0 B9R1.6 CC(=O)C1=CC=CN=C1 AM10949 [0,0,0,0,0,1|0,0,1]=2 1 B9R1.6 CC(=O)C1=CC=NC=C1 AM10950 [0,0,0,0,0,1|1,0,0]=2 2 B9R1.6 CC(=O)C1=NC=CC=C1 AM10450 [0,0,0,0,0,1|0,0,1]=2 3 B9R1.6 CN(C)C1=CC=NC=C1 AM11009 [0,0,0,0,0,1|3,0,0]=4 4 B9R1.6 O=C(Cl)C1=CN=CC=C1 AM10464 [0,0,0,0,0,1|1,0,1]=3 5 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [0,0,0,0,0,1|1,0,1]=3 6 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [0,0,0,0,0,1|1,0,1]=3 7 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 AM10710 [0,0,0,0,0,1|2,0,1]=4 8 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [0,1,0,0,0,1|0,0,1]=3 9 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [0,1,0,0,0,1|0,0,1]=3 10 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [0,1,0,0,0,1|0,0,1]=3 11 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [0,1,0,0,0,1|0,0,1]=3 12 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [0,1,0,0,0,1|0,0,1]=3 13 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [0,1,0,0,0,1|1,0,1]=4 14 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [0,1,0,0,0,1|1,0,1]=4 15 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [0,1,0,0,0,1|1,0,1]=4 16 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [0,1,0,0,0,1|1,0,1]=4 17 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [0,1,0,0,0,1|1,0,1]=4 18 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [0,1,0,0,0,1|1,0,1]=4 19 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [0,1,0,0,0,1|1,0,1]=4 20 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [0,1,0,0,0,1|1,0,1]=4 21 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [0,1,0,0,0,1|1,0,1]=4 22 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [0,1,0,0,0,1|1,0,1]=4 23 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [0,1,0,0,0,1|1,0,1]=4 24 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [0,1,0,0,0,1|1,0,1]=4 25 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [0,1,0,0,0,1|1,0,1]=4 26 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [0,1,0,0,0,1|1,0,1]=4 27 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [0,1,0,0,0,1|1,0,1]=4 28 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [0,1,0,0,0,1|1,0,1]=4 29 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [0,1,0,0,0,1|1,0,1]=4 30 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [0,1,0,0,0,1|1,0,1]=4 31 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [0,1,0,0,0,1|1,0,1]=4 32 B10R1.15 O=NC(=O)C1=CN=CC=C1 AM10407 [0,1,0,0,0,1|1,0,1]=4 33 B10R1.61 CC(=O)C1=CC=CN=C1Br AM11441 [0,1,0,0,0,1|0,0,1]=3 34 B10R1.61 CC(=O)C1=CC=CN=C1Cl AM11099 [0,1,0,0,0,1|0,0,1]=3 35 B10R1.61 CC(=O)C1=CC=CN=C1F AM11100 [0,1,0,0,0,1|0,0,1]=3 36 B10R1.61 CC(=O)C1=CC=CN=C1N AM10829 [0,1,0,0,0,1|0,0,1]=3 37 B10R1.61 CC(=O)C1=CC=CN=C1O AM11549 [0,1,0,0,0,1|0,0,1]=3 38 B10R1.61 CC(=O)C1=NC=CC=C1C AM11703 [0,1,0,0,0,1|0,0,1]=3 39 B10R1.61 CC(=O)C1=NC=CC=C1Cl AM10816 [0,1,0,0,0,1|0,0,1]=3 40 B10R1.61 CC(=O)C1=NC=CC=C1F AM10200 [0,1,0,0,0,1|0,0,1]=3 41 B10R1.61 CC(=O)C1=NC=CC=C1N AM11508 [0,1,0,0,0,1|0,0,1]=3 42 B10R1.61 CC(=O)C1=NC=CC=C1O AM10817 [0,1,0,0,0,1|0,0,1]=3 43 B10R1.61 CC1=C(C(=O)O)C=CN=C1 AM11181 [0,1,0,0,0,1|2,0,0]=4 44 B10R1.61 CC1=C(C(N)=O)C=CN=C1 AM11180 [0,1,0,0,0,1|2,0,0]=4 45 B10R1.61 CC1=CC=CN=C1C(=O)O AM11182 [0,1,0,0,0,1|1,0,1]=4 46 B10R1.61 CC1=CC=NC=C1C(=O)O AM10381 [0,1,0,0,0,1|1,0,1]=4 47 B10R1.61 NC(=O)C1=NC=CC=C1N AM11515 [0,1,0,0,0,1|1,0,1]=4 48 B10R1.61 NC1=C(C(=O)O)C=CC=N1 AM10826 [0,1,0,0,0,1|1,0,1]=4 49 B10R1.61 NC1=C(C(=O)O)C=CN=C1 AM11102 [0,1,0,0,0,1|2,0,0]=4 50 B10R1.61 NC1=CC=CN=C1C(=O)O AM10965 [0,1,0,0,0,1|1,0,1]=4 51 B10R1.61 NC1=CC=NC=C1C(=O)O AM11204 [0,1,0,0,0,1|1,0,1]=4 52 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 AM10767 [0,1,0,0,0,1|2,0,0]=4 53 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 AM10878 [0,1,0,0,0,1|1,0,1]=4 54 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 AM11439 [0,1,0,0,0,1|2,0,0]=4 55 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 AM10165 [0,1,0,0,0,1|1,0,1]=4 56 B10R1.61 O=C(O)C1=C(F)C=NC=C1 AM10082 [0,1,0,0,0,1|2,0,0]=4 57 B10R1.61 O=C(O)C1=C(F)N=CC=C1 AM10188 [0,1,0,0,0,1|1,0,1]=4 58 B10R1.61 O=C(O)C1=C(I)C=NC=C1 AM10929 [0,1,0,0,0,1|2,0,0]=4 59 B10R1.61 O=C(O)C1=CN=CC=C1Cl AM10093 [0,1,0,0,0,1|1,0,1]=4 60 B10R1.61 O=C(O)C1=CN=CC=C1I AM11236 [0,1,0,0,0,1|1,0,1]=4 61 B10R1.61 O=C(O)C1=CN=CC=C1O AM11232 [0,1,0,0,0,1|1,0,1]=4 62 B10R1.61 O=C(O)C1=NC=CC=C1Br AM10185 [0,1,0,0,0,1|1,0,1]=4 63 B10R1.61 O=C(O)C1=NC=CC=C1Cl AM11160 [0,1,0,0,0,1|1,0,1]=4 64 B10R1.61 O=C(O)C1=NC=CC=C1F AM10260 [0,1,0,0,0,1|1,0,1]=4 65 B10R1.61 O=C(O)C1=NC=CC=C1I AM10930 [0,1,0,0,0,1|1,0,1]=4 66 B10R1.61 O=C(O)c1cccnc1O AM10441 [0,1,0,0,0,1|1,0,1]=4 67 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 AM11720 [0,1,0,0,0,1|1,0,1]=4 68 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AM10684 [0,1,0,0,0,1|0,0,1]=3 69 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AM10593 [0,1,0,0,0,1|1,0,0]=3 70 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AM10820 [0,1,0,0,0,1|0,0,1]=3 71 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM10752 [0,1,0,0,0,1|0,0,1]=3 72 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM11518 [0,1,0,0,0,1|0,0,1]=3 73 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 AM11460 [0,1,0,0,0,1|1,0,1]=4 74 B10R1.113 CC1=CC(C(=O)O)=CN=C1 AM11349 [0,1,0,0,0,1|1,0,1]=4 75 B10R1.113 CC1=CC(C(=O)O)=NC=C1 AM11044 [0,1,0,0,0,1|1,0,1]=4 76 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11389 [0,1,0,0,0,1|1,0,1]=4 77 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11767 [0,1,0,0,0,1|1,0,1]=4 78 B10R1.113 CC1=NC=CC(C(=O)O)=C1 AM11438 [0,1,0,0,0,1|2,0,0]=4 79 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 AM10394 [0,1,0,0,0,1|2,0,0]=4 80 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 AM11534 [0,1,0,0,0,1|2,0,0]=4 81 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AM11304 [0,1,0,0,0,1|1,0,1]=4 82 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 AM10392 [0,1,0,0,0,1|1,0,1]=4 83 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AM11223 [0,1,0,0,0,1|1,0,1]=4 84 B10R1.113 NC(=O)c1cccc(I)n1 AM10580 [0,1,0,0,0,1|1,0,1]=4 85 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AM11265 [0,1,0,0,0,1|1,0,1]=4 86 B10R1.113 NC1=CC(C(=O)O)=NC=C1 AM11205 [0,1,0,0,0,1|1,0,1]=4 87 B10R1.113 NC1=CC=CC(C(=O)O)=N1 AM11361 [0,1,0,0,0,1|1,0,1]=4 88 B10R1.113 NC1=NC=CC(C(=O)O)=C1 AM10825 [0,1,0,0,0,1|2,0,0]=4 89 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM10057 [0,1,0,0,0,1|2,0,0]=4 90 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM11538 [0,1,0,0,0,1|2,0,0]=4 91 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 AM10440 [0,1,0,0,0,1|2,0,0]=4 92 B10R1.113 O=C(O)C1=CC(F)=NC=C1 AM10123 [0,1,0,0,0,1|2,0,0]=4 93 B10R1.113 O=C(O)C1=CC(O)=CN=C1 AM11028 [0,1,0,0,0,1|1,0,1]=4 94 B10R1.113 O=C(O)C1=CC(O)=NC=C1 AM11073 [0,1,0,0,0,1|2,0,0]=4 95 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AM11307 [0,1,0,0,0,1|1,0,1]=4 96 B10R1.113 O=C(O)C1=CN=CC(F)=C1 AM10470 [0,1,0,0,0,1|1,0,1]=4 97 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AM11342 [0,1,0,0,0,1|1,0,1]=4 98 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 AM10181 [0,1,0,0,0,1|1,0,1]=4 99 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 AM10028 [0,1,0,0,0,1|1,0,1]=4 100 B10R1.113 O=C(O)C1=NC(F)=CC=C1 AM10065 [0,1,0,0,0,1|1,0,1]=4 101 B10R1.113 O=C(O)C1=NC(I)=CC=C1 AM11384 [0,1,0,0,0,1|1,0,1]=4 102 B10R1.113 O=C(O)C1=NC(O)=CC=C1 AM11380 [0,1,0,0,0,1|1,0,1]=4 103 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AM10199 [0,1,0,0,0,1|1,0,1]=4 104 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AM11224 [0,1,0,0,0,1|1,0,1]=4 105 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AM11237 [0,1,0,0,0,1|1,0,1]=4 106 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AM11234 [0,1,0,0,0,1|1,0,1]=4 107 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 AM11849 [0,1,0,0,0,1|1,0,1]=4 108 B8R1.4 CC1=CC(N)=NC=C1 AM10960 [0,0,1,1,0,0|2,0,0]=4 109 B8R1.4 CC1=CC=CC(Br)=N1 AM10143 [0,0,1,1,0,0|2,0,0]=4 110 B8R1.4 CC1=CC=CC(C)=N1 AM11014 [0,0,1,1,0,0|2,0,0]=4 111 B8R1.4 CC1=CC=CC(Cl)=N1 AM10106 [0,0,1,1,0,0|2,0,0]=4 112 B8R1.4 CC1=CC=CC(F)=N1 AM10090 [0,0,1,1,0,0|2,0,0]=4 113 B8R1.4 CC1=CN=CC(N)=C1 AM10058 [0,0,1,1,0,0|2,0,0]=4 114 B8R1.4 CC1=CN=CC(N)=C1 AM11123 [0,0,1,1,0,0|2,0,0]=4 115 B8R1.4 CC1=NC=CC(N)=C1 AM10004 [0,0,1,1,0,0|2,0,0]=4 116 B8R1.4 NC1=CC=CC(N)=N1 AM10451 [0,0,1,1,0,0|2,0,0]=4 117 B8R1.4 NC1=NC(Br)=CC=C1 AM10092 [0,0,1,1,0,0|2,0,0]=4 118 B8R1.4 NC1=NC(Cl)=CC=C1 AM10078 [0,0,1,1,0,0|2,0,0]=4 119 B8R1.4 NC1=NC(F)=CC=C1 AM10946 [0,0,1,1,0,0|2,0,0]=4 120 B8R1.5 CC1=C(N)C=NC=C1 AM10686 [0,0,1,1,0,0|2,0,0]=4 121 B8R1.5 CC1=CC=CN=C1N AM10959 [0,0,1,1,0,0|2,0,0]=4 122 B8R1.5 CC1=NC=CC=C1Br AM10287 [0,0,1,1,0,0|2,0,0]=4 123 B8R1.5 CC1=NC=CC=C1Cl AM11157 [0,0,1,1,0,0|2,0,0]=4 124 B8R1.5 CC1=NC=CC=C1F AM10262 [0,0,1,1,0,0|2,0,0]=4 125 B8R1.5 CC1=NC=CC=C1I AM11175 [0,0,1,1,0,0|2,0,0]=4 126 B8R1.5 CC1=NC=CC=C1N AM10112 [0,0,1,1,0,0|1,0,0]=3 127 B8R1.5 CC1=NC=CC=C1O AM10696 [0,0,1,1,0,0|2,0,0]=4 128 B8R1.5 NC1=CC=CN=C1Br AM10542 [0,0,1,1,0,0|2,0,0]=4 129 B8R1.5 NC1=CC=CN=C1Cl AM10270 [0,0,1,1,0,0|2,0,0]=4 130 B8R1.5 NC1=CC=CN=C1F AM10208 [0,0,1,1,0,0|2,0,0]=4 131 B8R1.5 NC1=CC=CN=C1I AM11117 [0,0,1,1,0,0|2,0,0]=4 132 B8R1.5 NC1=CC=CN=C1O AM10432 [0,0,1,1,0,0|1,0,1]=4 133 B8R1.5 NC1=CC=CN=C1O AM10634 [0,0,1,1,0,0|1,0,1]=4 134 B8R1.2 CNC1=CC=NC=C1 AM11030 [1,0,0,0,0,1|2,0,0]=4 135 B8R1.2 COC1=CC=NC=C1 AM10079 [1,0,0,0,0,1|2,0,0]=4 136 B8R1.2 COC1=NC=CC=C1 AM10305 [1,0,0,0,0,1|1,0,1]=4 137 B8R1.2 CSC1=NC=CC=C1 AM11046 [1,0,0,0,0,1|1,0,1]=4 138 B10R1.18 O=C(O)CC1=CC=NC=C1 AM11048 [0,0,0,0,0,2|2,0,0]=4 139 B10R1.18 O=C(O)CC1=NC=CC=C1 AM11047 [0,0,0,0,0,2|1,0,1]=4