0 B10R1.18 O=C(O)CC1=CC=NC=C1 AM11048 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 O=C(O)CC1=NC=CC=C1 AM11047 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.8 CCOC1=CC=CN=C1 AM11723 [1,0,0,0,0,0|1,0,1]=3 3 B11R1.20 CC(=O)NC1=CN=C(Br)C=C1 AM11256 [0,1,0,0,0,0|2,0,0]=3 4 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 AM10518 [0,1,0,0,0,0|2,0,0]=3 5 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 AM10824 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 AM11187 [0,1,0,0,0,0|2,0,0]=3 7 B11R1.86 CC(C)OC1=NC=CC=C1Br AM10449 [0,1,0,0,0,0|2,0,1]=4 8 B11R1.86 CC(C)OC1=NC=CC=C1I AM11850 [0,1,0,0,0,0|2,0,1]=4 9 B11R1.157 CC(=O)NC1=NC(Br)=CC=C1 AM10813 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.157 CC(=O)NC1=NC(C)=CC=C1 AM10814 [0,1,0,0,0,0|2,0,0]=3 11 B11R2.10 O=C1NC2=C(C=CC=N2)O1 AM10446 [0,0,0,1,0,0|2,0,0]=3 12 B9R1.6 CC(=O)C1=CC=CN=C1 AM10949 [0,0,0,0,1,0|1,0,0]=2 13 B9R1.6 CC(=O)C1=CC=NC=C1 AM10950 [0,0,0,0,1,0|1,0,0]=2 14 B9R1.6 CC(=O)C1=NC=CC=C1 AM10450 [0,0,0,0,1,0|1,0,0]=2 15 B9R1.6 CN(C)C1=CC=NC=C1 AM11009 [0,0,0,0,1,0|3,0,0]=4 16 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM10464 [0,0,0,0,1,0|2,0,0]=3 17 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [0,0,0,0,1,0|2,0,0]=3 18 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [0,0,0,0,1,0|2,0,0]=3 19 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 AM10710 [0,0,0,0,1,0|3,0,0]=4 20 B8R1.2 CNC1=CC=NC=C1 AM11030 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.2 COC1=CC=NC=C1 AM10079 [2,0,0,0,0,0|1,0,0]=3 22 B8R1.2 COC1=NC=CC=C1 AM10305 [2,0,0,0,0,0|1,0,0]=3 23 B8R1.2 CSC1=NC=CC=C1 AM11046 [2,0,0,0,0,0|1,1,0]=4 24 B10R1.1 CCOC1=CC=[N+]([O-])C=C1 AM11544 [1,1,0,0,0,0|1,0,1]=4 25 B10R1.1 CCOC1=CN=C(Br)C=C1 AM10566 [1,1,0,0,0,0|1,0,1]=4 26 B10R1.1 CCOC1=CN=C(C)C=C1 AM11324 [1,1,0,0,0,0|1,0,1]=4 27 B10R1.1 CCOC1=NC=C(Br)C=C1 AM10308 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.1 CCOC1=NC=C(I)C=C1 AM10942 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.1 CCOC1=NC=C(N)C=C1 AM10608 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.4 CCOC1=C(Br)C=CN=C1 AM10717 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.4 CCOC1=C(N)C=NC=C1 AM11524 [1,1,0,0,0,0|1,0,1]=4 32 B10R1.4 CCOC1=CC=CN=C1Br AM10547 [1,1,0,0,0,0|1,0,1]=4 33 B10R1.4 CCOC1=CC=CN=C1C AM11165 [1,1,0,0,0,0|1,0,1]=4 34 B10R1.4 CCOC1=NC=CC=C1Br AM10607 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.4 CCOC1=NC=CC=C1Cl AM11152 [1,1,0,0,0,0|1,0,1]=4 36 B10R1.4 CCOC1=NC=CC=C1I AM10941 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.4 CCOC1=NC=CC=C1O AM10940 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.10 CCOC1=CC=CC(Br)=N1 AM10572 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.10 CCOC1=CN=CC(Br)=C1 AM10692 [1,1,0,0,0,0|1,0,1]=4 40 B10R1.10 CCOC1=CN=CC(Br)=C1 AM11467 [1,1,0,0,0,0|1,0,1]=4 41 B10R1.10 CCOC1=NC=CC(N)=C1 AM10711 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [0,1,0,0,1,0|1,0,0]=3 43 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [0,1,0,0,1,0|1,0,0]=3 44 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [0,1,0,0,1,0|1,0,0]=3 45 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [0,1,0,0,1,0|1,0,0]=3 46 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [0,1,0,0,1,0|1,0,0]=3 47 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [0,1,0,0,1,0|2,0,0]=4 48 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [0,1,0,0,1,0|2,0,0]=4 49 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [0,1,0,0,1,0|2,0,0]=4 50 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [0,1,0,0,1,0|2,0,0]=4 51 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [0,1,0,0,1,0|2,0,0]=4 52 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [0,1,0,0,1,0|2,0,0]=4 53 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [0,1,0,0,1,0|2,0,0]=4 54 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [0,1,0,0,1,0|2,0,0]=4 55 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [0,1,0,0,1,0|2,0,0]=4 56 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [0,1,0,0,1,0|2,0,0]=4 57 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [0,1,0,0,1,0|2,0,0]=4 58 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [0,1,0,0,1,0|2,0,0]=4 59 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [0,1,0,0,1,0|2,0,0]=4 60 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [0,1,0,0,1,0|2,0,0]=4 61 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [0,1,0,0,1,0|2,0,0]=4 62 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [0,1,0,0,1,0|2,0,0]=4 63 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [0,1,0,0,1,0|2,0,0]=4 64 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [0,1,0,0,1,0|2,0,0]=4 65 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [0,1,0,0,1,0|2,0,0]=4 66 B10R1.61 CC(=O)C1=CC=CN=C1Br AM11441 [0,1,0,0,1,0|1,0,0]=3 67 B10R1.61 CC(=O)C1=CC=CN=C1Cl AM11099 [0,1,0,0,1,0|1,0,0]=3 68 B10R1.61 CC(=O)C1=CC=CN=C1F AM11100 [0,1,0,0,1,0|1,0,0]=3 69 B10R1.61 CC(=O)C1=CC=CN=C1N AM10829 [0,1,0,0,1,0|1,0,0]=3 70 B10R1.61 CC(=O)C1=CC=CN=C1O AM11549 [0,1,0,0,1,0|1,0,0]=3 71 B10R1.61 CC(=O)C1=NC=CC=C1C AM11703 [0,1,0,0,1,0|1,0,0]=3 72 B10R1.61 CC(=O)C1=NC=CC=C1Cl AM10816 [0,1,0,0,1,0|1,0,0]=3 73 B10R1.61 CC(=O)C1=NC=CC=C1F AM10200 [0,1,0,0,1,0|1,0,0]=3 74 B10R1.61 CC(=O)C1=NC=CC=C1N AM11508 [0,1,0,0,1,0|1,0,0]=3 75 B10R1.61 CC(=O)C1=NC=CC=C1O AM10817 [0,1,0,0,1,0|1,0,0]=3 76 B10R1.61 CC1=C(C(=O)O)C=CN=C1 AM11181 [0,1,0,0,1,0|2,0,0]=4 77 B10R1.61 CC1=C(C(N)=O)C=CN=C1 AM11180 [0,1,0,0,1,0|2,0,0]=4 78 B10R1.61 CC1=CC=CN=C1C(=O)O AM11182 [0,1,0,0,1,0|2,0,0]=4 79 B10R1.61 CC1=CC=NC=C1C(=O)O AM10381 [0,1,0,0,1,0|2,0,0]=4 80 B10R1.61 NC(=O)C1=NC=CC=C1N AM11515 [0,1,0,0,1,0|2,0,0]=4 81 B10R1.61 NC1=C(C(=O)O)C=CC=N1 AM10826 [0,1,0,0,1,0|2,0,0]=4 82 B10R1.61 NC1=C(C(=O)O)C=CN=C1 AM11102 [0,1,0,0,1,0|2,0,0]=4 83 B10R1.61 NC1=CC=CN=C1C(=O)O AM10965 [0,1,0,0,1,0|2,0,0]=4 84 B10R1.61 NC1=CC=NC=C1C(=O)O AM11204 [0,1,0,0,1,0|2,0,0]=4 85 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 AM10767 [0,1,0,0,1,0|2,0,0]=4 86 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 AM10878 [0,1,0,0,1,0|2,0,0]=4 87 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 AM11439 [0,1,0,0,1,0|2,0,0]=4 88 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 AM10165 [0,1,0,0,1,0|2,0,0]=4 89 B10R1.61 O=C(O)C1=C(F)C=NC=C1 AM10082 [0,1,0,0,1,0|2,0,0]=4 90 B10R1.61 O=C(O)C1=C(F)N=CC=C1 AM10188 [0,1,0,0,1,0|2,0,0]=4 91 B10R1.61 O=C(O)C1=C(I)C=NC=C1 AM10929 [0,1,0,0,1,0|2,0,0]=4 92 B10R1.61 O=C(O)C1=CN=CC=C1Cl AM10093 [0,1,0,0,1,0|2,0,0]=4 93 B10R1.61 O=C(O)C1=CN=CC=C1I AM11236 [0,1,0,0,1,0|2,0,0]=4 94 B10R1.61 O=C(O)C1=CN=CC=C1O AM11232 [0,1,0,0,1,0|2,0,0]=4 95 B10R1.61 O=C(O)C1=NC=CC=C1Br AM10185 [0,1,0,0,1,0|2,0,0]=4 96 B10R1.61 O=C(O)C1=NC=CC=C1Cl AM11160 [0,1,0,0,1,0|2,0,0]=4 97 B10R1.61 O=C(O)C1=NC=CC=C1F AM10260 [0,1,0,0,1,0|2,0,0]=4 98 B10R1.61 O=C(O)C1=NC=CC=C1I AM10930 [0,1,0,0,1,0|2,0,0]=4 99 B10R1.61 O=C(O)c1cccnc1O AM10441 [0,1,0,0,1,0|2,0,0]=4 100 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 AM11720 [0,1,0,0,1,0|2,0,0]=4 101 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AM10684 [0,1,0,0,1,0|1,0,0]=3 102 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AM10593 [0,1,0,0,1,0|1,0,0]=3 103 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AM10820 [0,1,0,0,1,0|1,0,0]=3 104 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM10752 [0,1,0,0,1,0|1,0,0]=3 105 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM11518 [0,1,0,0,1,0|1,0,0]=3 106 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 AM11460 [0,1,0,0,1,0|2,0,0]=4 107 B10R1.113 CC1=CC(C(=O)O)=CN=C1 AM11349 [0,1,0,0,1,0|2,0,0]=4 108 B10R1.113 CC1=CC(C(=O)O)=NC=C1 AM11044 [0,1,0,0,1,0|2,0,0]=4 109 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11389 [0,1,0,0,1,0|2,0,0]=4 110 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11767 [0,1,0,0,1,0|2,0,0]=4 111 B10R1.113 CC1=NC=CC(C(=O)O)=C1 AM11438 [0,1,0,0,1,0|2,0,0]=4 112 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 AM10394 [0,1,0,0,1,0|2,0,0]=4 113 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 AM11534 [0,1,0,0,1,0|2,0,0]=4 114 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AM11304 [0,1,0,0,1,0|2,0,0]=4 115 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 AM10392 [0,1,0,0,1,0|2,0,0]=4 116 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AM11223 [0,1,0,0,1,0|2,0,0]=4 117 B10R1.113 NC(=O)c1cccc(I)n1 AM10580 [0,1,0,0,1,0|2,0,0]=4 118 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AM11265 [0,1,0,0,1,0|2,0,0]=4 119 B10R1.113 NC1=CC(C(=O)O)=NC=C1 AM11205 [0,1,0,0,1,0|2,0,0]=4 120 B10R1.113 NC1=CC=CC(C(=O)O)=N1 AM11361 [0,1,0,0,1,0|2,0,0]=4 121 B10R1.113 NC1=NC=CC(C(=O)O)=C1 AM10825 [0,1,0,0,1,0|2,0,0]=4 122 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM10057 [0,1,0,0,1,0|2,0,0]=4 123 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM11538 [0,1,0,0,1,0|2,0,0]=4 124 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 AM10440 [0,1,0,0,1,0|2,0,0]=4 125 B10R1.113 O=C(O)C1=CC(F)=NC=C1 AM10123 [0,1,0,0,1,0|2,0,0]=4 126 B10R1.113 O=C(O)C1=CC(O)=CN=C1 AM11028 [0,1,0,0,1,0|2,0,0]=4 127 B10R1.113 O=C(O)C1=CC(O)=NC=C1 AM11073 [0,1,0,0,1,0|2,0,0]=4 128 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AM11307 [0,1,0,0,1,0|2,0,0]=4 129 B10R1.113 O=C(O)C1=CN=CC(F)=C1 AM10470 [0,1,0,0,1,0|2,0,0]=4 130 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AM11342 [0,1,0,0,1,0|2,0,0]=4 131 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 AM10181 [0,1,0,0,1,0|2,0,0]=4 132 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 AM10028 [0,1,0,0,1,0|2,0,0]=4 133 B10R1.113 O=C(O)C1=NC(F)=CC=C1 AM10065 [0,1,0,0,1,0|2,0,0]=4 134 B10R1.113 O=C(O)C1=NC(I)=CC=C1 AM11384 [0,1,0,0,1,0|2,0,0]=4 135 B10R1.113 O=C(O)C1=NC(O)=CC=C1 AM11380 [0,1,0,0,1,0|2,0,0]=4 136 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AM10199 [0,1,0,0,1,0|2,0,0]=4 137 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AM11224 [0,1,0,0,1,0|2,0,0]=4 138 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AM11237 [0,1,0,0,1,0|2,0,0]=4 139 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AM11234 [0,1,0,0,1,0|2,0,0]=4 140 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 AM11849 [0,1,0,0,1,0|2,0,0]=4 141 B12R1.21 CC(=O)NNC1=NC=C(Br)C=C1 AM11627 [0,1,0,0,0,1|2,0,0]=4 142 B12R1.19 CC(=O)NC1=CC=C(Cl)C(C)=N1 AM11355 [0,2,0,0,0,0|2,0,0]=4 143 B12R1.19 CC(=O)NC1=NC(C)=C(Br)C=C1 AM10742 [0,2,0,0,0,0|2,0,0]=4 144 B12R1.19 CC(=O)NC1=NC=C(Br)C(C)=C1 AM10516 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.19 CC(=O)NC1=NC=C(Cl)C(C)=C1 AM10743 [0,2,0,0,0,0|2,0,0]=4 146 B12R1.19 CC(=O)NC1=NC=C(F)C(C)=C1 AM10517 [0,2,0,0,0,0|2,0,0]=4 147 B12R1.19 CC(=O)NC1=NC=C(N)C(C)=C1 AM10514 [0,2,0,0,0,0|2,0,0]=4 148 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 AM10312 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.49 COC(=O)NC1=NC=C(Br)C=C1 AM11653 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.233 CC(=O)NC1=CN=C(N)C=C1C AM11259 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.233 CC(=O)NC1=NC=C(Br)C=C1C AM10823 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.233 CC(=O)NC1=NC=C(C)C=C1Br AM10822 [0,2,0,0,0,0|2,0,0]=4 153 B12R1.233 CC(=O)NC1=NC=C(F)C=C1Br AM10809 [0,2,0,0,0,0|2,0,0]=4 154 B12R1.233 CC(=O)NC1=NC=C(N)C=C1Br AM10811 [0,2,0,0,0,0|2,0,0]=4 155 B12R1.32 CCOC(=O)CC1=NC=CC=C1 AM11024 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.101 CC(=O)NC1=NC(Br)=CC(C)=C1 AM10890 [0,2,0,0,0,0|2,0,0]=4