1.1 CNCCOC1=CC=C(Br)C=C1 9083AE [1,1,0,0,0,0|2,0,0]=4 166 B12R1.1 CNCCOC1=CC=C(C)C=C1 6914AE [1,1,0,0,0,0|1,0,0]=3 167 B12R1.1 CNCCOC1=CC=C(Cl)C=C1 0077AC [1,1,0,0,0,0|2,0,0]=4 168 B12R1.1 CNCCOC1=CC=C(F)C=C1 8149AC [1,1,0,0,0,0|2,0,0]=4 169 B12R1.1 CNCCOC1=CC=C(F)C=C1 8262AE [1,1,0,0,0,0|2,0,0]=4 170 B12R1.1 N(CCC)CC1=CC=C(Cl)C=C1 5502AE [1,1,0,0,0,0|1,0,1]=4 171 B12R1.1 OCCCCC1=CC=C(Br)C=C1 2484AJ [1,1,0,0,0,0|1,0,1]=4 172 B12R1.16 CC1=CC=C([C@H](N)CCO)C=C1 1218AL [1,1,0,0,0,0|0,0,2]=4 173 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 5727AB [1,1,0,0,0,0|0,0,2]=4 174 B12R1.49 O=CC(Cl)CC1=CC=C(Cl)C=C1 Y6536 [1,1,0,0,0,0|1,0,0]=3 175 B12R1.71 CCCCC1=CC=C(CBr)C=C1 6442AL [1,1,0,0,0,0|0,0,1]=3 176 B12R1.71 CCCCC1=CC=C(CO)C=C1 X4599 [1,1,0,0,0,0|0,0,1]=3 177 B12R1.71 CCCOC1=CC=C(CN)C=C1 7209AD [1,1,0,0,0,0|1,0,1]=4 178 B12R1.71 COC1=CC=C(CN=C=O)C=C1 5757AE [1,1,0,0,0,0|1,0,1]=4 179 B12R1.385 CCCCC1=CC=C(I)C(C)=C1 5845AD [1,1,0,0,0,0|1,0,1]=4 180 B12R1.385 CCCCC1=CC=C(O)C(O)=C1 Q179 [1,1,0,0,0,0|1,0,1]=4 181 B12R1.385 CCCOC1=CC=C(C)C(Br)=C1 Y3542 [1,1,0,0,0,0|1,0,1]=4 182 B12R1.385 CNCCC1=CC(O)=C(O)C=C1 9379AB [1,1,0,0,0,0|2,0,0]=4 183 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 3157AL [1,1,0,0,0,0|1,0,1]=4 184 B12R1.27 CCC(=O)CCC1=CC=CC=C1 U874 [1,1,0,0,0,0|0,0,0]=2 185 B12R1.27 CCC(=O)NNC1=CC=CC=C1 7054AD [1,1,0,0,0,0|2,0,0]=4 186 B12R1.27 COC(=O)CCC1=CC=NC=C1 6999AJ [1,1,0,0,0,0|1,0,0]=3 187 B12R1.27 COC(=O)CCC1=CN=CN=C1 X7986 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.27 NCC(=O)NCC1=CC=CN=C1 2265AD [1,1,0,0,0,0|2,0,0]=4 189 B12R1.27 NCC(=O)NCC1=CC=NC=C1 1843AD [1,1,0,0,0,0|2,0,0]=4 190 B12R1.27 NCC(=O)NCC1=NC=CC=C1 1909AD [1,1,0,0,0,0|2,0,0]=4 191 B12R1.27 NNC(=O)CCC1=CN=CC=C1 9437AJ [1,1,0,0,0,0|2,0,0]=4 192 B12R1.27 O=C(CCl)NNC1=CC=CC=C1 7817AD [1,1,0,0,0,0|2,0,0]=4 193 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O 0185AE [1,1,0,0,0,0|2,0,0]=4 194 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O 9529AF [1,1,0,0,0,0|2,0,0]=4 195 B12R1.43 CC(OC1=CC=CC=C1)C(N)=O 5101AH [1,1,0,0,0,0|2,0,0]=4 196 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O W3956 [1,1,0,0,0,0|1,0,0]=3 197 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O 6856AC [1,1,0,0,0,0|2,0,0]=4 198 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O 4699AB [1,1,0,0,0,0|2,0,0]=4 199 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O X2941 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.43 O=C(O)C(O)CC1=CN=CC=C1 4393AH [1,1,0,0,0,0|2,0,0]=4 201 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 R761 [1,1,0,0,0,0|1,0,0]=3 202 B12R1.107 C=C(NC(C)=O)C1=CC=CC=C1 3611AL [1,1,0,0,0,0|1,0,1]=4 203 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 W6216 [1,1,0,0,0,0|1,0,1]=4 204 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 X9200 [1,1,0,0,0,0|1,0,1]=4 205 B12R1.107 CC(CC(=O)O)C1=CN=CC=C1 3138AF [1,1,0,0,0,0|2,0,0]=4 206 B12R1.107 CN(C)C[C@@H](N)C1=CC=CC=C1 0890AC [1,1,0,0,0,0|2,0,0]=4 207 B12R1.125 CC(=O)CCC1=CC=CC=C1Cl 3201AF [1,1,0,0,0,0|0,0,0]=2 208 B12R1.125 CC(=O)\C=C\C1=CC=CC=C1F V4347 [1,1,0,0,0,0|0,0,2]=4 209 B12R1.125 CC1=C(OCC(=O)Cl)C=CC=C1 4865AD [1,1,0,0,0,0|2,0,0]=4 210 B12R1.125 CN(C)CCC1=CC=CC=C1N Y5394 [1,1,0,0,0,0|2,0,0]=4 211 B12R1.125 O=C(O)CCN1C=CC=CC1=O 0599AC [1,1,0,0,0,0|2,0,0]=4 212 B12R1.125 O=C(O)CCN1C=CC=CC1=O 1458AF [1,1,0,0,0,0|2,0,0]=4 213 B12R1.125 O=C(O)CNC1=C(Br)C=CC=C1 5549AB [1,1,0,0,0,0|2,0,0]=4 214 B12R1.226 C=C(C)COC1=CC(N)=CC=C1 8114AC [1,1,0,0,0,0|2,0,0]=4 215 B12R1.226 CC(=O)CCC1=CC=CC(F)=C1 1147AE [1,1,0,0,0,0|0,0,0]=2 216 B12R1.226 NC(=O)CCC1=CC(Br)=CC=C1 5635AJ [1,1,0,0,0,0|1,0,0]=3 217 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 0483AC [1,1,0,0,0,0|1,0,0]=3 218 B12R1.891 NS(=O)(=O)CCC1=CC=CC=C1 Y6084 [1,1,0,0,0,0|2,0,0]=4 219 B12R1.4 C=C(Br)CC1=CC=C(SC)C=C1 0379AF [0,1,0,0,1,0|1,0,1]=4 220 B12R1.4 C=C(C)CC1=CC=C(OC)C=C1 7091AD [0,1,0,0,1,0|1,0,0]=3 221 B12R1.4 CC(=O)CC1=CC=C(C#N)C=C1 8757AB [0,1,0,0,1,0|0,0,1]=3 222 B12R1.4 CC(=O)OC1=CC=C(CCl)C=C1 X4658 [0,1,0,0,1,0|1,0,0]=3 223 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 7067AA [0,1,0,0,1,0|1,0,0]=3 224 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 2717AL [0,1,0,0,1,0|0,0,0]=2 225 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 3012AB [0,1,0,0,1,0|2,0,0]=4 226 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 7496AE [0,1,0,0,1,0|2,0,0]=4 227 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 4244AB [0,1,0,0,1,0|1,0,1]=4 228 B12R1.19 CC(=O)NC1=CC=C(Cl)C(O)=C1 V4906 [0,1,0,0,1,0|2,0,0]=4 229 B12R1.19 CC1=CC(CC(=O)O)=CC=C1N 5220AJ [0,1,0,0,1,0|2,0,0]=4 230 B12R1.19 NC1=CC(CC(=O)O)=CC=C1O 2074AE [0,1,0,0,1,0|2,0,0]=4 231 B12R1.20 CC(=O)C(Br)C1=CC=C(O)C=C1 6547AC [0,1,0,0,1,0|1,0,0]=3 232 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 W8302 [0,1,0,0,1,0|2,0,0]=4 233 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 5426AJ [0,1,0,0,1,0|2,0,0]=4 234 B12R1.233 CC(=O)CC1=CC=C(Cl)C=C1Br 5576AA [0,1,0,0,1,0|1,0,0]=3 235 B12R1.233 O=C(O)CC1=C(Br)C=C(O)C=C1 5009AH [0,1,0,0,1,0|2,0,0]=4 236 B14R1.4 CN(C)CCOC1=CC=C(CO)C=C1 3629AD [0,1,0,0,0,1|2,0,0]=4 237 B14R1.4 COC1=CC=C(CCNC(C)C)C=C1 1768AF [0,1,0,0,0,1|1,0,1]=4 238 B14R1.4 COC1=CC=C(OCCN(C)C)C=C1 7145AB [0,1,0,0,0,1|2,0,0]=4 239 B14R1.4 COC1=CC=C(SCCC(=O)O)C=C1 2318AL [0,1,0,0,0,1|1,0,0]=3 240 B14R1.4 O=C(O)CCOC1=CC=C(CO)C=C1 5194AH [0,1,0,0,0,1|1,0,0]=3 241 B14R1.13 CC1=CC=C(CCNC(=S)NN)C=C1 7025AD [0,1,0,0,0,1|1,1,0]=4 242 B14R1.13 COC(=O)CCCC1=CC=C(Br)C=C1 4263AJ [0,1,0,0,0,1|1,0,0]=3 243 B14R1.13 COC(=O)CCNC1=CC=C(O)C=C1 7002AJ [0,1,0,0,0,1|1,0,0]=3 244 B14R1.13 O=C(CCl)NCCC1=CC=C(Cl)C=C1 2152AE [0,1,0,0,0,1|1,0,0]=3 245 B14R1.131 CS(=O)(=O)NCCC1=CC=C(O)C=C1 1576AF [0,1,0,0,0,1|2,0,0]=4 246 B14R1.678 CC(=O)OCC(=O)C1=CC=C(Br)C=C1 1666AC [0,1,0,0,0,1|1,0,1]=4 247 B14R1.678 CC(=O)OCC(=O)C1=CC=C(Cl)C=C1 2431AE [0,1,0,0,0,1|1,0,1]=4 248 B14R1.678 CC(=O)OCC(=O)C1=CC=C(F)C=C1 1723AE [0,1,0,0,0,1|1,0,1]=4 249 B14R1.678 CC1=CC=C(C(=O)CCN(C)C)C=C1 5709AJ [0,1,0,0,0,1|2,0,0]=4 250 B14R1.678 O=C(O)CCC(=O)C1=CC=C(Cl)C=C1 5246AB [0,1,0,0,0,1|2,0,0]=4 251 B14R1.679 N[C@@H](CCC1=CC=C(O)C=C1)C(=O)O V1131 [0,1,0,0,0,1|2,0,0]=4 252 B14R1.679 N[C@H](CCC1=CC=C(O)C=C1)C(=O)O Z5698 [0,1,0,0,0,1|2,0,0]=4 253 B14R1.687 CC1=C(F)C=CC(CCCC(=O)O)=C1 3795AB [0,1,0,0,0,1|2,0,0]=4 254 B14R1.687 O=C(O)CSCC1=CC(Cl)=C(Cl)C=C1 7426AE [0,1,0,0,0,1|2,0,0]=4 255 B14R1.698 CC1=CC=C(C[C@@H](N)CC(=O)O)C=C1 9329AA [0,1,0,0,0,1|1,0,0]=3 256 B14R1.698 CC1=CC=C(NC(=O)CC(=O)O)C=C1 4247AF [0,1,0,0,0,1|1,0,1]=4 257 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(I)C=C1 Z5798 [0,1,0,0,0,1|2,0,0]=4 258 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(O)C=C1 W5529 [0,1,0,0,0,1|2,0,0]=4 259 B14R1.4464 NC(=O)CCCC1=CC=C(Br)C=C1F Z9788 [0,1,0,0,0,1|2,0,0]=4 260 B14R1.2 CCC1=CC=C(C(N)CC(=O)O)C=C1 9946AC [0,2,0,0,0,0|1,0,0]=3 261 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 2651AE [0,2,0,0,0,0|0,0,1]=3 262 B14R1.2 COC1=NC=C([C@@H](N)CC(=O)O)C=C1 3938AC [0,2,0,0,0,0|2,0,0]=4 263 B14R1.2 COC1=NC=C([C@H](N)CC(=O)O)C=C1 1053AC [0,2,0,0,0,0|2,0,0]=4 264 B14R1.2 N#CC1=CC=C(C(N)CC(=O)O)C=C1 2584AC [0,2,0,0,0,0|1,0,1]=4 265 B14R1.3 CCC1=CC=C(C[C@@H](N)C(=O)O)C=C1 Q377 [0,2,0,0,0,0|1,0,0]=3 266 B14R1.3 CCC1=CC=C(C[C@H](N)C(=O)O)C=C1 Q378 [0,2,0,0,0,0|1,0,0]=3 267 B14R1.3 CCC1=CC=C(OC(C)C(=O)O)C=C1 4722AF [0,2,0,0,0,0|2,0,0]=4 268 B14R1.3 N#CC1=CC=C(C[C@H](N)C(=O)O)C=C1 1017AA [0,2,0,0,0,0|1,0,1]=4 269 B14R1.3 N#CC1=CC=C(C[C@H](N)C(=O)O)C=C1 E554 [0,2,0,0,0,0|1,0,1]=4 270 B14R1.3 NCC1=CC=C(C[C@@H](N)C(=O)O)C=C1 4019AA [0,2,0,0,0,0|1,0,0]=3 271 B14R1.3 NCC1=CC=C(C[C@H](N)C(=O)O)C=C1 7531AA [0,2,0,0,0,0|1,0,0]=3 272 B14R1.5 COC(=O)CCC1=CC=C(C#N)C=C1 1739AC [0,2,0,0,0,0|0,0,1]=3 273 B14R1.103 COC1=CC(F)=C(CCC(=O)O)C=C1 3198AC [0,2,0,0,0,0|1,0,0]=3 274 B14R1.142 [N-]=[N+]=NC1=CC=C(CCC(=O)O)C=C1 5166AH [0,2,0,0,0,0|2,0,0]=4 275 B14R1.419 CC(=O)C1=CC=C(OCC(N)=O)C=C1 3036AE [0,2,0,0,0,0|2,0,0]=4 276 B14R1.419 CC(=O)NCC1=CC=C(C(=O)O)C=C1 X9431 [0,2,0,0,0,0|1,0,1]=4 277 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 X2948 [0,2,0,0,0,0|1,0,0]=3 278 B14R1.3653 COC1=C(C)C=C(CCC(=O)O)C=C1 7672AD [0,2,0,0,0,0|1,0,0]=3 279 B14R1.10 COC(=O)CC(=O)C1=CC=C(O)C=C1 6541AL [0,2,0,0,0,0|1,0,1]=4 280 B14R1.10 COC(=O)CC(N)C1=CC=C(Cl)C=C1 2970AD [0,2,0,0,0,0|1,0,0]=3 281 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(Cl)C=C1 Z2162 [0,2,0,0,0,0|1,0,0]=3 282 B14R1.134 CC1=CC=C(OC(C)C(=O)NN)C=C1 0336AF [0,2,0,0,0,0|2,0,0]=4 283 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(F)C=C1 6850AJ [0,2,0,0,0,0|1,0,0]=3 284 B14R1.502 CC1=CC=C(CNC(=O)CCCl)C=C1 8266AC [0,2,0,0,0,0|1,0,0]=3 285 B14R1.502 CCOC(=O)CCC1=CC=C(C)C=C1 1044AC [0,2,0,0,0,0|0,0,0]=2 286 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 3633AH [0,2,0,0,0,0|2,0,0]=4 287 B14R1.502 N#CCC(=O)NCC1=CC=C(F)C=C1 5447AD [0,2,0,0,0,0|2,0,0]=4 288 B14R1.727 CC1=CC=C(OCC(=O)NN)C(Br)=C1 6590AE [0,2,0,0,0,0|2,0,0]=4 289 B14R1.833 CC1=C(C)C=C(OCC(=O)NN)C=C1 3150AD [0,2,0,0,0,0|2,0,0]=4 290 B14R1.833 NNC(=O)CCC1=CC=C(O)C(O)=C1 2623AE [0,2,0,0,0,0|2,0,0]=4 291 B14R1.685 CC(=O)CC(=O)C1=CC(C)=C(C)C=C1 4674AE [0,2,0,0,0,0|0,0,1]=3 292 B14R1.685 NC(CC(=O)O)C1=CC(Cl)=C(Cl)C=C1 9950AC [0,2,0,0,0,0|2,0,0]=4 293 B14R1.694 CC1=CC=C(S(=O)(=O)CC(=O)O)C=C1 V0626 [0,2,0,0,0,0|2,0,0]=4 294 B14R1.1019 NC[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 X3696 [0,2,0,0,0,0|2,0,0]=4 295 B14R1.1019 NC[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 X6885 [0,2,0,0,0,0|2,0,0]=4 296 B14R1.6048 CC1=CC(C)=C(C(N)CC(=O)O)C=C1 9947AC [0,2,0,0,0,0|1,0,0]=3 297 B14R1.6048 NC(CC(=O)O)C1=CC=C(O)C=C1O 5782AJ [0,2,0,0,0,0|2,0,0]=4 298 B14R1.536 CCC(OC1=CC=C(C)C=C1)C(=O)O 4301AD [0,2,0,0,0,0|2,0,0]=4 299 B14R1.536 CN[C@@H](CC1=CC=C(O)C=C1)C(=O)O Z5915 [0,2,0,0,0,0|2,0,0]=4 300 B14R1.536 NCC(CC1=CC=C(Cl)C=C1)C(=O)O 5775AJ [0,2,0,0,0,0|2,0,0]=4 301 B14R1.536 NCC(CC1=CC=C(F)C=C1)C(=O)O 1990AL [0,2,0,0,0,0|2,0,0]=4 302 B14R1.686 CC1=CC=C(C[C@H](N)C(=O)O)C=C1C 7003AA [0,2,0,0,0,0|1,0,0]=3 303 B14R1.686 CC1=CC=C(C[C@H](N)C(=O)O)C=C1C Q487 [0,2,0,0,0,0|1,0,0]=3 304 B14R1.686 CC1=CC=C(OC(C)C(=O)O)C=C1C 8404AD [0,2,0,0,0,0|2,0,0]=4 305 B14R1.686 NC(CC1=CC=C(Cl)C(Cl)=C1)C(=O)O 7949AB [0,2,0,0,0,0|2,0,0]=4 306 B14R1.686 N[C@@H](CC1=CC=C(O)C(F)=C1)C(=O)O W8200 [0,2,0,0,0,0|2,0,0]=4 307 B14R1.686 N[C@H](CC1=CC(O)=C(O)C=C1)C(=O)O O103 [0,2,0,0,0,0|2,0,0]=4 308 B14R1.6049 CC1=CC(C)=C(C[C@H](N)C(=O)O)C=C1 6379AB [0,2,0,0,0,0|1,0,0]=3 309 B14R1.6049 CC1=CC(C)=C(OC(C)C(=O)O)C=C1 9630AE [0,2,0,0,0,0|2,0,0]=4 310 B14R1.6049 NC(CC1=C(F)C=C(F)C=C1)C(=O)O 3551AB [0,2,0,0,0,0|2,0,0]=4 311 B14R1.6049 NC(CC1=CC=C(O)C=C1O)C(=O)O 8625AB [0,2,0,0,0,0|2,0,0]=4 312 B14R1.7626 CC1=CC=C(OC(C)(C)C(=O)O)C=C1 7932AD [0,2,0,0,0,0|2,0,0]=4 313 B14R1.7626 C[C@](N)(CC1=CC=C(O)C=C1)C(=O)O 9591AJ [0,2,0,0,0,0|2,0,0]=4 314 B14R1.3152 CC1=CC(Br)=C(OCC(=O)O)C(C)=C1 2078AE [0,2,0,0,0,0|2,0,0]=4 315 B14R1.15552 O=C(O)CCC1=CC(Br)=C(O)C(Br)=C1 4066AD [0,2,0,0,0,0|2,0,0]=4 316 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 9184AB [1,0,0,1,0,0|1,0,1]=4 317 B12R2.24 CC1=CC2=C(C=C1)CNCC2 5932AB [1,0,0,1,0,0|1,0,1]=4 318 B12R2.24 CC1=CC=C2CCNCC2=C1 2952AE [1,0,0,1,0,0|1,0,0]=3 319 B12R2.24 CC1=CC=C2CNCCC2=C1 6012AH [1,0,0,1,0,0|1,0,1]=4 320 B12R2.24 FC1=CC2=C(C=C1)CCNC2 2483AC [1,0,0,1,0,0|2,0,0]=4 321 B12R2.24 FC1=CC2=C(C=C1)CCNC2 5533AB [1,0,0,1,0,0|2,0,0]=4 322 B12R2.24 N1CCCC2=C1C=C(C)C=C2 9836AL [1,0,0,1,0,0|1,0,1]=4 323 B12R2.24 NC1=CC2=C(C=C1)CCNC2 9574AH [1,0,0,1,0,0|2,0,0]=4 324 B12R2.24 OC1=CC2=C(C=C1)CCNC2 Y5086 [1,0,0,1,0,0|2,0,0]=4 325 B12R2.24 OC1=CC=C2CCNCC2=C1 0195AC [1,0,0,1,0,0|2,0,0]=4 326 B12R2.132 CC1=CC=C2SC=C(C)C2=C1 Z5484 [1,0,0,1,0,0|1,0,1]=4 327 B12R2.132 CN1CCC2=C1C=C(N)C=C2 9914AH [1,0,0,1,0,0|2,0,0]=4 328 B12R2.132 CN1CCC2=CC=C(N)C=C21 9915AH [1,0,0,1,0,0|2,0,0]=4 329 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 8284AB [1,0,0,1,0,0|1,0,0]=3 330 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 7799AD [0,0,0,1,1,0|2,0,0]=4 331 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 V2187 [0,0,0,1,1,0|2,0,0]=4 332 B12R2.606 O=C1CC2=CC=C(O)C=C2O1 W1997 [0,0,0,1,1,0|2,0,0]=4 333 B14R2.20 O=C1CC(C2=CC=C(Cl)C=C2)CN1 8017AH [0,0,0,1,0,1|1,0,0]=3 334 B14R2.20 O=C1CC(C2=CC=C(F)C=C2)CN1 2535AL [0,0,0,1,0,1|1,0,0]=3 335 B14R2.20 O=C1CCC(C2=CC=C(Cl)C=C2)N1 2692AB [0,0,0,1,0,1|2,0,0]=4 336 B14R2.5816 O=C(O)C1CCC2=C1C=C(Cl)C=C2 Z4829 [0,0,0,1,0,1|2,0,0]=4 337 B14R2.134 COC1=CC2=C(C=C1)CCC(N)C2 4989AH [0,1,0,1,0,0|1,0,1]=4 338 B14R2.134 COC1=CC2=C(C=C1)OCC(=O)C2 1878AC [0,1,0,1,0,0|1,0,0]=3 339 B14R2.134 COC1=CC=C2CCC(N)CC2=C1 6045AH [0,1,0,1,0,0|1,0,1]=4 340 B14R2.134 COC1=CC=C2SCC(=O)NC2=C1 V9929 [0,1,0,1,0,0|2,0,0]=4 341 B14R2.134 O=C1CCC2=CC=C(CO)C=C2N1 3336AC [0,1,0,1,0,0|1,0,0]=3 342 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [1,0,0,0,1,0|1,0,0]=3 343 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [1,0,0,0,1,0|2,0,0]=4 344 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [1,0,0,0,1,0|1,0,1]=4 345 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [1,0,0,0,1,0|0,0,2]=4 346 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [1,0,0,0,1,0|2,0,0]=4 347 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [1,0,0,0,1,0|2,0,0]=4 348 B10R1.66 CC(=O)CCC1=CC=CO1 8369AE [1,0,0,0,1,0|1,0,0]=3 349 B10R1.66 CC(=O)CCN1C=CC=N1 2604AF [1,0,0,0,1,0|2,0,0]=4 350 B10R1.66 O=C(O)CCC1=CC=CN1 X6372 [1,0,0,0,1,0|2,0,0]=4 351 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,0,0,0,2,0|2,0,0]=4 352 B10R1.13 C=C(C)C1=CC=C(O)C=C1 5917AB [0,0,0,0,2,0|2,0,0]=4 353 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,0,0,0,2,0|1,0,0]=3 354 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,0,0,0,2,0|2,0,0]=4 355 B10R1.13 CC(=O)C1=CN=C(C)N=C1 4912AJ [0,0,0,0,2,0|2,0,0]=4 356 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,0,0,0,2,0|2,0,0]=4 357 B10R1.13 CC(=O)C1=NC=C(C)N=C1 9503AH [0,0,0,0,2,0|2,0,0]=4 358 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,0,0,0,2,0|1,0,0]=3 359 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 O143 [0,0,0,0,2,0|1,0,1]=4 360 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 2564AB [0,0,0,0,2,0|1,0,1]=4 361 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 5861AC [0,0,0,0,2,0|2,0,0]=4 362 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7848AF [0,0,0,0,2,0|2,0,0]=4 363 B10R1.54 CC1=CC=C(CC(=O)O)S1 0941AC [0,0,0,0,2,0|2,0,0]=4 364 B12R1.252 CC(C)CNCC1=CC=CC=C1 3705AL [1,0,0,0,0,1|1,0,1]=4 365 B12R1.252 CC(C)NCCC1=CC=CC=C1 2161AE [1,0,0,0,0,1|1,0,1]=4 366 B12R1.252 CC(N)CCCC1=CC=CC=C1 7584AD [1,0,0,0,0,1|1,0,1]=4 367 B12R1.252 O=C(O)CCCC1=CC=NC=C1 7697AC [1,0,0,0,0,1|2,0,0]=4 368 B12R1.252 O=C(O)CCCC1=CC=NC=C1 8657AE [1,0,0,0,0,1|2,0,0]=4 369 B12R1.252 O=C(O)CNCC1=NC=CC=C1 Z2473 [1,0,0,0,0,1|2,0,0]=4 370 B14R1.677 CC(=O)NCCSC1=CC=C(O)C=C1 7452AH [0,0,0,0,0,2|1,0,0]=3 371 B14R1.677 CC(=O)OCCOC1=CC=C(Br)C=C1 AMTH095 [0,0,0,0,0,2|1,0,0]=3 372 B14R1.677 CC(=O)OCCOC1=CC=C(C)C=C1 6178AL [0,0,0,0,0,2|0,0,0]=2 373 B14R1.677 CC1=CC=C(CCCCC(=O)O)C=C1 5730AH [0,0,0,0,0,2|1,0,0]=3 374 B14R1.677 O=C(O)CCCCC1=CC=C(F)C=C1 8236AD [0,0,0,0,0,2|2,0,0]=4 375 B14R1.677 O=C(O)CCCOC1=CC=C(Br)C=C1 8115AB [0,0,0,0,0,2|2,0,0]=4