0 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 AE-562/40207817 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 AE-562/43461428 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.166 CC1=CC(O)=CC=C1N(C)C AE-562/43286939 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=C1 AC-907/25004621 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 AN-228/40173369 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.166 CN(C)C1=C(Br)N=C(Br)C=C1 AC-907/25004671 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.166 CN(C)C1=CC=C(N)C=C1Br AE-562/43287162 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl AE-562/43287013 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 AE-562/41921969 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 O=[N+]([O-])C1=CC=C(Br)C=C1O AN-584/43409809 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)C=C1O AN-584/43362395 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1O AE-562/43461488 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC-907/25014209 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AB-131/40179700 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.13 CC(C)C1=CC=C(O)C=C1 AE-562/43459027 [1,0,0,0,0,0|1,0,0]=2 15 B10R1.13 CC1=CC=C(C(=O)O)C=C1 AB-131/40170882 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 AB-131/40227926 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.13 CN(C)C1=CC=C(Br)C=C1 AC-509/25001966 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.13 CN(C)C1=CC=C(Br)N=C1 AC-907/25004691 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.13 CN(C)C1=CC=C(Cl)N=C1 AC-907/25004696 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.13 CN(C)C1=CC=C(F)C=C1 AE-562/43460418 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.13 CN(C)C1=CC=C(O)C=C1 AE-562/43286954 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.25 CC1=CC=C(C#N)C(Br)=C1 AQ-344/43100001 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.25 CC1=NC(O)=C(C#N)C=C1 AE-842/30162007 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.25 COC1=C(Br)N=C(C)C=C1 AN-584/11435654 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.25 COC1=CC=C(C)N=C1Cl AN-584/43303032 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.25 COC1=CC=C(C)N=C1I AN-584/43294057 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.25 COC1=CC=C(C)N=C1N AP-501/43408348 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.25 COC1=CC=C(N)C=C1Br AF-962/00506056 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.25 NC1=CC=C(CO)C(Cl)=C1 AN-584/43417487 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.25 O=CC1=CC=C(O)C=C1O AP-065/40195541 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.61 CN(C)C1=CC=CC=C1O AE-562/43286985 [1,0,0,0,0,0|1,0,0]=2 32 B10R1.61 NC(=O)C1=C(O)C=CC=C1 AH-034/32461056 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 AB-131/40228446 [1,0,0,0,0,0|3,0,0]=4 34 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 AQ-358/40233645 [0,1,0,0,0,0|2,0,1]=4 35 B12R1.126 CC1=CC=C(S(C)(=O)=O)C(C)=C1 AE-562/43458989 [0,1,0,0,0,0|3,0,0]=4 36 B12R1.126 C[N+]1=CC(Br)=C(C(C)(C)C)N=C1 AC-907/25004960 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.232 CC(=O)C1=CC(N)=C(C)C=C1C AE-562/43458993 [0,1,0,0,0,0|2,0,1]=4 38 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N AG-205/25011063 [0,1,0,0,0,0|0,0,0]=1 39 B12R1.452 CN(C)C1=C(Br)C=C(C=O)C=C1 AN-584/13062409 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 AQ-776/40236565 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.1000 CC1=CC(Br)=CC(C)=C1N(C)C AE-562/43286937 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.1000 CC1=CC(C)=C([N+](=O)[O-])C(O)=C1 AE-562/43460694 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(O)=C1 AO-800/41069714 [0,1,0,0,0,0|2,0,1]=4 44 B12R1.1703 CC1=CC(C)=C(\C(C)=N\O)C=C1 AC-907/25005066 [0,1,0,0,0,0|2,0,1]=4 45 B12R1.1703 CCC(=O)C1=CC=C(O)C=C1O AE-562/40724473 [0,1,0,0,0,0|2,0,1]=4 46 B12R1.233 CC(=O)NC1=CC=C(C)C=C1Br AG-668/02843010 [0,0,0,0,0,1|2,0,1]=4 47 B9R1.1 CCC1=CC=C(C)N=C1 AC-907/25014214 [2,0,0,0,0,0|1,0,0]=3 48 B9R1.1 CCC1=CC=[N+]([O-])C=C1 AC-907/25004702 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.1 COC1=CC=C(N)C=C1 AC-907/25014180 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.1 NCC1=CC=C(Br)C=C1 AE-562/43286501 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.1 NCC1=CC=C(I)C=C1 AE-562/43460670 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.1 OCC1=CC=C(Cl)C=C1 AB-131/40228314 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.6 CN(C)C1=CC=NC=C1 AR-360/40355729 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.6 CN(C)C1=CN=CC=C1 AF-807/00322051 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.15 CC1=C(CN)C=CC=C1 AP-770/40653937 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.15 CCC1=C(C)C=CN=C1 AO-801/41077436 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.15 NC1=CC=CC=C1CO AC-907/25014178 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.15 OCC1=C(Cl)C=CC=C1 AC-509/25001981 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.15 OCC1=C(O)C=CC=N1 AJ-333/25006072 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.69 CC1=CC(N)=C(N)C=C1 AC-907/25014184 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.69 CC1=CC=C(C)C(C)=N1 AO-801/41077394 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.69 NC1=CC(O)=C(Br)C=C1 AN-584/43409802 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.69 NC1=CC=C(Br)C=C1O AN-584/43422886 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.69 OC1=CC(Br)=CC=C1Cl AO-801/41077424 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.3 CN(C)C1=CC=C(C#N)C=C1 AC-907/25014251 [1,1,0,0,0,0|1,0,1]=4 66 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 AG-205/03202034 [1,1,0,0,0,0|1,0,1]=4 67 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 AB-131/40181212 [1,1,0,0,0,0|2,0,0]=4 68 B11R1.3 COC1=CC=C(C(C)=O)C=C1 AB-131/40174083 [1,1,0,0,0,0|1,0,1]=4 69 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 AB-131/40227350 [1,1,0,0,0,0|1,0,1]=4 70 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 AE-562/40191182 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 AC-907/25014260 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.19 C[N+]1=CC=C(C(C)(C)C)N=C1 AC-907/34121018 [1,1,0,0,0,0|2,0,0]=4 73 B11R1.22 CC1=CC=C(C(O)C#N)C=C1 AK-823/41252323 [1,1,0,0,0,0|1,0,1]=4 74 B11R1.22 CC1=CC=C([S@](=O)CF)C=C1 AK-823/41252300 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.22 COC(=O)C1=CC=C(C)C=C1 AB-131/40218986 [1,1,0,0,0,0|1,0,1]=4 76 B11R1.37 COC1=C(OC)C=C(N)C=C1 AC-907/25014217 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.37 COC1=C(OC)C=C(O)C=C1 AE-508/42302277 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.81 CCOC1=CC=C(C)N=C1Br AN-584/43303034 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.464 CCC1=C(Cl)N=C(C)N=C1O AC-907/34118056 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.156 CC(=O)C1=C(O)C=CC=C1O AB-131/40185723 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 AE-641/00693054 [1,1,0,0,0,0|1,0,1]=4 82 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O AE-641/03312016 [1,1,0,0,0,0|1,0,1]=4 83 B13R1.51 CC(C)OC1=C(C=O)C=C(Br)C=C1 AN-655/15531054 [0,1,0,0,0,1|1,0,1]=4 84 B13R1.51 CC(C)OC1=C(CN)C=C(Cl)C=C1 AN-329/43449350 [0,1,0,0,0,1|2,0,0]=4 85 B13R1.315 COC1=CC(C)=CC(C)=C1C(C)=O AB-131/42301489 [0,2,0,0,0,0|1,0,1]=4 86 B13R1.356 CC1=CC=C(C(C)C)C(NC=O)=C1 AE-562/43459624 [0,2,0,0,0,0|0,0,1]=3 87 B13R1.2398 COC1=CC(C)=C(C)C=C1C(C)=O AQ-776/42801615 [0,2,0,0,0,0|1,0,1]=4 88 B13R1.96 COC1=CC=C(C(C)(C)C)C(C)=C1 AN-584/43408165 [0,2,0,0,0,0|1,0,0]=3 89 B13R1.884 CC1=C(N)C(C(C)(C)C)=CC=C1Cl AE-562/43287114 [0,2,0,0,0,0|2,0,0]=4 90 B13R1.2809 CC1=CC(C)=C(C(C)(C)O)C(C)=C1 AE-562/43287152 [0,2,0,0,0,0|1,0,0]=3 91 B13R1.95 CCC(=O)C1=C(O)C=C(OC)C=C1 AP-065/41884142 [0,2,0,0,0,0|1,0,1]=4 92 B13R1.428 COC1=CC(C)=C(C(C)O)C(C)=C1 AB-131/42301492 [0,2,0,0,0,0|2,0,0]=4 93 B13R1.3096 COC1=CC=C(C(C)=O)C(O)=C1I AP-960/14996072 [0,2,0,0,0,0|1,0,1]=4 94 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CO2 AM-807/25099016 [0,1,0,1,0,0|1,0,1]=4 95 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 AH-034/32844007 [1,0,0,0,0,1|1,0,1]=4 96 B11R1.20 CN(C)CC1=CC=C(N)C=C1 AE-562/43286955 [1,0,0,0,0,1|2,0,0]=4 97 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 AG-996/01589028 [1,0,0,0,0,1|1,0,1]=4