0 B10R1.61 CC(=O)C1=CC=CN=C1Br AM11441 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 CC(=O)C1=CC=CN=C1Cl AM11099 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 CC(=O)C1=CC=CN=C1F AM11100 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.61 CC(=O)C1=CC=CN=C1N AM10829 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.61 CC(=O)C1=CC=CN=C1O AM11549 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.61 CC(=O)C1=NC=CC=C1C AM11703 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.61 CC(=O)C1=NC=CC=C1Cl AM10816 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.61 CC(=O)C1=NC=CC=C1F AM10200 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 CC(=O)C1=NC=CC=C1N AM11508 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.61 CC(=O)C1=NC=CC=C1O AM10817 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC1=C(C(=O)O)C=CN=C1 AM11181 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.61 CC1=C(C(N)=O)C=CN=C1 AM11180 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 AM10709 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 AM11250 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.61 CC1=CC=CN=C1C(=O)O AM11182 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] AM10707 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.61 CC1=CC=NC=C1C(=O)O AM10381 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] AM10708 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.61 NC(=O)C1=NC=CC=C1N AM11515 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.61 NC1=C(C(=O)O)C=CC=N1 AM10826 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.61 NC1=C(C(=O)O)C=CN=C1 AM11102 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 AM10274 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 NC1=CC=CN=C1C(=O)O AM10965 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.61 NC1=CC=CN=C1[N+](=O)[O-] AM10685 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.61 NC1=CC=NC=C1C(=O)O AM11204 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] AM10098 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 AM10767 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 AM10878 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 AM11439 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 AM10165 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.61 O=C(O)C1=C(F)C=NC=C1 AM10082 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 O=C(O)C1=C(F)N=CC=C1 AM10188 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.61 O=C(O)C1=C(I)C=NC=C1 AM10929 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.61 O=C(O)C1=CN=CC=C1Cl AM10093 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.61 O=C(O)C1=CN=CC=C1I AM11236 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.61 O=C(O)C1=CN=CC=C1O AM11232 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.61 O=C(O)C1=NC=CC=C1Br AM10185 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.61 O=C(O)C1=NC=CC=C1Cl AM11160 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.61 O=C(O)C1=NC=CC=C1F AM10260 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.61 O=C(O)C1=NC=CC=C1I AM10930 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.61 O=C(O)c1cccnc1O AM10441 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 AM10719 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.61 O=[N+]([O-])C1=C(Br)C=NC=C1 AM10689 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 AM10169 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 AM11158 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 AM11172 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 AM10433 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 AM11027 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br AM10283 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl AM11708 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F AM10045 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O AM10434 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Br AM10291 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Cl AM10694 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F AM11170 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.61 O=[N+]([O-])C1=NC=CC=C1I AM10699 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.6 CC(=O)C1=CC=CN=C1 AM10949 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.6 CC(=O)C1=CC=NC=C1 AM10950 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.6 CC(=O)C1=NC=CC=C1 AM10450 [1,0,0,0,0,0|1,0,0]=2 59 B9R1.6 CN(C)C1=CC=NC=C1 AM11009 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM10464 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 AM10710 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 COC1=C(Br)C=NC=C1 AM11719 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 COC1=C(Cl)C=NC=C1 AM11722 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 COC1=C(F)C=NC=C1 AM10264 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.15 COC1=C(I)C=NC=C1 AM11177 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.15 COC1=CC=CN=C1Br AM10281 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 COC1=CC=CN=C1C AM10702 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 COC1=CC=CN=C1Cl AM10590 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 COC1=CC=CN=C1N AM10836 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.15 COC1=CC=CNC1=O AM10641 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.15 COC1=NC=CC=C1Br AM10289 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.15 COC1=NC=CC=C1Cl AM10660 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.15 COC1=NC=CC=C1F AM11694 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.15 COC1=NC=CC=C1F AM11782 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.15 COC1=NC=CC=C1I AM10661 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.15 COC1=NC=CC=C1N AM10656 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.15 N#CC1=CC=CN=C1N AM10032 [1,0,0,0,0,0|2,0,1]=4 80 B9R1.15 N#CC1=NC=CC=C1N AM11116 [1,0,0,0,0,0|2,0,1]=4 81 B9R1.15 O=CC1=C(Br)C=NC=C1 AM10977 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.53 COC1=C(C(=O)O)C=CN=C1 AM11178 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.53 COC1=CC=NC=C1C(=O)O AM11246 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.53 NNC1=C([N+](=O)[O-])C=NC=C1 AM11231 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.53 NNC1=CC=CN=C1[N+](=O)[O-] AM11457 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.53 NNC1=NC=CC=C1[N+](=O)[O-] AM11070 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.87 NC1=C(S(=O)(=O)O)C=NC=C1 AM11207 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.87 NC1=CC=CN=C1S(=O)(=O)O AM11126 [0,1,0,0,0,0|3,0,0]=4 89 B11R1.87 NC1=NC=CC=C1S(=O)(=O)O AM10868 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.156 CC1=C([N+](=O)[O-])C(N)=NC=C1 AM10089 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.156 CC1=NC=CC(N)=C1[N+](=O)[O-] AM11196 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.156 NC1=C([N+](=O)[O-])C(Br)=NC=C1 AM11189 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.156 NC1=C([N+](=O)[O-])C(Cl)=NC=C1 AM11192 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 AM10642 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.156 NC1=NC=CC(Cl)=C1[N+](=O)[O-] AM10170 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.156 O=C(O)C1=C(Br)C=NC=C1O AM11735 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1Cl AM10793 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1O AM11736 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I AM11619 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.159 CC1=CN=CC([N+](=O)[O-])=C1N AM11448 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 AM11111 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.159 NC1=C(Br)C=NC=C1[N+](=O)[O-] AM10952 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 AM11757 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 AM11483 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.159 O=C(O)C1=C(F)C(I)=NC=C1 AM11167 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.159 O=C(O)C1=C(I)C(Br)=CN=C1 AM11620 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.159 O=C(O)C1=C(I)C(Br)=NC=C1 AM10884 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl AM11547 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 AM11752 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.166 CC1=C(C(=O)O)C=CC(N)=N1 AM11356 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O AM11550 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.166 CC1=CC(F)=NC=C1C(=O)O AM10482 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.166 CC1=CC(N)=NC=C1C(=O)O AM10531 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 AM10519 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.166 CC1=CC=C([N+](=O)[O-])C(N)=N1 AM10268 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 AM10385 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1N AM11595 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O AM11576 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.166 NC1=CC(Br)=CN=C1[N+](=O)[O-] AM11610 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.166 NC1=CC(Br)=NC=C1[N+](=O)[O-] AM10903 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.166 NC1=CC(Cl)=NC=C1[N+](=O)[O-] AM11522 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.166 NC1=CC(O)=NC=C1[N+](=O)[O-] AM11194 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.166 NC1=NC(Br)=CC=C1[N+](=O)[O-] AM10863 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.166 NC1=NC(Cl)=CC=C1[N+](=O)[O-] AM10865 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 AM11480 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AM10154 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br AM11094 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AM11445 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AM11444 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl AM11096 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 AM10376 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.167 CC1=CN=C(N)C([N+](=O)[O-])=C1 AM10267 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.167 CC1=NC=C(I)C=C1C(=O)O AM11621 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 AM11456 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 AM10532 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 AM11357 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O AM11772 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O AM11526 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 AM11452 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O AM11262 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.167 NC1=CN=C(F)C=C1C(=O)O AM11727 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.167 NC1=NC=C(Br)C(C(=O)O)=C1 AM10843 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.167 NC1=NC=C(Br)C=C1[N+](=O)[O-] AM10162 [0,1,0,0,0,0|3,0,0]=4 144 B11R1.167 NC1=NC=C(Cl)C=C1[N+](=O)[O-] AM10031 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.167 NC1=NC=C(F)C=C1[N+](=O)[O-] AM10163 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.167 NC1=NC=C(I)C=C1[N+](=O)[O-] AM10857 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 AM11271 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AM10920 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 AM11278 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 AM11314 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.167 O=C(O)C1=C(O)N=CC(I)=C1 AM11077 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br AM11501 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl AM11759 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F AM10896 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F AM11312 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Br AM11270 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl AM10460 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.167 O=C(O)C1=CC(O)=NC=C1Br AM11277 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br AM11682 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br AM11148 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl AM10454 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 AM11771 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 AM11032 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.222 COC(=O)C1=C(I)N=CC=C1 AM11405 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.222 COC(=O)C1=C(N)C=NC=C1 AM11127 [0,1,0,0,0,0|1,0,0]=2 166 B11R1.222 COC(=O)C1=CC=CN=C1Cl AM11034 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.222 COC(=O)C1=CC=CN=C1O AM11589 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.222 COC(=O)C1=CN=CC=C1Cl AM11412 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.222 COC(=O)C1=NC=CC=C1Br AM11031 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.222 COC(=O)C1=NC=CC=C1Cl AM11409 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.222 COC(=O)C1=NC=CC=C1N AM11599 [0,1,0,0,0,0|1,0,0]=2 172 B11R2.1 BrC1=NNC2=C1C=NC=C2 AM11789 [0,0,0,1,0,0|3,0,0]=4 173 B11R2.1 BrC1=NNC2=CC=CN=C21 AM11788 [0,0,0,1,0,0|3,0,0]=4 174 B11R2.1 BrC1=NNC2=NC=CC=C12 AM11790 [0,0,0,1,0,0|3,0,0]=4 175 B11R2.1 CC1=NNC2=CC=CN=C21 AM11828 [0,0,0,1,0,0|2,0,0]=3 176 B11R2.1 ClC1=NNC2=NC=CC=C12 AM11798 [0,0,0,1,0,0|3,0,0]=4 177 B11R2.1 IC1=NNC2=NC=CC=C12 AM11794 [0,0,0,1,0,0|3,0,0]=4 178 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 AM11187 [0,0,0,0,0,1|1,0,0]=2 179 B8R1.2 CNC1=CC=NC=C1 AM11030 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 COC1=CC=NC=C1 AM10079 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.2 COC1=NC=CC=C1 AM10305 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.2 CSC1=NC=CC=C1 AM11046 [2,0,0,0,0,0|2,0,0]=4 183 B8R1.5 CC1=C(Br)C=CN=C1 AM10158 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.5 CC1=C(Br)C=CN=C1 AM10972 [2,0,0,0,0,0|2,0,0]=4 185 B8R1.5 CC1=C(Br)C=NC=C1 AM10152 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.5 CC1=C(Cl)C=CN=C1 AM10003 [2,0,0,0,0,0|2,0,0]=4 187 B8R1.5 CC1=C(Cl)C=NC=C1 AM10084 [2,0,0,0,0,0|2,0,0]=4 188 B8R1.5 CC1=C(F)C=CN=C1 AM11230 [2,0,0,0,0,0|2,0,0]=4 189 B8R1.5 CC1=C(F)C=NC=C1 AM10068 [2,0,0,0,0,0|2,0,0]=4 190 B8R1.5 CC1=C(N)C=NC=C1 AM10686 [2,0,0,0,0,0|1,0,0]=3 191 B8R1.5 CC1=C(O)C=NC=C1 AM11174 [2,0,0,0,0,0|2,0,0]=4 192 B8R1.5 CC1=CC=CN=C1Br AM10023 [2,0,0,0,0,0|2,0,0]=4 193 B8R1.5 CC1=CC=CN=C1Cl AM10077 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.5 CC1=CC=CN=C1F AM10044 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.5 CC1=CC=CN=C1N AM10959 [2,0,0,0,0,0|1,0,0]=3 196 B8R1.5 CC1=NC=CC=C1Br AM10287 [2,0,0,0,0,0|2,0,0]=4 197 B8R1.5 CC1=NC=CC=C1Cl AM11157 [2,0,0,0,0,0|2,0,0]=4 198 B8R1.5 CC1=NC=CC=C1F AM10262 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.5 CC1=NC=CC=C1I AM11175 [2,0,0,0,0,0|2,0,0]=4 200 B8R1.5 CC1=NC=CC=C1N AM10112 [2,0,0,0,0,0|1,0,0]=3 201 B8R1.5 CC1=NC=CC=C1O AM10696 [2,0,0,0,0,0|2,0,0]=4 202 B8R1.5 NC1=C(Br)C=CN=C1 AM10716 [2,0,0,0,0,0|2,0,0]=4 203 B8R1.5 NC1=C(Br)C=NC=C1 AM10713 [2,0,0,0,0,0|2,0,0]=4 204 B8R1.5 NC1=C(Cl)C=CN=C1 AM10722 [2,0,0,0,0,0|2,0,0]=4 205 B8R1.5 NC1=C(Cl)C=NC=C1 AM10715 [2,0,0,0,0,0|2,0,0]=4 206 B8R1.5 NC1=C(F)C=NC=C1 AM10056 [2,0,0,0,0,0|2,0,0]=4 207 B8R1.5 NC1=C(I)C=CN=C1 AM10729 [2,0,0,0,0,0|2,0,0]=4 208 B8R1.5 NC1=C(I)C=NC=C1 AM10700 [2,0,0,0,0,0|2,0,0]=4 209 B8R1.5 NC1=C(N)C=NC=C1 AM11000 [2,0,0,0,0,0|2,0,0]=4 210 B8R1.5 NC1=CC=CN=C1Br AM10542 [2,0,0,0,0,0|2,0,0]=4 211 B8R1.5 NC1=CC=CN=C1Cl AM10270 [2,0,0,0,0,0|2,0,0]=4 212 B8R1.5 NC1=CC=CN=C1F AM10208 [2,0,0,0,0,0|2,0,0]=4 213 B8R1.5 NC1=CC=CN=C1I AM11117 [2,0,0,0,0,0|2,0,0]=4 214 B8R1.5 NC1=CC=CN=C1O AM10432 [2,0,0,0,0,0|1,0,1]=4 215 B8R1.5 NC1=CC=CN=C1O AM10634 [2,0,0,0,0,0|1,0,1]=4 216 B8R1.5 NC1=NC=CC=C1Br AM10429 [2,0,0,0,0,0|2,0,0]=4 217 B8R1.5 NC1=NC=CC=C1Cl AM10128 [2,0,0,0,0,0|2,0,0]=4 218 B8R1.5 NC1=NC=CC=C1F AM10161 [2,0,0,0,0,0|2,0,0]=4 219 B8R1.5 NC1=NC=CC=C1I AM10527 [2,0,0,0,0,0|2,0,0]=4 220 B8R1.5 Nc1ccncc1F AM10209 [2,0,0,0,0,0|2,0,0]=4 221 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [1,1,0,0,0,0|2,0,0]=4 230 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [1,1,0,0,0,0|2,0,0]=4 240 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [1,1,0,0,0,0|2,0,0]=4 243 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.15 O=NC(=O)C1=CN=CC=C1 AM10407 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 AM11720 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AM10684 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AM10593 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AM10820 [1,1,0,0,0,0|1,0,0]=3 250 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM10752 [1,1,0,0,0,0|1,0,0]=3 251 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM11518 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 AM11460 [1,1,0,0,0,0|2,0,0]=4 253 B10R1.113 CC1=CC(C(=O)O)=CN=C1 AM11349 [1,1,0,0,0,0|2,0,0]=4 254 B10R1.113 CC1=CC(C(=O)O)=NC=C1 AM11044 [1,1,0,0,0,0|2,0,0]=4 255 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11389 [1,1,0,0,0,0|2,0,0]=4 256 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11767 [1,1,0,0,0,0|2,0,0]=4 257 B10R1.113 CC1=NC=CC(C(=O)O)=C1 AM11438 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 AM10394 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 AM11534 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AM11304 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 AM10392 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AM11223 [1,1,0,0,0,0|2,0,0]=4 263 B10R1.113 NC(=O)c1cccc(I)n1 AM10580 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AM11265 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.113 NC1=CC(C(=O)O)=NC=C1 AM11205 [1,1,0,0,0,0|2,0,0]=4 266 B10R1.113 NC1=CC=CC(C(=O)O)=N1 AM11361 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.113 NC1=NC=CC(C(=O)O)=C1 AM10825 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM10057 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM11538 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 AM10440 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.113 O=C(O)C1=CC(F)=NC=C1 AM10123 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.113 O=C(O)C1=CC(O)=CN=C1 AM11028 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.113 O=C(O)C1=CC(O)=NC=C1 AM11073 [1,1,0,0,0,0|2,0,0]=4 274 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AM11307 [1,1,0,0,0,0|2,0,0]=4 275 B10R1.113 O=C(O)C1=CN=CC(F)=C1 AM10470 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AM11342 [1,1,0,0,0,0|2,0,0]=4 277 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 AM10181 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 AM10028 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.113 O=C(O)C1=NC(F)=CC=C1 AM10065 [1,1,0,0,0,0|2,0,0]=4 280 B10R1.113 O=C(O)C1=NC(I)=CC=C1 AM11384 [1,1,0,0,0,0|2,0,0]=4 281 B10R1.113 O=C(O)C1=NC(O)=CC=C1 AM11380 [1,1,0,0,0,0|2,0,0]=4 282 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AM10199 [1,1,0,0,0,0|2,0,0]=4 283 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AM11224 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AM11237 [1,1,0,0,0,0|2,0,0]=4 285 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AM11234 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 AM11849 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.2 COC1=NC=CC(C)=C1N AM10655 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.2 COC1=NC=CC(Cl)=C1N AM11118 [1,1,0,0,0,0|2,0,0]=4 289 B10R1.4 CCOC1=C(N)C=NC=C1 AM11524 [1,1,0,0,0,0|1,0,1]=4 290 B10R1.25 COC1=CC=C(Br)N=C1N AM10861 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.25 COC1=NC=C(Br)C=C1N AM11121 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.25 O=Cc1ccc(F)nc1Cl AM10402 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.30 COC1=C(N)C=CC(C)=N1 AM11264 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.30 COC1=CC(Br)=CN=C1N AM10847 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.30 COC1=NC(Br)=CC=C1N AM10763 [1,1,0,0,0,0|2,0,0]=4 296 B12R1.233 CC(=O)NC1=CN=C(N)C=C1C AM11259 [0,1,0,0,0,1|2,0,0]=4 297 B12R1.233 CC(=O)NC1=NC=C(Br)C=C1C AM10823 [0,1,0,0,0,1|2,0,0]=4 298 B12R1.233 CC(=O)NC1=NC=C(C)C=C1Br AM10822 [0,1,0,0,0,1|2,0,0]=4 299 B12R1.233 CC(=O)NC1=NC=C(F)C=C1Br AM10809 [0,1,0,0,0,1|2,0,0]=4 300 B12R1.233 CC(=O)NC1=NC=C(N)C=C1Br AM10811 [0,1,0,0,0,1|2,0,0]=4 301 B12R1.77 COC(=O)C1=CN=CC=C1OC AM11416 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.24 COC(=O)C1=C(N)C(Cl)=NC=C1 AM11408 [0,2,0,0,0,0|1,0,0]=3 303 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl AM11410 [0,2,0,0,0,0|2,0,0]=4 304 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C AM11546 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.354 COC(=O)C1=C(Cl)N=CC(Br)=C1 AM11418 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.354 COC(=O)C1=C(O)N=CC(Br)=C1 AM11420 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.354 COC(=O)C1=CC(=O)NC=C1Br AM11419 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Br AM11417 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br AM11402 [0,2,0,0,0,0|2,0,0]=4 310 B12R1.354 COC(=O)C1=NC(Br)=CC=C1Br AM11407 [0,2,0,0,0,0|2,0,0]=4 311 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C AM11485 [0,2,0,0,0,0|2,0,0]=4 312 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br AM11425 [0,2,0,0,0,0|2,0,0]=4 313 B12R1.354 COC(=O)C1=NC(O)=CC=C1Br AM11618 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.453 COC1=CC=C(N)C(C(=O)O)=N1 AM11125 [0,2,0,0,0,0|2,0,0]=4 315 B12R1.308 CCOC(=O)C1=C(N)C=CN=C1 AM11600 [0,2,0,0,0,0|1,0,0]=3 316 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 AM11393 [0,2,0,0,0,0|1,0,0]=3 317 B12R1.308 CCOC(=O)C1=CC=CN=C1N AM10386 [0,2,0,0,0,0|1,0,0]=3 318 B12R1.308 CCOC(=O)C1=NC=CC=C1N AM11512 [0,2,0,0,0,0|1,0,0]=3 319 B10R2.7 C1=CN=C2NC=CC2=C1 AM11060 [1,0,0,1,0,0|1,0,1]=4 320 B12R2.612 CC1=NNC2=NC(F)=CC=C12 AM11826 [0,1,0,1,0,0|2,0,0]=4 321 B12R2.132 CC1=NNC2=NC=C(Br)C=C12 AM11804 [0,1,0,1,0,0|2,0,0]=4