0 B10R1.1 CC1=CC=C(CCN)C=C1 AE-562/42006047 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.1 CC1=CC=C(NC=O)C=C1 AR-360/41338148 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.1 CC1=CC=C([Se]C#N)C=C1 AI-942/25034525 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.1 CCOC1=CC=C(Br)C=N1 AC-907/25004667 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.1 N#CCC1=CC=C(O)C=C1 AE-562/40164564 [0,0,0,0,0,0|0,0,2]=2 5 B10R1.1 N#CSC1=CC=C(O)C=C1 AJ-087/25124022 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.1 N#C[Se]C1=CC=C(Br)C=C1 AI-942/25034323 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.1 N#C[Se]C1=CC=C(Cl)C=C1 AI-942/25034326 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.1 O=CNC1=CC=C(Br)C=C1 AE-641/02550056 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.1 O=CNC1=CC=C(Cl)C=C1 AR-360/41301998 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.1 O\N=C\C1=CC=C(O)C=C1 AF-753/00286030 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.1 CCC1=CC=C(C)N=C1 AC-907/25014214 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.1 CCC1=CC=[N+]([O-])C=C1 AC-907/25004702 [1,0,0,0,0,0|1,0,1]=3 13 B9R1.1 COC1=CC=C(Br)C=N1 AC-907/25004518 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.1 COC1=CC=C(N)C=C1 AC-907/25014180 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.1 COC1=CC=C(N)C=N1 AO-080/40859930 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.1 ClCC1=CN=C(Cl)C=C1 AN-717/25052001 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.1 N#CC1=CC=C(N)C=C1 AC-907/34118024 [1,0,0,0,0,0|1,0,2]=4 18 B9R1.1 NCC1=CC=C(Br)C=C1 AE-562/43286501 [1,0,0,0,0,0|1,0,0]=2 19 B9R1.1 NCC1=CC=C(I)C=C1 AE-562/43460670 [1,0,0,0,0,0|1,0,0]=2 20 B9R1.1 O=CC1=CC=C(Br)C=C1 AB-131/40654019 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.1 O=CC1=CC=C(O)C=C1 AB-131/40191192 [1,0,0,0,0,0|1,0,1]=3 22 B9R1.1 OCC1=CC=C(Cl)C=C1 AB-131/40228314 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.8 CCOC1=CC=CC=N1 AC-907/25014179 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.8 N#CC[N+]1=CC=CC=C1 AA-516/25012031 [1,0,0,0,0,0|1,0,2]=4 25 B9R1.8 O=CNC1=CC=CC=C1 AR-360/40233696 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.1 C=CCOC1=CC=C(O)C=C1 AK-087/42718133 [0,1,0,0,0,0|1,0,1]=3 27 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 AC-509/25002068 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.20 CC1=CC=C(OC(N)=S)C=C1 AL-398/25017029 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.20 CN(C)CC1=CC=C(N)C=C1 AE-562/43286955 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 AR-360/40260054 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.20 NC(=O)NC1=CC=C(I)C=C1 AE-848/33822044 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 AF-399/25108015 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 AE-508/40191188 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 AH-034/32462009 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AE-641/00136032 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 AM-814/41090691 [0,1,0,0,0,0|1,0,1]=3 37 B11R1.22 CC1=CC=C(C(O)C#N)C=C1 AK-823/41252323 [0,1,0,0,0,0|1,0,2]=4 38 B11R1.22 CC1=CC=C([S@](=O)CF)C=C1 AK-823/41252300 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 AH-034/32461042 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 AE-641/00195035 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 AF-676/00077028 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.22 N#C[C@H](O)C1=CC=C(Cl)C=C1 AK-823/41252322 [0,1,0,0,0,0|1,0,2]=4 43 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 AE-848/00959051 [0,1,0,0,0,0|1,0,1]=3 44 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 AE-641/01150029 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 AN-584/40260804 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.83 COC1=CC=C([Se]C#N)C=C1 AI-942/25034518 [0,1,0,0,0,0|1,0,2]=4 47 B11R1.83 COC1=CC=C(\C=N/O)C=C1 AG-777/25006430 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.192 CCNC1=CC=C(O)C(O)=C1 AN-308/25123001 [0,1,0,0,0,0|2,0,0]=3 49 B11R2.36 NC1=CC2=C(C=C1)C=NN2 AE-562/40205851 [0,0,0,1,0,0|2,0,1]=4 50 B8R1.2 CNC1=CC=NC=C1 AE-842/30373017 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.2 COC1=CC=NC=C1 AC-907/25004551 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.2 OCC1=CC=CC=N1 AE-641/00340018 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.3 CC1=CC=C(Br)C=N1 AC-907/30003023 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.3 CC1=CC=C(N)N=C1 AC-907/25014132 [2,0,0,0,0,0|2,0,0]=4 55 B8R1.3 CC1=CC=C(O)C=N1 AC-907/25014124 [2,0,0,0,0,0|1,0,0]=3 56 B8R1.3 CC1=CC=[N+](C)C=C1 AC-907/25004713 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.3 CN1C=CC(=N)C=C1 AC-907/25004567 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.3 NC1=CC=C(Br)C=C1 AC-907/25014110 [2,0,0,0,0,0|1,0,0]=3 59 B8R1.3 NC1=CC=C(Br)C=N1 AC-907/34116004 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.3 NC1=CC=C(Cl)C=N1 AG-617/02036012 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.3 NC1=CC=C(Cl)N=C1 AC-907/25014053 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.3 NC1=CC=C(F)N=C1 AJ-333/36120022 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.3 NC1=CC=C(N)N=C1 AC-907/25014078 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.3 NC1=CC=C(O)C=C1 AJ-333/25022099 [2,0,0,0,0,0|0,0,0]=2 65 B8R1.3 NC1=CC=C(O)N=C1 AF-399/40963069 [2,0,0,0,0,0|1,0,0]=3 66 B8R1.3 OC1=CC=C(Cl)N=C1 AM-977/25004381 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.3 [O-][N+]1=CC=C(O)C=C1 AC-907/30003022 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.3 COC1=CC=C(C=S)C=C1 AB-131/40897145 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.3 N#CC1=CC=C(CI)C=C1 AC-907/25004768 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.3 OCC1=CN=C(CO)C=C1 AO-289/25117026 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC-907/25014209 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AB-131/40179700 [1,1,0,0,0,0|0,0,1]=3 73 B10R1.13 CC(C)C1=CC=C(O)C=C1 AE-562/43459027 [1,1,0,0,0,0|0,0,0]=2 74 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 AB-131/40227926 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.13 CN(C)C1=CC=C(Br)C=C1 AC-509/25001966 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.13 CN(C)C1=CC=C(F)C=C1 AE-562/43460418 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.13 CN(C)C1=CC=C(O)C=C1 AE-562/43286954 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AE-562/42287617 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.13 NC(=O)C1=CC=C(O)C=C1 AE-562/40219003 [1,1,0,0,0,0|0,0,1]=3 80 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AE-848/32195059 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 AE-562/40217722 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.25 COC1=CC=C(N)C=C1Br AF-962/00506056 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.25 NC1=CC=C(CO)C(Cl)=C1 AN-584/43417487 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.25 O=CC1=CC=C(O)C=C1O AP-065/40195541 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.176 COC1=CC=C(C)C(N)=C1 AE-562/43460378 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.176 COC1=CC=C(N)C(Cl)=C1 AN-584/40152016 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.176 O=CC1=CC=C(O)C(O)=C1 AR-360/40191185 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.176 OCC1=CC=C(O)C(Br)=N1 AP-501/43408177 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.15 O=C(CBr)C1=CC=CC=C1 AC-907/25014200 [1,1,0,0,0,0|1,0,1]=4 90 B10R1.17 N#CSCC1=CC=CC=C1 AJ-087/40225997 [1,1,0,0,0,0|0,0,2]=4 91 B10R1.17 OCCNC1=CC=CC=N1 AE-641/00646003 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.18 CC(C)CC1=CC=NC=C1 AO-801/41077396 [1,1,0,0,0,0|2,0,0]=4 93 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 AE-473/30684056 [0,2,0,0,0,0|1,0,0]=3 94 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 AE-562/43460369 [0,2,0,0,0,0|1,0,0]=3 95 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 AE-641/00345037 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 AQ-358/40179730 [0,2,0,0,0,0|1,0,0]=3 97 B12R1.49 O=C(CCl)NC1=CC=C(O)C=C1 AN-068/25067001 [0,2,0,0,0,0|1,0,1]=4 98 B12R1.71 COC1=CC=C(OCCBr)C=C1 AH-481/02707035 [0,2,0,0,0,0|1,0,0]=3 99 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 AE-562/40223956 [0,2,0,0,0,0|1,0,1]=4 100 B12R1.4 COC1=CC=C(NC(N)=S)C=C1 AE-641/30147012 [0,2,0,0,0,0|1,0,1]=4 101 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 AE-562/40848536 [0,2,0,0,0,0|1,0,1]=4 102 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 AB-131/40236160 [0,2,0,0,0,0|1,0,1]=4 103 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 AQ-917/42754012 [0,2,0,0,0,0|1,0,1]=4 104 B12R1.367 CCC(=O)C1=CC=C(O)C(Cl)=C1 AN-651/43112611 [0,2,0,0,0,0|1,0,1]=4 105 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 AG-668/02796057 [0,2,0,0,0,0|1,0,1]=4 106 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 AT-051/43421153 [0,2,0,0,0,0|1,0,1]=4 107 B12R1.1703 CCC(=O)C1=CC=C(O)C=C1O AE-562/40724473 [0,2,0,0,0,0|1,0,1]=4 108 B12R1.112 CCOC1=CC=C(O)C=C1OC AE-562/43461499 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.1095 CC1=CC(C)=C(CCO)C(C)=C1 AE-641/00008046 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.113 CCOC1=CC=C(C(=O)O)C=C1 AH-034/32461045 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 AE-562/43460635 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.113 N#CCC1=CC=C(C(=O)O)C=C1 AE-562/43460634 [0,2,0,0,0,0|0,0,2]=4 113 B12R1.113 NCCC1=CC=C(C(=O)O)C=C1 AE-562/42531522 [0,2,0,0,0,0|0,0,0]=2 114 B12R1.113 NCCC1=CC=C([N+](=O)[O-])C=C1 AG-205/01866038 [0,2,0,0,0,0|0,0,1]=3 115 B12R1.113 O=C(O)C1=CC=C(CCBr)C=C1 AE-562/43460135 [0,2,0,0,0,0|1,0,0]=3 116 B10R2.7 C1=CC2=C(C=C1)NCC2 AG-690/11351758 [1,0,0,1,0,0|0,0,0]=2 117 B10R2.7 C1=CC2=C(C=C1)NN=C2 AC-907/25014165 [1,0,0,1,0,0|1,0,1]=4 118 B10R2.7 C1=CC2=C(C=C1)NN=N2 AC-907/34124039 [1,0,0,1,0,0|2,0,0]=4 119 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 AE-848/00220058 [0,1,0,1,0,0|1,0,1]=4 120 B12R2.246 NC1=C2CCCC2=NC(O)=C1 AT-051/43422601 [0,1,0,1,0,0|2,0,0]=4 121 B12R2.44 COC1=CC2=C(C=CN2)C=C1 AQ-776/40228276 [0,1,0,1,0,0|0,0,2]=4 122 B12R2.44 OCC1=CC=C2OCOC2=C1 AP-065/40214405 [0,1,0,1,0,0|2,0,0]=4