0 B10R1.61 CC(=O)C1=CC=CN=C1Br AM11441 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(=O)C1=CC=CN=C1Cl AM11099 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC(=O)C1=CC=CN=C1F AM11100 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.61 CC(=O)C1=CC=CN=C1N AM10829 [0,0,0,0,0,0|3,0,0]=3 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|3,0,0]=3 6 B10R1.61 CC(=O)C1=NC=CC=C1Cl AM10816 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 CC(=O)C1=NC=CC=C1F AM10200 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.61 CC(=O)C1=NC=CC=C1N AM11508 [0,0,0,0,0,0|3,0,0]=3 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|2,0,0]=2 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|3,0,1]=4 13 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 AM11250 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.61 CC1=CC=CN=C1C(=O)O AM11182 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] AM10707 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.61 CC1=CC=NC=C1C(=O)O AM10381 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] AM10708 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.61 NC(=O)C1=NC=CC=C1N AM11515 [0,0,0,0,0,0|3,0,0]=3 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|3,0,1]=4 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|3,0,1]=4 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|3,0,1]=4 26 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 AM10767 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 AM10878 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 AM11439 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 AM10165 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.61 O=C(O)C1=C(F)C=NC=C1 AM10082 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.61 O=C(O)C1=C(F)N=CC=C1 AM10188 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.61 O=C(O)C1=C(I)C=NC=C1 AM10929 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.61 O=C(O)C1=CN=CC=C1Cl AM10093 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 O=C(O)C1=CN=CC=C1I AM11236 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.61 O=C(O)C1=CN=CC=C1O AM11232 [0,0,0,0,0,0|1,0,0]=1 36 B10R1.61 O=C(O)C1=NC=CC=C1Br AM10185 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.61 O=C(O)C1=NC=CC=C1Cl AM11160 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.61 O=C(O)C1=NC=CC=C1F AM10260 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.61 O=C(O)C1=NC=CC=C1I AM10930 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.61 O=C(O)c1cccnc1O AM10441 [0,0,0,0,0,0|1,0,0]=1 41 B10R1.61 O=[N+]([O-])C1=C(Br)C=CN=C1 AM10719 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.61 O=[N+]([O-])C1=C(Br)C=NC=C1 AM10689 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 AM10169 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 AM11158 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 AM11172 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 AM10433 [0,0,0,0,0,0|2,0,1]=3 47 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 AM11027 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br AM10283 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl AM11708 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F AM10045 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O AM10434 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Br AM10291 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Cl AM10694 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F AM11170 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.61 O=[N+]([O-])C1=NC=CC=C1I AM10699 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.6 CC(=O)C1=CC=CN=C1 AM10949 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.6 CC(=O)C1=CC=NC=C1 AM10950 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.6 CC(=O)C1=NC=CC=C1 AM10450 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM10464 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [1,0,0,0,0,0|1,0,0]=2 61 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [1,0,0,0,0,0|1,0,0]=2 62 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 AM10710 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.15 N#CC1=CC=CN=C1O AM11076 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.15 N#CC1=NC=CC=C1O AM10932 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.15 N#CC1=NC=CC=C1O AM10934 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.15 O=CC1=C(Br)C=NC=C1 AM10977 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.15 OCC1=CC=CN=C1Cl AM10457 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.15 OCc1ncccc1O AM10762 [1,0,0,0,0,0|1,0,1]=3 69 B11R1.53 COC1=C(C(=O)O)C=CN=C1 AM11178 [0,1,0,0,0,0|1,0,0]=2 70 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 AM10730 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] AM10703 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.53 COC1=CC=NC=C1C(=O)O AM11246 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] AM10666 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.87 CC1=C(S(=O)(=O)O)C=CN=C1 AM11481 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.87 CC1=C(S(=O)(=O)O)C=NC=C1 AM11253 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.87 CC1=CC=CN=C1S(=O)(=O)O AM11183 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.87 NC1=C(S(=O)(=O)O)C=NC=C1 AM11207 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.87 NC1=CC=CN=C1S(=O)(=O)O AM11126 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.87 NC1=NC=CC=C1S(=O)(=O)O AM10868 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.87 NS(=O)(=O)C1=C(O)C=CN=C1 AM11235 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.87 O=S(=O)(O)C1=CC=CN=C1Br AM10911 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.87 O=S(=O)(O)C1=NC=CC=C1O AM10927 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.156 CC1=C([N+](=O)[O-])C(O)=NC=C1 AM10029 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.156 CC1=NC=CC(O)=C1[N+](=O)[O-] AM11233 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 AM10642 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.156 O=C(O)C1=C(Br)C=NC=C1O AM11735 [0,1,0,0,0,0|1,0,0]=2 87 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1Cl AM10793 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1O AM11736 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I AM11619 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1Br AM11706 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1Cl AM10917 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1O AM10496 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 AM11111 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 AM11757 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 AM11483 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.159 O=C(O)C1=C(F)C(I)=NC=C1 AM11167 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.159 O=C(O)C1=C(I)C(Br)=CN=C1 AM11620 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.159 O=C(O)C1=C(I)C(Br)=NC=C1 AM10884 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl AM11547 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 AM11752 [0,1,0,0,0,0|1,0,0]=2 101 B11R1.166 CC1=C(C(=O)O)C=CC(N)=N1 AM11356 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O AM11550 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.166 CC1=CC(F)=NC=C1C(=O)O AM10482 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.166 CC1=CC(N)=NC=C1C(=O)O AM10531 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 AM10519 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 AM10303 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 AM10385 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1N AM11595 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O AM11576 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 AM11480 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AM10154 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br AM11094 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AM11445 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AM11444 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl AM11096 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1O AM11367 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 AM10376 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.167 CC1=CC=C(O)C([N+](=O)[O-])=N1 AM10698 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.167 CC1=CN=C(O)C([N+](=O)[O-])=C1 AM10645 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.167 CC1=NC=C(I)C=C1C(=O)O AM11621 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 AM11456 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 AM10532 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 AM11357 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O AM11772 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O AM11526 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 AM11452 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O AM11262 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.167 NC1=CN=C(F)C=C1C(=O)O AM11727 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.167 NC1=NC=C(Br)C(C(=O)O)=C1 AM10843 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 AM11271 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AM10920 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 AM11278 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 AM11314 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.167 O=C(O)C1=C(O)N=CC(I)=C1 AM11077 [0,1,0,0,0,0|1,0,0]=2 135 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br AM11501 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl AM11759 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F AM10896 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F AM11312 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Br AM11270 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl AM10460 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.167 O=C(O)C1=CC(O)=NC=C1Br AM11277 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br AM11682 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br AM11148 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl AM10454 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(Cl)=N1 AM10921 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1O AM10151 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1O AM10040 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1O AM10761 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O AM10898 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 AM11771 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 AM11032 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.222 COC(=O)C1=C(I)N=CC=C1 AM11405 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.222 COC(=O)C1=C(N)C=NC=C1 AM11127 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.222 COC(=O)C1=CC=CN=C1Cl AM11034 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.222 COC(=O)C1=CC=CN=C1O AM11589 [0,1,0,0,0,0|1,0,0]=2 156 B11R1.222 COC(=O)C1=CN=CC=C1Cl AM11412 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.222 COC(=O)C1=NC=CC=C1Br AM11031 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.222 COC(=O)C1=NC=CC=C1Cl AM11409 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.222 COC(=O)C1=NC=CC=C1N AM11599 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 AM11187 [0,0,0,0,0,1|3,0,0]=4 161 B8R1.2 OCC1=NC=CC=C1 AM11026 [2,0,0,0,0,0|1,0,1]=4 162 B8R1.5 CC1=C(O)C=NC=C1 AM11174 [2,0,0,0,0,0|1,0,1]=4 163 B8R1.5 CC1=NC=CC=C1O AM10696 [2,0,0,0,0,0|1,0,1]=4 164 B8R1.5 NC1=CC=CN=C1O AM10432 [2,0,0,0,0,0|2,0,0]=4 165 B8R1.5 NC1=CC=CN=C1O AM10634 [2,0,0,0,0,0|2,0,0]=4 166 B8R1.5 OC1=C(Br)C=NC=C1 AM10728 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.5 OC1=C(F)C=NC=C1 AM10261 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.5 OC1=CC=CN=C1Br AM10431 [2,0,0,0,0,0|2,0,0]=4 169 B8R1.5 OC1=CC=CN=C1Cl AM10739 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.5 OC1=CC=CN=C1F AM10615 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.5 OC1=CC=CN=C1I AM10650 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.5 OC1=CC=CN=C1O AM10437 [2,0,0,0,0,0|1,0,0]=3 173 B8R1.5 OC1=NC=CC=C1Br AM10288 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.5 OC1=NC=CC=C1Br AM10637 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.5 OC1=NC=CC=C1Cl AM10639 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.5 OC1=NC=CC=C1Cl AM11155 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.5 OC1=NC=CC=C1F AM11166 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.5 OC1=NC=CC=C1I AM10740 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [1,1,0,0,0,0|1,0,0]=3 185 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [1,1,0,0,0,0|1,0,0]=3 201 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [1,1,0,0,0,0|1,0,0]=3 202 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [1,1,0,0,0,0|1,0,0]=3 203 B10R1.15 O=NC(=O)C1=CN=CC=C1 AM10407 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 AM11052 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AM10684 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AM10593 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AM10820 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM10752 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM11518 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 AM11460 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.113 CC1=CC(C(=O)O)=CN=C1 AM11349 [1,1,0,0,0,0|1,0,0]=3 212 B10R1.113 CC1=CC(C(=O)O)=NC=C1 AM11044 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11389 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11767 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.113 CC1=NC=CC(C(=O)O)=C1 AM11438 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 AM10394 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 AM11534 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AM11304 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 AM10392 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AM11223 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.113 NC(=O)c1cccc(I)n1 AM10580 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AM11265 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.113 NC1=CC(C(=O)O)=NC=C1 AM11205 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.113 NC1=CC=CC(C(=O)O)=N1 AM11361 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.113 NC1=NC=CC(C(=O)O)=C1 AM10825 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM10057 [1,1,0,0,0,0|1,0,0]=3 227 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM11538 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 AM10440 [1,1,0,0,0,0|1,0,0]=3 229 B10R1.113 O=C(O)C1=CC(F)=NC=C1 AM10123 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.113 O=C(O)C1=CC(O)=CN=C1 AM11028 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.113 O=C(O)C1=CC(O)=NC=C1 AM11073 [1,1,0,0,0,0|1,0,0]=3 232 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AM11307 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.113 O=C(O)C1=CN=CC(F)=C1 AM10470 [1,1,0,0,0,0|1,0,0]=3 234 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AM11342 [1,1,0,0,0,0|1,0,0]=3 235 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 AM10181 [1,1,0,0,0,0|1,0,0]=3 236 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 AM10028 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.113 O=C(O)C1=NC(F)=CC=C1 AM10065 [1,1,0,0,0,0|1,0,0]=3 238 B10R1.113 O=C(O)C1=NC(I)=CC=C1 AM11384 [1,1,0,0,0,0|1,0,0]=3 239 B10R1.113 O=C(O)C1=NC(O)=CC=C1 AM11380 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AM10199 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AM11224 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AM11237 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AM11234 [1,1,0,0,0,0|1,0,0]=3 244 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 AM11849 [1,1,0,0,0,0|1,0,1]=4 245 B10R1.20 OCC1=CC=CN=C1CO AM11007 [1,1,0,0,0,0|1,0,1]=4 246 B10R1.25 O=Cc1ccc(F)nc1Cl AM10402 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=N1 AM11284 [0,2,0,0,0,0|1,0,0]=3 248 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=N1 AM11317 [0,2,0,0,0,0|1,0,0]=3 249 B12R1.57 COC1=CC(Cl)=NC=C1C(=O)O AM11372 [0,2,0,0,0,0|1,0,0]=3 250 B12R1.77 COC(=O)C1=CN=CC=C1OC AM11416 [0,2,0,0,0,0|1,0,0]=3 251 B12R1.261 O=C(O)C1=C([N+](=O)[O-])C=CN=C1 AM11475 [0,2,0,0,0,0|1,0,1]=4 252 B12R1.261 O=C(O)C1=C([N+](=O)[O-])C=NC=C1 AM11184 [0,2,0,0,0,0|1,0,1]=4 253 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O AM11051 [0,2,0,0,0,0|1,0,0]=3 254 B12R1.261 O=C(O)C1=CC=CN=C1[N+](=O)[O-] AM11082 [0,2,0,0,0,0|1,0,1]=4 255 B12R1.261 O=C(O)C1=NC=CC=C1[N+](=O)[O-] AM11185 [0,2,0,0,0,0|1,0,1]=4 256 B12R1.261 O=C(O)c1cccnc1C(=O)O AM10445 [0,2,0,0,0,0|1,0,0]=3 257 B12R1.24 COC(=O)C1=C(N)C(Cl)=NC=C1 AM11408 [0,2,0,0,0,0|2,0,0]=4 258 B12R1.452 COC1=NC(Cl)=C(C(=O)O)C=C1 AM11548 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl AM11410 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C AM11546 [0,2,0,0,0,0|2,0,0]=4 261 B12R1.354 COC(=O)C1=C(Cl)N=CC(Br)=C1 AM11418 [0,2,0,0,0,0|2,0,0]=4 262 B12R1.354 COC(=O)C1=C(O)N=CC(Br)=C1 AM11420 [0,2,0,0,0,0|1,0,0]=3 263 B12R1.354 COC(=O)C1=CC(=O)NC=C1Br AM11419 [0,2,0,0,0,0|2,0,0]=4 264 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Br AM11417 [0,2,0,0,0,0|2,0,0]=4 265 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br AM11402 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.354 COC(=O)C1=NC(Br)=CC=C1Br AM11407 [0,2,0,0,0,0|2,0,0]=4 267 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C AM11485 [0,2,0,0,0,0|2,0,0]=4 268 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br AM11425 [0,2,0,0,0,0|2,0,0]=4 269 B12R1.354 COC(=O)C1=NC(O)=CC=C1Br AM11618 [0,2,0,0,0,0|2,0,0]=4 270 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=N1 AM11617 [0,2,0,0,0,0|2,0,0]=4 271 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=N1 AM11654 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.453 COC1=CC=C(Cl)C(C(=O)O)=N1 AM11597 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.453 COC1=CC=C(N)C(C(=O)O)=N1 AM11125 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.308 CCOC(=O)C1=C(N)C=CN=C1 AM11600 [0,2,0,0,0,0|2,0,0]=4 275 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 AM11393 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.308 CCOC(=O)C1=CC=CN=C1N AM10386 [0,2,0,0,0,0|2,0,0]=4 277 B12R1.308 CCOC(=O)C1=NC=CC=C1N AM11512 [0,2,0,0,0,0|2,0,0]=4 278 B10R1.18 O=C(O)CC1=NC=CC=C1 AM11047 [0,0,1,1,0,0|1,0,1]=4