0 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 AM10561 [0,0,0,0,0,1|2,1,0]=4 1 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AM11101 [0,0,0,0,0,1|2,0,0]=3 2 B10R1.13 CC(=O)C1=CN=C(C)C=C1 AM10774 [0,0,0,0,0,1|3,0,0]=4 3 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AM10819 [0,0,0,0,0,1|3,0,0]=4 4 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 AM10818 [0,0,0,0,0,1|2,0,0]=3 5 B10R1.13 CC1=CN=C(C(=O)O)C=C1 AM11347 [0,0,0,0,0,1|2,0,0]=3 6 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AM10338 [0,0,0,0,0,1|3,0,0]=4 7 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AM11365 [0,0,0,0,0,1|2,1,0]=4 8 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AM11375 [0,0,0,0,0,1|2,0,0]=3 9 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 AM10978 [0,0,0,0,0,1|2,1,0]=4 10 B10R1.13 NC(=O)C1=NC=C(N)C=C1 AM11545 [0,0,0,0,0,1|3,0,0]=4 11 B10R1.13 NC(=O)C1=NC=C(O)C=C1 AM11776 [0,0,0,0,0,1|3,0,0]=4 12 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11266 [0,0,0,0,0,1|2,0,0]=3 13 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AM11510 [0,0,0,0,0,1|2,0,0]=3 14 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AM11360 [0,0,0,0,0,1|2,0,0]=3 15 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 AM11376 [0,0,0,0,0,1|2,0,0]=3 16 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 AM10062 [0,0,0,0,0,1|1,1,0]=3 17 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AM10442 [0,0,0,0,0,1|1,0,0]=2 18 B10R1.13 O=C(O)C1=CN=C(F)C=C1 AM10117 [0,0,0,0,0,1|1,1,0]=3 19 B10R1.13 O=C(O)C1=CN=C(O)C=C1 AM10755 [0,0,0,0,0,1|2,0,0]=3 20 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 AM10459 [0,0,0,0,0,1|1,1,0]=3 21 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 AM11322 [0,0,0,0,0,1|1,0,0]=2 22 B10R1.13 O=C(O)C1=NC=C(F)C=C1 AM11332 [0,0,0,0,0,1|1,1,0]=3 23 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AM11340 [0,0,0,0,0,1|2,0,0]=3 24 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 AM10947 [0,0,0,0,0,1|2,0,1]=4 25 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 AM10734 [0,0,0,0,0,1|2,0,1]=4 26 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AM10684 [0,0,0,0,0,1|2,1,0]=4 27 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AM10593 [0,0,0,0,0,1|2,0,0]=3 28 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AM10820 [0,0,0,0,0,1|2,1,0]=4 29 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM10752 [0,0,0,0,0,1|3,0,0]=4 30 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AM11518 [0,0,0,0,0,1|3,0,0]=4 31 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 AM11460 [0,0,0,0,0,1|3,0,0]=4 32 B10R1.113 CC1=CC(C(=O)O)=CN=C1 AM11349 [0,0,0,0,0,1|2,0,0]=3 33 B10R1.113 CC1=CC(C(=O)O)=NC=C1 AM11044 [0,0,0,0,0,1|2,0,0]=3 34 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11389 [0,0,0,0,0,1|2,0,0]=3 35 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AM11767 [0,0,0,0,0,1|2,0,0]=3 36 B10R1.113 CC1=NC=CC(C(=O)O)=C1 AM11438 [0,0,0,0,0,1|2,0,0]=3 37 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 AM10394 [0,0,0,0,0,1|2,1,0]=4 38 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 AM11534 [0,0,0,0,0,1|2,0,0]=3 39 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AM11304 [0,0,0,0,0,1|2,1,0]=4 40 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 AM10392 [0,0,0,0,0,1|2,1,0]=4 41 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AM11223 [0,0,0,0,0,1|2,0,0]=3 42 B10R1.113 NC(=O)c1cccc(I)n1 AM10580 [0,0,0,0,0,1|2,1,0]=4 43 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AM11265 [0,0,0,0,0,1|2,0,0]=3 44 B10R1.113 NC1=CC(C(=O)O)=NC=C1 AM11205 [0,0,0,0,0,1|2,0,0]=3 45 B10R1.113 NC1=CC=CC(C(=O)O)=N1 AM11361 [0,0,0,0,0,1|2,0,0]=3 46 B10R1.113 NC1=NC=CC(C(=O)O)=C1 AM10825 [0,0,0,0,0,1|2,0,0]=3 47 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM10057 [0,0,0,0,0,1|1,1,0]=3 48 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 AM11538 [0,0,0,0,0,1|1,1,0]=3 49 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 AM10440 [0,0,0,0,0,1|1,0,0]=2 50 B10R1.113 O=C(O)C1=CC(F)=NC=C1 AM10123 [0,0,0,0,0,1|1,1,0]=3 51 B10R1.113 O=C(O)C1=CC(O)=CN=C1 AM11028 [0,0,0,0,0,1|2,0,0]=3 52 B10R1.113 O=C(O)C1=CC(O)=NC=C1 AM11073 [0,0,0,0,0,1|2,0,0]=3 53 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AM11307 [0,0,0,0,0,1|1,0,0]=2 54 B10R1.113 O=C(O)C1=CN=CC(F)=C1 AM10470 [0,0,0,0,0,1|1,1,0]=3 55 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AM11342 [0,0,0,0,0,1|1,1,0]=3 56 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 AM10181 [0,0,0,0,0,1|1,1,0]=3 57 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 AM10028 [0,0,0,0,0,1|1,0,0]=2 58 B10R1.113 O=C(O)C1=NC(F)=CC=C1 AM10065 [0,0,0,0,0,1|1,1,0]=3 59 B10R1.113 O=C(O)C1=NC(I)=CC=C1 AM11384 [0,0,0,0,0,1|1,1,0]=3 60 B10R1.113 O=C(O)C1=NC(O)=CC=C1 AM11380 [0,0,0,0,0,1|2,0,0]=3 61 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AM10199 [0,0,0,0,0,1|1,1,0]=3 62 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AM11224 [0,0,0,0,0,1|1,0,0]=2 63 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AM11237 [0,0,0,0,0,1|1,1,0]=3 64 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AM11234 [0,0,0,0,0,1|2,0,0]=3 65 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 AM11849 [0,0,0,0,0,1|1,1,1]=4 66 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 AM10015 [0,0,0,0,0,1|2,0,1]=4 67 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 AM11711 [0,0,0,0,0,1|2,0,1]=4 68 B10R1.113 O=[N+]([O-])C1=NC=CC(Cl)=C1 AM10721 [0,0,0,0,0,1|2,0,1]=4 69 B11R1.3 COC1=CN=C(C(=O)O)C=C1 AM11345 [0,1,0,0,0,1|2,0,0]=4 70 B11R1.3 COC1=NC=C(C(=O)O)C=C1 AM11437 [0,1,0,0,0,1|2,0,0]=4 71 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 AM11763 [0,1,0,0,0,1|2,0,0]=4 72 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 AM10738 [0,1,0,0,0,1|2,0,0]=4 73 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)N=C1 AM11378 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.21 CC(=O)C1=CN=C(Cl)C(Cl)=C1 AM11257 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.21 CC1=CC(C(=O)O)=CN=C1F AM10515 [0,1,0,0,0,1|1,1,0]=4 76 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 AM11758 [0,1,0,0,0,1|1,0,0]=3 77 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 AM10212 [0,1,0,0,0,1|1,1,0]=4 78 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AM11299 [0,1,0,0,0,1|1,0,0]=3 79 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 AM10025 [0,1,0,0,0,1|1,0,0]=3 80 B11R1.21 O=C(O)C1=CN=C(O)C(Br)=C1 AM11302 [0,1,0,0,0,1|2,0,0]=4 81 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 AM10754 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.21 O=C(O)C1=NC=C(F)C(Cl)=C1 AM11770 [0,1,0,0,0,1|1,1,0]=4 83 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 AM10066 [0,1,0,0,0,1|1,1,0]=4 84 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 AM11430 [0,1,0,0,0,1|1,0,0]=3 85 B11R1.22 COC(=O)C1=CN=C(I)C=C1 AM11471 [0,1,0,0,0,1|1,1,0]=4 86 B11R1.22 COC(=O)C1=CN=C(N)C=C1 AM11427 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.22 COC(=O)C1=CN=C(O)C=C1 AM11431 [0,1,0,0,0,1|2,0,0]=4 88 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 AM10311 [0,1,0,0,0,1|1,1,0]=4 89 B11R1.22 COC(=O)C1=NC=C(N)C=C1 AM11583 [0,1,0,0,0,1|2,0,0]=4 90 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 AM11752 [0,1,0,0,0,1|1,1,0]=4 91 B11R1.166 CC1=C(C(=O)O)C=CC(N)=N1 AM11356 [0,1,0,0,0,1|2,0,0]=4 92 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O AM11550 [0,1,0,0,0,1|1,1,0]=4 93 B11R1.166 CC1=CC(F)=NC=C1C(=O)O AM10482 [0,1,0,0,0,1|1,1,0]=4 94 B11R1.166 CC1=CC(N)=NC=C1C(=O)O AM10531 [0,1,0,0,0,1|2,0,0]=4 95 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 AM10519 [0,1,0,0,0,1|2,0,0]=4 96 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 AM10385 [0,1,0,0,0,1|2,0,0]=4 97 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1N AM11595 [0,1,0,0,0,1|2,0,0]=4 98 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O AM11576 [0,1,0,0,0,1|1,1,0]=4 99 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 AM11480 [0,1,0,0,0,1|1,0,0]=3 100 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AM10154 [0,1,0,0,0,1|1,0,0]=3 101 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br AM11094 [0,1,0,0,0,1|1,1,0]=4 102 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AM11445 [0,1,0,0,0,1|1,1,0]=4 103 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AM11444 [0,1,0,0,0,1|1,0,0]=3 104 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl AM11096 [0,1,0,0,0,1|1,0,0]=3 105 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 AM10452 [0,1,0,0,0,1|2,0,0]=4 106 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 AM10076 [0,1,0,0,0,1|1,1,0]=4 107 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 AM11608 [0,1,0,0,0,1|1,0,0]=3 108 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 AM11403 [0,1,0,0,0,1|1,0,0]=3 109 B11R1.23 COC(=O)C1=CC(N)=NC=C1 AM10842 [0,1,0,0,0,1|2,0,0]=4 110 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 AM10383 [0,1,0,0,0,1|1,1,0]=4 111 B11R1.23 COC(=O)C1=CN=CC(O)=C1 AM11424 [0,1,0,0,0,1|2,0,0]=4 112 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 AM11429 [0,1,0,0,0,1|1,1,0]=4 113 B11R1.23 COC(=O)C1=NC(Cl)=CC=C1 AM11370 [0,1,0,0,0,1|1,0,0]=3 114 B11R1.23 COC(=O)C1=NC(N)=CC=C1 AM11428 [0,1,0,0,0,1|2,0,0]=4 115 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 AM11411 [0,1,0,0,0,1|1,1,0]=4 116 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AM11227 [0,1,0,0,0,1|1,0,0]=3 117 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AM11413 [0,1,0,0,0,1|1,0,0]=3 118 B11R1.23 COC(=O)C1=NC=CC(I)=C1 AM11414 [0,1,0,0,0,1|1,1,0]=4 119 B11R1.23 COC(=O)C1=NC=CC(N)=C1 AM11582 [0,1,0,0,0,1|2,0,0]=4 120 B11R1.23 COC(=O)c1cccc(I)n1 AM10563 [0,1,0,0,0,1|1,1,0]=4 121 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 AM11225 [0,1,0,0,0,1|2,0,0]=4 122 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 AM11453 [0,1,0,0,0,1|1,0,0]=3 123 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 AM11004 [0,1,0,0,0,1|2,0,0]=4 124 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 AM10802 [0,1,0,0,0,1|1,1,0]=4 125 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 AM10439 [0,1,0,0,0,1|1,0,0]=3 126 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 AM11008 [0,1,0,0,0,1|2,0,0]=4 127 B11R1.155 O=S(=O)(O)C1=NC(Cl)=CC=C1 AM11377 [0,1,0,0,0,1|2,0,0]=4 128 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 AM11111 [0,1,0,0,0,1|2,0,0]=4 129 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 AM11757 [0,1,0,0,0,1|1,1,0]=4 130 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 AM11483 [0,1,0,0,0,1|1,0,0]=3 131 B11R1.159 O=C(O)C1=C(F)C(I)=NC=C1 AM11167 [0,1,0,0,0,1|1,1,0]=4 132 B11R1.159 O=C(O)C1=C(I)C(Br)=CN=C1 AM11620 [0,1,0,0,0,1|1,1,0]=4 133 B11R1.159 O=C(O)C1=C(I)C(Br)=NC=C1 AM10884 [0,1,0,0,0,1|1,1,0]=4 134 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl AM11547 [0,1,0,0,0,1|1,0,0]=3 135 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 AM10376 [0,1,0,0,0,1|2,0,0]=4 136 B11R1.167 CC1=NC=C(I)C=C1C(=O)O AM11621 [0,1,0,0,0,1|1,1,0]=4 137 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 AM11456 [0,1,0,0,0,1|2,0,0]=4 138 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 AM10532 [0,1,0,0,0,1|1,1,0]=4 139 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 AM11357 [0,1,0,0,0,1|2,0,0]=4 140 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O AM11772 [0,1,0,0,0,1|1,1,0]=4 141 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O AM11526 [0,1,0,0,0,1|1,0,0]=3 142 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 AM11452 [0,1,0,0,0,1|2,0,0]=4 143 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O AM11262 [0,1,0,0,0,1|1,0,0]=3 144 B11R1.167 NC1=CN=C(F)C=C1C(=O)O AM11727 [0,1,0,0,0,1|1,1,0]=4 145 B11R1.167 NC1=NC=C(Br)C(C(=O)O)=C1 AM10843 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 AM11271 [0,1,0,0,0,1|1,1,0]=4 147 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AM10920 [0,1,0,0,0,1|1,1,0]=4 148 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 AM11278 [0,1,0,0,0,1|1,1,0]=4 149 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 AM11314 [0,1,0,0,0,1|1,0,0]=3 150 B11R1.167 O=C(O)C1=C(O)N=CC(I)=C1 AM11077 [0,1,0,0,0,1|1,1,0]=4 151 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br AM11501 [0,1,0,0,0,1|1,1,0]=4 152 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl AM11759 [0,1,0,0,0,1|1,1,0]=4 153 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F AM10896 [0,1,0,0,0,1|1,1,0]=4 154 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F AM11312 [0,1,0,0,0,1|1,0,0]=3 155 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Br AM11270 [0,1,0,0,0,1|1,0,0]=3 156 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl AM10460 [0,1,0,0,0,1|1,0,0]=3 157 B11R1.167 O=C(O)C1=CC(O)=NC=C1Br AM11277 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br AM11682 [0,1,0,0,0,1|1,1,0]=4 159 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br AM11148 [0,1,0,0,0,1|1,0,0]=3 160 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl AM10454 [0,1,0,0,0,1|1,0,0]=3 161 B11R1.266 COC1=CC(C(=O)O)=NC=C1 AM11244 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.266 COC1=CC=CC(C(=O)O)=N1 AM11386 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.266 N#CC1=NC=CC(C(=O)O)=C1 AM11479 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.266 NNC1=CN=CC(C(=O)O)=C1 AM11334 [0,1,0,0,0,1|2,0,0]=4 165 B9R1.6 O=C(O)C1=CC=CN=C1 AM11050 [0,0,1,1,0,0|2,0,0]=4 166 B9R1.6 O=C(O)C1=NC=CC=C1 AM11049 [0,0,1,1,0,0|2,0,0]=4 167 B9R1.2 CC1=CC=CC(C=O)=N1 AM11043 [1,0,0,0,0,1|2,0,0]=4 168 B9R1.2 CC1=CN=CC(C=O)=C1 AM11535 [1,0,0,0,0,1|2,0,0]=4 169 B9R1.2 O=CC1=CC(Br)=CN=C1 AM11540 [1,0,0,0,0,1|1,1,0]=4 170 B9R1.2 O=CC1=CC(Br)=NC=C1 AM10976 [1,0,0,0,0,1|1,1,0]=4 171 B9R1.2 O=CC1=CC(Cl)=CN=C1 AM11541 [1,0,0,0,0,1|1,0,0]=3 172 B9R1.2 O=CC1=CC(Cl)=NC=C1 AM11536 [1,0,0,0,0,1|1,0,0]=3