0 B7R1.3 BrC1=CC=NC=C1 AC-907/25004363 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.3 BrC1=CN=CN=C1 AC-907/25014018 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.3 C[N+]1=CC=CC=C1 AF-960/00443054 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.3 C[N+]1=CC=NC=C1 AC-907/25004459 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.3 IC1=CC=NC=C1 AC-907/25004389 [0,0,0,0,0,0|1,0,0]=1 5 B7R1.3 IC1=CN=CC=C1 AC-907/30003005 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.3 IC1=CN=CN=C1 AC-907/25004280 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.3 NC1=CC=CC=N1 AC-907/25014346 [0,0,0,0,0,0|2,0,0]=2 8 B7R1.3 NC1=CC=NC=C1 AC-907/25014071 [0,0,0,0,0,0|0,0,0]=0 9 B7R1.3 NC1=CN=CC=C1 AC-907/25014070 [0,0,0,0,0,0|2,0,0]=2 10 B7R1.3 NC1=CN=CC=N1 AC-907/25014024 [0,0,0,0,0,0|3,0,0]=3 11 B7R1.3 NC1=NN=CC=N1 AO-040/25080001 [0,0,0,0,0,0|4,0,0]=4 12 B7R1.3 OC1=CC=CC=N1 AC-907/25014059 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.3 OC1=CC=CN=N1 AC-907/30002019 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 OC1=CC=NC=C1 AC-907/34116018 [0,0,0,0,0,0|1,0,0]=1 15 B7R1.3 OC1=CN=CC=C1 AC-907/25014060 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 OC1=CN=CC=N1 AC-907/25004286 [0,0,0,0,0,0|4,0,0]=4 17 B7R1.3 OC1=NC=CC=N1 AB-323/25048086 [0,0,0,0,0,0|4,0,0]=4 18 B7R1.3 OC1=NC=NC=C1 AC-907/30002018 [0,0,0,0,0,0|2,0,0]=2 19 B7R1.3 [O-]C1=CC=NC=C1 AC-907/25005566 [0,0,0,0,0,0|1,0,0]=1 20 B7R1.3 [O-]C1=CN=CC=N1 AC-907/25004285 [0,0,0,0,0,0|4,0,0]=4 21 B7R1.3 [O-][N+]1=CC=CC=C1 AC-907/25014058 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.2 CNC1=CC=NC=C1 AE-842/30373017 [0,1,0,0,0,0|0,0,0]=1 23 B8R1.2 COC1=CC=NC=C1 AC-907/25004551 [0,1,0,0,0,0|1,0,0]=2 24 B8R1.2 N#CC1=CC=NC=C1 AC-907/25014099 [0,1,0,0,0,0|0,0,1]=2 25 B8R1.2 N#CC1=CN=CC=C1 AC-907/25014098 [0,1,0,0,0,0|2,0,1]=4 26 B8R1.2 NNC1=NC=CC=N1 AC-907/34123044 [0,1,0,0,0,0|3,0,0]=4 27 B8R1.2 OCC1=CC=CC=N1 AE-641/00340018 [0,1,0,0,0,0|3,0,0]=4 28 B8R1.3 CC1=CC=C(Br)C=N1 AC-907/30003023 [0,1,0,0,0,0|3,0,0]=4 29 B8R1.3 CC1=CC=C(N)N=C1 AC-907/25014132 [0,1,0,0,0,0|2,0,0]=3 30 B8R1.3 CC1=CC=C(O)C=N1 AC-907/25014124 [0,1,0,0,0,0|3,0,0]=4 31 B8R1.3 CC1=CC=[N+](C)C=C1 AC-907/25004713 [0,1,0,0,0,0|1,0,1]=3 32 B8R1.3 CC1=NN=C(N)C=C1 AC-907/34116044 [0,1,0,0,0,0|3,0,0]=4 33 B8R1.3 CN1C=CC(=N)C=C1 AC-907/25004567 [0,1,0,0,0,0|0,0,2]=3 34 B8R1.3 ClC1=CC=C(Br)N=C1 AC-907/25004332 [0,1,0,0,0,0|3,0,0]=4 35 B8R1.3 IC1=CC=C(I)N=C1 AC-907/25004356 [0,1,0,0,0,0|3,0,0]=4 36 B8R1.3 NC1=CC=C(Br)C=C1 AC-907/25014110 [0,1,0,0,0,0|1,0,0]=2 37 B8R1.3 NC1=CC=C(Br)C=N1 AC-907/34116004 [0,1,0,0,0,0|2,0,0]=3 38 B8R1.3 NC1=CC=C(Cl)C=N1 AG-617/02036012 [0,1,0,0,0,0|2,0,0]=3 39 B8R1.3 NC1=CC=C(Cl)N=C1 AC-907/25014053 [0,1,0,0,0,0|2,0,0]=3 40 B8R1.3 NC1=CC=C(F)N=C1 AJ-333/36120022 [0,1,0,0,0,0|2,0,0]=3 41 B8R1.3 NC1=CC=C(N)N=C1 AC-907/25014078 [0,1,0,0,0,0|2,0,0]=3 42 B8R1.3 NC1=CC=C(O)C=C1 AJ-333/25022099 [0,1,0,0,0,0|1,0,0]=2 43 B8R1.3 NC1=CC=C(O)N=C1 AF-399/40963069 [0,1,0,0,0,0|2,0,0]=3 44 B8R1.3 NC1=CN=C(Br)C=N1 AC-907/25005447 [0,1,0,0,0,0|3,0,0]=4 45 B8R1.3 NC1=NC=C(Br)C=N1 AC-907/25014021 [0,1,0,0,0,0|3,0,0]=4 46 B8R1.3 NC1=NN=C(Cl)C=C1 AC-907/25014022 [0,1,0,0,0,0|3,0,0]=4 47 B8R1.3 O=C1C=CC(Br)=CN1 AC-907/25004372 [0,1,0,0,0,0|3,0,0]=4 48 B8R1.3 O=C1C=CC(Cl)=CN1 AC-907/25014042 [0,1,0,0,0,0|3,0,0]=4 49 B8R1.3 OC1=CC=C(Cl)N=C1 AM-977/25004381 [0,1,0,0,0,0|3,0,0]=4 50 B8R1.3 [O-]C1=CC=[N+]([O-])C=C1 AC-907/25004410 [0,1,0,0,0,0|1,0,1]=3 51 B8R1.3 [O-][N+]1=CC=C(O)C=C1 AC-907/30003022 [0,1,0,0,0,0|1,0,1]=3 52 B8R1.4 BrC1=CC=NC(Br)=C1 AC-907/25004342 [0,1,0,0,0,0|1,0,0]=2 53 B8R1.4 BrC1=CN=CC(Br)=C1 AC-907/30002039 [0,1,0,0,0,0|3,0,0]=4 54 B8R1.4 BrC1=CN=CC(I)=C1 AO-801/41077497 [0,1,0,0,0,0|3,0,0]=4 55 B8R1.4 BrC1=NC=CC(I)=C1 AF-399/40658937 [0,1,0,0,0,0|1,0,0]=2 56 B8R1.4 CC1=CC=CC(=O)N1 AE-646/31214032 [0,1,0,0,0,0|3,0,0]=4 57 B8R1.4 CC1=CC=CC(C)=N1 AC-907/25014177 [0,1,0,0,0,0|3,0,0]=4 58 B8R1.4 CC1=CC=C[N+]([O-])=C1 AC-907/34117036 [0,1,0,0,0,0|3,0,0]=4 59 B8R1.4 CC1=CC=NC(N)=C1 AC-907/25014131 [0,1,0,0,0,0|1,0,0]=2 60 B8R1.4 CC1=NC(N)=CC=N1 AG-690/33373005 [0,1,0,0,0,0|1,0,0]=2 61 B8R1.4 CC1=NC(O)=NC=C1 AC-907/30003036 [0,1,0,0,0,0|2,0,0]=3 62 B8R1.4 CC1=NC=CC(Br)=C1 AN-584/43413320 [0,1,0,0,0,0|1,0,0]=2 63 B8R1.4 CC1=NC=NC(O)=C1 AC-907/30003034 [0,1,0,0,0,0|2,0,0]=3 64 B8R1.4 C[N+]1=CC=CC(Cl)=C1 AC-907/25004544 [0,1,0,0,0,0|3,0,0]=4 65 B8R1.4 C[N+]1=CC=CC(N)=C1 AB-323/25048193 [0,1,0,0,0,0|2,0,0]=3 66 B8R1.4 C[N+]1=CC=NC(N)=C1 AC-907/25004468 [0,1,0,0,0,0|2,0,0]=3 67 B8R1.4 ClC1=CC=CC(Cl)=N1 AC-907/25014035 [0,1,0,0,0,0|3,0,0]=4 68 B8R1.4 FC1=CN=CC(Br)=C1 AO-160/25072004 [0,1,0,0,0,0|3,0,0]=4 69 B8R1.4 IC1=CC(I)=NC=N1 AC-907/25004270 [0,1,0,0,0,0|2,0,0]=3 70 B8R1.4 NC1=CC(Br)=CC=N1 AC-907/34116002 [0,1,0,0,0,0|1,0,0]=2 71 B8R1.4 NC1=CC(Cl)=CC=N1 AF-399/42648911 [0,1,0,0,0,0|1,0,0]=2 72 B8R1.4 NC1=CC(N)=NC=N1 AC-907/25014027 [0,1,0,0,0,0|1,0,0]=2 73 B8R1.4 NC1=CC(O)=CC=N1 AQ-776/40171296 [0,1,0,0,0,0|1,0,0]=2 74 B8R1.4 NC1=CC=CC(Br)=N1 AC-907/25000246 [0,1,0,0,0,0|2,0,0]=3 75 B8R1.4 NC1=CC=CC(Cl)=N1 AC-907/25004401 [0,1,0,0,0,0|2,0,0]=3 76 B8R1.4 NC1=CC=CC(N)=N1 AC-907/25014391 [0,1,0,0,0,0|2,0,0]=3 77 B8R1.4 NC1=CC=CC(O)=N1 AJ-333/25006202 [0,1,0,0,0,0|2,0,0]=3 78 B8R1.4 NC1=CC=NC(Br)=C1 AC-907/30003013 [0,1,0,0,0,0|0,0,0]=1 79 B8R1.4 NC1=CC=NC(N)=C1 AC-907/34116042 [0,1,0,0,0,0|0,0,0]=1 80 B8R1.4 NC1=CN=CC(Br)=C1 AC-907/30003012 [0,1,0,0,0,0|2,0,0]=3 81 B8R1.4 NC1=CN=CC(Cl)=C1 AF-399/40963071 [0,1,0,0,0,0|2,0,0]=3 82 B8R1.4 NC1=C[N+]([O-])=CC=C1 AE-842/30158061 [0,1,0,0,0,0|2,0,0]=3 83 B8R1.4 NC1=NC(=O)C=CN1 AC-907/25004299 [0,1,0,0,0,0|2,0,1]=4 84 B8R1.4 NC1=NC(Cl)=NC=C1 AC-907/30002015 [0,1,0,0,0,0|1,0,0]=2 85 B8R1.4 NC1=NC=CC(Cl)=N1 AC-907/30002014 [0,1,0,0,0,0|2,0,0]=3 86 B8R1.4 NC1=NC=NC(Cl)=C1 AC-907/30002016 [0,1,0,0,0,0|1,0,0]=2 87 B8R1.4 NC1=NC=NC(O)=C1 AB-323/25048064 [0,1,0,0,0,0|1,0,0]=2 88 B8R1.4 OC1=CC(Br)=CC=N1 AC-907/25004371 [0,1,0,0,0,0|1,0,0]=2 89 B8R1.4 OC1=CC(Br)=CN=C1 AC-907/30002047 [0,1,0,0,0,0|3,0,0]=4 90 B8R1.4 OC1=CC(O)=NC=N1 AB-323/25048196 [0,1,0,0,0,0|2,0,0]=3 91 B8R1.4 OC1=CC=CC(Br)=N1 AC-907/25004373 [0,1,0,0,0,0|3,0,0]=4 92 B8R1.4 OC1=CC=NC(Cl)=C1 AC-907/34115048 [0,1,0,0,0,0|1,0,0]=2 93 B8R1.4 OC1=CC=NC(O)=C1 AC-907/25014063 [0,1,0,0,0,0|1,0,0]=2 94 B8R1.4 OC1=CN=CC(O)=C1 AC-907/34116019 [0,1,0,0,0,0|3,0,0]=4 95 B8R1.4 OC1=NC(O)=NC=C1 AC-907/30002021 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.4 OC1=NC=NC(Cl)=C1 AC-907/25004276 [0,1,0,0,0,0|2,0,0]=3 97 B8R1.4 S=C1N=CC=C(S)N1 AB-323/25048186 [0,1,0,0,0,0|2,0,0]=3 98 B8R1.4 [O-][N+]1=CC=CC(Br)=C1 AC-907/30002048 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.4 [O-][N+]1=CC=CC(O)=C1 AC-907/25014065 [0,1,0,0,0,0|3,0,0]=4 100 B8R1.5 BrC1=C(Br)N=CC=C1 AC-907/25004341 [0,1,0,0,0,0|3,0,0]=4 101 B8R1.5 BrC1=CC=NC=C1Br AC-907/25004343 [0,1,0,0,0,0|1,0,0]=2 102 B8R1.5 CC1=C(Br)N=CC=C1 AC-907/30003020 [0,1,0,0,0,0|3,0,0]=4 103 B8R1.5 CC1=CC=CC=[N+]1C AC-907/25004712 [0,1,0,0,0,0|3,0,0]=4 104 B8R1.5 CC1=CC=CC=[N+]1[O-] AC-907/25014127 [0,1,0,0,0,0|3,0,0]=4 105 B8R1.5 CC1=CC=NC=C1Br AC-907/25014109 [0,1,0,0,0,0|1,0,0]=2 106 B8R1.5 CC1=CC=NC=C1N AF-807/00322016 [0,1,0,0,0,0|1,0,0]=2 107 B8R1.5 CC1=CN=CC=C1N AC-907/34117051 [0,1,0,0,0,0|0,0,0]=1 108 B8R1.5 CC1=NC=CC=C1Br AN-584/43273903 [0,1,0,0,0,0|3,0,0]=4 109 B8R1.5 CC1=NC=CC=C1O AQ-344/40575762 [0,1,0,0,0,0|3,0,0]=4 110 B8R1.5 CN1C=CC=CC1=N AC-907/25004566 [0,1,0,0,0,0|2,0,1]=4 111 B8R1.5 CN1C=CC=CC1=O AC-907/25014126 [0,1,0,0,0,0|3,0,0]=4 112 B8R1.5 CN1C=NC=CC1=O AB-323/25048160 [0,1,0,0,0,0|2,0,0]=3 113 B8R1.5 ClC1=C(Br)C=CC=N1 AC-907/25004333 [0,1,0,0,0,0|3,0,0]=4 114 B8R1.5 ClC1=C(Cl)N=CC=C1 AF-834/25002667 [0,1,0,0,0,0|3,0,0]=4 115 B8R1.5 ClC1=C(I)C=CC=N1 AJ-333/25006075 [0,1,0,0,0,0|3,0,0]=4 116 B8R1.5 NC1=C(Br)C=CC=N1 AC-907/34116001 [0,1,0,0,0,0|2,0,0]=3 117 B8R1.5 NC1=C(Br)C=NC=N1 AC-907/25004281 [0,1,0,0,0,0|1,0,0]=2 118 B8R1.5 NC1=C(Br)N=CC=C1 AC-907/25004397 [0,1,0,0,0,0|2,0,0]=3 119 B8R1.5 NC1=C(Cl)N=CC=C1 AC-907/25014052 [0,1,0,0,0,0|2,0,0]=3 120 B8R1.5 NC1=C(N)C=CC=C1 AC-907/25014349 [0,1,0,0,0,0|1,0,0]=2 121 B8R1.5 NC1=C(N)N=CN=C1 AE-842/32231042 [0,1,0,0,0,0|1,0,0]=2 122 B8R1.5 NC1=C(O)N=CC=C1 AE-641/00363028 [0,1,0,0,0,0|2,0,0]=3 123 B8R1.5 NC1=CC=CC=[N+]1[O-] AE-842/30093005 [0,1,0,0,0,0|2,0,0]=3 124 B8R1.5 NC1=CC=CN=C1N AC-907/25014077 [0,1,0,0,0,0|2,0,0]=3 125 B8R1.5 NC1=CC=NC=C1Br AC-907/30003014 [0,1,0,0,0,0|0,0,0]=1 126 B8R1.5 NC1=CC=NC=C1Cl AF-807/00322024 [0,1,0,0,0,0|0,0,0]=1 127 B8R1.5 NC1=CC=NC=C1N AC-907/34116043 [0,1,0,0,0,0|0,0,0]=1 128 B8R1.5 NC1=CN=CC=C1Cl AC-907/25005560 [0,1,0,0,0,0|1,0,0]=2 129 B8R1.5 NC1=CN=CC=C1O AC-907/25004436 [0,1,0,0,0,0|1,0,0]=2 130 B8R1.5 NC1=NC=CC=C1Cl AF-399/40963070 [0,1,0,0,0,0|2,0,0]=3 131 B8R1.5 O=C1C=CC=CN1O AC-907/25004409 [0,1,0,0,0,0|3,0,0]=4 132 B8R1.5 O=C1NC=CC=C1Br AG-690/03080022 [0,1,0,0,0,0|3,0,0]=4 133 B8R1.5 OC1=C(Br)N=CC=C1 AC-907/30002046 [0,1,0,0,0,0|3,0,0]=4 134 B8R1.5 OC1=C(Cl)C=CC=N1 AC-907/34115049 [0,1,0,0,0,0|3,0,0]=4 135 B8R1.5 OC1=C(I)N=CC=C1 AC-907/30003006 [0,1,0,0,0,0|3,0,0]=4 136 B8R1.5 OC1=C(O)C=CC=C1 AB-131/40235236 [0,1,0,0,0,0|2,0,0]=3 137 B8R1.5 OC1=C(O)N=CC=C1 AC-907/25014062 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.5 OC1=CC=NC=C1I AC-907/30003007 [0,1,0,0,0,0|1,0,0]=2 139 B8R1.5 OC1=NC=NC=C1Br AC-907/30002009 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.5 [O-][N+]1=CC=CC=C1Cl AN-584/43417532 [0,1,0,0,0,0|3,0,0]=4 141 B8R1.5 [O-][N+]1=CC=CC=C1O AC-907/25014064 [0,1,0,0,0,0|3,0,0]=4 142 B6R1.2 BrC1=CN=CN1 AC-907/34115001 [0,0,0,0,1,0|2,0,0]=3 143 B6R1.2 BrC1=CNN=C1 AC-907/25014004 [0,0,0,0,1,0|2,0,0]=3 144 B6R1.2 BrC1=NNC=C1 AC-907/30002001 [0,0,0,0,1,0|2,0,1]=4 145 B6R1.2 CC1=CN=CN1 AL-398/25017073 [0,0,0,0,1,0|2,0,0]=3 146 B6R1.2 ClC1=CNC=N1 AE-562/43286932 [0,0,0,0,1,0|2,0,1]=4 147 B6R1.2 ClC1=CNN=C1 AK-968/37166380 [0,0,0,0,1,0|2,0,0]=3 148 B6R1.2 IC1=CC=NN1 AE-562/12222298 [0,0,0,0,1,0|2,0,0]=3 149 B6R1.2 IC1=CNN=C1 AE-641/00647033 [0,0,0,0,1,0|2,0,0]=3 150 B6R1.2 NC1=NC=CN1 AL-398/25017027 [0,0,0,0,1,0|2,0,0]=3 151 B6R1.2 NC1=NC=CO1 AN-584/43408342 [0,0,0,0,1,0|2,0,0]=3 152 B6R1.2 NC1=NC=CS1 AB-601/30915002 [0,0,0,0,1,0|2,0,0]=3 153 B6R1.2 NC1=NC=NS1 AE-842/30373034 [0,0,0,0,1,0|2,0,0]=3 154 B6R1.2 NC1=NNC=N1 AE-641/30106057 [0,0,0,0,1,0|2,0,1]=4 155 B6R1.2 O=C1NC=CN1 AK-564/25068002 [0,0,0,0,1,0|3,0,0]=4 156 B6R1.2 SC1=NC=CN1 AP-836/41220351 [0,0,0,0,1,0|3,0,0]=4 157 B6R1.2 SC1=NN=CN1 AG-690/11353437 [0,0,0,0,1,0|3,0,0]=4 158 B6R1.2 [S-]C1=CN=NN1 AO-090/25092001 [0,0,0,0,1,0|3,0,0]=4 159 B5R0.1 C\C(N)=C/C=O AJ-333/25022116 [1,0,1,0,0,0|1,0,1]=4 160 B7R1.1 CNC1=NC=CS1 AN-584/41682965 [0,1,0,0,1,0|2,0,0]=4 161 B7R1.1 NNC1=NC=CS1 AH-034/32832026 [0,1,0,0,1,0|2,0,0]=4 162 B7R1.1 O=CC1=CNC=C1 AC-776/25122024 [0,1,0,0,1,0|1,0,1]=4 163 B7R1.1 OCC1=CN=CN1 AB-131/25126047 [0,1,0,0,1,0|2,0,0]=4 164 B7R1.1 OCC1=COC=C1 AE-641/00180028 [0,1,0,0,1,0|2,0,0]=4 165 B7R1.2 CC1=CC(C)=NN1 AE-848/32586026 [0,1,0,0,1,0|2,0,0]=4 166 B7R1.2 CC1=NN=C(N)N1 AG-205/37166003 [0,1,0,0,1,0|2,0,0]=4 167 B7R1.2 CC1=NNC(Cl)=C1 AC-907/25004293 [0,1,0,0,1,0|2,0,0]=4 168 B7R1.2 IC1=CC=C(I)S1 AI-942/42301759 [0,1,0,0,1,0|2,0,0]=4 169 B7R1.2 NC1=CC(N)=[S+]S1 AO-840/42718091 [0,1,0,0,1,0|2,0,0]=4 170 B7R1.2 NC1=NC=C(Br)S1 AC-907/25004245 [0,1,0,0,1,0|2,0,0]=4 171 B7R1.2 NC1=NNC(N)=N1 AG-670/31515053 [0,1,0,0,1,0|2,0,0]=4 172 B7R1.4 CC1=C(C)NC=N1 AC-907/34124054 [0,1,0,0,1,0|2,0,0]=4 173 B7R1.4 CC1=CC=NN1C AC-907/34116052 [0,1,0,0,1,0|2,0,0]=4 174 B7R1.4 CN1C=CN=C1I AG-777/25006424 [0,1,0,0,1,0|2,0,0]=4 175 B7R1.4 CN1C=CN=C1N AE-848/31013002 [0,1,0,0,1,0|2,0,0]=4 176 B7R1.4 CN1C=NC=C1Cl AA-516/30012007 [0,1,0,0,1,0|2,0,0]=4 177 B9R1.1 CCC1=CC=[N+]([O-])C=C1 AC-907/25004702 [0,2,0,0,0,0|1,0,1]=4 178 B9R1.1 COC1=CC=C(N)C=C1 AC-907/25014180 [0,2,0,0,0,0|1,0,0]=3 179 B9R1.1 COC1=CC=C(N)C=N1 AO-080/40859930 [0,2,0,0,0,0|2,0,0]=4 180 B9R1.1 N#CC1=CC=C(N)C=C1 AC-907/34118024 [0,2,0,0,0,0|1,0,0]=3 181 B9R1.1 N#CC1=CN=C(N)C=C1 AF-399/40963074 [0,2,0,0,0,0|2,0,0]=4 182 B9R1.1 NCC1=CC=C(Br)C=C1 AE-562/43286501 [0,2,0,0,0,0|1,0,0]=3 183 B9R1.1 NCC1=CC=C(I)C=C1 AE-562/43460670 [0,2,0,0,0,0|1,0,0]=3 184 B9R1.1 O=CC1=CC=C(Br)C=C1 AB-131/40654019 [0,2,0,0,0,0|2,0,0]=4 185 B9R1.1 O=CC1=CC=C(O)C=C1 AB-131/40191192 [0,2,0,0,0,0|2,0,0]=4 186 B9R1.1 OCC1=CC=C(Cl)C=C1 AB-131/40228314 [0,2,0,0,0,0|2,0,0]=4 187 B9R1.2 CC[N+]1=CC=NC(Cl)=C1 AC-907/25004563 [0,2,0,0,0,0|2,0,0]=4 188 B9R1.2 CC[N+]1=CC=NC(N)=C1 AC-907/25004590 [0,2,0,0,0,0|2,0,0]=4 189 B9R1.2 CNC1=CC(=O)NC=N1 AB-323/25048061 [0,2,0,0,0,0|1,0,1]=4 190 B9R1.2 CNC1=CC=CC(Cl)=N1 AC-907/25004545 [0,2,0,0,0,0|2,0,0]=4 191 B9R1.2 CNC1=NC(Br)=CC=C1 AN-584/43416474 [0,2,0,0,0,0|2,0,0]=4 192 B9R1.2 CNC1=NC=NC(Cl)=C1 AN-584/41473266 [0,2,0,0,0,0|1,0,0]=3 193 B9R1.2 COC1=CC(C)=NC=N1 AN-584/42206187 [0,2,0,0,0,0|2,0,0]=4 194 B9R1.2 COC1=CC(Cl)=NC=N1 AN-584/43099709 [0,2,0,0,0,0|2,0,0]=4 195 B9R1.2 COC1=CC(N)=NC=N1 AG-664/25098047 [0,2,0,0,0,0|1,0,0]=3 196 B9R1.2 COC1=CC=NC(N)=N1 AC-907/34123047 [0,2,0,0,0,0|2,0,0]=4 197 B9R1.2 COC1=CC=NC(O)=C1 AC-907/34117039 [0,2,0,0,0,0|1,0,0]=3 198 B9R1.2 CSC1=NC=CC(C)=N1 AR-527/42979548 [0,2,0,0,0,0|2,0,0]=4 199 B9R1.2 CSC1=NC=CC(O)=N1 AB-323/25048187 [0,2,0,0,0,0|2,0,0]=4 200 B9R1.2 CSC1=NN=CC(N)=N1 AC-907/25004304 [0,2,0,0,0,0|2,0,0]=4 201 B9R1.2 N#CC1=CC=NC(Cl)=C1 AC-907/30003049 [0,2,0,0,0,0|0,0,1]=3 202 B9R1.2 N#CC1=CC=NC(Cl)=N1 AC-907/25005416 [0,2,0,0,0,0|1,0,1]=4 203 B9R1.2 NCC1=CC(Br)=CC=C1 AE-562/11384036 [0,2,0,0,0,0|1,0,0]=3 204 B9R1.2 NNC1=CC=NC(Br)=C1 AC-907/25004424 [0,2,0,0,0,0|0,0,0]=2 205 B9R1.2 NNC1=NC=NC(Cl)=C1 AC-907/34115020 [0,2,0,0,0,0|1,0,0]=3 206 B9R1.6 CN(C)C1=CC=NC=C1 AR-360/40355729 [0,2,0,0,0,0|0,0,0]=2 207 B9R1.6 CN(C)C1=CN=CC=C1 AF-807/00322051 [0,2,0,0,0,0|2,0,0]=4 208 B9R1.6 N=C(N)C1=CC=CC=C1 AE-641/30119009 [0,2,0,0,0,0|1,0,0]=3 209 B9R1.6 NC(=O)C1=CN=CC=C1 AC-907/25014114 [0,2,0,0,0,0|2,0,0]=4 210 B9R1.6 NC(=S)C1=CC=CC=C1 AO-840/40187641 [0,2,0,0,0,0|1,0,0]=3 211 B9R1.6 O=C(O)C1=CC=NC=C1 AC-907/25014347 [0,2,0,0,0,0|1,0,0]=3 212 B9R1.6 O=C(O)C1=NC=NC=C1 AE-641/00364016 [0,2,0,0,0,0|2,0,0]=4 213 B9R1.8 O=CNC1=CC=CC=C1 AR-360/40233696 [0,2,0,0,0,0|1,0,0]=3 214 B9R1.15 CC1=C(C#N)C=CN=C1 AN-584/42118740 [0,2,0,0,0,0|0,0,1]=3 215 B9R1.15 CC1=C(CN)C=CC=C1 AP-770/40653937 [0,2,0,0,0,0|1,0,0]=3 216 B9R1.15 CC1=CC=NC=C1C#N AC-907/25004626 [0,2,0,0,0,0|1,0,0]=3 217 B9R1.15 CCC1=C(C)C=CN=C1 AO-801/41077436 [0,2,0,0,0,0|1,0,0]=3 218 B9R1.15 CNC1=C(Cl)N=CC=C1 AC-907/34117030 [0,2,0,0,0,0|2,0,0]=4 219 B9R1.15 COC1=C(Cl)N=CN=C1 AN-584/42206186 [0,2,0,0,0,0|2,0,0]=4 220 B9R1.15 COC1=CC=NNC1=O AM-944/40947510 [0,2,0,0,0,0|2,0,0]=4 221 B9R1.15 COC1=CN=CNC1=O AC-907/30003042 [0,2,0,0,0,0|2,0,0]=4 222 B9R1.15 N#CC1=C(I)C=CC=C1 AE-641/03255019 [0,2,0,0,0,0|1,0,1]=4 223 B9R1.15 N#CC1=C(N)N=CN=C1 AC-907/25014049 [0,2,0,0,0,0|1,0,0]=3 224 B9R1.15 N#CC1=C(O)N=CN=C1 AC-907/43099733 [0,2,0,0,0,0|2,0,0]=4 225 B9R1.15 N#CC1=CC=CC=C1Br AC-907/25014151 [0,2,0,0,0,0|1,0,1]=4 226 B9R1.15 N#CC1=CC=CN=C1N AF-399/40963073 [0,2,0,0,0,0|2,0,0]=4 227 B9R1.15 NC1=C(C=O)C=CC=N1 AA-516/30054004 [0,2,0,0,0,0|2,0,0]=4 228 B9R1.15 NC1=CC=CC=C1CO AC-907/25014178 [0,2,0,0,0,0|1,0,0]=3 229 B9R1.15 NNC1=C(Cl)C=NC=N1 AC-907/34115019 [0,2,0,0,0,0|1,0,0]=3 230 B9R1.15 OCC1=C(Cl)C=CC=C1 AC-509/25001981 [0,2,0,0,0,0|2,0,0]=4 231 B9R1.69 BrC1=CC(Br)=C(Br)C=N1 AC-907/25004327 [0,2,0,0,0,0|1,0,0]=3 232 B9R1.69 CC1=C(Br)C=CC(N)=N1 AC-907/30003055 [0,2,0,0,0,0|2,0,0]=4 233 B9R1.69 CC1=C(Br)C=NC(N)=C1 AC-907/34104054 [0,2,0,0,0,0|1,0,0]=3 234 B9R1.69 CC1=C(N)C=CC(Br)=C1 AE-562/43306593 [0,2,0,0,0,0|1,0,0]=3 235 B9R1.69 CC1=C(N)N=CC(Br)=C1 AC-907/30003004 [0,2,0,0,0,0|2,0,0]=4 236 B9R1.69 CC1=C(O)C=CC(Br)=C1 AN-329/40925146 [0,2,0,0,0,0|2,0,0]=4 237 B9R1.69 CC1=C(O)N=C(S)N=C1 AC-907/25004441 [0,2,0,0,0,0|2,0,0]=4 238 B9R1.69 CC1=CC(Br)=C(N)N=C1 AC-907/25014120 [0,2,0,0,0,0|2,0,0]=4 239 B9R1.69 CC1=CC(C)=[N+](C)C=N1 AC-907/25004724 [0,2,0,0,0,0|2,0,0]=4 240 B9R1.69 CC1=CC(I)=CC=C1N AE-641/01196008 [0,2,0,0,0,0|1,0,0]=3 241 B9R1.69 CC1=CC(N)=C(N)C=C1 AC-907/25014184 [0,2,0,0,0,0|1,0,0]=3 242 B9R1.69 CC1=CC(O)=NC=C1Br AN-584/42482460 [0,2,0,0,0,0|1,0,0]=3 243 B9R1.69 CC1=CC(O)=NN=C1O AC-907/30003041 [0,2,0,0,0,0|2,0,0]=4 244 B9R1.69 CC1=CC=C(O)C(N)=N1 AP-501/43408347 [0,2,0,0,0,0|2,0,0]=4 245 B9R1.69 CC1=CC=[N+]([O-])C=C1Br AC-907/25004520 [0,2,0,0,0,0|1,0,1]=4 246 B9R1.69 CC1=NC(C)=C(N)C=C1 AJ-333/36120002 [0,2,0,0,0,0|2,0,0]=4 247 B9R1.69 CC1=NC(N)=NC=C1Br AN-584/43409793 [0,2,0,0,0,0|2,0,0]=4 248 B9R1.69 CC1=NNC(=O)C(N)=C1 AH-034/11364376 [0,2,0,0,0,0|1,0,0]=3 249 B9R1.69 ClC1=NC(Cl)=C(Br)C=N1 AF-399/25108039 [0,2,0,0,0,0|2,0,0]=4 250 B9R1.69 NC1=C(Br)C=C(O)C=C1 AN-584/43409803 [0,2,0,0,0,0|1,0,0]=3 251 B9R1.69 NC1=C(Br)N=C(Br)C=C1 AC-907/30003003 [0,2,0,0,0,0|2,0,0]=4 252 B9R1.69 NC1=C(Cl)C=C(Cl)C=N1 AC-907/25014045 [0,2,0,0,0,0|2,0,0]=4 253 B9R1.69 NC1=C(Cl)N=C(Cl)C=C1 AC-907/25014046 [0,2,0,0,0,0|2,0,0]=4 254 B9R1.69 NC1=C(I)N=C(I)C=C1 AC-907/25004392 [0,2,0,0,0,0|2,0,0]=4 255 B9R1.69 NC1=C(N)C=C(Cl)N=C1 AC-907/25004429 [0,2,0,0,0,0|0,0,0]=2 256 B9R1.69 NC1=C(N)N=C(Cl)N=C1 AC-907/25004294 [0,2,0,0,0,0|1,0,0]=3 257 B9R1.69 NC1=C(N)N=CC(Br)=C1 AH-357/03488033 [0,2,0,0,0,0|2,0,0]=4 258 B9R1.69 NC1=CC(Br)=C(O)C=C1 AN-584/43422701 [0,2,0,0,0,0|1,0,0]=3 259 B9R1.69 NC1=CC(Br)=CC=C1Br AE-641/00174041 [0,2,0,0,0,0|1,0,0]=3 260 B9R1.69 NC1=CC(Br)=CC=C1Cl AN-584/42710811 [0,2,0,0,0,0|1,0,0]=3 261 B9R1.69 NC1=CC(Cl)=NN=C1Cl AG-670/31545005 [0,2,0,0,0,0|1,0,0]=3 262 B9R1.69 NC1=CC(O)=C(Br)C=C1 AN-584/43409802 [0,2,0,0,0,0|1,0,0]=3 263 B9R1.69 NC1=CC(S)=NN=C1N AM-944/40947417 [0,2,0,0,0,0|1,0,0]=3 264 B9R1.69 NC1=CC=C(Br)C=C1N AQ-358/42003067 [0,2,0,0,0,0|1,0,0]=3 265 B9R1.69 NC1=CC=C(Br)C=C1O AN-584/43422886 [0,2,0,0,0,0|1,0,0]=3 266 B9R1.69 NC1=CC=C(Br)N=C1Cl AC-907/34114024 [0,2,0,0,0,0|2,0,0]=4 267 B9R1.69 NC1=CC=C(Cl)C(I)=C1 AE-562/43458279 [0,2,0,0,0,0|1,0,0]=3 268 B9R1.69 NC1=CC=C(Cl)C=C1I AE-562/43460424 [0,2,0,0,0,0|1,0,0]=3 269 B9R1.69 NC1=CC=C(N)C(I)=C1 AI-942/42301889 [0,2,0,0,0,0|1,0,0]=3 270 B9R1.69 NC1=CC=C(N)C(N)=N1 AN-584/41981990 [0,2,0,0,0,0|2,0,0]=4 271 B9R1.69 NC1=CC=C(O)C=C1Cl AN-584/43422655 [0,2,0,0,0,0|1,0,0]=3 272 B9R1.69 NC1=NC(N)=C(Br)C=C1 AF-399/42648914 [0,2,0,0,0,0|2,0,0]=4 273 B9R1.69 NC1=NC(O)=NC=C1I AG-690/12885355 [0,2,0,0,0,0|1,0,0]=3 274 B9R1.69 OC1=CC(Br)=CC=C1Cl AO-801/41077424 [0,2,0,0,0,0|2,0,0]=4 275 B9R1.69 OC1=CC=C(Br)C=C1Br AN-329/40869004 [0,2,0,0,0,0|2,0,0]=4 276 B9R1.69 OC1=CC=C(Br)C=C1Cl AN-329/41610044 [0,2,0,0,0,0|2,0,0]=4 277 B9R1.3 BrC1=CC=NC(Br)=C1Br AC-907/25004324 [0,2,0,0,0,0|1,0,0]=3 278 B9R1.3 BrC1=CN=CC(Br)=C1Br AC-907/30002030 [0,2,0,0,0,0|1,0,0]=3 279 B9R1.3 CC1=C(Cl)N=CN=C1Cl AC-907/34115055 [0,2,0,0,0,0|2,0,0]=4 280 B9R1.3 CC1=C(O)C(=S)C=CO1 AJ-797/37154018 [0,2,0,0,0,0|2,0,0]=4 281 B9R1.3 CC1=C(O)N=CN=C1O AC-907/30003039 [0,2,0,0,0,0|2,0,0]=4 282 B9R1.3 CC1=CC=CC(C)=C1O AB-131/40171179 [0,2,0,0,0,0|2,0,0]=4 283 B9R1.3 CC1=CC=CC(N)=[N+]1[O-] AE-842/32999054 [0,2,0,0,0,0|2,0,0]=4 284 B9R1.3 CC1=CN=CC(C)=C1N AP-263/40182490 [0,2,0,0,0,0|0,0,0]=2 285 B9R1.3 CC1=NC=NC(N)=C1I AI-942/42301812 [0,2,0,0,0,0|1,0,0]=3 286 B9R1.3 CC1=NC=NC(O)=C1I AC-907/25004407 [0,2,0,0,0,0|2,0,0]=4 287 B9R1.3 ClC1=C(Br)C=NC=C1Br AC-907/25004319 [0,2,0,0,0,0|1,0,0]=3 288 B9R1.3 ClC1=C(Br)N=CC=C1Br AC-907/25004318 [0,2,0,0,0,0|1,0,0]=3 289 B9R1.3 NC1=C(Br)C=CC=C1Br AC-907/25014102 [0,2,0,0,0,0|1,0,0]=3 290 B9R1.3 NC1=C(Br)C=NC=C1Br AC-907/25004378 [0,2,0,0,0,0|0,0,0]=2 291 B9R1.3 NC1=C(Cl)C=NC=C1Cl AC-907/25014344 [0,2,0,0,0,0|0,0,0]=2 292 B9R1.3 NC1=C(Cl)N=CN=C1Cl AB-323/25048131 [0,2,0,0,0,0|2,0,0]=4 293 B9R1.3 NC1=C(N)C(Cl)=CN=N1 AB-323/25048523 [0,2,0,0,0,0|1,0,0]=3 294 B9R1.3 NC1=C(O)C(Cl)=CC=C1 AN-584/43422705 [0,2,0,0,0,0|1,0,0]=3 295 B9R1.3 NC1=CC=CC(O)=C1Cl AN-584/43422714 [0,2,0,0,0,0|1,0,0]=3 296 B9R1.3 NC1=CC=NC(Br)=C1Cl AC-907/30002045 [0,2,0,0,0,0|0,0,0]=2 297 B9R1.3 NC1=CC=NC(Cl)=C1N AG-996/25003209 [0,2,0,0,0,0|0,0,0]=2 298 B9R1.3 NC1=NC=NC(Cl)=C1N AG-670/32486004 [0,2,0,0,0,0|1,0,0]=3 299 B9R1.3 NC1=NC=NC(N)=C1N AC-907/34115032 [0,2,0,0,0,0|1,0,0]=3 300 B9R1.3 NN1C(=O)C=NN=C1S AO-365/41745626 [0,2,0,0,0,0|2,0,0]=4 301 B9R1.3 O=C1C(I)=CNC=C1I AC-907/25014036 [0,2,0,0,0,0|1,0,1]=4 302 B9R1.3 O=C1NN=CC(Cl)=C1Cl AC-907/25004268 [0,2,0,0,0,0|2,0,0]=4 303 B9R1.3 OC1=C(Br)C=CC=C1Br AJ-087/41885654 [0,2,0,0,0,0|2,0,0]=4 304 B9R1.3 OC1=C(Br)C=NC=C1Br AC-907/25014033 [0,2,0,0,0,0|1,0,0]=3 305 B9R1.3 OC1=CC=CC(O)=C1O AB-131/40221933 [0,2,0,0,0,0|2,0,0]=4 306 B9R1.3 OC1=CC=NC(O)=C1Br AC-907/25004374 [0,2,0,0,0,0|1,0,0]=3 307 B9R1.3 OC1=CC=NC(O)=C1Cl AC-907/34115051 [0,2,0,0,0,0|1,0,0]=3 308 B9R1.3 OC1=CC=NC(O)=C1I AC-907/30003008 [0,2,0,0,0,0|1,0,0]=3 309 B9R1.34 CC1=CC(=O)NC(C)=C1 AN-584/40195566 [0,2,0,0,0,0|1,0,1]=4 310 B9R1.34 CC1=CC(=O)NC(N)=N1 AG-670/25003504 [0,2,0,0,0,0|2,0,0]=4 311 B9R1.34 CC1=CC(=S)C=C(C)O1 AO-801/33291061 [0,2,0,0,0,0|2,0,0]=4 312 B9R1.34 CC1=CC(Br)=CC(C)=N1 AC-907/34118036 [0,2,0,0,0,0|1,0,0]=3 313 B9R1.34 CC1=CC(Br)=NC(C)=N1 AN-584/43408156 [0,2,0,0,0,0|2,0,0]=4 314 B9R1.34 CC1=CC(C)=NC(C)=N1 AC-907/25004715 [0,2,0,0,0,0|2,0,0]=4 315 B9R1.34 CC1=CC(C)=NC(Cl)=N1 AF-399/25039008 [0,2,0,0,0,0|2,0,0]=4 316 B9R1.34 CC1=CC(C)=NC(N)=N1 AC-907/34118007 [0,2,0,0,0,0|2,0,0]=4 317 B9R1.34 CC1=CC(C)=NC(O)=N1 AC-907/25014135 [0,2,0,0,0,0|2,0,0]=4 318 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 AN-584/42118738 [0,2,0,0,0,0|1,0,0]=3 319 B9R1.34 CC1=CC(N)=CC(C)=N1 AC-907/34119009 [0,2,0,0,0,0|0,0,0]=2 320 B9R1.34 CC1=CC(N)=NC(S)=N1 AN-584/42206192 [0,2,0,0,0,0|1,0,0]=3 321 B9R1.34 CC1=CC(O)=CC(=O)N1 AB-337/25021037 [0,2,0,0,0,0|1,0,1]=4 322 B9R1.34 CC1=CC(S)=NC(O)=N1 AB-323/25048184 [0,2,0,0,0,0|2,0,0]=4 323 B9R1.34 CC1=NC(C)=NC(Cl)=C1 AC-907/25004546 [0,2,0,0,0,0|2,0,0]=4 324 B9R1.34 CC1=NC(C)=NC(N)=C1 AI-942/40171331 [0,2,0,0,0,0|1,0,0]=3 325 B9R1.34 CC1=NC(C)=NC(O)=C1 AC-907/25014137 [0,2,0,0,0,0|2,0,0]=4 326 B9R1.34 CC1=NC(N)=CC(N)=N1 AG-670/32485056 [0,2,0,0,0,0|1,0,0]=3 327 B9R1.34 CC1=NC(N)=CC(O)=N1 AB-323/25048060 [0,2,0,0,0,0|1,0,0]=3 328 B9R1.34 CC1=NC(N)=NC(Cl)=C1 AE-848/06047015 [0,2,0,0,0,0|2,0,0]=4 329 B9R1.34 CC1=NC(N)=NC(N)=C1 AB-323/25048181 [0,2,0,0,0,0|1,0,0]=3 330 B9R1.34 CC1=NC(O)=CC(=O)N1 AC-907/25014073 [0,2,0,0,0,0|2,0,0]=4 331 B9R1.34 CC1=NC(O)=CC(Cl)=N1 AP-501/43400472 [0,2,0,0,0,0|2,0,0]=4 332 B9R1.34 CC1=NC(S)=NC(O)=C1 AC-907/30003038 [0,2,0,0,0,0|2,0,0]=4 333 B9R1.34 NC1=CC(=S)NC(=O)N1 AB-323/25048057 [0,2,0,0,0,0|1,0,1]=4 334 B9R1.34 NC1=CC(Br)=CC(Br)=C1 AE-562/43460373 [0,2,0,0,0,0|1,0,0]=3 335 B9R1.34 NC1=CC(Cl)=NC(Cl)=C1 AC-907/25014047 [0,2,0,0,0,0|0,0,0]=2 336 B9R1.34 NC1=CC(N)=CC(N)=C1 AG-205/25005648 [0,2,0,0,0,0|1,0,0]=3 337 B9R1.34 NC1=CC(N)=NC(=O)N1 AB-323/25048090 [0,2,0,0,0,0|1,0,0]=3 338 B9R1.34 NC1=CC(N)=NC(=S)N1 AE-848/32943037 [0,2,0,0,0,0|1,0,0]=3 339 B9R1.34 NC1=CC(O)=NC(O)=N1 AC-907/25004303 [0,2,0,0,0,0|1,0,0]=3 340 B9R1.34 NC1=CC(O)=NC(S)=N1 AB-323/25048536 [0,2,0,0,0,0|1,0,0]=3 341 B9R1.34 NC1=NC(=O)C=C(F)N1 AG-670/25003506 [0,2,0,0,0,0|2,0,0]=4 342 B9R1.34 NC1=NC(=O)NC(F)=C1 AG-670/25003507 [0,2,0,0,0,0|1,0,1]=4 343 B9R1.34 NC1=NC(N)=NC(Cl)=C1 AE-861/30098081 [0,2,0,0,0,0|1,0,0]=3 344 B9R1.34 NC1=NC(N)=NC(O)=C1 AB-323/25048074 [0,2,0,0,0,0|1,0,0]=3 345 B9R1.34 OC1=CC(Br)=NC(Br)=C1 AR-362/43519191 [0,2,0,0,0,0|1,0,0]=3 346 B5R1.1 C1=CNN=C1 AC-907/25014006 [1,0,0,0,1,0|1,0,0]=3 347 B5R1.1 C1=COC=N1 AA-511/25015522 [1,0,0,0,1,0|1,0,0]=3 348 B5R1.1 C1=NC=N[N-]1 AR-011/42531523 [1,0,0,0,1,0|2,0,0]=4