0 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 SY022010 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SY004032 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SY007830 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SY003984 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.21 N=C(N)NCC1=CC=C(N)C=C1 SY238059 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SY079645 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.21 O=C(O)C=CC1=CC=C(Cl)C=C1 SY003740 [0,0,0,0,0,0|2,0,2]=4 7 B12R1.21 O=C(O)C=CC1=CC=C(F)C=C1 SY036413 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.21 O=C(O)C=CC1=CC=C(O)C=C1 SY015618 [0,0,0,0,0,0|1,0,2]=3 9 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SY013641 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SY003370 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SY006122 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SY016883 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 SY012298 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 SY003346 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SY049560 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SY012252 [0,0,0,0,0,0|2,0,2]=4 17 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SY020906 [0,0,0,0,0,0|1,0,2]=3 18 B12R1.21 O=[N+]([O-])CCC1=CC=C(F)C=C1 SY266526 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.1 C=CCCC1=CC=C(O)C=C1 SY045828 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.1 CC1=CC=C(OCCN)C=C1 SY008282 [1,0,0,0,0,0|2,0,1]=4 21 B11R1.1 CCCCC1=CC=C(Br)C=C1 SY013489 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.1 CCCCC1=CC=C(I)C=C1 SY029294 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.1 CCCOC1=CC=C(O)C=C1 SY036399 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.1 CCNCC1=CC=C(O)C=C1 SY018668 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.1 CNCCC1=CC=C(Cl)C=C1 SY002514 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.1 FC1=CC=C(CCCI)C=C1 SY249460 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.1 NCCOC1=CC=C(Cl)C=C1 SY008276 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.1 NCCOC1=CC=C(F)C=C1 SY008270 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.1 NCCOC1=CC=C(F)C=C1 SY110214 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.1 NOCCC1=CC=C(Cl)C=C1 SY281852 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.1 NOCCC1=CC=C(Cl)C=C1 SY281853 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.1 NOCCC1=CC=C(F)C=C1 SY281706 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.1 NOCCC1=CC=C(F)C=C1 SY281707 [1,0,0,0,0,0|2,0,0]=3 34 B11R1.1 OCCCC1=CC=C(Br)C=C1 SY008370 [1,0,0,0,0,0|1,0,2]=4 35 B11R1.1 OCCCC1=CC=C(Cl)C=C1 SY062743 [1,0,0,0,0,0|1,0,2]=4 36 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SY051763 [1,0,0,0,0,0|1,0,2]=4 37 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.91 CC(=O)COC1=NC=CC=C1 SY251719 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.91 N=C(N)COC1=CC=CC=C1 SY003970 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.91 NC(=O)CCC1=CC=CN=C1 SY022419 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.91 NC(=O)CCC1=CC=NC=C1 SY022418 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.91 NC(=O)CCC1=NC=CC=C1 SY022420 [1,0,0,0,0,0|1,0,0]=2 43 B11R1.91 NC(=O)NCC1=CC=CC=C1 SY049437 [1,0,0,0,0,0|1,0,0]=2 44 B11R1.91 NC(=O)OCC1=CC=CC=C1 SY015067 [1,0,0,0,0,0|1,0,0]=2 45 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [1,0,0,0,0,0|1,0,2]=4 46 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.91 O=C(O)CCC1=CC=NC=C1 SY022403 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.91 O=C(O)CCC1=CN=CC=C1 SY017981 [1,0,0,0,0,0|2,0,0]=3 49 B11R1.91 O=C(O)CCC1=NC=CC=C1 SY013900 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.91 O=C(O)COC1=CC=CN=C1 SY110065 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 SY043104 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.91 OB(O)CCC1=CC=CC=C1 SY014651 [1,0,0,0,0,0|2,0,1]=4 53 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 SY003344 [0,1,0,0,0,0|1,0,0]=2 54 B13R1.3 COC1=CC=C(COC(C)=O)C=C1 SY033222 [0,1,0,0,0,0|2,0,0]=3 55 B13R1.3 COC1=CC=C(OCC(C)=O)C=C1 SY286683 [0,1,0,0,0,0|2,0,0]=3 56 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 SY286685 [0,1,0,0,0,0|2,0,1]=4 57 B13R1.3 CSC1=CC=C(OCC(=O)O)C=C1 SY008347 [0,1,0,0,0,0|2,1,0]=4 58 B13R1.3 N#CC1=CC=C(NCC(=O)O)C=C1 SY021403 [0,1,0,0,0,0|3,0,0]=4 59 B13R1.3 N#CC1=CC=C(OCC(=O)O)C=C1 SY008338 [0,1,0,0,0,0|3,0,0]=4 60 B13R1.3 O=C(O)COC1=CC=C(CO)C=C1 SY019087 [0,1,0,0,0,0|2,0,0]=3 61 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SY013642 [0,1,0,0,0,0|2,0,0]=3 62 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 SY028002 [0,1,0,0,0,0|2,0,0]=3 63 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 SY003634 [0,1,0,0,0,0|1,0,0]=2 64 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 SY102551 [0,1,0,0,0,0|3,0,0]=4 65 B13R1.132 CC1=CC=C(C(N)CC(=O)O)C=C1 SY016253 [0,1,0,0,0,0|2,0,0]=3 66 B13R1.132 NC(CC(=O)O)C1=CC=C(Br)C=C1 SY013390 [0,1,0,0,0,0|2,0,0]=3 67 B13R1.132 NC(CC(=O)O)C1=CC=C(Cl)C=C1 SY007325 [0,1,0,0,0,0|2,0,0]=3 68 B13R1.132 NC(CC(=O)O)C1=CC=C(F)C=C1 SY007326 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.132 NC(CC(=O)O)C1=CC=C(O)C=C1 SY027393 [0,1,0,0,0,0|1,0,0]=2 70 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 SY033465 [0,1,0,0,0,0|2,0,0]=3 71 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 SY109623 [0,1,0,0,0,0|2,0,0]=3 72 B13R1.132 O=C(O)CC(=O)C1=CC=C(F)C=C1 SY226864 [0,1,0,0,0,0|2,0,1]=4 73 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SY035279 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY035280 [0,1,0,0,0,0|2,0,0]=3 75 B13R1.133 CN(CC1=CC=C(N)C=C1)C(=N)N SY262251 [0,1,0,0,0,0|3,0,0]=4 76 B13R1.133 C[C@@H](OC1=CC=C(O)C=C1)C(=O)O SY030163 [0,1,0,0,0,0|2,0,0]=3 77 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O SY049643 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.133 NC(CC1=CC=C(F)C=C1)C(=O)O SY044822 [0,1,0,0,0,0|2,0,0]=3 79 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SY013607 [0,1,0,0,0,0|1,0,0]=2 80 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY065205 [0,1,0,0,0,0|2,0,0]=3 81 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY110355 [0,1,0,0,0,0|2,0,0]=3 82 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O SY023877 [0,1,0,0,0,0|2,0,0]=3 83 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O SY035278 [0,1,0,0,0,0|2,0,0]=3 84 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SY030990 [0,1,0,0,0,0|2,0,0]=3 85 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O SY023876 [0,1,0,0,0,0|2,0,0]=3 86 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O SY032852 [0,1,0,0,0,0|2,0,0]=3 87 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O SY009526 [0,1,0,0,0,0|2,0,0]=3 88 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O SY014304 [0,1,0,0,0,0|1,0,0]=2 89 B13R1.133 O=C(O)C(=O)CC1=CC=C(F)C=C1 SY235376 [0,1,0,0,0,0|2,0,1]=4 90 B13R1.133 O=C(O)C(O)CC1=CC=C(Cl)C=C1 SY036070 [0,1,0,0,0,0|2,0,0]=3 91 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(Br)C=C1 SY058958 [0,1,0,0,0,0|2,0,0]=3 92 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(F)C=C1 SY036072 [0,1,0,0,0,0|2,0,0]=3 93 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(Br)C=C1 SY036071 [0,1,0,0,0,0|2,0,0]=3 94 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(F)C=C1 SY008377 [0,1,0,0,0,0|2,0,0]=3 95 B13R1.164 CC(=O)OCC1=CC=C(I)C=C1Br SY274360 [0,1,0,0,0,0|3,0,0]=4 96 B13R1.164 CC1=CC=C(OCC(=O)O)C(C)=C1 SY274420 [0,1,0,0,0,0|3,0,0]=4 97 B13R1.164 O=C(Cl)CCC1=CC=C(F)C=C1F SY309961 [0,1,0,0,0,0|2,0,0]=3 98 B13R1.164 O=C(O)CCC1=CC=C(Br)C=C1F SY025547 [0,1,0,0,0,0|2,0,0]=3 99 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1Cl SY014686 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1F SY104017 [0,1,0,0,0,0|2,0,0]=3 101 B13R1.164 O=C(O)COC1=CC=C(Br)C=C1F SY132339 [0,1,0,0,0,0|3,0,0]=4 102 B13R1.511 O=C(O)C=CC1=CC=C(O)C(O)=C1 SY009299 [0,1,0,0,0,0|1,0,2]=4 103 B13R1.511 O=C(O)CCC1=CC=C(Cl)C(Cl)=C1 SY062468 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.511 O=C(O)CCC1=CC=C(Cl)C(F)=C1 SY102324 [0,1,0,0,0,0|2,0,0]=3 105 B13R1.511 O=C(O)CCC1=CC=C(F)C(F)=C1 SY016517 [0,1,0,0,0,0|2,0,0]=3 106 B13R1.511 O=C(O)CCC1=CC=C(O)C(O)=C1 SY101000 [0,1,0,0,0,0|1,0,0]=2 107 B13R1.511 O=[N+]([O-])CCC1=CC=C(F)C(F)=C1 SY266609 [0,1,0,0,0,0|3,0,0]=4 108 B13R2.147 NC1CC(C2=CC=C(Br)C=C2)C1 SY017013 [0,0,0,1,0,0|2,0,1]=4 109 B13R2.147 N[C@H]1C[C@H](C2=CC=C(Br)C=C2)C1 SY162987 [0,0,0,1,0,0|2,0,1]=4 110 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 SY017720 [0,0,0,1,0,0|2,0,0]=3 111 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 SY025890 [0,0,0,1,0,0|1,0,2]=4 112 B13R2.155 NC1=CC2=CC(O)=CC=C2N=C1 SY241258 [0,0,0,1,0,0|2,0,1]=4 113 B13R2.155 NC1=CC=C2COC(=O)NC2=C1 SY129167 [0,0,0,1,0,0|2,0,0]=3 114 B13R2.155 N[C@H]1CCC2=CC=C(O)C=C2C1 SY009732 [0,0,0,1,0,0|1,0,1]=3 115 B13R2.155 O=C1C=CC2=C(C=C(Br)C=C2)N1 SY022625 [0,0,0,1,0,0|1,0,2]=4 116 B13R2.155 O=C1C=CC2=C(C=C(I)C=C2)N1 SY294241 [0,0,0,1,0,0|1,0,2]=4 117 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 SY047363 [0,0,0,1,0,0|0,0,2]=3 118 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 SY001924 [0,0,0,1,0,0|1,0,2]=4 119 B13R2.155 O=C1C=NC2=C(C=C(Br)C=C2)N1 SY112246 [0,0,0,1,0,0|2,0,1]=4 120 B13R2.155 O=C1CC2=C(C=CC(Br)=C2)CN1 SY263246 [0,0,0,1,0,0|3,0,0]=4 121 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)N1 SY024896 [0,0,0,1,0,0|1,0,0]=2 122 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)O1 SY289389 [0,0,0,1,0,0|2,0,0]=3 123 B13R2.155 O=C1CCC2=C(C=C(Cl)N=C2)N1 SY262941 [0,0,0,1,0,0|2,0,0]=3 124 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)N1 SY016687 [0,0,0,1,0,0|1,0,0]=2 125 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 SY009657 [0,0,0,1,0,0|0,0,0]=1 126 B13R2.155 O=C1CCC2=NC=C(Br)C=C2N1 SY060537 [0,0,0,1,0,0|2,0,0]=3 127 B13R2.155 O=C1CNC2=CC=C(Cl)N=C2N1 SY291712 [0,0,0,1,0,0|3,0,0]=4 128 B13R2.155 O=C1COC2=C(C=C(Br)C=C2)N1 SY007660 [0,0,0,1,0,0|2,0,0]=3 129 B13R2.155 O=C1COC2=C(C=C(Br)N=C2)N1 SY059724 [0,0,0,1,0,0|3,0,0]=4 130 B13R2.155 O=C1COC2=C(C=C(Cl)N=C2)N1 SY025992 [0,0,0,1,0,0|3,0,0]=4 131 B13R2.155 O=C1COC2=CC=C(Br)N=C2N1 SY019440 [0,0,0,1,0,0|3,0,0]=4 132 B13R2.155 O=C1COC2=NC=C(Br)C=C2N1 SY060496 [0,0,0,1,0,0|3,0,0]=4 133 B13R2.155 O=C1COC2=NC=C(Cl)C=C2N1 SY130725 [0,0,0,1,0,0|3,0,0]=4 134 B13R2.155 O=C1NC2=CC(Br)=CC=C2CO1 SY058763 [0,0,0,1,0,0|2,0,0]=3 135 B13R2.155 O=C1NC2=CC(Cl)=CC=C2CO1 SY129152 [0,0,0,1,0,0|2,0,0]=3 136 B13R2.155 O=C1NC2=CC(F)=CC=C2CO1 SY129162 [0,0,0,1,0,0|2,0,0]=3 137 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SY045434 [0,0,0,0,1,0|2,0,0]=3 138 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 SY042746 [0,0,0,0,1,0|2,0,0]=3 139 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 SY017113 [0,0,0,0,1,0|2,0,0]=3 140 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SY017054 [0,0,0,0,1,0|2,0,0]=3 141 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SY049651 [0,0,0,0,1,0|3,0,0]=4 142 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SY035719 [0,0,0,0,1,0|3,0,0]=4 143 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SY001162 [0,0,0,0,1,0|2,0,0]=3 144 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SY016072 [0,0,0,0,1,0|3,0,0]=4 145 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 SY233693 [0,0,0,0,1,0|3,0,0]=4 146 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 SY246635 [0,0,0,0,1,0|2,0,0]=3 147 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SY013543 [0,0,0,0,1,0|2,0,0]=3 148 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 SY031092 [0,0,0,0,1,0|3,0,0]=4 149 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 SY132432 [0,0,0,0,1,0|1,0,0]=2 150 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SY001683 [0,0,0,0,1,0|0,0,0]=1 151 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SY001637 [0,0,0,0,1,0|2,0,0]=3 152 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 SY113865 [0,0,0,0,1,0|3,0,0]=4 153 B11R1.20 O=C(Cl)OC1=CC=C(I)C=C1 SY296872 [0,0,0,0,1,0|3,0,0]=4 154 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SY001685 [0,0,0,0,1,0|2,0,0]=3 155 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 SY041953 [0,0,0,0,1,0|3,0,0]=4 156 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SY001347 [0,0,0,0,1,0|2,0,0]=3 157 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SY016997 [0,0,0,0,1,0|2,0,0]=3 158 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SY004128 [0,0,0,0,1,0|1,0,0]=2 159 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SY097003 [0,0,0,0,1,0|3,0,0]=4 160 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SY039154 [0,0,0,0,1,0|3,0,0]=4 161 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 SY103177 [0,0,0,0,0,1|1,0,0]=2 162 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 SY030207 [0,0,0,0,0,1|2,0,0]=3 163 B13R1.513 O=C(Cl)CCCC1=CC=C(F)C=C1 SY039298 [0,0,0,0,0,1|2,0,0]=3 164 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 SY006986 [0,0,0,0,0,1|2,0,0]=3 165 B13R1.513 O=C(O)CCCC1=CC=C(Cl)C=C1 SY033190 [0,0,0,0,0,1|2,0,0]=3 166 B13R1.513 O=C(O)CCCC1=CC=C(F)C=C1 SY039290 [0,0,0,0,0,1|2,0,0]=3 167 B13R1.513 O=C(O)CCCC1=CC=C(O)C=C1 SY031852 [0,0,0,0,0,1|1,0,0]=2 168 B13R1.513 O=C(O)CCOC1=CC=C(Br)C=C1 SY123396 [0,0,0,0,0,1|2,0,0]=3 169 B13R1.513 O=C(O)CCOC1=CC=C(Cl)C=C1 SY008353 [0,0,0,0,0,1|2,0,0]=3 170 B10R1.1 C=CCC1=CC=C(O)C=C1 SY045829 [2,0,0,0,0,0|0,0,1]=3 171 B10R1.1 CC1=CC=C(CCO)C=C1 SY036805 [2,0,0,0,0,0|1,0,1]=4 172 B10R1.1 CC1=CC=C(CNN)C=C1 SY048073 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.1 CCCC1=CC=C(Br)C=C1 SY016468 [2,0,0,0,0,0|1,0,1]=4 174 B10R1.1 CCOC1=CC=C(O)C=C1 SY015677 [2,0,0,0,0,0|1,0,1]=4 175 B10R1.1 CNCC1=CC=C(O)C=C1 SY018667 [2,0,0,0,0,0|1,0,1]=4 176 B10R1.1 COCC1=CC=C(O)C=C1 SY026430 [2,0,0,0,0,0|1,0,1]=4 177 B10R1.1 ClC1=CC=C(CCBr)C=C1 SY101293 [2,0,0,0,0,0|2,0,0]=4 178 B10R1.1 FC1=CC=C(CCBr)C=C1 SY004855 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.1 NC1=CC=C(CCO)C=C1 SY030989 [2,0,0,0,0,0|1,0,1]=4 180 B10R1.1 NCCC1=CC=C(Br)C=C1 SY004635 [2,0,0,0,0,0|1,0,0]=3 181 B10R1.1 NCCC1=CC=C(Cl)C=C1 SY006689 [2,0,0,0,0,0|1,0,0]=3 182 B10R1.1 NCCC1=CC=C(F)C=C1 SY279169 [2,0,0,0,0,0|1,0,0]=3 183 B10R1.1 NCCC1=CC=C(N)C=C1 SY002473 [2,0,0,0,0,0|1,0,0]=3 184 B10R1.1 NCCC1=CC=C(O)C=C1 SY002127 [2,0,0,0,0,0|0,0,0]=2 185 B10R1.1 NCCC1=CC=C(O)C=C1 SY057039 [2,0,0,0,0,0|0,0,0]=2 186 B10R1.1 NNCC1=CC=C(Br)C=C1 SY048080 [2,0,0,0,0,0|2,0,0]=4 187 B10R1.1 NOCC1=CC=C(Br)C=C1 SY281555 [2,0,0,0,0,0|2,0,0]=4 188 B10R1.1 NOCC1=CC=C(Br)C=C1 SY281556 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.1 NOCC1=CC=C(F)C=C1 SY246091 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.1 NOCC1=CC=C(I)C=C1 SY281768 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.1 NOCC1=CC=C(I)C=C1 SY281769 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.1 O=CCC1=CC=C(Br)C=C1 SY110273 [2,0,0,0,0,0|1,0,0]=3 193 B10R1.1 O=CCC1=CC=C(Br)N=C1 SY253045 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.1 OC1=CC=C(CCBr)C=C1 SY020164 [2,0,0,0,0,0|1,0,0]=3 195 B10R1.1 OCCC1=CC=C(Br)C=C1 SY002573 [2,0,0,0,0,0|1,0,1]=4 196 B10R1.1 OCCC1=CC=C(Cl)C=C1 SY018274 [2,0,0,0,0,0|1,0,1]=4 197 B10R1.1 OCCC1=CC=C(F)C=C1 SY016325 [2,0,0,0,0,0|1,0,1]=4 198 B10R1.1 OCCC1=CC=C(I)C=C1 SY105110 [2,0,0,0,0,0|1,0,1]=4 199 B10R1.1 OCCC1=CC=C(O)C=C1 SY001653 [2,0,0,0,0,0|0,0,1]=3 200 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [2,0,0,0,0,0|1,0,1]=4 201 B10R1.17 C1=CC=CC=C1CCC#N SY246292 [2,0,0,0,0,0|0,0,2]=4 202 B10R1.17 C=COCC1=CC=CC=C1 SY097145 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [2,0,0,0,0,0|2,0,0]=4 204 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [2,0,0,0,0,0|1,0,1]=4 205 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [2,0,0,0,0,0|1,0,1]=4 206 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [2,0,0,0,0,0|0,0,1]=3 207 B10R1.17 NCCCC1=CC=CN=C1 SY022422 [2,0,0,0,0,0|1,0,1]=4 208 B10R1.17 NCCCC1=CC=NC=C1 SY022421 [2,0,0,0,0,0|1,0,1]=4 209 B10R1.17 NCCCC1=NC=CC=C1 SY022423 [2,0,0,0,0,0|1,0,1]=4 210 B10R1.17 NCCNC1=CC=CC=C1 SY009366 [2,0,0,0,0,0|1,0,1]=4 211 B10R1.17 NCCOC1=CC=CC=C1 SY004523 [2,0,0,0,0,0|1,0,1]=4 212 B10R1.17 NNCCC1=CC=CC=C1 SY048081 [2,0,0,0,0,0|1,0,0]=3 213 B10R1.17 NOCCC1=CC=CC=C1 SY114401 [2,0,0,0,0,0|1,0,0]=3 214 B10R1.17 NOCCC1=CC=CC=C1 SY281546 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.17 O=CC#CC1=CC=CC=C1 SY015622 [2,0,0,0,0,0|0,0,2]=4 216 B10R1.17 O=CNCC1=NC=CC=C1 SY236692 [2,0,0,0,0,0|2,0,0]=4 217 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [2,0,0,0,0,0|0,0,2]=4 218 B12R1.1 CC1=CC=C(OCCCN)C=C1 SY008304 [1,1,0,0,0,0|1,0,1]=4 219 B12R1.1 NCCCOC1=CC=C(Cl)C=C1 SY008298 [1,1,0,0,0,0|1,0,1]=4 220 B12R1.1 NCCCOC1=CC=C(F)C=C1 SY008292 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.1 O=C=NCCC1=CC=C(Br)C=C1 SY248184 [1,1,0,0,0,0|1,0,1]=4 222 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 SY008896 [1,1,0,0,0,0|2,0,0]=4 223 B12R1.71 C=CCCC1=CC=C(OC)C=C1 SY046756 [1,1,0,0,0,0|1,0,0]=3 224 B12R1.71 CNCCC1=CC=C(OC)C=C1 SY002518 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.71 COC1=CC=C(CCCO)C=C1 SY101959 [1,1,0,0,0,0|0,0,2]=4 226 B12R1.71 COC1=CC=C(NCCN)C=C1 SY032211 [1,1,0,0,0,0|1,0,1]=4 227 B12R1.71 COC1=CC=C(OCCN)C=C1 SY008273 [1,1,0,0,0,0|1,0,1]=4 228 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SY004327 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.27 COC(=O)CCC1=CC=CC=C1 SY017877 [1,1,0,0,0,0|1,0,0]=3 230 B12R1.27 COC(=O)CCC1=CC=NC=C1 SY022395 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.27 COC(=O)CCC1=NC=CC=C1 SY022458 [1,1,0,0,0,0|2,0,0]=4 232 B12R1.27 COC(=O)COC1=CC=CC=C1 SY037886 [1,1,0,0,0,0|2,0,0]=4 233 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY021003 [1,1,0,0,0,0|1,0,0]=3 234 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY038933 [1,1,0,0,0,0|1,0,0]=3 235 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SY017007 [1,1,0,0,0,0|1,0,0]=3 236 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SY002918 [1,1,0,0,0,0|2,0,0]=4 237 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SY115712 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SY024162 [1,1,0,0,0,0|1,0,0]=3 239 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SY006039 [1,1,0,0,0,0|1,0,1]=4 240 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O SY185587 [1,1,0,0,0,0|1,0,0]=3 241 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SY009482 [1,1,0,0,0,0|0,0,0]=2 242 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SY036427 [1,1,0,0,0,0|0,0,0]=2 243 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SY034084 [1,1,0,0,0,0|0,0,0]=2 244 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SY001531 [1,1,0,0,0,0|1,0,0]=3 245 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O SY057601 [1,1,0,0,0,0|2,0,0]=4 246 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O SY057718 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SY005120 [1,1,0,0,0,0|1,0,0]=3 248 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O SY033040 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SY103074 [1,1,0,0,0,0|1,0,0]=3 250 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SY036063 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SY020879 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SY021341 [1,1,0,0,0,0|1,0,0]=3 253 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SY011141 [1,1,0,0,0,0|1,0,1]=4 254 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SY007036 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.107 CC(CC(N)=O)C1=CC=CC=C1 SY249488 [1,1,0,0,0,0|0,0,0]=2 256 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 SY231348 [1,1,0,0,0,0|1,0,0]=3 257 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SY226436 [1,1,0,0,0,0|1,0,0]=3 258 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SY002485 [1,1,0,0,0,0|1,0,0]=3 259 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 SY013379 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SY017494 [1,1,0,0,0,0|1,0,0]=3 261 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 SY014163 [1,1,0,0,0,0|1,0,0]=3 262 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SY045029 [1,1,0,0,0,0|1,0,1]=4 263 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 SY017555 [1,1,0,0,0,0|1,0,0]=3 264 B12R1.125 CC1=CC=CC=C1CCC(=O)O SY017785 [1,1,0,0,0,0|1,0,0]=3 265 B12R1.125 N=C(N)COC1=CC=CC=C1Cl SY003969 [1,1,0,0,0,0|2,0,0]=4 266 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SY017169 [1,1,0,0,0,0|1,0,0]=3 267 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SY003324 [1,1,0,0,0,0|1,0,0]=3 268 B12R1.125 O=C(O)CCC1=CC=CC=C1F SY016160 [1,1,0,0,0,0|1,0,0]=3 269 B12R1.125 O=C(O)CCC1=CC=CC=C1I SY238889 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.125 O=C(O)CCC1=CC=CC=C1O SY101015 [1,1,0,0,0,0|1,0,0]=3 271 B12R1.125 O=C(O)CCC1=NC=CC=C1Br SY244454 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.125 O=C(O)COC1=CC=CC=C1F SY008332 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.125 O=[N+]([O-])CCC1=CC=CC=C1Cl SY266525 [1,1,0,0,0,0|2,0,0]=4 274 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 SY062646 [1,1,0,0,0,0|1,0,0]=3 275 B12R1.226 N=C(N)NCC1=CC=CC(F)=C1 SY294082 [1,1,0,0,0,0|2,0,0]=4 276 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 SY032519 [1,1,0,0,0,0|0,0,0]=2 277 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 SY062293 [1,1,0,0,0,0|1,0,0]=3 278 B12R1.226 O=C(Cl)COC1=CC=CC(F)=C1 SY128814 [1,1,0,0,0,0|2,0,0]=4 279 B12R1.226 O=C(O)CCC1=CC(Br)=CC=C1 SY013761 [1,1,0,0,0,0|1,0,0]=3 280 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SY017063 [1,1,0,0,0,0|1,0,0]=3 281 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 SY017727 [1,1,0,0,0,0|1,0,0]=3 282 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 SY022016 [1,1,0,0,0,0|1,0,0]=3 283 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 SY008336 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SY122974 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 SY008331 [1,1,0,0,0,0|2,0,0]=4 286 B12R1.226 O=[N+]([O-])CCC1=CC=CC(Cl)=C1 SY266524 [1,1,0,0,0,0|2,0,0]=4 287 B12R1.226 O=[N+]([O-])CCC1=CC=CC(F)=C1 SY266555 [1,1,0,0,0,0|2,0,0]=4 288 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 SY039026 [1,1,0,0,0,0|2,0,0]=4 289 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 SY001095 [0,1,0,0,1,0|1,0,0]=3 290 B12R1.4 COC1=CC=C(CC(=O)O)C=N1 SY013002 [0,1,0,0,1,0|2,0,0]=4 291 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 SY001528 [0,1,0,0,1,0|1,0,0]=3 292 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SY078829 [0,1,0,0,1,0|2,0,0]=4 293 B12R1.4 N#CC1=CC=C(CC(=O)Cl)C=C1 SY292155 [0,1,0,0,1,0|2,0,0]=4 294 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 SY007137 [0,1,0,0,1,0|2,0,0]=4 295 B12R1.4 N#CC1=CC=C(CC(N)=O)C=C1 SY147070 [0,1,0,0,1,0|1,0,0]=3 296 B12R1.4 N#CC1=CC=C(CC(N)=S)C=C1 SY292154 [0,1,0,0,1,0|1,1,0]=4 297 B12R1.4 NCC1=CC=C(CC(N)=O)C=C1 SY166682 [0,1,0,0,1,0|1,0,0]=3 298 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 SY017383 [0,1,0,0,1,0|2,0,0]=4 299 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 SY278691 [0,1,0,0,1,0|2,0,0]=4 300 B12R1.4 O=C(O)CC1=CC=C(CCl)C=C1 SY019601 [0,1,0,0,1,0|2,0,0]=4 301 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 SY046320 [0,1,0,0,1,0|1,0,0]=3 302 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 SY026371 [0,1,0,0,1,0|1,0,1]=4 303 B12R1.19 CC(=O)NC1=CC=C(O)C(Cl)=C1 SY101186 [0,1,0,0,1,0|2,0,0]=4 304 B12R1.19 CC1=CC(CC(=O)O)=CC=C1Br SY110282 [0,1,0,0,1,0|2,0,0]=4 305 B12R1.19 CC1=CC(CC(=O)O)=CC=C1N SY026682 [0,1,0,0,1,0|2,0,0]=4 306 B12R1.19 CC1=CC=C(CC(=O)O)C=C1C SY021853 [0,1,0,0,1,0|2,0,0]=4 307 B12R1.19 O=C(O)CC1=CC=C(Br)C(F)=C1 SY021396 [0,1,0,0,1,0|2,0,0]=4 308 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 SY003305 [0,1,0,0,1,0|2,0,0]=4 309 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 SY041310 [0,1,0,0,1,0|2,0,0]=4 310 B12R1.19 O=C(O)CC1=CC=C(F)C(Br)=C1 SY018603 [0,1,0,0,1,0|2,0,0]=4 311 B12R1.19 O=C(O)CC1=CC=C(F)C(Cl)=C1 SY019212 [0,1,0,0,1,0|2,0,0]=4 312 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 SY024310 [0,1,0,0,1,0|2,0,0]=4 313 B12R1.19 O=C(O)CC1=CC=C(O)C(Br)=C1 SY039207 [0,1,0,0,1,0|1,0,0]=3 314 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 SY015718 [0,1,0,0,1,0|1,0,0]=3 315 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 SY021366 [0,1,0,0,1,0|2,0,0]=4 316 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 SY229641 [0,1,0,0,1,0|2,0,0]=4 317 B12R1.20 CC(C(N)=O)C1=CC=C(Br)C=C1 SY233699 [0,1,0,0,1,0|1,0,0]=3 318 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 SY023256 [0,1,0,0,1,0|2,0,0]=4 319 B12R1.20 CC1=CC=C(C(F)C(=O)O)C=C1 SY263432 [0,1,0,0,1,0|2,0,0]=4 320 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 SY232364 [0,1,0,0,1,0|1,0,0]=3 321 B12R1.20 C[C@H](C(=O)O)C1=CC=C(O)C=C1 SY232323 [0,1,0,0,1,0|1,0,0]=3 322 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 SY004786 [0,1,0,0,1,0|2,0,0]=4 323 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 SY017756 [0,1,0,0,1,0|2,0,0]=4 324 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 SY004676 [0,1,0,0,1,0|2,0,0]=4 325 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 SY015212 [0,1,0,0,1,0|2,0,0]=4 326 B12R1.20 NC(C(=O)O)C1=CC=C(O)C=C1 SY032272 [0,1,0,0,1,0|1,0,0]=3 327 B12R1.20 NC1=CC=C([C@@H](O)C(=O)O)C=C1 SY290823 [0,1,0,0,1,0|2,0,0]=4 328 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 SY004700 [0,1,0,0,1,0|2,0,0]=4 329 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 SY036146 [0,1,0,0,1,0|1,0,0]=3 330 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 SY034129 [0,1,0,0,1,0|2,0,0]=4 331 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 SY004699 [0,1,0,0,1,0|2,0,0]=4 332 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 SY047013 [0,1,0,0,1,0|1,0,0]=3 333 B12R1.20 O=C(O)C(F)C1=CC=C(Cl)C=C1 SY263425 [0,1,0,0,1,0|2,0,0]=4 334 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 SY018914 [0,1,0,0,1,0|2,0,0]=4 335 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 SY016990 [0,1,0,0,1,0|2,0,0]=4 336 B12R1.20 O=C(O)[C@H](O)C1=CC=C(F)C=C1 SY264087 [0,1,0,0,1,0|2,0,0]=4 337 B12R1.106 NS(=O)(=O)NC1=CC=C(O)C=C1 SY268122 [0,1,0,0,1,0|2,0,0]=4 338 B12R1.233 CC1=CC(Cl)=CC=C1CC(=O)O SY272295 [0,1,0,0,1,0|2,0,0]=4 339 B12R1.233 CC1=CC=C(CC(=O)O)C(C)=C1 SY021822 [0,1,0,0,1,0|2,0,0]=4 340 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 SY003610 [0,1,0,0,1,0|2,0,0]=4 341 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1F SY018076 [0,1,0,0,1,0|2,0,0]=4 342 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Br SY045471 [0,1,0,0,1,0|2,0,0]=4 343 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F SY014146 [0,1,0,0,1,0|2,0,0]=4 344 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Br SY020962 [0,1,0,0,1,0|2,0,0]=4 345 B12R1.233 O=C(O)CC1=CC=C(F)C=C1F SY017050 [0,1,0,0,1,0|2,0,0]=4 346 B12R1.233 O=C(O)CC1=CC=C(O)C=C1F SY102182 [0,1,0,0,1,0|1,0,0]=3 347 B14R1.4 COC1=CC=C(CCCC(=O)O)C=C1 SY004394 [0,1,0,0,0,1|1,0,0]=3 348 B14R1.4 COC1=CC=C(OCCC(=O)O)C=C1 SY008350 [0,1,0,0,0,1|1,0,0]=3 349 B14R1.4 CSC1=CC=C(OCCC(=O)O)C=C1 SY008365 [0,1,0,0,0,1|1,1,0]=4 350 B14R1.4 N#CC1=CC=C(OCCC(=O)O)C=C1 SY008356 [0,1,0,0,0,1|2,0,0]=4 351 B14R1.13 COC(=O)CCNC1=CC=C(O)C=C1 SY027115 [0,1,0,0,0,1|1,0,0]=3 352 B14R1.678 CC1=CC=C(C(=O)CCC(=O)O)C=C1 SY032321 [0,1,0,0,0,1|2,0,0]=4 353 B14R1.678 O=C(O)CCC(=O)C1=CC=C(Br)C=C1 SY006987 [0,1,0,0,0,1|2,0,0]=4 354 B14R1.678 O=C(O)CCC(=O)C1=CC=C(F)C=C1 SY008025 [0,1,0,0,0,1|2,0,0]=4 355 B14R1.678 O=C(O)CCC(=O)C1=CC=C(O)C=C1 SY240171 [0,1,0,0,0,1|1,0,0]=3 356 B14R1.698 CC1=CC=C(CC(N)CC(=O)O)C=C1 SY224951 [0,1,0,0,0,1|2,0,0]=4 357 B14R1.698 NC(CC(=O)O)CC1=CC=C(Br)C=C1 SY224953 [0,1,0,0,0,1|2,0,0]=4 358 B14R1.698 NC(CC(=O)O)CC1=CC=C(Cl)C=C1 SY225004 [0,1,0,0,0,1|2,0,0]=4 359 B14R1.698 NC(CC(=O)O)CC1=CC=C(F)C=C1 SY224946 [0,1,0,0,0,1|2,0,0]=4 360 B14R1.698 NC(CC(=O)O)CC1=CC=C(I)C=C1 SY224992 [0,1,0,0,0,1|2,0,0]=4 361 B14R1.698 NC(CC(=O)O)CC1=CC=C(O)C=C1 SY059876 [0,1,0,0,0,1|1,0,0]=3 362 B14R1.2 COC1=CC=C(C(N)CC(=O)O)C=C1 SY007346 [0,2,0,0,0,0|1,0,0]=3 363 B14R1.3 COC1=CC=C(CC(N)C(=O)O)C=C1 SY044844 [0,2,0,0,0,0|1,0,0]=3 364 B14R1.3 COC1=CC=C(OC(C)C(=O)[O-])C=C1 SY127593 [0,2,0,0,0,0|2,0,0]=4 365 B14R1.5 C#CC1=CC=C(CCC(=O)OC)C=C1 SY028001 [0,2,0,0,0,0|2,0,0]=4 366 B14R1.142 CCOC1=CC=C(CCC(=O)O)C=C1 SY173374 [0,2,0,0,0,0|1,0,0]=3 367 B14R1.419 CC(=O)OCC1=CC=C(C(=O)O)C=C1 SY017144 [0,2,0,0,0,0|2,0,0]=4 368 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 SY101569 [0,2,0,0,0,0|2,0,0]=4 369 B14R1.419 O=C(O)CCC1=CC=C(C(=O)O)C=C1 SY032042 [0,2,0,0,0,0|1,0,0]=3 370 B14R1.419 O=C(O)CCC1=CC=C([N+](=O)[O-])C=C1 SY018637 [0,2,0,0,0,0|1,0,1]=4 371 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1Cl SY066908 [0,2,0,0,0,0|1,0,0]=3 372 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1F SY035666 [0,2,0,0,0,0|1,0,0]=3 373 B14R1.3653 COC1=CC=C(CC[N+](=O)[O-])C=C1F SY266610 [0,2,0,0,0,0|2,0,0]=4 374 B14R1.10 COC(=O)CC(N)C1=CC=C(O)C=C1 SY028034 [0,2,0,0,0,0|1,0,0]=3 375 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 SY109110 [0,2,0,0,0,0|2,0,0]=4 376 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 SY011309 [0,2,0,0,0,0|1,0,0]=3 377 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 SY015879 [0,2,0,0,0,0|1,0,0]=3 378 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Br)C=C1 SY237222 [0,2,0,0,0,0|2,0,0]=4 379 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(O)C=C1 SY057646 [0,2,0,0,0,0|1,0,0]=3 380 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(F)C=C1 SY008378 [0,2,0,0,0,0|2,0,0]=4 381 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 SY021681 [0,2,0,0,0,0|2,0,0]=4 382 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 SY043383 [0,2,0,0,0,0|2,0,0]=4 383 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 SY018459 [0,2,0,0,0,0|1,0,0]=3 384 B14R1.727 COC(=O)CCC1=CC=C(Br)C=C1O SY289390 [0,2,0,0,0,0|2,0,0]=4 385 B14R1.727 COC(=O)CCC1=CC=C(O)C=C1C SY026463 [0,2,0,0,0,0|1,0,0]=3 386 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(Cl)C=C1 SY254100 [0,2,0,0,0,0|2,0,0]=4 387 B14R1.685 CC1=CC=C(C(N)CC(=O)O)C=C1C SY044852 [0,2,0,0,0,0|2,0,0]=4 388 B14R1.685 NC(CC(=O)O)C1=CC=C(F)C(Cl)=C1 SY044898 [0,2,0,0,0,0|2,0,0]=4 389 B14R1.1019 NCC(CC(=O)O)C1=CC=C(Cl)C=C1 SY052300 [0,2,0,0,0,0|2,0,0]=4 390 B14R1.6048 NC(CC(=O)O)C1=CC=C(Br)C=C1F SY044838 [0,2,0,0,0,0|2,0,0]=4 391 B14R1.6048 NC(CC(=O)O)C1=CC=C(Cl)C=C1Cl SY044842 [0,2,0,0,0,0|2,0,0]=4 392 B14R1.6048 NC(CC(=O)O)C1=CC=C(F)C=C1F SY044847 [0,2,0,0,0,0|2,0,0]=4 393 B14R1.6048 NC(CC(=O)O)C1=CC=C(O)C=C1O SY026951 [0,2,0,0,0,0|1,0,0]=3 394 B14R1.536 CC1=CC=C(CC(C#N)C(=O)O)C=C1 SY047939 [0,2,0,0,0,0|2,0,0]=4 395 B14R1.536 CO[C@H](CC1=CC=C(N)C=C1)C(=O)O SY268138 [0,2,0,0,0,0|2,0,0]=4 396 B14R1.536 N#CC(CC1=CC=C(Br)C=C1)C(=O)O SY023764 [0,2,0,0,0,0|2,0,0]=4 397 B14R1.536 N#CC(CC1=CC=C(Cl)C=C1)C(=O)O SY047957 [0,2,0,0,0,0|2,0,0]=4 398 B14R1.536 N#CC(CC1=CC=C(F)C=C1)C(=O)O SY047922 [0,2,0,0,0,0|2,0,0]=4 399 B14R1.536 N#CC(CC1=CC=C(O)C=C1)C(=O)O SY026460 [0,2,0,0,0,0|1,0,0]=3 400 B14R1.536 NCC(CC1=CC=C(Cl)C=C1)C(=O)O SY019945 [0,2,0,0,0,0|2,0,0]=4 401 B14R1.686 CC1=CC=C(CC(N)C(=O)O)C=C1C SY044846 [0,2,0,0,0,0|2,0,0]=4 402 B14R1.686 NC(CC1=CC=C(Cl)C(Cl)=C1)C(=O)O SY044854 [0,2,0,0,0,0|2,0,0]=4 403 B14R1.686 NC(CC1=CC=C(F)C(Cl)=C1)C(=O)O SY044899 [0,2,0,0,0,0|2,0,0]=4 404 B14R1.686 N[C@@H](CC1=CC(I)=C(O)C=C1)C(=O)O SY041757 [0,2,0,0,0,0|1,0,0]=3 405 B14R1.686 N[C@@H](CC1=CC=C(O)C(Br)=C1)C(=O)O SY108324 [0,2,0,0,0,0|1,0,0]=3 406 B14R1.686 N[C@@H](CC1=CC=C(O)C(Cl)=C1)C(=O)O SY101146 [0,2,0,0,0,0|1,0,0]=3 407 B14R1.686 N[C@@H](CC1=CC=C(O)C(F)=C1)C(=O)O SY278246 [0,2,0,0,0,0|1,0,0]=3 408 B14R1.686 N[C@@H](CC1=CC=C(O)C(O)=C1)C(=O)O SY010977 [0,2,0,0,0,0|1,0,0]=3 409 B14R1.686 N[C@H](CC1=CC(F)=C(O)C=C1)C(=O)O SY258076 [0,2,0,0,0,0|1,0,0]=3 410 B14R1.686 N[C@H](CC1=CC=C(Cl)C(Cl)=C1)C(=O)O SY030289 [0,2,0,0,0,0|2,0,0]=4 411 B14R1.6049 NC(CC1=CC=C(Br)C=C1F)C(=O)O SY044909 [0,2,0,0,0,0|2,0,0]=4 412 B14R1.6049 NC(CC1=CC=C(Cl)C=C1Cl)C(=O)O SY044843 [0,2,0,0,0,0|2,0,0]=4 413 B14R1.6049 NC(CC1=CC=C(F)C=C1F)C(=O)O SY044824 [0,2,0,0,0,0|2,0,0]=4 414 B14R1.6049 N[C@@H](CC1=CC=C(Cl)C=C1Cl)C(=O)O SY096734 [0,2,0,0,0,0|2,0,0]=4 415 B14R1.6049 N[C@H](CC1=CC=C(Cl)C=C1Cl)C(=O)O SY031008 [0,2,0,0,0,0|2,0,0]=4 416 B14R1.7626 CC(N)(CC1=CC=C(O)C=C1)C(=O)O SY045851 [0,2,0,0,0,0|1,0,0]=3 417 B14R1.7626 C[C@](N)(CC1=CC=C(O)C=C1)C(=O)O SY099144 [0,2,0,0,0,0|1,0,0]=3 418 B14R1.1600 COC1=CC(Br)=CC=C1CCC(=O)O SY150825 [0,2,0,0,0,0|2,0,0]=4 419 B14R1.1600 COC1=CC(N)=CC=C1OCC(N)=O SY267490 [0,2,0,0,0,0|2,0,0]=4 420 B14R1.42 COC1=CC(CCC(C)=O)=CC=C1O SY017980 [0,2,0,0,0,0|1,0,0]=3 421 B14R1.15552 CC1=CC(CCC(=O)O)=CC(C)=C1O SY026461 [0,2,0,0,0,0|1,0,0]=3 422 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 SY018944 [1,0,0,1,0,0|1,0,1]=4 423 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 SY118852 [1,0,0,1,0,0|1,0,1]=4 424 B12R2.24 NC1=CC2=C(C=C1)CCCN2 SY110739 [1,0,0,1,0,0|1,0,1]=4 425 B12R2.24 OC1=CC2=C(C=C1)CCCN2 SY021160 [1,0,0,1,0,0|0,0,1]=3 426 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 SY047274 [1,0,0,1,0,0|1,0,1]=4 427 B12R2.79 NC1CC1C2=CC=C(F)C=C2 SY044993 [1,0,0,1,0,0|1,0,1]=4 428 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 SY045000 [1,0,0,1,0,0|1,0,1]=4 429 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 SY045001 [1,0,0,1,0,0|1,0,1]=4 430 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 SY019194 [1,0,0,1,0,0|1,0,0]=3 431 B12R2.132 NC1=CC2=C(C=C1)CNC2=O SY031793 [1,0,0,1,0,0|2,0,0]=4 432 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 SY007083 [1,0,0,1,0,0|1,0,0]=3 433 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 SY021488 [1,0,0,1,0,0|1,0,0]=3 434 B12R2.132 O=C1CCC2=C1C=C(O)C=C2 SY047079 [1,0,0,1,0,0|0,0,0]=2 435 B12R2.132 O=C1CCC2=CC=C(F)C=C12 SY010637 [1,0,0,1,0,0|1,0,0]=3 436 B12R2.132 O=C1COC2=CC=C(Br)C=C12 SY009757 [1,0,0,1,0,0|2,0,0]=4 437 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 SY011536 [1,0,0,1,0,0|2,0,0]=4 438 B12R2.132 O=C1COC2=CC=C(F)C=C12 SY011534 [1,0,0,1,0,0|2,0,0]=4 439 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 SY017598 [1,0,0,1,0,0|2,0,0]=4 440 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 SY043062 [1,0,0,1,0,0|2,0,0]=4 441 B12R2.132 O=C1NCC2=C1C=C(O)C=C2 SY031207 [1,0,0,1,0,0|1,0,0]=3 442 B12R2.132 O=C1OCC2=C1C=C(Br)C=C2 SY030534 [1,0,0,1,0,0|2,0,0]=4 443 B12R2.2302 BrC1=CC=C(C2CCN2)C=C1 SY197341 [1,0,0,1,0,0|1,0,1]=4 444 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SY029843 [1,0,0,1,0,0|1,0,0]=3 445 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 SY185508 [1,0,0,1,0,0|1,0,0]=3 446 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 SY020777 [0,0,0,1,1,0|1,0,0]=3 447 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 SY045908 [0,0,0,1,1,0|2,0,0]=4 448 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SY030708 [0,0,0,1,1,0|1,0,0]=3 449 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 SY007179 [0,0,0,1,1,0|2,0,0]=4 450 B12R2.606 NC1=CC=C2OC(=O)NC2=C1 SY043261 [0,0,0,1,1,0|2,0,0]=4 451 B12R2.606 NC1=NC2=CC=C(O)C=C2S1 SY079918 [0,0,0,1,1,0|1,1,0]=4 452 B12R2.606 NC1CC2=C(C=C(O)C=C2)C1 SY290730 [0,0,0,1,1,0|1,0,1]=4 453 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 SY040582 [0,0,0,1,1,0|2,0,0]=4 454 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SY002545 [0,0,0,1,1,0|1,0,0]=3 455 B12R2.606 O=C1CC2=C(C=C(Cl)N=C2)N1 SY031690 [0,0,0,1,1,0|2,0,0]=4 456 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 SY028412 [0,0,0,1,1,0|1,0,0]=3 457 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 SY023129 [0,0,0,1,1,0|0,0,0]=2 458 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 SY004439 [0,0,0,1,1,0|1,0,0]=3 459 B12R2.606 O=C1CC2=CC=C(Cl)N=C2N1 SY031668 [0,0,0,1,1,0|2,0,0]=4 460 B12R2.606 O=C1CC2=NC=C(Cl)C=C2N1 SY033632 [0,0,0,1,1,0|2,0,0]=4 461 B12R2.606 O=C1NC2=CC(Br)=CC=C2O1 SY038495 [0,0,0,1,1,0|2,0,0]=4 462 B12R2.606 O=C1NC2=CC(F)=CC=C2O1 SY101449 [0,0,0,1,1,0|2,0,0]=4 463 B12R2.606 O=C1NC2=CC(I)=CC=C2O1 SY268394 [0,0,0,1,1,0|2,0,0]=4 464 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 SY004487 [0,0,0,1,1,0|2,0,0]=4 465 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 SY039596 [0,0,0,1,1,0|2,0,0]=4 466 B12R2.606 O=C1NC2=CC=C(O)C=C2S1 SY261696 [0,0,0,1,1,0|2,0,0]=4 467 B14R2.20 O=C1CCC(C2=CC=C(Br)C=C2)N1 SY111565 [0,0,0,1,0,1|1,0,0]=3 468 B14R2.4402 CC1=CC=C(C2CC2C(=O)O)C=C1 SY080401 [0,0,0,1,0,1|2,0,0]=4 469 B14R2.4402 CC1=CC=C([C@@H]2C[C@H]2C(=O)O)C=C1 SY266122 [0,0,0,1,0,1|2,0,0]=4 470 B14R2.4402 CC1=CC=C([C@@H]2C[C@H]2C(=O)O)C=C1 SY266123 [0,0,0,1,0,1|2,0,0]=4 471 B14R2.4402 CC1=CC=C([C@H]2C[C@@H]2C(=O)O)C=C1 SY266121 [0,0,0,1,0,1|2,0,0]=4 472 B14R2.4402 O=C(O)C1CC1C2=CC=C(Br)C=C2 SY036324 [0,0,0,1,0,1|2,0,0]=4 473 B14R2.4402 O=C(O)C1CC1C2=CC=C(Cl)C=C2 SY036707 [0,0,0,1,0,1|2,0,0]=4 474 B14R2.4402 O=C(O)C1CC1C2=CC=C(F)C=C2 SY020770 [0,0,0,1,0,1|2,0,0]=4 475 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(Br)C=C2 SY266099 [0,0,0,1,0,1|2,0,0]=4 476 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(Cl)C=C2 SY205590 [0,0,0,1,0,1|2,0,0]=4 477 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(Cl)C=C2 SY266088 [0,0,0,1,0,1|2,0,0]=4 478 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(F)C=C2 SY167556 [0,0,0,1,0,1|2,0,0]=4 479 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(F)C=C2 SY266080 [0,0,0,1,0,1|2,0,0]=4 480 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(Br)C=C2 SY096714 [0,0,0,1,0,1|2,0,0]=4 481 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(Cl)C=C2 SY266087 [0,0,0,1,0,1|2,0,0]=4 482 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(F)C=C2 SY266079 [0,0,0,1,0,1|2,0,0]=4 483 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 SY004719 [0,1,0,1,0,0|1,0,0]=3 484 B14R2.134 COC1=CC2=C(C=C1)COC(=O)C2 SY241602 [0,1,0,1,0,0|2,0,0]=4 485 B14R2.134 COC1=CC=C2COC(=O)NC2=C1 SY129174 [0,1,0,1,0,0|1,0,0]=3 486 B14R2.134 COC1=CC=C2OCC(=O)NC2=C1 SY130717 [0,1,0,1,0,0|1,0,0]=3 487 B14R2.134 O=C1COC2=CC=C(CO)N=C2N1 SY279376 [0,1,0,1,0,0|2,0,0]=4 488 B14R2.4513 CC1=C(Br)C=CC2=C1NC(=O)CC2 SY060536 [0,1,0,1,0,0|1,0,0]=3 489 B14R2.4513 CC1=C2NC(=O)COC2=CC=C1Br SY100552 [0,1,0,1,0,0|2,0,0]=4 490 B14R2.4513 CC1=CC=C2COC(=O)NC2=C1C SY129165 [0,1,0,1,0,0|2,0,0]=4 491 B14R2.4513 CN1C(=O)COC2=CC=C(N)C=C21 SY192499 [0,1,0,1,0,0|2,0,0]=4 492 B14R2.4513 CN1C(=O)CSC2=CC=C(N)C=C21 SY264738 [0,1,0,1,0,0|2,0,0]=4 493 B14R2.4513 O=C1CCC2=C(N1)C(Br)=C(F)C=C2 SY271494 [0,1,0,1,0,0|1,0,0]=3 494 B14R2.4513 O=C1COC2=CC=C(Br)C(F)=C2N1 SY100556 [0,1,0,1,0,0|2,0,0]=4 495 B14R2.29365 O=C1COC2=C(Cl)C=C(Br)C=C2N1 SY100549 [0,1,0,1,0,0|2,0,0]=4 496 B14R2.29365 O=C1COC2=C(Cl)C=C(Cl)C=C2N1 SY130726 [0,1,0,1,0,0|2,0,0]=4 497 B14R2.29365 O=C1NC2=CC(F)=CC(F)=C2CO1 SY129211 [0,1,0,1,0,0|2,0,0]=4 498 B14R2.8239 NC1CC2=C(C=C(Cl)C=C2)NC1=O SY031681 [0,1,0,1,0,0|1,0,0]=3 499 B14R2.8239 O=C1CCC2=C(C=C(F)C(Br)=C2)N1 SY016679 [0,1,0,1,0,0|1,0,0]=3 500 B14R2.8239 O=C1CNC2=C(C=C(Br)C(F)=C2)N1 SY060532 [0,1,0,1,0,0|2,0,0]=4 501 B14R2.8239 O=C1CNC2=C(C=C(F)C(Br)=C2)N1 SY291520 [0,1,0,1,0,0|2,0,0]=4 502 B14R2.8239 O=C1NC2=CC(F)=C(F)C=C2CO1 SY129192 [0,1,0,1,0,0|2,0,0]=4 503 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [1,0,0,0,1,0|2,0,0]=4 504 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [1,0,0,0,1,0|2,0,0]=4 505 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [1,0,0,0,1,0|2,0,0]=4 506 B10R1.18 N=C(N)NC1=CC=CC=C1 SY059286 [1,0,0,0,1,0|2,0,0]=4 507 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [1,0,0,0,1,0|0,0,0]=2 508 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [1,0,0,0,1,0|1,0,0]=3 509 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [1,0,0,0,1,0|2,0,0]=4 510 B10R1.18 O=C(O)CC1=CC=NC=C1 SY003595 [1,0,0,0,1,0|2,0,0]=4 511 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [1,0,0,0,1,0|2,0,0]=4 512 B10R1.66 NC(=O)CCN1C=CN=C1 SY084458 [1,0,0,0,1,0|2,0,0]=4 513 B10R1.66 O=C(O)CCC1=CC=CS1 SY005413 [1,0,0,0,1,0|2,0,0]=4 514 B10R1.66 O=C(O)CCC1=CSC=C1 SY122984 [1,0,0,0,1,0|2,0,0]=4 515 B10R1.66 O=C(O)CCN1C=CC=C1 SY010374 [1,0,0,0,1,0|2,0,0]=4 516 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SY001458 [0,0,0,0,2,0|2,0,0]=4 517 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SY011859 [0,0,0,0,2,0|2,0,0]=4 518 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SY011145 [0,0,0,0,2,0|2,0,0]=4 519 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SY009665 [0,0,0,0,2,0|1,0,0]=3 520 B10R1.13 CC(=O)C1=CC=C(O)N=C1 SY022345 [0,0,0,0,2,0|2,0,0]=4 521 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SY003713 [0,0,0,0,2,0|2,0,0]=4 522 B10R1.13 CC1=CC=C(C(N)=O)C=N1 SY023122 [0,0,0,0,2,0|2,0,0]=4 523 B10R1.13 CC1=CC=C(S(N)=O)C=C1 SY261118 [0,0,0,0,2,0|2,0,0]=4 524 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 SY114833 [0,0,0,0,2,0|2,0,0]=4 525 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 SY014927 [0,0,0,0,2,0|2,0,0]=4 526 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SY014928 [0,0,0,0,2,0|2,0,0]=4 527 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SY032215 [0,0,0,0,2,0|2,0,0]=4 528 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SY017964 [0,0,0,0,2,0|2,0,0]=4 529 B10R1.13 N=C(N)C1=CC=C(O)C=C1 SY018812 [0,0,0,0,2,0|1,0,0]=3 530 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 SY020099 [0,0,0,0,2,0|1,0,0]=3 531 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 SY048513 [0,0,0,0,2,0|1,0,0]=3 532 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SY013152 [0,0,0,0,2,0|1,0,0]=3 533 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SY004554 [0,0,0,0,2,0|1,0,0]=3 534 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 SY047606 [0,0,0,0,2,0|2,0,0]=4 535 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 SY004157 [0,0,0,0,2,0|2,0,0]=4 536 B10R1.13 NC(=O)C1=CN=C(N)C=C1 SY038238 [0,0,0,0,2,0|2,0,0]=4 537 B10R1.13 NC(=O)C1=CN=C(O)N=C1 SY041469 [0,0,0,0,2,0|2,0,0]=4 538 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 SY064801 [0,0,0,0,2,0|2,0,0]=4 539 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 SY075316 [0,0,0,0,2,0|2,0,0]=4 540 B10R1.13 NC(=O)C1=NN=C(O)C=C1 SY016718 [0,0,0,0,2,0|2,0,0]=4 541 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SY030992 [0,0,0,0,2,0|0,1,0]=3 542 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SY003749 [0,0,0,0,2,0|2,0,0]=4 543 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SY001067 [0,0,0,0,2,0|2,0,0]=4 544 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SY002326 [0,0,0,0,2,0|2,0,0]=4 545 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SY001592 [0,0,0,0,2,0|2,0,0]=4 546 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SY001356 [0,0,0,0,2,0|2,0,0]=4 547 B10R1.13 O=C(O)C1=CN=C(O)C=C1 SY004348 [0,0,0,0,2,0|2,0,0]=4 548 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SY013072 [0,0,0,0,2,0|2,0,0]=4 549 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SY026499 [0,0,0,0,2,0|2,0,0]=4 550 B12R1.252 CC(=O)COCC1=CC=CC=C1 SY107427 [1,0,0,0,0,1|1,0,0]=3 551 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SY004771 [1,0,0,0,0,1|1,0,0]=3 552 B12R1.252 O=C(O)CCCC1=NC=CC=C1 SY110052 [1,0,0,0,0,1|2,0,0]=4 553 B12R1.252 O=C(O)CCNC1=CC=CC=C1 SY019790 [1,0,0,0,0,1|1,0,0]=3 554 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SY003481 [1,0,0,0,0,1|1,0,0]=3 555 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SY015802 [1,0,0,0,0,1|1,0,0]=3 556 B12R1.252 O=C(O)COCC1=CC=CC=C1 SY002087 [1,0,0,0,0,1|1,0,0]=3 557 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 SY083558 [1,0,0,0,0,1|1,0,1]=4 558 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 SY067225 [1,0,0,0,0,1|1,0,0]=3 559 B12R1.252 O=[N+]([O-])CCCC1=CC=CC=C1 SY266519 [1,0,0,0,0,1|2,0,0]=4