0 B10R1.10 CCOC1=CC(Br)=CN=C1 AC-907/25004452 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.10 CCOC1=CC(N)=CC=N1 AC-907/34119014 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.10 CCOC1=CC=NC(Br)=C1 AC-907/25004669 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.10 CCOC1=CC=NC(Cl)=C1 AC-907/25004672 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.10 CCOC1=CC=NC(N)=C1 AC-907/34124050 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.10 CCOC1=CC=NC(O)=N1 AC-907/25004575 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.10 CCOC1=CN=CC(O)=C1 AE-842/00015017 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.10 CCOC1=NC(Br)=CC=C1 AC-907/25005382 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.10 CCSC1=NC=CC(O)=N1 AB-323/25048189 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.10 OC1=CC(N=C=S)=CC=C1 AN-806/25032001 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.2 CC[N+]1=CC=NC(Cl)=C1 AC-907/25004563 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.2 CC[N+]1=CC=NC(N)=C1 AC-907/25004590 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.2 CNC1=CC=CC(Cl)=N1 AC-907/25004545 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.2 CNC1=NC(Br)=CC=C1 AN-584/43416474 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.2 COC1=CC(Br)=CN=C1 AC-907/25004516 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.2 COC1=CC(Cl)=CN=C1 AN-584/42206185 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.2 COC1=CC=NC(O)=C1 AC-907/34117039 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.2 CSC1=NC=CC(O)=N1 AB-323/25048187 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.2 NCC1=CC(Br)=CC=C1 AE-562/11384036 [1,0,0,0,0,0|1,0,0]=2 19 B9R1.2 NNC1=CC=NC(Br)=C1 AC-907/25004424 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.8 CCOC1=CC=CC=N1 AC-907/25014179 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.8 N#CC[N+]1=CC=CC=C1 AA-516/25012031 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.8 O=CNC1=CC=CC=C1 AR-360/40233696 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.13 N#CCC1=C(Cl)C(Cl)=CC=C1 AJ-087/41885659 [0,1,0,0,0,0|1,0,2]=4 24 B11R1.23 COC(=O)C1=CC=CC(O)=C1 AE-562/40228867 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.23 N#CC(O)C1=CC(O)=CC=C1 AT-159/43484298 [0,1,0,0,0,0|0,0,2]=3 26 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 AN-068/40169986 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 AG-205/01792011 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 AE-641/02329020 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.23 NNC(=O)C1=CC=CC(O)=C1 AE-641/02473023 [0,1,0,0,0,0|1,0,1]=3 30 B11R1.24 CCCOC1=NC(N)=CC=C1 AC-907/34120018 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.157 CN(C)CC1=CC=CC(I)=C1 AE-562/43460444 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.157 NC(=O)CC1=CC=CC(F)=C1 AE-562/43460575 [0,1,0,0,0,0|1,0,1]=3 33 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 AE-562/43460501 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 AC-509/25001994 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 AC-509/25002041 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AE-562/43460499 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AE-562/43460505 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 AE-562/43460507 [0,1,0,0,0,0|1,0,1]=3 39 B11R1.189 COC1=CC(CCN)=CC=C1 AE-562/40171055 [0,1,0,0,0,0|0,0,0]=1 40 B11R1.192 CCNC1=CC=C(O)C(O)=C1 AN-308/25123001 [0,1,0,0,0,0|2,0,0]=3 41 B11R2.36 NC1=CC2=C(C=C1)NN=C2 AE-562/40222977 [0,0,0,1,0,0|2,0,1]=4 42 B11R2.36 NC1=CC=C2NC=NC2=C1 AH-034/32844026 [0,0,0,1,0,0|2,0,1]=4 43 B11R2.106 NC1=C2CCCC2=CC=C1 AE-646/31213054 [0,0,0,1,0,0|2,0,0]=3 44 B8R1.2 CNC1=CC=NC=C1 AE-842/30373017 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.2 COC1=CC=NC=C1 AC-907/25004551 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.2 OCC1=CC=CC=N1 AE-641/00340018 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.4 CC1=CC=CC(=O)N1 AE-646/31214032 [2,0,0,0,0,0|1,0,1]=4 48 B8R1.4 CC1=CC=CC(C)=N1 AC-907/25014177 [2,0,0,0,0,0|2,0,0]=4 49 B8R1.4 CC1=CC=C[N+]([O-])=C1 AC-907/34117036 [2,0,0,0,0,0|1,0,1]=4 50 B8R1.4 CC1=CC=NC(N)=C1 AC-907/25014131 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.4 CC1=NC(O)=NC=C1 AC-907/30003036 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.4 CC1=NC=CC(Br)=C1 AN-584/43413320 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.4 CC1=NC=NC(O)=C1 AC-907/30003034 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.4 C[N+]1=CC=CC(Cl)=C1 AC-907/25004544 [2,0,0,0,0,0|2,0,0]=4 55 B8R1.4 C[N+]1=CC=CC(N)=C1 AB-323/25048193 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.4 NC1=CC(Br)=CC=N1 AC-907/34116002 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.4 NC1=CC(Cl)=CC=N1 AF-399/42648911 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.4 NC1=CC(O)=CC=N1 AQ-776/40171296 [2,0,0,0,0,0|1,0,0]=3 59 B8R1.4 NC1=CC=CC(Br)=N1 AC-907/25000246 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.4 NC1=CC=CC(Cl)=N1 AC-907/25004401 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.4 NC1=CC=CC(N)=N1 AC-907/25014391 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.4 NC1=CC=CC(O)=N1 AJ-333/25006202 [2,0,0,0,0,0|1,0,0]=3 63 B8R1.4 NC1=CC=NC(Br)=C1 AC-907/30003013 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.4 NC1=CC=NC(N)=C1 AC-907/34116042 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.4 NC1=CN=CC(Br)=C1 AC-907/30003012 [2,0,0,0,0,0|2,0,0]=4 66 B8R1.4 NC1=CN=CC(Cl)=C1 AF-399/40963071 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.4 NC1=C[N+]([O-])=CC=C1 AE-842/30158061 [2,0,0,0,0,0|1,0,1]=4 68 B8R1.4 NC1=NC=NC(O)=C1 AB-323/25048064 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.4 OC1=CC(Br)=CC=N1 AC-907/25004371 [2,0,0,0,0,0|2,0,0]=4 70 B8R1.4 OC1=CC(Br)=CN=C1 AC-907/30002047 [2,0,0,0,0,0|2,0,0]=4 71 B8R1.4 OC1=CC=CC(Br)=N1 AC-907/25004373 [2,0,0,0,0,0|2,0,0]=4 72 B8R1.4 OC1=CC=NC(Cl)=C1 AC-907/34115048 [2,0,0,0,0,0|2,0,0]=4 73 B8R1.4 OC1=CC=NC(O)=C1 AC-907/25014063 [2,0,0,0,0,0|2,0,0]=4 74 B8R1.4 OC1=CN=CC(O)=C1 AC-907/34116019 [2,0,0,0,0,0|2,0,0]=4 75 B8R1.4 [O-][N+]1=CC=CC(O)=C1 AC-907/25014065 [2,0,0,0,0,0|2,0,0]=4 76 B10R1.2 COC1=C(Cl)C(N)=CC=C1 AN-584/40152017 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.2 COC1=C(N)C(Cl)=CC=C1 AN-584/43422706 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.2 O=CC1=CC=CC(O)=C1O AE-641/30608014 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.30 CC1=CC=C(O)C(CO)=C1 AE-562/43461492 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.30 COC1=C(N)C=CC(Br)=C1 AN-584/11607260 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.30 COC1=CC(Cl)=CC=C1N AN-584/43422715 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.30 OCC1=C(I)C=CC(Cl)=C1 AE-641/25069012 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.113 CC(=O)C1=CC=CC(O)=C1 AE-562/41047023 [1,1,0,0,0,0|0,0,1]=3 84 B10R1.113 CC(O)C1=CC=C[N+]([O-])=C1 AP-123/42300627 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.113 CC1=CC=CC(C(N)=S)=C1 AB-131/42301722 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.113 CS(=O)C1=CC=CC(N)=C1 AN-584/43201061 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.113 C[C@@H](N)C1=CC(N)=CC=C1 AN-584/42259924 [1,1,0,0,0,0|1,0,0]=3 88 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 AC-907/41484593 [1,1,0,0,0,0|1,0,1]=4 89 B10R1.113 NC(=O)C1=CC(O)=CC=C1 AE-562/40219001 [1,1,0,0,0,0|0,0,1]=3 90 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AE-562/40227537 [1,1,0,0,0,0|1,0,1]=4 91 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 AE-562/40296193 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.172 CNC1=CC(SC)=CC=C1 AR-527/43405045 [1,1,0,0,0,0|1,1,0]=4 93 B10R1.172 COC1=CN=CC(OC)=C1 AC-907/34118062 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.176 COC1=CC=C(C)C(N)=C1 AE-562/43460378 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.176 COC1=CC=C(N)C(Cl)=C1 AN-584/40152016 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.176 O=CC1=CC=C(O)C(O)=C1 AR-360/40191185 [1,1,0,0,0,0|1,0,1]=4 97 B10R1.1 CC1=CC=C(CCN)C=C1 AE-562/42006047 [1,1,0,0,0,0|0,0,0]=2 98 B10R1.1 N#CCC1=CC=C(O)C=C1 AE-562/40164564 [1,1,0,0,0,0|0,0,2]=4 99 B10R1.15 O=C(CBr)C1=CC=CC=C1 AC-907/25014200 [1,1,0,0,0,0|1,0,1]=4 100 B10R1.17 N#CSCC1=CC=CC=C1 AJ-087/40225997 [1,1,0,0,0,0|0,0,2]=4 101 B10R1.17 OCCNC1=CC=CC=N1 AE-641/00646003 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.18 CC(C)CC1=CC=NC=C1 AO-801/41077396 [1,1,0,0,0,0|2,0,0]=4 103 B12R1.24 O=C(CCl)C1=CC=CC(O)=C1O AE-562/43458977 [0,2,0,0,0,0|1,0,1]=4 104 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 AE-562/40233260 [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 B12R1.100 NCCNC1=NC(O)=NC(N)=C1 AB-323/25048096 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 AE-562/43460511 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 AE-562/43460517 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 AJ-087/41885649 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 AE-641/00196031 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 AN-651/40987637 [0,2,0,0,0,0|1,0,0]=3 113 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 AE-562/43380772 [0,2,0,0,0,0|1,0,1]=4 114 B12R1.279 CCOC1=CC(C(=O)O)=CC=C1 AE-562/40249747 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.279 N#CCC1=CC(C(=O)O)=CC=C1 AE-562/43460679 [0,2,0,0,0,0|0,0,2]=4 116 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 B12R2.1081 OC1=CC=CC2=C1NCCC2 AF-399/25108090 [0,1,0,1,0,0|0,0,0]=2 120 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 AE-848/00220058 [0,1,0,1,0,0|1,0,0]=3 121 B12R2.246 NC1=C2CCCC2=NC(O)=C1 AT-051/43422601 [0,1,0,1,0,0|2,0,0]=4 122 B12R2.606 O=C1CC2=CC(O)=CC=C2N1 AR-683/41718240 [0,1,0,1,0,0|0,0,1]=3 123 B12R2.44 COC1=CC2=C(C=C1)NC=C2 AB-337/25021007 [0,1,0,1,0,0|0,0,2]=4 124 B12R2.44 O=CC1=CC=C2NCCC2=C1 AT-051/43422878 [0,1,0,1,0,0|0,0,1]=3 125 B12R2.44 OCC1=CC=C2OCOC2=C1 AP-065/40214405 [0,1,0,1,0,0|2,0,0]=4