0 B13R2.369 Brc1[n]c2ccccc2[n]c1Br Amb24121534 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.369 Brc1cc2cc[n]cc2cc1Br Amb25674114 [0,0,0,0,0,0|4,0,0]=4 2 B13R2.369 Brc1cc2ccc[n]c2cc1Br Amb25744078 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.369 Brc1cc2ccc[n]c2cc1I Amb24686218 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.369 Brc1cc2ccccc2[n]c1I Amb24483630 [0,0,0,0,0,0|3,0,0]=3 5 B13R2.369 Brc1cc2ccccc2cc1I Amb13883628 [0,0,0,0,0,0|3,0,0]=3 6 B13R2.369 Brc1cc2ccccc2nc1Cl Amb10606855 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.369 Brc1cc2ccccc2nc1O Amb10608236 [0,0,0,0,0,0|2,0,1]=3 8 B13R2.369 Brc1cc2cccnc2nc1O Amb13881381 [0,0,0,0,0,0|3,0,1]=4 9 B13R2.369 Brc1cc2ncccc2nc1Br Amb17912720 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.369 C=C1Cc2ccccc2NC1=O Amb25263953 [0,0,0,0,0,0|2,0,1]=3 11 B13R2.369 CC1=Cc2ccc[n]c2NC1=O Amb22497900 [0,0,0,0,0,0|3,0,0]=3 12 B13R2.369 CC1=Cc2ccc[n]c2SC1=O Amb25066905 [0,0,0,0,0,0|2,1,0]=3 13 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,0,0,0,0,0|2,0,0]=2 14 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,0,0,0,0,0|1,0,0]=1 15 B13R2.369 CC1=Nc2c[n]ccc2NC1=O Amb23597033 [0,0,0,0,0,0|4,0,0]=4 16 B13R2.369 CC1=Nc2cc[n]cc2NC1=O Amb23597005 [0,0,0,0,0,0|4,0,0]=4 17 B13R2.369 CC1=Nc2ccc[n]c2NC1=O Amb19373141 [0,0,0,0,0,0|4,0,0]=4 18 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,0,0,0,0,0|3,0,0]=3 19 B13R2.369 CC1=Nc2ccccc2NC1=S Amb18043495 [0,0,0,0,0,0|3,1,0]=4 20 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,0,0,0,0,0|2,0,1]=3 21 B13R2.369 CC1Cc2ccccc2OC1=O Amb24484179 [0,0,0,0,0,0|1,0,2]=3 22 B13R2.369 CC1N=C2C=CC=CC2=CC1=O Amb24061572 [0,0,0,0,0,0|2,0,2]=4 23 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,0,0,0,0,0|3,0,1]=4 24 B13R2.369 CC1Oc2ccccc2CC1=O Amb24583554 [0,0,0,0,0,0|1,0,3]=4 25 B13R2.369 CC1Oc2ccccc2N=C1Cl Amb18118342 [0,0,0,0,0,0|3,0,1]=4 26 B13R2.369 CC1Oc2ccccc2NC1=S Amb24594293 [0,0,0,0,0,0|2,1,1]=4 27 B13R2.369 CC=1Nc2ccccc2NC1C Amb24101599 [0,0,0,0,0,0|4,0,0]=4 28 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,0,0,0,0,0|3,0,1]=4 29 B13R2.369 CN1Sc2ccccc2NC1=O Amb25827228 [0,0,0,0,0,0|4,0,0]=4 30 B13R2.369 C[C@@H]1Cc2ccccc2NC1=O Amb25795819 [0,0,0,0,0,0|2,0,2]=4 31 B13R2.369 C[C@@H]1Nc2ccccc2NC1=O Amb24382630 [0,0,0,0,0,0|3,0,1]=4 32 B13R2.369 C[C@H]1Cc2ccccc2NC1=O Amb25707457 [0,0,0,0,0,0|2,0,2]=4 33 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,0,0,0,0,0|3,0,1]=4 34 B13R2.369 C[C@H]1Nc2ccccc2OC1=O Amb25152544 [0,0,0,0,0,0|2,0,1]=3 35 B13R2.369 Cc1[n]c2[n]cccc2cc1O Amb25359913 [0,0,0,0,0,0|3,0,0]=3 36 B13R2.369 Cc1[n]c2c[n]ccc2cc1O Amb25231988 [0,0,0,0,0,0|3,0,0]=3 37 B13R2.369 Cc1[n]c2cc[n]cc2cc1N Amb23441222 [0,0,0,0,0,0|4,0,0]=4 38 B13R2.369 Cc1[n]c2cc[n]cc2cc1O Amb24692629 [0,0,0,0,0,0|3,0,0]=3 39 B13R2.369 Cc1[n]c2ccccc2[n]c1Br Amb19374379 [0,0,0,0,0,0|4,0,0]=4 40 B13R2.369 Cc1[n]c2ccccc2[n]c1F Amb24084182 [0,0,0,0,0,0|4,0,0]=4 41 B13R2.369 Cc1[n]c2ccccc2[n]c1I Amb24398458 [0,0,0,0,0,0|4,0,0]=4 42 B13R2.369 Cc1[n]c2ccccc2cc1Cl Amb22235665 [0,0,0,0,0,0|3,0,0]=3 43 B13R2.369 Cc1[n]c2ccccc2cc1N Amb18062093 [0,0,0,0,0,0|3,0,0]=3 44 B13R2.369 Cc1[n]c2ccccc2cc1N Amb20239532 [0,0,0,0,0,0|3,0,0]=3 45 B13R2.369 Cc1cc2[n]c[n]cc2cc1O Amb24092208 [0,0,0,0,0,0|4,0,0]=4 46 B13R2.369 Cc1cc2[n]cccc2cc1Br Amb21858684 [0,0,0,0,0,0|4,0,0]=4 47 B13R2.369 Cc1cc2[n]cccc2cc1F Amb23504855 [0,0,0,0,0,0|4,0,0]=4 48 B13R2.369 Cc1cc2[n]cccc2cc1O Amb18645152 [0,0,0,0,0,0|3,0,0]=3 49 B13R2.369 Cc1cc2c[n]ccc2[n]c1N Amb25373980 [0,0,0,0,0,0|4,0,0]=4 50 B13R2.369 Cc1cc2c[n]ccc2cc1F Amb24485443 [0,0,0,0,0,0|4,0,0]=4 51 B13R2.369 Cc1cc2c[n]ccc2cc1O Amb21963927 [0,0,0,0,0,0|3,0,0]=3 52 B13R2.369 Cc1cc2cc[n]cc2[n]c1C Amb25152409 [0,0,0,0,0,0|4,0,0]=4 53 B13R2.369 Cc1cc2ccc[n]c2[n]c1Cl Amb22497901 [0,0,0,0,0,0|4,0,0]=4 54 B13R2.369 Cc1cc2ccc[n]c2cc1C Amb24309324 [0,0,0,0,0,0|4,0,0]=4 55 B13R2.369 Cc1cc2ccc[n]c2cc1Cl Amb22276931 [0,0,0,0,0,0|4,0,0]=4 56 B13R2.369 Cc1cc2ccc[n]c2cc1F Amb24074018 [0,0,0,0,0,0|4,0,0]=4 57 B13R2.369 Cc1cc2ccc[n]c2cc1N Amb24091881 [0,0,0,0,0,0|4,0,0]=4 58 B13R2.369 Cc1cc2ccc[n]c2cc1O Amb18645153 [0,0,0,0,0,0|3,0,0]=3 59 B13R2.369 Cc1cc2cccc[n+]2cc1C Amb25289018 [0,0,0,0,0,0|4,0,0]=4 60 B13R2.369 Cc1cc2ccccc2c[n+]1C Amb10573297 [0,0,0,0,0,0|4,0,0]=4 61 B13R2.369 Cc1cc2ccccc2c[n+]1C Amb10573311 [0,0,0,0,0,0|4,0,0]=4 62 B13R2.369 Cc1cc2ccccc2cc1Br Amb22228668 [0,0,0,0,0,0|3,0,0]=3 63 B13R2.369 Cc1cc2ccccc2cc1Cl Amb24408885 [0,0,0,0,0,0|3,0,0]=3 64 B13R2.369 Cc1cc2ccccc2cc1F Amb24484265 [0,0,0,0,0,0|3,0,0]=3 65 B13R2.369 Cc1cc2ccccc2cc1N Amb22751118 [0,0,0,0,0,0|3,0,0]=3 66 B13R2.369 Cc1cc2ccccc2cc1O Amb22262990 [0,0,0,0,0,0|2,0,0]=2 67 B13R2.369 Cc1cc2ccccc2nc1C Amb2411347 [0,0,0,0,0,0|3,0,0]=3 68 B13R2.369 Cc1cc2ccccc2nc1Cl Amb2447526 [0,0,0,0,0,0|3,0,0]=3 69 B13R2.369 Cc1cc2ccccc2nc1N Amb1994301 [0,0,0,0,0,0|3,0,0]=3 70 B13R2.369 Cc1cc2ncccc2nc1Br Amb10879381 [0,0,0,0,0,0|4,0,0]=4 71 B13R2.369 Clc1cc2[n]cccc2cc1Br Amb21858687 [0,0,0,0,0,0|4,0,0]=4 72 B13R2.369 Clc1cc2cc[n]cc2cc1Cl Amb23589877 [0,0,0,0,0,0|4,0,0]=4 73 B13R2.369 Clc1cc2ccc[n]c2[n]c1Br Amb22751899 [0,0,0,0,0,0|4,0,0]=4 74 B13R2.369 Clc1cc2ccc[n]c2cc1Cl Amb21964466 [0,0,0,0,0,0|4,0,0]=4 75 B13R2.369 Clc1cc2ccccc2[n]c1Br Amb21857269 [0,0,0,0,0,0|3,0,0]=3 76 B13R2.369 Clc1cc2ccccc2[n]c1Cl Amb19958556 [0,0,0,0,0,0|3,0,0]=3 77 B13R2.369 Clc1cc2ccccc2cc1Cl Amb22730503 [0,0,0,0,0,0|3,0,0]=3 78 B13R2.369 Clc1cc2ccccc2cc1I Amb24483314 [0,0,0,0,0,0|3,0,0]=3 79 B13R2.369 Clc1cc2cccnc2cc1C Amb17610985 [0,0,0,0,0,0|4,0,0]=4 80 B13R2.369 Clc1nc2ccccc2nc1Cl Amb1157547 [0,0,0,0,0,0|4,0,0]=4 81 B13R2.369 Fc1[n]c2ccccc2[n]c1F Amb24065287 [0,0,0,0,0,0|4,0,0]=4 82 B13R2.369 Fc1cc2[n]cccc2cc1Br Amb18548688 [0,0,0,0,0,0|4,0,0]=4 83 B13R2.369 Fc1cc2c[n]ccc2cc1Br Amb23439691 [0,0,0,0,0,0|4,0,0]=4 84 B13R2.369 Fc1cc2cc[n]cc2cc1Br Amb22235927 [0,0,0,0,0,0|4,0,0]=4 85 B13R2.369 Fc1cc2cc[n]cc2cc1Cl Amb22410838 [0,0,0,0,0,0|4,0,0]=4 86 B13R2.369 Fc1cc2ccccc2[n]c1Br Amb22547372 [0,0,0,0,0,0|3,0,0]=3 87 B13R2.369 Fc1cc2ccccc2[n]c1I Amb25797787 [0,0,0,0,0,0|3,0,0]=3 88 B13R2.369 Fc1cc2ccccc2cc1Br Amb25351655 [0,0,0,0,0,0|3,0,0]=3 89 B13R2.369 Fc1cc2ccccc2cc1Cl Amb24606517 [0,0,0,0,0,0|3,0,0]=3 90 B13R2.369 Fc1cc2ccccc2cc1F Amb25100177 [0,0,0,0,0,0|3,0,0]=3 91 B13R2.369 Fc1cc2cnccc2cc1C Amb10603927 [0,0,0,0,0,0|4,0,0]=4 92 B13R2.369 Ic1cc2ccccc2cc1I Amb21954221 [0,0,0,0,0,0|3,0,0]=3 93 B13R2.369 Ic1cc2ccccc2nc1Cl Amb10602052 [0,0,0,0,0,0|3,0,0]=3 94 B13R2.369 N=C1Nc2ccccc2NC1=O Amb19804517 [0,0,0,0,0,0|3,0,0]=3 95 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,0,0,0,0,0|2,0,0]=2 96 B13R2.369 NC1=Cc2ccccc2NC1=O Amb18563072 [0,0,0,0,0,0|2,0,0]=2 97 B13R2.369 NC1=Cc2ccccc2NC1=S Amb24373878 [0,0,0,0,0,0|2,1,0]=3 98 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,0,0,0,0,0|1,0,0]=1 99 B13R2.369 NC1=Nc2ccc[n]c2NC1=O Amb25106877 [0,0,0,0,0,0|4,0,0]=4 100 B13R2.369 NC1=Nc2ccccc2OC1=N Amb25373848 [0,0,0,0,0,0|3,0,0]=3 101 B13R2.369 NC1=Nc2ccccc2OC1=O Amb18645599 [0,0,0,0,0,0|2,0,0]=2 102 B13R2.369 NC1=Nc2ccccc2SC1=O Amb25150924 [0,0,0,0,0,0|2,1,0]=3 103 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,0,0,0,0,0|1,0,2]=3 104 B13R2.369 NC1Nc2ccccc2NC1=O Amb24085791 [0,0,0,0,0,0|3,0,1]=4 105 B13R2.369 NN1Cc2ccccc2CC1=O Amb18645670 [0,0,0,0,0,0|3,0,1]=4 106 B13R2.369 N[C@H]1Cc2ccccc2NC1=O Amb25212947 [0,0,0,0,0,0|2,0,2]=4 107 B13R2.369 N[C@H]1Oc2ccccc2C[C@H]1O Amb25179222 [0,0,0,0,0,0|1,0,3]=4 108 B13R2.369 Nc1[n]c2ccccc2[n]c1Br Amb25195357 [0,0,0,0,0,0|4,0,0]=4 109 B13R2.369 Nc1[n]c2ccccc2[n]c1S Amb18648058 [0,0,0,0,0,0|3,1,0]=4 110 B13R2.369 Nc1[n]c2ccccc2cc1Br Amb21962044 [0,0,0,0,0,0|3,0,0]=3 111 B13R2.369 Nc1[n]c2ccccc2cc1Cl Amb22233882 [0,0,0,0,0,0|3,0,0]=3 112 B13R2.369 Nc1[n]c2ccccc2cc1F Amb25800913 [0,0,0,0,0,0|3,0,0]=3 113 B13R2.369 Nc1cc2[n]cccc2[n]c1N Amb18645346 [0,0,0,0,0,0|4,0,0]=4 114 B13R2.369 Nc1cc2[n]cccc2cc1Cl Amb21858706 [0,0,0,0,0,0|4,0,0]=4 115 B13R2.369 Nc1cc2cc[n]cc2cc1Br Amb24667746 [0,0,0,0,0,0|4,0,0]=4 116 B13R2.369 Nc1cc2cc[n]cc2cc1Cl Amb18824789 [0,0,0,0,0,0|4,0,0]=4 117 B13R2.369 Nc1cc2cc[n]cc2cc1F Amb18829767 [0,0,0,0,0,0|4,0,0]=4 118 B13R2.369 Nc1cc2cc[n]cc2cc1O Amb18830217 [0,0,0,0,0,0|3,0,0]=3 119 B13R2.369 Nc1cc2ccc[n]c2[n]c1N Amb21811362 [0,0,0,0,0,0|4,0,0]=4 120 B13R2.369 Nc1cc2ccc[n]c2cc1Br Amb24092032 [0,0,0,0,0,0|4,0,0]=4 121 B13R2.369 Nc1cc2ccc[n]c2cc1Cl Amb24601767 [0,0,0,0,0,0|4,0,0]=4 122 B13R2.369 Nc1cc2ccc[n]c2cc1N Amb24081523 [0,0,0,0,0,0|4,0,0]=4 123 B13R2.369 Nc1cc2ccccc2[n]c1Br Amb22499505 [0,0,0,0,0,0|3,0,0]=3 124 B13R2.369 Nc1cc2ccccc2[n]c1Cl Amb22263229 [0,0,0,0,0,0|3,0,0]=3 125 B13R2.369 Nc1cc2ccccc2[n]c1Cl Amb22757378 [0,0,0,0,0,0|3,0,0]=3 126 B13R2.369 Nc1cc2ccccc2[n]c1N Amb18645201 [0,0,0,0,0,0|3,0,0]=3 127 B13R2.369 Nc1cc2ccccc2[n]c1O Amb18645300 [0,0,0,0,0,0|2,0,1]=3 128 B13R2.369 Nc1cc2ccccc2cc1Cl Amb18648080 [0,0,0,0,0,0|3,0,0]=3 129 B13R2.369 Nc1cc2ccccc2cc1I Amb21955955 [0,0,0,0,0,0|3,0,0]=3 130 B13R2.369 Nc1cc2ccccc2cc1S Amb18647915 [0,0,0,0,0,0|2,1,0]=3 131 B13R2.369 Nc1cc2cccnc2nc1Br Amb13881196 [0,0,0,0,0,0|4,0,0]=4 132 B13R2.369 Nc1cc2cccnc2nc1O Amb13881382 [0,0,0,0,0,0|3,0,1]=4 133 B13R2.369 Nc1cc2ncccc2nc1Br Amb13881197 [0,0,0,0,0,0|4,0,0]=4 134 B13R2.369 Nc1nc2ccccc2nc1Cl Amb1149908 [0,0,0,0,0,0|4,0,0]=4 135 B13R2.369 Nc1nc2ccccc2nc1N Amb2518943 [0,0,0,0,0,0|4,0,0]=4 136 B13R2.369 Nc1nc2ccccc2nc1O Amb1086511 [0,0,0,0,0,0|3,0,0]=3 137 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,0,0,0,0,0|2,0,1]=3 138 B13R2.369 O=C1Nc2c[n]ccc2C=C1Br Amb24472517 [0,0,0,0,0,0|3,0,0]=3 139 B13R2.369 O=C1Nc2c[n]ccc2C=C1Cl Amb25675767 [0,0,0,0,0,0|3,0,0]=3 140 B13R2.369 O=C1Nc2c[n]ccc2NC1=O Amb18043122 [0,0,0,0,0,0|3,0,1]=4 141 B13R2.369 O=C1Nc2ccc[n]c2C=C1Br Amb20671324 [0,0,0,0,0,0|3,0,0]=3 142 B13R2.369 O=C1Nc2ccc[n]c2NC1=O Amb19813203 [0,0,0,0,0,0|3,0,1]=4 143 B13R2.369 O=C1Nc2ccccc2C=C1Br Amb20247010 [0,0,0,0,0,0|2,0,0]=2 144 B13R2.369 O=C1Nc2ccccc2C=C1Cl Amb21857147 [0,0,0,0,0,0|2,0,0]=2 145 B13R2.369 O=C1Nc2ccccc2C=C1F Amb22547229 [0,0,0,0,0,0|2,0,0]=2 146 B13R2.369 O=C1Nc2ccccc2C=C1I Amb22263260 [0,0,0,0,0,0|2,0,0]=2 147 B13R2.369 O=C1Nc2ccccc2CC1=O Amb24497058 [0,0,0,0,0,0|1,0,2]=3 148 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,0,0,0,0,0|2,0,2]=4 149 B13R2.369 O=C1Nc2ccccc2CC1C Amb10604462 [0,0,0,0,0,0|2,0,2]=4 150 B13R2.369 O=C1Nc2ccccc2CC1Cl Amb22739973 [0,0,0,0,0,0|2,0,2]=4 151 B13R2.369 O=C1Nc2ccccc2CC1N Amb10975380 [0,0,0,0,0,0|2,0,2]=4 152 B13R2.369 O=C1Nc2ccccc2CC1N Amb2196732 [0,0,0,0,0,0|2,0,2]=4 153 B13R2.369 O=C1Nc2ccccc2N=C1Cl Amb20258737 [0,0,0,0,0,0|3,0,0]=3 154 B13R2.369 O=C1Nc2ccccc2NC1=O Amb18545062 [0,0,0,0,0,0|2,0,1]=3 155 B13R2.369 O=C1Nc2ccccc2NC1=S Amb19654259 [0,0,0,0,0,0|2,1,0]=3 156 B13R2.369 O=C1Nc2ccccc2NC1=S Amb22283802 [0,0,0,0,0,0|2,1,0]=3 157 B13R2.369 O=C1Nc2ccccc2OC1C Amb2568450 [0,0,0,0,0,0|2,0,2]=4 158 B13R2.369 O=C1Nc2ccccc2SC1Cl Amb25751175 [0,0,0,0,0,0|3,0,1]=4 159 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,0,0,0,0,0|1,0,0]=1 160 B13R2.369 O=C1Oc2ccccc2C=C1Cl Amb19517278 [0,0,0,0,0,0|1,0,0]=1 161 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,0,0,0,0,0|1,0,0]=1 162 B13R2.369 O=C1Oc2ccccc2CC1=O Amb22755081 [0,0,0,0,0,0|0,0,2]=2 163 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,0,0,0,0,0|2,0,0]=2 164 B13R2.369 O=C1Oc2ccccc2NC1=O Amb19650977 [0,0,0,0,0,0|1,0,1]=2 165 B13R2.369 O=C1Oc2ccccc2NC1C Amb17217247 [0,0,0,0,0,0|2,0,1]=3 166 B13R2.369 O=C1Oc2ccccc2OC1=O Amb20663468 [0,0,0,0,0,0|1,0,1]=2 167 B13R2.369 O=C1Sc2ccccc2C=C1Br Amb19886583 [0,0,0,0,0,0|1,1,0]=2 168 B13R2.369 O=C1Sc2ccccc2C=C1Cl Amb22347336 [0,0,0,0,0,0|1,1,0]=2 169 B13R2.369 O=C1Sc2ccccc2C=C1F Amb22641706 [0,0,0,0,0,0|1,1,0]=2 170 B13R2.369 O=C1Sc2ccccc2CC1=O Amb24497321 [0,0,0,0,0,0|0,1,2]=3 171 B13R2.369 O=c1[nH]c2ccccc2[nH]c1=O Amb1675756 [0,0,0,0,0,0|2,0,1]=3 172 B13R2.369 O=c1[nH]c2ncccc2[nH]c1=O Amb1040622 [0,0,0,0,0,0|3,0,1]=4 173 B13R2.369 O=c1[nH]c2ncccc2cc1O Amb15692187 [0,0,0,0,0,0|2,0,0]=2 174 B13R2.369 O=c1oc2ccccc2cc1N Amb1967145 [0,0,0,0,0,0|1,0,0]=1 175 B13R2.369 OC1=Cc2[n]c[n]cc2NC1=O Amb24724823 [0,0,0,0,0,0|3,0,0]=3 176 B13R2.369 OC1=Cc2[n]cc[n]c2NC1=O Amb24677014 [0,0,0,0,0,0|3,0,0]=3 177 B13R2.369 OC1=Cc2[n]cccc2NC1=O Amb24417104 [0,0,0,0,0,0|2,0,0]=2 178 B13R2.369 OC1=Cc2c[n]ccc2NC1=O Amb25034645 [0,0,0,0,0,0|2,0,0]=2 179 B13R2.369 OC1=Cc2ccccc2NC1=O Amb20619410 [0,0,0,0,0,0|1,0,0]=1 180 B13R2.369 OC1=Cc2ccccc2NC1=S Amb25119288 [0,0,0,0,0,0|1,1,0]=2 181 B13R2.369 OC1=Cc2ccccc2OC1=O Amb18511465 [0,0,0,0,0,0|0,0,0]=0 182 B13R2.369 OC1=Nc2ccccc2OC1=O Amb22494623 [0,0,0,0,0,0|1,0,0]=1 183 B13R2.369 OC1CN2C=CC=CC2=NC1=O Amb24649897 [0,0,0,0,0,0|2,0,2]=4 184 B13R2.369 OC1Cc2ccccc2NC1=O Amb22899290 [0,0,0,0,0,0|1,0,2]=3 185 B13R2.369 OC1Cc2ccccc2NC1=S Amb25764408 [0,0,0,0,0,0|1,1,2]=4 186 B13R2.369 OC1Cc2ccccc2OC1=O Amb25158158 [0,0,0,0,0,0|0,0,2]=2 187 B13R2.369 OC1Oc2ccc[n]c2NC1=O Amb25352472 [0,0,0,0,0,0|3,0,1]=4 188 B13R2.369 O[C@@H]1Cc2ccccc2NC1=O Amb25097865 [0,0,0,0,0,0|1,0,2]=3 189 B13R2.369 Oc1[n]c2ccccc2[n]c1Br Amb25127755 [0,0,0,0,0,0|3,0,0]=3 190 B13R2.369 Oc1[n]c2ccccc2[n]c1Cl Amb22497412 [0,0,0,0,0,0|3,0,0]=3 191 B13R2.369 Oc1cc2CC=CCc2cc1O Amb18645635 [0,0,0,0,0,0|1,0,3]=4 192 B13R2.369 Oc1cc2[n]cc[n]c2cc1O Amb24081525 [0,0,0,0,0,0|3,0,1]=4 193 B13R2.369 Oc1cc2[n]cccc2cc1F Amb24091704 [0,0,0,0,0,0|3,0,0]=3 194 B13R2.369 Oc1cc2[n]cccc2cc1I Amb25771696 [0,0,0,0,0,0|3,0,0]=3 195 B13R2.369 Oc1cc2c[n][n]cc2cc1O Amb24364228 [0,0,0,0,0,0|3,0,1]=4 196 B13R2.369 Oc1cc2c[n]ccc2cc1Br Amb24453966 [0,0,0,0,0,0|3,0,0]=3 197 B13R2.369 Oc1cc2cc[n]cc2cc1F Amb24092091 [0,0,0,0,0,0|3,0,0]=3 198 B13R2.369 Oc1cc2cc[n]cc2cc1O Amb18645444 [0,0,0,0,0,0|2,0,1]=3 199 B13R2.369 Oc1cc2ccc[n]c2[n]c1Br Amb21811364 [0,0,0,0,0,0|3,0,0]=3 200 B13R2.369 Oc1cc2ccc[n]c2cc1Br Amb18658931 [0,0,0,0,0,0|3,0,0]=3 201 B13R2.369 Oc1cc2ccc[n]c2cc1Cl Amb23403182 [0,0,0,0,0,0|3,0,0]=3 202 B13R2.369 Oc1cc2ccc[n]c2cc1F Amb23437334 [0,0,0,0,0,0|3,0,0]=3 203 B13R2.369 Oc1cc2ccc[n]c2cc1I Amb23437335 [0,0,0,0,0,0|3,0,0]=3 204 B13R2.369 Oc1cc2ccccc2[n]c1Br Amb18134374 [0,0,0,0,0,0|2,0,0]=2 205 B13R2.369 Oc1cc2ccccc2[n]c1Cl Amb21963885 [0,0,0,0,0,0|2,0,0]=2 206 B13R2.369 Oc1cc2ccccc2cc1Br Amb17596080 [0,0,0,0,0,0|2,0,0]=2 207 B13R2.369 Oc1cc2ccccc2cc1I Amb25148790 [0,0,0,0,0,0|2,0,0]=2 208 B13R2.369 Oc1cc2ccccc2cc1S Amb24497217 [0,0,0,0,0,0|1,1,0]=2 209 B13R2.369 Oc1cc2ncccc2cc1O Amb17594015 [0,0,0,0,0,0|2,0,1]=3 210 B13R2.369 Oc1cc2nccnc2cc1F Amb1067933 [0,0,0,0,0,0|4,0,0]=4 211 B13R2.369 Oc1nc2ccccc2nc1F Amb2425841 [0,0,0,0,0,0|3,0,0]=3 212 B13R2.369 S=C1Nc2ccccc2NC1=S Amb22527759 [0,0,0,0,0,0|2,2,0]=4 213 B13R2.369 Sc1nc2ccccc2nc1S Amb1154155 [0,0,0,0,0,0|2,2,0]=4 214 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [1,0,0,0,0,0|2,0,1]=4 215 B12R2.24 BrC=1CNc2ccccc2C1 Amb24381392 [1,0,0,0,0,0|2,0,1]=4 216 B12R2.24 Brc1[n]c2ccccc2c[n]1 Amb23399840 [1,0,0,0,0,0|3,0,0]=4 217 B12R2.24 Brc1c[n+]2ccccc2cc1 Amb24392821 [1,0,0,0,0,0|3,0,0]=4 218 B12R2.24 Brc1cc2[n]cccc2[n]c1 Amb19958317 [1,0,0,0,0,0|3,0,0]=4 219 B12R2.24 Brc1cc2c[n]ccc2[n]c1 Amb18176152 [1,0,0,0,0,0|3,0,0]=4 220 B12R2.24 Brc1cc2c[n]ccc2cc1 Amb22276934 [1,0,0,0,0,0|3,0,0]=4 221 B12R2.24 Brc1cc2cc[n]cc2[n]c1 Amb22500442 [1,0,0,0,0,0|3,0,0]=4 222 B12R2.24 Brc1cc2cc[n]cc2cc1 Amb24183290 [1,0,0,0,0,0|3,0,0]=4 223 B12R2.24 Brc1cc2ccc[n]c2cc1 Amb19516224 [1,0,0,0,0,0|3,0,0]=4 224 B12R2.24 Brc1cc2ccc[n]c2cc1 Amb22233550 [1,0,0,0,0,0|3,0,0]=4 225 B12R2.24 Brc1ccc2c(c1)cccc2 Amb1159157 [1,0,0,0,0,0|2,0,0]=3 226 B12R2.24 Brc1ccc2c(c1)cccn2 Amb1033034 [1,0,0,0,0,0|3,0,0]=4 227 B12R2.24 Brc1ccc2c(n1)ccnc2 Amb10070412 [1,0,0,0,0,0|3,0,0]=4 228 B12R2.24 Brc1ccc2cc[n]cc2[n]1 Amb21962043 [1,0,0,0,0,0|3,0,0]=4 229 B12R2.24 Brc1cnc2c(c1)cccn2 Amb2541644 [1,0,0,0,0,0|3,0,0]=4 230 B12R2.24 Brc1nnc2c(c1)cccc2 Amb10602274 [1,0,0,0,0,0|3,0,0]=4 231 B12R2.24 C=C1C=C2C=CC=CC2=CN1 Amb25268639 [1,0,0,0,0,0|3,0,0]=4 232 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [1,0,0,0,0,0|1,0,2]=4 233 B12R2.24 CC1C=Cc2[n]cccc2O1 Amb25700391 [1,0,0,0,0,0|2,0,1]=4 234 B12R2.24 CC1C=Cc2c(N1)cccc2 Amb17593644 [1,0,0,0,0,0|2,0,1]=4 235 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [1,0,0,0,0,0|1,0,1]=3 236 B12R2.24 CC=1CNc2ccccc2C1 Amb18559652 [1,0,0,0,0,0|2,0,1]=4 237 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [1,0,0,0,0,0|1,0,1]=3 238 B12R2.24 CC=1CSc2ccccc2C1 Amb24485796 [1,0,0,0,0,0|1,1,1]=4 239 B12R2.24 CC=1Cc2ccccc2ON1 Amb25077210 [1,0,0,0,0,0|2,0,1]=4 240 B12R2.24 C[n+]1ccc2c(c1)cccc2 Amb1147460 [1,0,0,0,0,0|3,0,0]=4 241 B12R2.24 Cc1[n]c2ccccc2c[n]1 Amb23400987 [1,0,0,0,0,0|3,0,0]=4 242 B12R2.24 Cc1cc2c[n]ccc2cc1 Amb18349166 [1,0,0,0,0,0|3,0,0]=4 243 B12R2.24 Cc1cc2cc[n]cc2[n]c1 Amb25857151 [1,0,0,0,0,0|3,0,0]=4 244 B12R2.24 Cc1cc2ccc[n]c2cc1 Amb22235973 [1,0,0,0,0,0|3,0,0]=4 245 B12R2.24 Cc1cc2ccccc2[n][n]1 Amb24062163 [1,0,0,0,0,0|3,0,0]=4 246 B12R2.24 Cc1ccc2c(c1)cccn2 Amb10553829 [1,0,0,0,0,0|3,0,0]=4 247 B12R2.24 Cc1ccc2c(c1)ccnc2 Amb10071945 [1,0,0,0,0,0|3,0,0]=4 248 B12R2.24 Cc1ccc2c(n1)cccc2 Amb1151967 [1,0,0,0,0,0|2,0,0]=3 249 B12R2.24 Cc1ccc2c(n1)cccn2 Amb15692772 [1,0,0,0,0,0|3,0,0]=4 250 B12R2.24 Cc1ccc2c[n]ccc2[n]1 Amb23441223 [1,0,0,0,0,0|3,0,0]=4 251 B12R2.24 Cc1ccc2cc[n]cc2[n]1 Amb25305156 [1,0,0,0,0,0|3,0,0]=4 252 B12R2.24 Cc1ccc2ccccc2[n]1 Amb24097096 [1,0,0,0,0,0|2,0,0]=3 253 B12R2.24 Cc1cnc2c(c1)cccc2 Amb2447051 [1,0,0,0,0,0|2,0,0]=3 254 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [1,0,0,0,0,0|2,0,1]=4 255 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [1,0,0,0,0,0|2,0,1]=4 256 B12R2.24 Clc1cc2[n]cccc2[n]c1 Amb22754099 [1,0,0,0,0,0|3,0,0]=4 257 B12R2.24 Clc1cc2cc[n]cc2[n]c1 Amb22500678 [1,0,0,0,0,0|3,0,0]=4 258 B12R2.24 Clc1cc2ccc[n]c2[n]c1 Amb21864631 [1,0,0,0,0,0|3,0,0]=4 259 B12R2.24 Clc1cc2ccc[n]c2cc1 Amb22234257 [1,0,0,0,0,0|3,0,0]=4 260 B12R2.24 Clc1cc2ccccc2[n][n]1 Amb22523503 [1,0,0,0,0,0|3,0,0]=4 261 B12R2.24 Clc1cc2ccccc2[n]c1 Amb19515997 [1,0,0,0,0,0|2,0,0]=3 262 B12R2.24 Clc1ccc2[n]cccc2[n]1 Amb21856967 [1,0,0,0,0,0|3,0,0]=4 263 B12R2.24 Clc1ccc2c(c1)ccnc2 Amb10603859 [1,0,0,0,0,0|3,0,0]=4 264 B12R2.24 Clc1ccc2c(c1)nccc2 Amb10069239 [1,0,0,0,0,0|3,0,0]=4 265 B12R2.24 Clc1ccc2c(n1)ccnc2 Amb10602045 [1,0,0,0,0,0|3,0,0]=4 266 B12R2.24 Clc1cnc2c(n1)cccc2 Amb2371875 [1,0,0,0,0,0|3,0,0]=4 267 B12R2.24 Clc1ncc2c(c1)cccc2 Amb10071462 [1,0,0,0,0,0|3,0,0]=4 268 B12R2.24 FC=1CNc2ccccc2C1 Amb25063014 [1,0,0,0,0,0|2,0,1]=4 269 B12R2.24 Fc1[n]c2ccccc2c[n]1 Amb24097068 [1,0,0,0,0,0|3,0,0]=4 270 B12R2.24 Fc1c[n]c2ccccc2[n]1 Amb24097105 [1,0,0,0,0,0|3,0,0]=4 271 B12R2.24 Fc1cc2[n]cccc2[n]c1 Amb20621305 [1,0,0,0,0,0|3,0,0]=4 272 B12R2.24 Fc1cc2c[n]ccc2[n]c1 Amb25342347 [1,0,0,0,0,0|3,0,0]=4 273 B12R2.24 Fc1cc2c[n]ccc2cc1 Amb19100617 [1,0,0,0,0,0|3,0,0]=4 274 B12R2.24 Fc1cc2cc[n]cc2[n]c1 Amb25304063 [1,0,0,0,0,0|3,0,0]=4 275 B12R2.24 Fc1cc2cc[n]cc2cc1 Amb19958275 [1,0,0,0,0,0|3,0,0]=4 276 B12R2.24 Fc1cc2ccc[n]c2[n]c1 Amb24365104 [1,0,0,0,0,0|3,0,0]=4 277 B12R2.24 Fc1cc2ccc[n]c2cc1 Amb22831215 [1,0,0,0,0,0|3,0,0]=4 278 B12R2.24 Fc1cc2ccccc2[n]c1 Amb22234447 [1,0,0,0,0,0|2,0,0]=3 279 B12R2.24 Fc1cc2ccccc2c[n]1 Amb20621378 [1,0,0,0,0,0|3,0,0]=4 280 B12R2.24 Fc1ccc2[n]cccc2[n]1 Amb24569524 [1,0,0,0,0,0|3,0,0]=4 281 B12R2.24 Fc1ccc2ccc[n]c2[n]1 Amb24511773 [1,0,0,0,0,0|3,0,0]=4 282 B12R2.24 Fc1ccc2ccccc2[n]1 Amb20171185 [1,0,0,0,0,0|2,0,0]=3 283 B12R2.24 Ic1c[n]c2ccccc2[n]1 Amb24084425 [1,0,0,0,0,0|3,0,0]=4 284 B12R2.24 Ic1cc2[n]cccc2cc1 Amb21858708 [1,0,0,0,0,0|3,0,0]=4 285 B12R2.24 Ic1cc2c[n]ccc2cc1 Amb22170101 [1,0,0,0,0,0|3,0,0]=4 286 B12R2.24 Ic1cc2ccccc2[n]c1 Amb19373724 [1,0,0,0,0,0|2,0,0]=3 287 B12R2.24 Ic1cc2ccccc2c[n]1 Amb22170100 [1,0,0,0,0,0|3,0,0]=4 288 B12R2.24 Ic1ccc2[n]cccc2[n]1 Amb24638054 [1,0,0,0,0,0|3,0,0]=4 289 B12R2.24 Ic1ccc2c(c1)cccn2 Amb10066910 [1,0,0,0,0,0|3,0,0]=4 290 B12R2.24 Ic1ccc2c(c1)ccnc2 Amb10070847 [1,0,0,0,0,0|3,0,0]=4 291 B12R2.24 Ic1ccc2c(n1)cccc2 Amb10604284 [1,0,0,0,0,0|2,0,0]=3 292 B12R2.24 Ic1ccc2c[n]ccc2[n]1 Amb20618854 [1,0,0,0,0,0|3,0,0]=4 293 B12R2.24 Ic1cnc2c(c1)nccc2 Amb13890060 [1,0,0,0,0,0|3,0,0]=4 294 B12R2.24 N=C1CN=c2ccccc2=C1 Amb24061571 [1,0,0,0,0,0|2,0,1]=4 295 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [1,0,0,0,0,0|2,0,1]=4 296 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [1,0,0,0,0,0|1,0,1]=3 297 B12R2.24 NC=1CNc2ccccc2C1 Amb25079184 [1,0,0,0,0,0|2,0,1]=4 298 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [1,0,0,0,0,0|2,0,1]=4 299 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [1,0,0,0,0,0|2,0,1]=4 300 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10553664 [1,0,0,0,0,0|3,0,0]=4 301 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10553680 [1,0,0,0,0,0|3,0,0]=4 302 B12R2.24 N[n+]1ccc2c(c1)cccc2 Amb10558624 [1,0,0,0,0,0|3,0,0]=4 303 B12R2.24 Nc1cc2[n]cccc2cc1 Amb24183307 [1,0,0,0,0,0|3,0,0]=4 304 B12R2.24 Nc1cc2c[n]ccc2[n]c1 Amb18831471 [1,0,0,0,0,0|3,0,0]=4 305 B12R2.24 Nc1cc2cc[n]cc2[n]c1 Amb24060730 [1,0,0,0,0,0|3,0,0]=4 306 B12R2.24 Nc1cc2ccc[n]c2cc1 Amb22235930 [1,0,0,0,0,0|3,0,0]=4 307 B12R2.24 Nc1cc2ccccc2[n]c1 Amb22276924 [1,0,0,0,0,0|2,0,0]=3 308 B12R2.24 Nc1cc2ccccc2cc1 Amb22057457 [1,0,0,0,0,0|2,0,0]=3 309 B12R2.24 Nc1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618259 [1,0,0,0,0,0|2,0,0]=3 310 B12R2.24 Nc1ccc2c(c1)cccn2 Amb1116987 [1,0,0,0,0,0|3,0,0]=4 311 B12R2.24 Nc1ccc2c(n1)cccc2 Amb1152993 [1,0,0,0,0,0|2,0,0]=3 312 B12R2.24 Nc1ccc2cc[n]cc2[n]1 Amb18124738 [1,0,0,0,0,0|3,0,0]=4 313 B12R2.24 Nc1cnc2c(c1)nccc2 Amb13881251 [1,0,0,0,0,0|3,0,0]=4 314 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [1,0,0,0,0,0|2,0,0]=3 315 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [1,0,0,0,0,0|2,0,0]=3 316 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [1,0,0,0,0,0|2,0,1]=4 317 B12R2.24 O=C1C=C2C=CC=NC2C=C1 Amb24090301 [1,0,0,0,0,0|2,0,1]=4 318 B12R2.24 O=C1C=C2CN=CC=C2C=C1 Amb24407165 [1,0,0,0,0,0|2,0,1]=4 319 B12R2.24 O=C1C=CC2=NCC=CC2=C1 Amb24090272 [1,0,0,0,0,0|2,0,1]=4 320 B12R2.24 O=C1C=CN2N=CC=CC2=N1 Amb22497885 [1,0,0,0,0,0|3,0,0]=4 321 B12R2.24 O=C1C=Cc2[n]c[n]cc2N1 Amb21811941 [1,0,0,0,0,0|3,0,0]=4 322 B12R2.24 O=C1C=Cc2[n]cc[n]c2N1 Amb19957771 [1,0,0,0,0,0|3,0,0]=4 323 B12R2.24 O=C1C=Cc2[n]cccc2N1 Amb21856966 [1,0,0,0,0,0|2,0,0]=3 324 B12R2.24 O=C1C=Cc2c[n]ccc2N1 Amb21618693 [1,0,0,0,0,0|2,0,0]=3 325 B12R2.24 O=C1C=Cc2cc[n]cc2N1 Amb22493786 [1,0,0,0,0,0|2,0,0]=3 326 B12R2.24 O=C1C=Cc2cc[n]cc2O1 Amb24395883 [1,0,0,0,0,0|1,0,0]=2 327 B12R2.24 O=C1C=Cc2ccc[n]c2N1 Amb22001403 [1,0,0,0,0,0|2,0,0]=3 328 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [1,0,0,0,0,0|1,0,0]=2 329 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [1,0,0,0,0,0|0,0,0]=1 330 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [1,0,0,0,0,0|0,1,0]=2 331 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [1,0,0,0,0,0|1,0,0]=2 332 B12R2.24 O=C1C=NC2=CC=CCC2=C1 Amb24078599 [1,0,0,0,0,0|1,0,2]=4 333 B12R2.24 O=C1C=NC2=CCC=CC2=C1 Amb24078605 [1,0,0,0,0,0|1,0,2]=4 334 B12R2.24 O=C1C=NC2=CNC=CC2=N1 Amb24719954 [1,0,0,0,0,0|3,0,0]=4 335 B12R2.24 O=C1C=Nc2cc[n]cc2N1 Amb18016830 [1,0,0,0,0,0|3,0,0]=4 336 B12R2.24 O=C1C=Nc2ccc[n]c2N1 Amb20461570 [1,0,0,0,0,0|3,0,0]=4 337 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [1,0,0,0,0,0|2,0,0]=3 338 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [1,0,0,0,0,0|1,0,2]=4 339 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [1,0,0,0,0,0|1,0,1]=3 340 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [1,0,0,0,0,0|0,0,3]=4 341 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [1,0,0,0,0,0|1,0,2]=4 342 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [1,0,0,0,0,0|2,0,1]=4 343 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [1,0,0,0,0,0|2,0,1]=4 344 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [1,0,0,0,0,0|2,0,0]=3 345 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [1,0,0,0,0,0|2,0,1]=4 346 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [1,0,0,0,0,0|3,0,0]=4 347 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [1,0,0,0,0,0|2,0,1]=4 348 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [1,0,0,0,0,0|1,0,0]=2 349 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [1,0,0,0,0,0|2,0,1]=4 350 B12R2.24 O=C1NCc2ccccc2S1 Amb24713217 [1,0,0,0,0,0|1,1,1]=4 351 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [1,0,0,0,0,0|2,0,0]=3 352 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [1,0,0,0,0,0|2,0,0]=3 353 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [1,0,0,0,0,0|2,0,1]=4 354 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [1,0,0,0,0,0|2,0,1]=4 355 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [1,0,0,0,0,0|1,0,1]=3 356 B12R2.24 O=[n]1cc2ccccc2cc1 Amb20247039 [1,0,0,0,0,0|2,0,0]=3 357 B12R2.24 O=c1[nH]nc2c(c1)cccc2 Amb16204922 [1,0,0,0,0,0|2,0,1]=4 358 B12R2.24 O=c1c[n]c2[n]cccc2[nH]1 Amb24082016 [1,0,0,0,0,0|3,0,0]=4 359 B12R2.24 O=c1cc[n]2ccc[n]c2[n]1 Amb24100805 [1,0,0,0,0,0|3,0,0]=4 360 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [1,0,0,0,0,0|0,0,0]=1 361 B12R2.24 O=c1ccc2c[n]c[n]c2o1 Amb24066304 [1,0,0,0,0,0|2,0,0]=3 362 B12R2.24 O=c1ccc2c[n]ccc2o1 Amb24100794 [1,0,0,0,0,0|1,0,0]=2 363 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [1,0,0,0,0,0|2,0,0]=3 364 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [1,0,0,0,0,0|2,0,0]=3 365 B12R2.24 OC1=CC=C2C=CC=CN2C1 Amb17835334 [1,0,0,0,0,0|2,0,1]=4 366 B12R2.24 OC1=COc2[n]cccc2N1 Amb19516358 [1,0,0,0,0,0|2,0,0]=3 367 B12R2.24 OC1=COc2ccccc2O1 Amb24060689 [1,0,0,0,0,0|1,0,0]=2 368 B12R2.24 OC1=Nc2c(NC1)cccc2 Amb2373483 [1,0,0,0,0,0|2,0,1]=4 369 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [1,0,0,0,0,0|0,0,2]=3 370 B12R2.24 OC1COc2c(O1)cccc2 Amb10552971 [1,0,0,0,0,0|1,0,2]=4 371 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [1,0,0,0,0,0|0,0,3]=4 372 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [1,0,0,0,0,0|0,0,1]=2 373 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [1,0,0,0,0,0|1,0,1]=3 374 B12R2.24 O[13c]1[13cH][13c]2[13cH][13cH][13cH][13cH][13c]2[13cH][13cH]1 Amb22055903 [1,0,0,0,0,0|1,0,0]=2 375 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [1,0,0,0,0,0|1,0,2]=4 376 B12R2.24 Oc1c[n]c2c[n]ccc2[n]1 Amb25312692 [1,0,0,0,0,0|3,0,0]=4 377 B12R2.24 Oc1cc2[n][n]ccc2cc1 Amb25319976 [1,0,0,0,0,0|3,0,0]=4 378 B12R2.24 Oc1cc2[n]c[n]cc2cc1 Amb24066333 [1,0,0,0,0,0|3,0,0]=4 379 B12R2.24 Oc1cc2[n]cc[n]c2[n]c1 Amb23401943 [1,0,0,0,0,0|3,0,0]=4 380 B12R2.24 Oc1cc2c[n]ccc2c[n]1 Amb25051663 [1,0,0,0,0,0|3,0,0]=4 381 B12R2.24 Oc1cc2c[n]ccc2cc1 Amb19373209 [1,0,0,0,0,0|2,0,0]=3 382 B12R2.24 Oc1cc2cc[n]cc2[n]c1 Amb18124769 [1,0,0,0,0,0|2,0,0]=3 383 B12R2.24 Oc1cc2cccc[n+]2cc1 Amb24309279 [1,0,0,0,0,0|2,0,0]=3 384 B12R2.24 Oc1cc2ccccc2cc1 Amb21973568 [1,0,0,0,0,0|1,0,0]=2 385 B12R2.24 Oc1ccc2OCC=Cc2c1 Amb18124873 [1,0,0,0,0,0|2,0,1]=4 386 B12R2.24 Oc1ccc2[n]cccc2[n]1 Amb18124768 [1,0,0,0,0,0|2,0,1]=4 387 B12R2.24 Oc1ccc2c(c1)ccnc2 Amb10067627 [1,0,0,0,0,0|2,0,0]=3 388 B12R2.24 Oc1ccc2c(c1)cncc2 Amb1152014 [1,0,0,0,0,0|2,0,0]=3 389 B12R2.24 Oc1ccc2c(c1)nccn2 Amb2548376 [1,0,0,0,0,0|3,0,0]=4 390 B12R2.24 Oc1ccc2c(n1)cccc2 Amb1818223 [1,0,0,0,0,0|1,0,1]=3 391 B12R2.24 Oc1cnc2c(c1)nccc2 Amb13890072 [1,0,0,0,0,0|2,0,0]=3 392 B12R2.24 Oc1ncc2c(c1)cccc2 Amb10068513 [1,0,0,0,0,0|2,0,0]=3 393 B12R2.24 Oc1ncc2c(n1)cccc2 Amb1971493 [1,0,0,0,0,0|2,0,1]=4 394 B12R2.24 Oc1nnc2c(c1)cccc2 Amb10552926 [1,0,0,0,0,0|2,0,0]=3 395 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [1,0,0,0,0,0|1,1,0]=3 396 B12R2.24 S=C1C=Cc2ccccc2O1 Amb21884783 [1,0,0,0,0,0|0,1,0]=2 397 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [1,0,0,0,0,0|2,1,0]=4 398 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [1,0,0,0,0,0|0,1,2]=4 399 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [1,0,0,0,0,0|1,1,1]=4 400 B12R2.24 S=c1ccc2ccccc2[s]1 Amb24065643 [1,0,0,0,0,0|0,2,0]=3 401 B12R2.24 SN1Cc2ccccc2C=C1 Amb25826109 [1,0,0,0,0,0|2,1,0]=4 402 B12R2.24 Sc1cc2c[n]ccc2cc1 Amb25150431 [1,0,0,0,0,0|2,1,0]=4 403 B12R2.24 Sc1cc2ccc[n]c2cc1 Amb25076144 [1,0,0,0,0,0|2,1,0]=4 404 B12R2.24 Sc1cc2ccccc2[n]c1 Amb23440777 [1,0,0,0,0,0|1,1,0]=3 405 B12R2.24 Sc1cc2ccccc2c[n]1 Amb24624669 [1,0,0,0,0,0|2,1,0]=4 406 B12R2.24 Sc1ccc2c(c1)cccc2 Amb1152959 [1,0,0,0,0,0|1,1,0]=3 407 B12R2.24 Sc1ccc2c(n1)cccc2 Amb1151737 [1,0,0,0,0,0|1,1,0]=3 408 B12R2.24 [13CH3][13c]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17617622 [1,0,0,0,0,0|2,0,0]=3 409 B12R2.24 [Mg+]c1cc2ccccc2cc1 Amb22044011 [1,0,0,0,0,0|2,0,0]=3 410 B12R2.24 [NH3+]c1cc2[13cH][13cH][13cH][13cH]c2cc1 Amb22057458 [1,0,0,0,0,0|2,0,0]=3 411 B12R2.24 [O-]c1ccc2ccccc2[n]1 Amb22474102 [1,0,0,0,0,0|1,0,1]=3 412 B12R2.24 [SiH3]c1cc2ccccc2[n]c1 Amb24102605 [1,0,0,0,0,0|2,0,0]=3 413 B12R2.24 c1([2H])ccc2c(n1)cccc2 Amb10573520 [1,0,0,0,0,0|2,0,0]=3 414 B14R2.639 CC1(O)Cc2ccccc2NC1=O Amb25667949 [0,1,0,0,0,0|1,0,2]=4 415 B14R2.1128 BrCc1[n]c2ccccc2cc1I Amb25069552 [0,1,0,0,0,0|3,0,0]=4 416 B14R2.1128 Brc1[n]c2ccccc2cc1CBr Amb25154976 [0,1,0,0,0,0|3,0,0]=4 417 B14R2.1128 C#Cc1cc2ccccc2[n]c1Cl Amb22292332 [0,1,0,0,0,0|3,0,0]=4 418 B14R2.1128 C=CC1=Cc2ccccc2NC1=O Amb25789661 [0,1,0,0,0,0|2,0,0]=3 419 B14R2.1128 C=CC1=Cc2ccccc2OC1=O Amb25830590 [0,1,0,0,0,0|1,0,0]=2 420 B14R2.1128 C=Cc1[n]c2ccccc2cc1O Amb25239115 [0,1,0,0,0,0|2,0,0]=3 421 B14R2.1128 C=Cc1cc2ccccc2[n]c1Cl Amb23481186 [0,1,0,0,0,0|3,0,0]=4 422 B14R2.1128 C=Cc1cc2ccccc2[n]c1Cl Amb25216291 [0,1,0,0,0,0|3,0,0]=4 423 B14R2.1128 CC/1=Nc2ccccc2N\C1=N/O Amb19518000 [0,1,0,0,0,0|3,0,0]=4 424 B14R2.1128 CC1Oc2ccccc2C=C1CO Amb24331388 [0,1,0,0,0,0|1,0,1]=3 425 B14R2.1128 CC=1Oc2ccccc2OC1CO Amb25159166 [0,1,0,0,0,0|2,0,0]=3 426 B14R2.1128 CC=1Oc2ccccc2SC1C=O Amb24534419 [0,1,0,0,0,0|2,0,1]=4 427 B14R2.1128 CCC1=Cc2ccccc2NC1=O Amb22723317 [0,1,0,0,0,0|2,0,0]=3 428 B14R2.1128 CCC1=Nc2ccccc2NC1=O Amb19891159 [0,1,0,0,0,0|3,0,0]=4 429 B14R2.1128 CCC1Nc2ccccc2OC1=O Amb24415409 [0,1,0,0,0,0|2,0,1]=4 430 B14R2.1128 CCc1[n]c2ccccc2cc1O Amb24749839 [0,1,0,0,0,0|2,0,0]=3 431 B14R2.1128 CCc1cc2ccccc2cc1O Amb25059607 [0,1,0,0,0,0|2,0,0]=3 432 B14R2.1128 CCc1cc2ccccc2nc1Br Amb17158083 [0,1,0,0,0,0|3,0,0]=4 433 B14R2.1128 CCc1cc2ccccc2nc1N Amb1994295 [0,1,0,0,0,0|3,0,0]=4 434 B14R2.1128 CCc1nc2ccccc2cc1C Amb10568525 [0,1,0,0,0,0|3,0,0]=4 435 B14R2.1128 CNC1=Nc2ccccc2NC1=O Amb19550516 [0,1,0,0,0,0|3,0,0]=4 436 B14R2.1128 CNc1cc2ccccc2[n]c1Cl Amb25088301 [0,1,0,0,0,0|3,0,0]=4 437 B14R2.1128 COC1=CC2=CC=CNC2=CC1=N Amb24524090 [0,1,0,0,0,0|3,0,0]=4 438 B14R2.1128 COC1=Cc2ccccc2OC1=O Amb23512578 [0,1,0,0,0,0|0,0,0]=1 439 B14R2.1128 COC1=Nc2ccc[n]c2NC1=O Amb24674244 [0,1,0,0,0,0|3,0,0]=4 440 B14R2.1128 COC1Oc2ccccc2NC1=O Amb25324958 [0,1,0,0,0,0|2,0,1]=4 441 B14R2.1128 COc1[n]c2ccccc2[nH]c1=O Amb24102316 [0,1,0,0,0,0|2,0,0]=3 442 B14R2.1128 COc1[n]c2ccccc2[n]c1N Amb18127415 [0,1,0,0,0,0|3,0,0]=4 443 B14R2.1128 COc1[n]c2ccccc2cc1Cl Amb24533657 [0,1,0,0,0,0|2,0,1]=4 444 B14R2.1128 COc1[n]c2ccccc2cc1F Amb22547228 [0,1,0,0,0,0|2,0,1]=4 445 B14R2.1128 COc1cc2[n]cccc2cc1N Amb24427333 [0,1,0,0,0,0|3,0,0]=4 446 B14R2.1128 COc1cc2[n]cccc2cc1O Amb24092164 [0,1,0,0,0,0|2,0,1]=4 447 B14R2.1128 COc1cc2c[n]ccc2cc1Br Amb25771927 [0,1,0,0,0,0|3,0,0]=4 448 B14R2.1128 COc1cc2c[n]ccc2cc1Cl Amb24433387 [0,1,0,0,0,0|3,0,0]=4 449 B14R2.1128 COc1cc2c[n]ccc2cc1F Amb25697053 [0,1,0,0,0,0|3,0,0]=4 450 B14R2.1128 COc1cc2c[n]ccc2cc1I Amb24566749 [0,1,0,0,0,0|3,0,0]=4 451 B14R2.1128 COc1cc2c[n]ccc2cc1N Amb18197674 [0,1,0,0,0,0|3,0,0]=4 452 B14R2.1128 COc1cc2c[n]ccc2cc1O Amb24092161 [0,1,0,0,0,0|2,0,1]=4 453 B14R2.1128 COc1cc2ccc[n]c2cc1Br Amb23437339 [0,1,0,0,0,0|3,0,0]=4 454 B14R2.1128 COc1cc2ccc[n]c2cc1Cl Amb23401102 [0,1,0,0,0,0|3,0,0]=4 455 B14R2.1128 COc1cc2ccc[n]c2cc1F Amb19957347 [0,1,0,0,0,0|3,0,0]=4 456 B14R2.1128 COc1cc2ccc[n]c2cc1I Amb23400929 [0,1,0,0,0,0|3,0,0]=4 457 B14R2.1128 COc1cc2ccc[n]c2cc1N Amb24565737 [0,1,0,0,0,0|3,0,0]=4 458 B14R2.1128 COc1cc2ccc[n]c2cc1O Amb25226833 [0,1,0,0,0,0|2,0,1]=4 459 B14R2.1128 COc1cc2ccccc2[n]c1Br Amb25739600 [0,1,0,0,0,0|2,0,0]=3 460 B14R2.1128 COc1cc2ccccc2[n]c1Cl Amb24534649 [0,1,0,0,0,0|2,0,0]=3 461 B14R2.1128 COc1cc2ccccc2c[n+]1[O-] Amb25246981 [0,1,0,0,0,0|2,0,1]=4 462 B14R2.1128 COc1cc2ccccc2cc1Br Amb22445934 [0,1,0,0,0,0|2,0,0]=3 463 B14R2.1128 COc1cc2ccccc2cc1Cl Amb24735700 [0,1,0,0,0,0|2,0,0]=3 464 B14R2.1128 COc1cc2ccccc2cc1N Amb18127045 [0,1,0,0,0,0|2,0,0]=3 465 B14R2.1128 COc1cc2cccnc2[nH]c1=O Amb15692186 [0,1,0,0,0,0|2,0,0]=3 466 B14R2.1128 COc1nc2ccccc2cc1Br Amb10608360 [0,1,0,0,0,0|2,0,1]=4 467 B14R2.1128 CSC1=Nc2ccccc2NC1=O Amb19655026 [0,1,0,0,0,0|2,1,0]=4 468 B14R2.1128 CSc1cc2ccccc2[n]c1Cl Amb25099465 [0,1,0,0,0,0|2,1,0]=4 469 B14R2.1128 CSc1cc2ccccc2[n]c1O Amb24564502 [0,1,0,0,0,0|1,1,1]=4 470 B14R2.1128 CSc1cc2ccccc2cc1O Amb25776653 [0,1,0,0,0,0|1,1,0]=3 471 B14R2.1128 C[C@H]1Oc2ccccc2C=C1C=O Amb24462140 [0,1,0,0,0,0|1,0,2]=4 472 B14R2.1128 Cc1[n]c2ccccc2[n]c1CO Amb25187738 [0,1,0,0,0,0|3,0,0]=4 473 B14R2.1128 Cc1[n]c2ccccc2[n]c1OC Amb24084542 [0,1,0,0,0,0|3,0,0]=4 474 B14R2.1128 Cc1[n]c2ccccc2cc1C#N Amb18126506 [0,1,0,0,0,0|3,0,0]=4 475 B14R2.1128 Cc1[n]c2ccccc2cc1C=O Amb25178959 [0,1,0,0,0,0|2,0,1]=4 476 B14R2.1128 Cc1[n]c2ccccc2cc1OC Amb22496216 [0,1,0,0,0,0|2,0,0]=3 477 B14R2.1128 Cc1cc2[n]cccc2cc1CO Amb24518841 [0,1,0,0,0,0|3,0,0]=4 478 B14R2.1128 Cc1cc2[n]cccc2cc1OC Amb22886999 [0,1,0,0,0,0|3,0,0]=4 479 B14R2.1128 Cc1cc2c[n]ccc2cc1OC Amb24091791 [0,1,0,0,0,0|3,0,0]=4 480 B14R2.1128 Cc1cc2cc[n]cc2cc1OC Amb24092162 [0,1,0,0,0,0|3,0,0]=4 481 B14R2.1128 Cc1cc2ccc[n]c2cc1C=O Amb25334766 [0,1,0,0,0,0|3,0,0]=4 482 B14R2.1128 Cc1cc2ccc[n]c2cc1CO Amb24679316 [0,1,0,0,0,0|3,0,0]=4 483 B14R2.1128 Cc1cc2ccccc2[n]c1C#N Amb22002124 [0,1,0,0,0,0|3,0,0]=4 484 B14R2.1128 Cc1cc2ccccc2[n]c1C=O Amb22372301 [0,1,0,0,0,0|2,0,0]=3 485 B14R2.1128 Cc1cc2ccccc2[n]c1CBr Amb22498481 [0,1,0,0,0,0|3,0,0]=4 486 B14R2.1128 Cc1cc2ccccc2[n]c1CBr Amb22498483 [0,1,0,0,0,0|3,0,0]=4 487 B14R2.1128 Cc1cc2ccccc2[n]c1CCl Amb22498479 [0,1,0,0,0,0|3,0,0]=4 488 B14R2.1128 Cc1cc2ccccc2[n]c1CCl Amb22498484 [0,1,0,0,0,0|3,0,0]=4 489 B14R2.1128 Cc1cc2ccccc2[n]c1CN Amb22498477 [0,1,0,0,0,0|3,0,0]=4 490 B14R2.1128 Cc1cc2ccccc2[n]c1CO Amb22498485 [0,1,0,0,0,0|2,0,1]=4 491 B14R2.1128 Cc1cc2ccccc2[n]c1NO Amb25052227 [0,1,0,0,0,0|2,0,1]=4 492 B14R2.1128 Cc1cc2ccccc2[n]c1OC Amb22498215 [0,1,0,0,0,0|2,0,1]=4 493 B14R2.1128 Cc1cc2ccccc2cc1C=O Amb18126678 [0,1,0,0,0,0|2,0,0]=3 494 B14R2.1128 Cc1cc2ccccc2cc1CBr Amb17778929 [0,1,0,0,0,0|3,0,0]=4 495 B14R2.1128 Cc1cc2ccccc2cc1CCl Amb17778928 [0,1,0,0,0,0|3,0,0]=4 496 B14R2.1128 Cc1cc2ccccc2cc1CN Amb24665750 [0,1,0,0,0,0|3,0,0]=4 497 B14R2.1128 Cc1cc2ccccc2cc1NN Amb25836864 [0,1,0,0,0,0|3,0,0]=4 498 B14R2.1128 Cc1cc2ccccc2cc1OC Amb24415328 [0,1,0,0,0,0|2,0,0]=3 499 B14R2.1128 ClCc1cc2ccccc2cc1Br Amb25365052 [0,1,0,0,0,0|3,0,0]=4 500 B14R2.1128 ClCc1cc2ccccc2nc1Cl Amb1154286 [0,1,0,0,0,0|3,0,0]=4 501 B14R2.1128 Clc1[n]c2ccccc2cc1CBr Amb24105731 [0,1,0,0,0,0|3,0,0]=4 502 B14R2.1128 Clc1cc2ccccc2cc1CCl Amb25040819 [0,1,0,0,0,0|3,0,0]=4 503 B14R2.1128 FCc1cc2ccccc2[n]c1Cl Amb25141192 [0,1,0,0,0,0|3,0,0]=4 504 B14R2.1128 N#CC1=Cc2c[n]ccc2NC1=O Amb25815326 [0,1,0,0,0,0|3,0,0]=4 505 B14R2.1128 N#CC1=Cc2ccc[n]c2NC1=O Amb19895271 [0,1,0,0,0,0|3,0,0]=4 506 B14R2.1128 N#CC1=Cc2ccccc2NC1=O Amb18003107 [0,1,0,0,0,0|2,0,0]=3 507 B14R2.1128 N#CC1=Cc2ccccc2OC1=O Amb18531768 [0,1,0,0,0,0|1,0,0]=2 508 B14R2.1128 N#CC1=Nc2ccccc2NC1=O Amb18126753 [0,1,0,0,0,0|3,0,0]=4 509 B14R2.1128 N#Cc1[n]c2ccccc2cc1Br Amb18134854 [0,1,0,0,0,0|3,0,0]=4 510 B14R2.1128 N#Cc1[n]c2ccccc2cc1F Amb25138627 [0,1,0,0,0,0|3,0,0]=4 511 B14R2.1128 N#Cc1[n]c2ccccc2cc1O Amb24655868 [0,1,0,0,0,0|2,0,0]=3 512 B14R2.1128 N#Cc1cc2[n]cccc2cc1O Amb25219998 [0,1,0,0,0,0|3,0,0]=4 513 B14R2.1128 N#Cc1cc2ccc[n]c2cc1O Amb25097189 [0,1,0,0,0,0|3,0,0]=4 514 B14R2.1128 N#Cc1cc2ccccc2[n]c1S Amb18649389 [0,1,0,0,0,0|2,1,0]=4 515 B14R2.1128 N#Cc1cc2ccccc2cc1Br Amb25771839 [0,1,0,0,0,0|3,0,0]=4 516 B14R2.1128 N#Cc1cc2ccccc2nc1Cl Amb1994234 [0,1,0,0,0,0|3,0,0]=4 517 B14R2.1128 N=C1Oc2ccccc2C=C1C#N Amb18048521 [0,1,0,0,0,0|2,0,0]=3 518 B14R2.1128 NC=1Oc2ccccc2CC1C#N Amb19337145 [0,1,0,0,0,0|2,0,1]=4 519 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb17991271 [0,1,0,0,0,0|2,0,0]=3 520 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb18908960 [0,1,0,0,0,0|2,0,0]=3 521 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [0,1,0,0,0,0|1,0,0]=2 522 B14R2.1128 NCc1[n]c2ccccc2[nH]c1=O Amb24085311 [0,1,0,0,0,0|3,0,0]=4 523 B14R2.1128 NCc1cc2ccccc2[n]c1Br Amb22497904 [0,1,0,0,0,0|3,0,0]=4 524 B14R2.1128 NCc1cc2ccccc2[n]c1Cl Amb22396141 [0,1,0,0,0,0|3,0,0]=4 525 B14R2.1128 NCc1cc2ccccc2[n]c1I Amb25802785 [0,1,0,0,0,0|3,0,0]=4 526 B14R2.1128 NCc1cc2ccccc2cc1Cl Amb25299156 [0,1,0,0,0,0|3,0,0]=4 527 B14R2.1128 NCc1cc2ccccc2cc1I Amb24448245 [0,1,0,0,0,0|3,0,0]=4 528 B14R2.1128 NCc1cc2ccccc2nc1C Amb17578252 [0,1,0,0,0,0|3,0,0]=4 529 B14R2.1128 NCc1nc2ccccc2cc1C Amb17578253 [0,1,0,0,0,0|3,0,0]=4 530 B14R2.1128 NNC1=Nc2ccccc2NC1=O Amb18127652 [0,1,0,0,0,0|3,0,0]=4 531 B14R2.1128 NNc1nc2ccccc2nc1O Amb1351727 [0,1,0,0,0,0|3,0,0]=4 532 B14R2.1128 Nc1[n]c2ccccc2[n]c1C=O Amb25794060 [0,1,0,0,0,0|3,0,0]=4 533 B14R2.1128 Nc1[n]c2ccccc2cc1C=O Amb24624679 [0,1,0,0,0,0|2,0,1]=4 534 B14R2.1128 Nc1[n]c2ccccc2cc1CO Amb18946793 [0,1,0,0,0,0|2,0,0]=3 535 B14R2.1128 Nc1cc2ccccc2[n]c1C#N Amb23400485 [0,1,0,0,0,0|3,0,0]=4 536 B14R2.1128 Nc1cc2ccccc2[n]c1C=O Amb23401878 [0,1,0,0,0,0|2,0,0]=3 537 B14R2.1128 Nc1cc2ccccc2[n]c1CN Amb23399949 [0,1,0,0,0,0|3,0,0]=4 538 B14R2.1128 Nc1cc2ccccc2[n]c1CO Amb18127225 [0,1,0,0,0,0|2,0,1]=4 539 B14R2.1128 Nc1cc2ccccc2cc1C=O Amb25782655 [0,1,0,0,0,0|2,0,0]=3 540 B14R2.1128 Nc1cc2ccccc2cc1CN Amb18944641 [0,1,0,0,0,0|3,0,0]=4 541 B14R2.1128 Nc1cc2ccccc2cc1CO Amb19959319 [0,1,0,0,0,0|2,0,0]=3 542 B14R2.1128 O=C1Nc2[n]cccc2C=C1CBr Amb25338287 [0,1,0,0,0,0|3,0,0]=4 543 B14R2.1128 O=C1Nc2ccccc2C=C1C=O Amb18014582 [0,1,0,0,0,0|1,0,1]=3 544 B14R2.1128 O=C1Nc2ccccc2C=C1CBr Amb25364224 [0,1,0,0,0,0|2,0,0]=3 545 B14R2.1128 O=C1Nc2ccccc2C=C1CCl Amb18015274 [0,1,0,0,0,0|2,0,0]=3 546 B14R2.1128 O=C1Nc2ccccc2N=C1CBr Amb18026153 [0,1,0,0,0,0|3,0,0]=4 547 B14R2.1128 O=C1Nc2ccccc2N=C1CCl Amb24723234 [0,1,0,0,0,0|3,0,0]=4 548 B14R2.1128 O=C1Nc2ccccc2N=C1CS Amb25232685 [0,1,0,0,0,0|2,1,0]=4 549 B14R2.1128 O=C1Oc2ccccc2C=C1C=O Amb18647793 [0,1,0,0,0,0|0,0,1]=2 550 B14R2.1128 O=C1Oc2ccccc2C=C1CCl Amb21937093 [0,1,0,0,0,0|1,0,0]=2 551 B14R2.1128 O=CC1=Cc2ccccc2OC1C Amb2491693 [0,1,0,0,0,0|1,0,2]=4 552 B14R2.1128 O=CC=1Cc2ccccc2CC1Cl Amb24620144 [0,1,0,0,0,0|2,0,1]=4 553 B14R2.1128 O=CC=1Cc2ccccc2NC1Cl Amb24753701 [0,1,0,0,0,0|3,0,0]=4 554 B14R2.1128 O=Cc1[n]c2ccccc2[n]c1Cl Amb18651347 [0,1,0,0,0,0|3,0,0]=4 555 B14R2.1128 O=Cc1[n]c2ccccc2[n]c1I Amb24549250 [0,1,0,0,0,0|3,0,0]=4 556 B14R2.1128 O=Cc1[n]c2ccccc2cc1Br Amb19516501 [0,1,0,0,0,0|2,0,0]=3 557 B14R2.1128 O=Cc1[n]c2ccccc2cc1F Amb22547353 [0,1,0,0,0,0|2,0,0]=3 558 B14R2.1128 O=Cc1cc2[n]cccc2cc1F Amb24529606 [0,1,0,0,0,0|3,0,0]=4 559 B14R2.1128 O=Cc1cc2ccc[n]c2cc1F Amb20076039 [0,1,0,0,0,0|3,0,0]=4 560 B14R2.1128 O=Cc1cc2ccccc2[n]c1Br Amb24695342 [0,1,0,0,0,0|2,0,1]=4 561 B14R2.1128 O=Cc1cc2ccccc2[n]c1Cl Amb17659425 [0,1,0,0,0,0|2,0,1]=4 562 B14R2.1128 O=Cc1cc2ccccc2[n]c1I Amb21897312 [0,1,0,0,0,0|2,0,1]=4 563 B14R2.1128 O=Cc1cc2ccccc2cc1Br Amb18135677 [0,1,0,0,0,0|2,0,0]=3 564 B14R2.1128 O=Cc1cc2ccccc2cc1Cl Amb18650675 [0,1,0,0,0,0|2,0,0]=3 565 B14R2.1128 O=Cc1cc2ccccc2cc1F Amb18647802 [0,1,0,0,0,0|2,0,0]=3 566 B14R2.1128 O=Cc1cc2ccccc2cc1S Amb24682804 [0,1,0,0,0,0|1,1,0]=3 567 B14R2.1128 O=Cc1cc2ccccc2nc1O Amb1794818 [0,1,0,0,0,0|2,0,0]=3 568 B14R2.1128 O=Cc1cc2ccccc2nc1S Amb1153030 [0,1,0,0,0,0|1,1,1]=4 569 B14R2.1128 O=Cc1cc2cccnc2cc1Cl Amb10976392 [0,1,0,0,0,0|3,0,0]=4 570 B14R2.1128 O=Cc1nc2ccccc2nc1O Amb17594377 [0,1,0,0,0,0|2,0,0]=3 571 B14R2.1128 OCC1=Cc2ccccc2NC1=O Amb18528795 [0,1,0,0,0,0|1,0,0]=2 572 B14R2.1128 OCC1=Cc2ccccc2OC1=O Amb24495416 [0,1,0,0,0,0|0,0,0]=1 573 B14R2.1128 OCC1=Nc2ccccc2NC1=O Amb18184029 [0,1,0,0,0,0|2,0,0]=3 574 B14R2.1128 OCC1Oc2ccccc2NC1=O Amb25315206 [0,1,0,0,0,0|2,0,1]=4 575 B14R2.1128 OCC1Sc2ccccc2NC1=O Amb2445324 [0,1,0,0,0,0|2,0,1]=4 576 B14R2.1128 OC[C@@H]1Nc2ccccc2NC1=O Amb25373955 [0,1,0,0,0,0|2,0,1]=4 577 B14R2.1128 OC[C@H]1Nc2ccccc2NC1=O Amb24567701 [0,1,0,0,0,0|2,0,1]=4 578 B14R2.1128 OCc1[n]c2ccccc2cc1I Amb25262837 [0,1,0,0,0,0|2,0,1]=4 579 B14R2.1128 OCc1cc2ccc[n]c2cc1Br Amb24695406 [0,1,0,0,0,0|3,0,0]=4 580 B14R2.1128 OCc1cc2ccc[n]c2cc1F Amb25108554 [0,1,0,0,0,0|3,0,0]=4 581 B14R2.1128 OCc1cc2ccccc2[n]c1Br Amb25720178 [0,1,0,0,0,0|2,0,0]=3 582 B14R2.1128 OCc1cc2ccccc2[n]c1I Amb24309344 [0,1,0,0,0,0|2,0,0]=3 583 B14R2.1128 ONC1=Nc2ccccc2NC1=O Amb20641462 [0,1,0,0,0,0|2,0,0]=3 584 B14R2.1128 ONC1=Nc2ccccc2OC1=O Amb20641490 [0,1,0,0,0,0|1,0,0]=2 585 B14R2.1128 ONC1=Nc2ccccc2SC1=O Amb20641550 [0,1,0,0,0,0|1,1,0]=3 586 B14R2.1128 Oc1cc2OCC=Cc2cc1C=O Amb24539284 [0,1,0,0,0,0|2,0,1]=4 587 B14R2.1128 Oc1cc2[n]cccc2cc1C=O Amb24432684 [0,1,0,0,0,0|2,0,0]=3 588 B14R2.1128 Oc1cc2ccc[n]c2cc1C=O Amb25701934 [0,1,0,0,0,0|2,0,0]=3 589 B14R2.1128 Oc1cc2ccccc2[n]c1C=O Amb24104528 [0,1,0,0,0,0|1,0,0]=2 590 B14R2.1128 Oc1cc2ccccc2cc1CO Amb18127196 [0,1,0,0,0,0|1,0,1]=3 591 B14R2.1128 Oc1cc2ccccc2cc1N=O Amb25190069 [0,1,0,0,0,0|1,0,0]=2 592 B14R2.8188 CC1=C(Br)C(=O)Nc2ccccc21 Amb19650649 [0,1,0,0,0,0|2,0,0]=3 593 B14R2.8188 CC1=C(Cl)C(=O)Nc2ccccc21 Amb21963397 [0,1,0,0,0,0|2,0,0]=3 594 B14R2.8188 CC1=C(F)C(=O)Nc2ccccc21 Amb21963398 [0,1,0,0,0,0|2,0,0]=3 595 B14R2.8188 CC1=C(N)C(=O)Nc2ccccc21 Amb23448331 [0,1,0,0,0,0|2,0,0]=3 596 B14R2.8188 CC1=C(N)C(=O)Oc2ccccc21 Amb18127405 [0,1,0,0,0,0|1,0,0]=2 597 B14R2.8188 CC1=C(N)C(=S)Nc2ccccc21 Amb24679987 [0,1,0,0,0,0|2,1,0]=4 598 B14R2.8188 CC1=C(N)c2ccccc2NC1=O Amb25097050 [0,1,0,0,0,0|2,0,0]=3 599 B14R2.8188 CC1=C(N)c2ccccc2OC1=O Amb18127404 [0,1,0,0,0,0|1,0,0]=2 600 B14R2.8188 CC1=C(O)C(=O)Nc2[n]cccc21 Amb24534647 [0,1,0,0,0,0|2,0,0]=3 601 B14R2.8188 CC1=C(O)C(=O)Nc2ccccc21 Amb22752590 [0,1,0,0,0,0|1,0,0]=2 602 B14R2.8188 CC1=C(O)c2ccccc2NC1=O Amb22752589 [0,1,0,0,0,0|2,0,0]=3 603 B14R2.8188 CC1=C(O)c2ccccc2OC1=O Amb20247475 [0,1,0,0,0,0|1,0,0]=2 604 B14R2.8188 CC1=Cc2ccccc2C(=O)N1O Amb25348704 [0,1,0,0,0,0|3,0,0]=4 605 B14R2.8188 CC1=Cc2ccccc2N(C)C1=O Amb22904186 [0,1,0,0,0,0|2,0,0]=3 606 B14R2.8188 CC1=Nc2ccccc2C(=O)C1=O Amb25034287 [0,1,0,0,0,0|2,0,1]=4 607 B14R2.8188 CC1=Nc2ccccc2C(=O)N1O Amb19748303 [0,1,0,0,0,0|3,0,0]=4 608 B14R2.8188 CC1=Nc2ccccc2N(C)C1=O Amb19652902 [0,1,0,0,0,0|3,0,0]=4 609 B14R2.8188 CC1C(=O)Oc2ccccc2C1=O Amb25834411 [0,1,0,0,0,0|1,0,1]=3 610 B14R2.8188 CC=1C(=O)Oc2ccccc2C1C Amb20247473 [0,1,0,0,0,0|1,0,0]=2 611 B14R2.8188 CC=1C(=O)c2ccccc2NC1C Amb18180399 [0,1,0,0,0,0|3,0,0]=4 612 B14R2.8188 CC=1C(=O)c2ccccc2SC1C Amb24414145 [0,1,0,0,0,0|2,1,0]=4 613 B14R2.8188 CC=1C(=S)c2ccccc2NC1C Amb19553674 [0,1,0,0,0,0|3,0,0]=4 614 B14R2.8188 CC=1C(Cl)C(=O)N=C2C=CC=CC21 Amb22015274 [0,1,0,0,0,0|2,0,1]=4 615 B14R2.8188 CC=1C(F)C(=O)N=C2C=CC=CC21 Amb22015275 [0,1,0,0,0,0|2,0,1]=4 616 B14R2.8188 CC=1Cc2ccccc2C(=O)C1O Amb25066311 [0,1,0,0,0,0|2,0,0]=3 617 B14R2.8188 CC=1Nc2ccccc2C(=O)C1Br Amb19905460 [0,1,0,0,0,0|3,0,0]=4 618 B14R2.8188 CC=1Nc2ccccc2C(=O)C1I Amb23533648 [0,1,0,0,0,0|3,0,0]=4 619 B14R2.8188 CC=1Nc2ccccc2C(=O)C1N Amb18647838 [0,1,0,0,0,0|3,0,0]=4 620 B14R2.8188 CC=1Nc2ccccc2C(=O)C1O Amb20171457 [0,1,0,0,0,0|2,0,0]=3 621 B14R2.8188 CC=1Oc2ccccc2C(=O)C1Br Amb22344050 [0,1,0,0,0,0|2,0,0]=3 622 B14R2.8188 CC=1Oc2ccccc2C(=O)C1N Amb18127402 [0,1,0,0,0,0|2,0,0]=3 623 B14R2.8188 CC=1Oc2ccccc2C(=O)C1O Amb24633658 [0,1,0,0,0,0|1,0,0]=2 624 B14R2.8188 CC=1Oc2ccccc2C(=O)[N+]1C Amb20661021 [0,1,0,0,0,0|3,0,0]=4 625 B14R2.8188 CC=1Sc2ccccc2C(=O)C1Br Amb25721193 [0,1,0,0,0,0|2,1,0]=4 626 B14R2.8188 CN1C(=C)c2ccccc2NC1=O Amb25309633 [0,1,0,0,0,0|3,0,0]=4 627 B14R2.8188 CN1C(=O)C(Br)=Cc2ccccc12 Amb20246919 [0,1,0,0,0,0|2,0,0]=3 628 B14R2.8188 CN1C(=O)C(Cl)=Nc2ccccc12 Amb21926980 [0,1,0,0,0,0|3,0,0]=4 629 B14R2.8188 CN1C(=O)C(F)=Cc2ccccc12 Amb22547226 [0,1,0,0,0,0|2,0,0]=3 630 B14R2.8188 CN1C(=O)C(N)=Cc2ccc[n]c12 Amb23456040 [0,1,0,0,0,0|3,0,0]=4 631 B14R2.8188 CN1C(=O)C(N)=Cc2ccccc12 Amb18065259 [0,1,0,0,0,0|2,0,0]=3 632 B14R2.8188 CN1C(=O)C(O)=Cc2ccccc12 Amb22751143 [0,1,0,0,0,0|1,0,0]=2 633 B14R2.8188 CN1C(=O)C(O)=Nc2[n]cccc12 Amb23557988 [0,1,0,0,0,0|3,0,0]=4 634 B14R2.8188 CN1C(=O)C(O)Cc2ccccc12 Amb25788945 [0,1,0,0,0,0|1,0,2]=4 635 B14R2.8188 CN1C(=O)Nc2ccccc2C1=O Amb19372548 [0,1,0,0,0,0|3,0,0]=4 636 B14R2.8188 CN1C(O)c2ccccc2OC1=O Amb25115917 [0,1,0,0,0,0|2,0,1]=4 637 B14R2.8188 CN1c2ccccc2CC(=O)C1=O Amb24492727 [0,1,0,0,0,0|1,0,2]=4 638 B14R2.8188 CN1c2ccccc2NC(=O)C1=O Amb19516760 [0,1,0,0,0,0|2,0,1]=4 639 B14R2.8188 C[C@@H]1Oc2ccccc2C(=O)[C@@H]1O Amb24576039 [0,1,0,0,0,0|1,0,2]=4 640 B14R2.8188 C[n]1c(=O)c(Cl)cc2ccccc12 Amb24085901 [0,1,0,0,0,0|2,0,0]=3 641 B14R2.8188 C[n]1c(=O)c(I)cc2ccccc12 Amb24102257 [0,1,0,0,0,0|2,0,0]=3 642 B14R2.8188 Cc1[n]c2ccccc2c(Br)c1Br Amb20239900 [0,1,0,0,0,0|3,0,0]=4 643 B14R2.8188 Cc1[n]c2ccccc2c(Br)c1Cl Amb20239720 [0,1,0,0,0,0|3,0,0]=4 644 B14R2.8188 Cc1[n]c2ccccc2c(Br)c1I Amb25819986 [0,1,0,0,0,0|3,0,0]=4 645 B14R2.8188 Cc1[n]c2ccccc2c(Cl)c1Br Amb20239854 [0,1,0,0,0,0|3,0,0]=4 646 B14R2.8188 Cc1[n]c2ccccc2c(Cl)c1Cl Amb20239675 [0,1,0,0,0,0|3,0,0]=4 647 B14R2.8188 Cc1[n]c2ccccc2c(Cl)c1I Amb23536188 [0,1,0,0,0,0|3,0,0]=4 648 B14R2.8188 Cc1[n]c2ccccc2c(Cl)c1N Amb25189967 [0,1,0,0,0,0|3,0,0]=4 649 B14R2.8188 Cc1[n]c2ccccc2c(N)c1Br Amb20239946 [0,1,0,0,0,0|3,0,0]=4 650 B14R2.8188 Cc1[n]c2ccccc2c(N)c1Cl Amb18129991 [0,1,0,0,0,0|3,0,0]=4 651 B14R2.8188 Cc1[n]c2ccccc2c(N)c1I Amb25156460 [0,1,0,0,0,0|3,0,0]=4 652 B14R2.8188 Cc1[n]c2ccccc2c(N)c1N Amb24407169 [0,1,0,0,0,0|3,0,0]=4 653 B14R2.8188 Cc1[n]c2ccccc2c(O)c1Br Amb20239810 [0,1,0,0,0,0|3,0,0]=4 654 B14R2.8188 Cc1[n]c2ccccc2c(O)c1Cl Amb18130041 [0,1,0,0,0,0|3,0,0]=4 655 B14R2.8188 Cc1c(Br)c(Cl)[n]c2ccccc21 Amb23556984 [0,1,0,0,0,0|3,0,0]=4 656 B14R2.8188 Cc1c(C)cc2c(c1Br)cccc2 Amb2388319 [0,1,0,0,0,0|3,0,0]=4 657 B14R2.8188 Cc1c(C)nc2c(c1C)cccc2 Amb1421566 [0,1,0,0,0,0|3,0,0]=4 658 B14R2.8188 Cc1c(C)nc2c(c1O)cccc2 Amb10604258 [0,1,0,0,0,0|3,0,0]=4 659 B14R2.8188 Cc1c(Cl)[n]c2ccccc2c1C Amb24698947 [0,1,0,0,0,0|3,0,0]=4 660 B14R2.8188 Cc1c(Cl)c(C)[n]c2ccccc12 Amb23555807 [0,1,0,0,0,0|3,0,0]=4 661 B14R2.8188 Cc1c(Cl)c2ccccc2[n]c1C Amb19050431 [0,1,0,0,0,0|3,0,0]=4 662 B14R2.8188 Cc1c(N)c2ccccc2[n]c1C Amb18943873 [0,1,0,0,0,0|3,0,0]=4 663 B14R2.8188 Cc1c(O)[n]c2ccccc2c1Br Amb24065666 [0,1,0,0,0,0|2,0,1]=4 664 B14R2.8188 Cc1c(O)c(Cl)[n]c2ccccc21 Amb25108358 [0,1,0,0,0,0|2,0,0]=3 665 B14R2.8188 Cc1c(O)cc2cccc[n]2c1=O Amb24065653 [0,1,0,0,0,0|3,0,0]=4 666 B14R2.8188 Cc1c(O)nc2c(c1C)cccc2 Amb17594354 [0,1,0,0,0,0|2,0,1]=4 667 B14R2.8188 Cc1c2ccccc2cc(N)c1N Amb24663153 [0,1,0,0,0,0|3,0,0]=4 668 B14R2.8188 Cc1c2ccccc2cc(O)c1C Amb24309351 [0,1,0,0,0,0|2,0,0]=3 669 B14R2.8188 Cc1cc2ccccc2c(N)c1C Amb18647536 [0,1,0,0,0,0|3,0,0]=4 670 B14R2.8188 Cc1cc2ccccc2c(O)c1O Amb24686471 [0,1,0,0,0,0|2,0,0]=3 671 B14R2.8188 Cc1nc2ccccc2n(c1=O)C Amb1677472 [0,1,0,0,0,0|3,0,0]=4 672 B14R2.8188 Clc1c(Br)c(Cl)[n]c2ccccc12 Amb21961810 [0,1,0,0,0,0|3,0,0]=4 673 B14R2.8188 Clc1c(Cl)cc2c(c1O)cccc2 Amb17595761 [0,1,0,0,0,0|3,0,0]=4 674 B14R2.8188 Clc1c(I)c(Cl)[n]c2ccccc12 Amb22546714 [0,1,0,0,0,0|3,0,0]=4 675 B14R2.8188 Clc1c(O)cc2c(c1Cl)cccc2 Amb17595770 [0,1,0,0,0,0|2,0,0]=3 676 B14R2.8188 Ic1c(Br)cc2c(c1F)cccc2 Amb16185878 [0,1,0,0,0,0|3,0,0]=4 677 B14R2.8188 NC1=C(O)c2ccccc2OC1=O Amb18127826 [0,1,0,0,0,0|1,0,0]=2 678 B14R2.8188 NC1C(=O)Oc2ccccc2C1=O Amb25363267 [0,1,0,0,0,0|1,0,1]=3 679 B14R2.8188 NC=1C(=O)Nc2ccccc2C1N Amb18647899 [0,1,0,0,0,0|2,0,0]=3 680 B14R2.8188 NC=1C(=O)Oc2ccccc2C1N Amb18647951 [0,1,0,0,0,0|1,0,0]=2 681 B14R2.8188 NC=1C(=O)Sc2ccccc2C1N Amb20414819 [0,1,0,0,0,0|1,1,0]=3 682 B14R2.8188 NN1C(=N)c2ccccc2NC1=O Amb25307925 [0,1,0,0,0,0|3,0,0]=4 683 B14R2.8188 NN1C(=O)Nc2ccccc2C1=O Amb18186048 [0,1,0,0,0,0|3,0,0]=4 684 B14R2.8188 NN1c2ccccc2NC(=O)C1=O Amb25828466 [0,1,0,0,0,0|2,0,1]=4 685 B14R2.8188 Nc1[n]c2ccccc2c(Br)c1Cl Amb25323913 [0,1,0,0,0,0|3,0,0]=4 686 B14R2.8188 Nc1[n]c2ccccc2c(Cl)c1Cl Amb25243791 [0,1,0,0,0,0|3,0,0]=4 687 B14R2.8188 Nc1[n]c2ccccc2c(O)c1Br Amb25686170 [0,1,0,0,0,0|3,0,0]=4 688 B14R2.8188 Nc1c(Cl)[n]c2ccccc2c1Cl Amb22753411 [0,1,0,0,0,0|3,0,0]=4 689 B14R2.8188 Nc1c(Cl)c(O)[n]c2ccccc21 Amb24119519 [0,1,0,0,0,0|2,0,1]=4 690 B14R2.8188 Nc1c(Cl)c2ccccc2[n]c1N Amb25172544 [0,1,0,0,0,0|3,0,0]=4 691 B14R2.8188 Nc1c(Cl)c2ccccc2cc1Br Amb25180226 [0,1,0,0,0,0|3,0,0]=4 692 B14R2.8188 Nc1c(Cl)c2ccccc2cc1Cl Amb25278245 [0,1,0,0,0,0|3,0,0]=4 693 B14R2.8188 Nc1c(O)c(Br)cc2ccccc21 Amb18663067 [0,1,0,0,0,0|2,0,0]=3 694 B14R2.8188 Nc1c(O)c(Cl)cc2ccccc21 Amb18130046 [0,1,0,0,0,0|2,0,0]=3 695 B14R2.8188 Nc1c(O)cc2c(c1N)cccc2 Amb17594400 [0,1,0,0,0,0|2,0,0]=3 696 B14R2.8188 Nc1cc2ccccc2c(Cl)c1Cl Amb24585688 [0,1,0,0,0,0|3,0,0]=4 697 B14R2.8188 Nc1cc2ccccc2c(N)c1N Amb25327858 [0,1,0,0,0,0|3,0,0]=4 698 B14R2.8188 Nn1c(=O)cc2c(c1C)cccc2 Amb10564854 [0,1,0,0,0,0|3,0,0]=4 699 B14R2.8188 O=C1C(=Cc2c(C1=O)cccc2)O Amb17594373 [0,1,0,0,0,0|1,0,0]=2 700 B14R2.8188 O=C1C(=O)Cc2ccccc2C1=O Amb24575959 [0,1,0,0,0,0|1,0,1]=3 701 B14R2.8188 O=C1C(=O)Oc2ccccc2C1=O Amb24492787 [0,1,0,0,0,0|0,0,1]=2 702 B14R2.8188 O=C1Cc2ccccc2C(=O)N1C Amb2406825 [0,1,0,0,0,0|3,0,0]=4 703 B14R2.8188 O=C1Cc2ccccc2C(=O)N1O Amb10553629 [0,1,0,0,0,0|2,0,0]=3 704 B14R2.8188 O=C1Nc2ccccc2C(Cl)=C1Br Amb23533718 [0,1,0,0,0,0|2,0,0]=3 705 B14R2.8188 O=C1Nc2ccccc2C(Cl)=C1Cl Amb24383080 [0,1,0,0,0,0|2,0,0]=3 706 B14R2.8188 O=C1Oc2ccccc2C(Br)=C1Br Amb24084280 [0,1,0,0,0,0|1,0,0]=2 707 B14R2.8188 O=C1Oc2ccccc2C(C1Br)Br Amb2137043 [0,1,0,0,0,0|1,0,2]=4 708 B14R2.8188 O=C1Oc2ccccc2C(Cl)=C1Cl Amb20001572 [0,1,0,0,0,0|1,0,0]=2 709 B14R2.8188 O=C1c2ccccc2NC(=O)N1Cl Amb25190171 [0,1,0,0,0,0|3,0,0]=4 710 B14R2.8188 O=c1[nH]c2ccccc2c(c1Br)O Amb1303079 [0,1,0,0,0,0|2,0,0]=3 711 B14R2.8188 O=c1oc2ccccc2c(c1Br)O Amb1883962 [0,1,0,0,0,0|1,0,0]=2 712 B14R2.8188 OC1=C(Br)C(=O)Nc2ccccc21 Amb19667944 [0,1,0,0,0,0|2,0,0]=3 713 B14R2.8188 OC1=C(Br)C(=O)Oc2ccccc21 Amb19517267 [0,1,0,0,0,0|1,0,0]=2 714 B14R2.8188 OC1=C(Cl)C(=O)Nc2ccccc21 Amb22433700 [0,1,0,0,0,0|2,0,0]=3 715 B14R2.8188 OC1=C(F)C(=O)Nc2ccccc21 Amb19667464 [0,1,0,0,0,0|2,0,0]=3 716 B14R2.8188 OC1=C(I)C(=O)Nc2[n]cccc21 Amb20660455 [0,1,0,0,0,0|3,0,0]=4 717 B14R2.8188 OC1Sc2ccccc2N(O)C1=O Amb25837921 [0,1,0,0,0,0|2,0,1]=4 718 B14R2.8188 OC=1C(=O)Nc2cc[n]cc2C1F Amb24391580 [0,1,0,0,0,0|2,0,0]=3 719 B14R2.8188 OC=1C(=O)Nc2ccc[n]c2C1F Amb25758727 [0,1,0,0,0,0|2,0,0]=3 720 B14R2.8188 OC=1C(=O)Nc2ccccc2C1O Amb21912810 [0,1,0,0,0,0|1,0,0]=2 721 B14R2.8188 OC=1C(=O)Oc2ccccc2C1I Amb22488353 [0,1,0,0,0,0|0,0,0]=1 722 B14R2.8188 OC=1C(=O)c2ccccc2SC1Br Amb25315767 [0,1,0,0,0,0|1,1,0]=3 723 B14R2.8188 ON1C(=O)Nc2ccccc2C1=O Amb25743026 [0,1,0,0,0,0|2,0,0]=3 724 B14R2.8188 ON1C(=O)c2ccc[n]c2NC1=O Amb25669367 [0,1,0,0,0,0|3,0,0]=4 725 B14R2.8188 ON1C(=O)c2ccccc2N=C1S Amb19792176 [0,1,0,0,0,0|2,1,0]=4 726 B14R2.8188 ON1C(=O)c2ccccc2NC1=S Amb21884839 [0,1,0,0,0,0|2,1,0]=4 727 B14R2.8188 ON1c2ccccc2OC(=O)C1=O Amb20663543 [0,1,0,0,0,0|1,0,1]=3 728 B14R2.8188 O[C@H]1Oc2ccccc2N(O)C1=O Amb24412905 [0,1,0,0,0,0|2,0,1]=4 729 B14R2.8188 O[C@H]1[C@@H](O)c2ccccc2NC1=O Amb24611199 [0,1,0,0,0,0|1,0,2]=4 730 B14R2.8188 Oc1c(Br)[n]c2ccccc2c1Br Amb24579499 [0,1,0,0,0,0|2,0,0]=3 731 B14R2.8188 Oc1c(C)nc2c(c1Br)cccc2 Amb15695061 [0,1,0,0,0,0|2,0,0]=3 732 B14R2.8188 Oc1c(Cl)cc2c(c1Cl)cccc2 Amb17595764 [0,1,0,0,0,0|2,0,0]=3 733 B14R2.8188 Oc1c(N)cc2c(c1N)cccc2 Amb17594395 [0,1,0,0,0,0|2,0,0]=3 734 B14R2.8188 Oc1c(N)cc2c(c1O)cccc2 Amb17594426 [0,1,0,0,0,0|2,0,0]=3 735 B14R2.8188 Oc1c(O)cc2c(c1N)cccc2 Amb17594436 [0,1,0,0,0,0|1,0,1]=3 736 B14R2.8188 Oc1c(O)cc2c(c1O)cccc2 Amb17594459 [0,1,0,0,0,0|1,0,1]=3 737 B14R2.8188 Oc1nc2ccccc2n(c1=O)C Amb10553642 [0,1,0,0,0,0|2,0,0]=3 738 B14R2.8188 Oc1oc2ccccc2c(=O)c1Br Amb24097513 [0,1,0,0,0,0|1,0,1]=3 739 B14R2.8239 Brc1ccc2c(c1)cc(c(n2)Cl)C Amb1994745 [0,1,0,0,0,0|3,0,0]=4 740 B14R2.8239 Brc1ccc2c(c1)cc(c(n2)N)C Amb1994288 [0,1,0,0,0,0|3,0,0]=4 741 B14R2.8239 Brc1ccc2c(c1)nc(c(c2)C)Cl Amb1994534 [0,1,0,0,0,0|3,0,0]=4 742 B14R2.8239 Brc1ccc2c(c1)nc(c(c2)C)N Amb1994289 [0,1,0,0,0,0|3,0,0]=4 743 B14R2.8239 C=C1Nc2ccc(Cl)cc2NC1=O Amb25095814 [0,1,0,0,0,0|3,0,0]=4 744 B14R2.8239 CC1=Cc2cc(Br)c[n]c2NC1=O Amb22497903 [0,1,0,0,0,0|3,0,0]=4 745 B14R2.8239 CC1=Cc2cc(Br)ccc2NC1=O Amb24452914 [0,1,0,0,0,0|2,0,0]=3 746 B14R2.8239 CC1=Cc2cc(Cl)ccc2NC1=O Amb25293769 [0,1,0,0,0,0|2,0,0]=3 747 B14R2.8239 CC1=Cc2cc(N)ccc2NC1=O Amb18529717 [0,1,0,0,0,0|2,0,0]=3 748 B14R2.8239 CC1=Cc2cc(O)ccc2NC1=O Amb18538502 [0,1,0,0,0,0|2,0,0]=3 749 B14R2.8239 CC1=Cc2cc(O)ccc2OC1=O Amb24492395 [0,1,0,0,0,0|1,0,0]=2 750 B14R2.8239 CC1=Cc2ccc(N)cc2NC1=O Amb18537355 [0,1,0,0,0,0|2,0,0]=3 751 B14R2.8239 CC1=Cc2ccc(N)cc2OC1=O Amb24424532 [0,1,0,0,0,0|1,0,0]=2 752 B14R2.8239 CC1=Cc2ccc(O)cc2NC1=O Amb22752603 [0,1,0,0,0,0|2,0,0]=3 753 B14R2.8239 CC1=Cc2ccc(O)cc2OC1=O Amb18127560 [0,1,0,0,0,0|1,0,0]=2 754 B14R2.8239 CC1=Nc2cc(Br)ccc2NC1=O Amb20412635 [0,1,0,0,0,0|3,0,0]=4 755 B14R2.8239 CC1=Nc2cc(Cl)ccc2NC1=O Amb25192470 [0,1,0,0,0,0|3,0,0]=4 756 B14R2.8239 CC1=Nc2ccc(Br)cc2NC1=O Amb19657942 [0,1,0,0,0,0|3,0,0]=4 757 B14R2.8239 CC1=Nc2ccc(C)cc2CC1=O Amb25334939 [0,1,0,0,0,0|3,0,0]=4 758 B14R2.8239 CC1=Nc2ccc(Cl)cc2NC1=O Amb20412679 [0,1,0,0,0,0|3,0,0]=4 759 B14R2.8239 CC1=Nc2ccc(N)cc2OC1=O Amb18028962 [0,1,0,0,0,0|2,0,0]=3 760 B14R2.8239 CC1=Nc2ccc(O)cc2OC1=O Amb18127819 [0,1,0,0,0,0|2,0,0]=3 761 B14R2.8239 CC1Cc2cc(O)ccc2OC1=O Amb25729135 [0,1,0,0,0,0|1,0,2]=4 762 B14R2.8239 CN1Cc2cc(Br)ccc2OC1=O Amb17844347 [0,1,0,0,0,0|2,0,1]=4 763 B14R2.8239 Cc1[n]c2cc(Cl)ccc2cc1N Amb20239531 [0,1,0,0,0,0|3,0,0]=4 764 B14R2.8239 Cc1[n]c2cc(Cl)ccc2cc1N Amb22753391 [0,1,0,0,0,0|3,0,0]=4 765 B14R2.8239 Cc1[n]c2cc(F)ccc2[nH]c1=O Amb24091697 [0,1,0,0,0,0|3,0,0]=4 766 B14R2.8239 Cc1[n]c2cc(N)ccc2[n]c1O Amb18127409 [0,1,0,0,0,0|3,0,0]=4 767 B14R2.8239 Cc1[n]c2ccc(Br)cc2cc1O Amb22496218 [0,1,0,0,0,0|2,0,0]=3 768 B14R2.8239 Cc1[n]c2ccc(Cl)cc2cc1N Amb22753390 [0,1,0,0,0,0|3,0,0]=4 769 B14R2.8239 Cc1[n]c2ccc(F)cc2[nH]c1=O Amb24092086 [0,1,0,0,0,0|3,0,0]=4 770 B14R2.8239 Cc1[n]c2ccc(N)cc2[n]c1O Amb24091990 [0,1,0,0,0,0|3,0,0]=4 771 B14R2.8239 Cc1cc2C=C(Br)C(=O)Oc2cc1 Amb23580464 [0,1,0,0,0,0|1,0,0]=2 772 B14R2.8239 Cc1cc2C=C(C)C(=O)Nc2cc1 Amb24703263 [0,1,0,0,0,0|2,0,0]=3 773 B14R2.8239 Cc1cc2C=C(Cl)C(=O)Oc2cc1 Amb24084284 [0,1,0,0,0,0|1,0,0]=2 774 B14R2.8239 Cc1cc2C=C(O)C(=O)Nc2[n]c1 Amb24464093 [0,1,0,0,0,0|2,0,0]=3 775 B14R2.8239 Cc1cc2C=C(O)C(=O)Nc2cc1 Amb22752606 [0,1,0,0,0,0|1,0,0]=2 776 B14R2.8239 Cc1cc2C=CC(=O)Oc2cc1O Amb18127564 [0,1,0,0,0,0|3,0,0]=4 777 B14R2.8239 Cc1cc2N=C(N)C(=O)Nc2cc1 Amb18127438 [0,1,0,0,0,0|3,0,0]=4 778 B14R2.8239 Cc1cc2N=C(N)C(=O)Oc2cc1 Amb18647952 [0,1,0,0,0,0|2,0,0]=3 779 B14R2.8239 Cc1cc2NC(=C)C(=O)Nc2cc1 Amb25222560 [0,1,0,0,0,0|3,0,0]=4 780 B14R2.8239 Cc1cc2NC(=O)C(=O)Nc2cc1 Amb18043058 [0,1,0,0,0,0|2,0,1]=4 781 B14R2.8239 Cc1cc2NC(=O)C(C)=Cc2cc1 Amb24670978 [0,1,0,0,0,0|2,0,0]=3 782 B14R2.8239 Cc1cc2NC(=O)C(C)=Nc2cc1 Amb20412682 [0,1,0,0,0,0|3,0,0]=4 783 B14R2.8239 Cc1cc2NC(=O)C(N)=Nc2cc1 Amb18647896 [0,1,0,0,0,0|3,0,0]=4 784 B14R2.8239 Cc1cc2NC(=O)C(O)=Cc2cc1 Amb22752604 [0,1,0,0,0,0|1,0,0]=2 785 B14R2.8239 Cc1cc2NC(=O)C(O)Oc2cc1 Amb25674636 [0,1,0,0,0,0|2,0,1]=4 786 B14R2.8239 Cc1cc2OC(O)C(=O)Nc2cc1 Amb25714187 [0,1,0,0,0,0|2,0,1]=4 787 B14R2.8239 Cc1cc2[n]c(C)c(=O)[nH]c2cc1 Amb24085592 [0,1,0,0,0,0|3,0,0]=4 788 B14R2.8239 Cc1cc2c[n]c(O)cc2cc1O Amb24556178 [0,1,0,0,0,0|3,0,0]=4 789 B14R2.8239 Cc1cc2cc(Br)c(Cl)[n]c2cc1 Amb23449340 [0,1,0,0,0,0|3,0,0]=4 790 B14R2.8239 Cc1cc2cc(Br)c(N)[n]c2cc1 Amb23449355 [0,1,0,0,0,0|3,0,0]=4 791 B14R2.8239 Cc1cc2cc(Cl)ccc2[n]c1C Amb22755382 [0,1,0,0,0,0|3,0,0]=4 792 B14R2.8239 Cc1cc2cc(Cl)ccc2[n]c1S Amb25198540 [0,1,0,0,0,0|2,1,0]=4 793 B14R2.8239 Cc1cc2cc(N)c(C)cc2cc1 Amb24432802 [0,1,0,0,0,0|3,0,0]=4 794 B14R2.8239 Cc1cc2cc(N)c(Cl)[n]c2cc1 Amb25159188 [0,1,0,0,0,0|3,0,0]=4 795 B14R2.8239 Cc1cc2cc(N)c(N)[n]c2cc1 Amb24724908 [0,1,0,0,0,0|3,0,0]=4 796 B14R2.8239 Cc1cc2cc(O)c(C)cc2cc1 Amb25093730 [0,1,0,0,0,0|2,0,0]=3 797 B14R2.8239 Cc1cc2cc(O)c(O)cc2cc1 Amb24707060 [0,1,0,0,0,0|1,0,1]=3 798 B14R2.8239 Cc1cc2cc(O)ccc2[n]c1C Amb25768556 [0,1,0,0,0,0|3,0,0]=4 799 B14R2.8239 Cc1cc2ccc(Br)cc2[n]c1I Amb24679380 [0,1,0,0,0,0|3,0,0]=4 800 B14R2.8239 Cc1cc2ccc(F)cc2[n]c1S Amb25800900 [0,1,0,0,0,0|2,1,0]=4 801 B14R2.8239 Cc1ccc2C=C(Br)C(=O)Nc2[n]1 Amb23455854 [0,1,0,0,0,0|3,0,0]=4 802 B14R2.8239 Cc1ccc2NC(=O)C(O)Cc2c1 Amb25037192 [0,1,0,0,0,0|1,0,2]=4 803 B14R2.8239 Cc1ccc2c(c1)cc(c(n2)Br)C Amb17158082 [0,1,0,0,0,0|3,0,0]=4 804 B14R2.8239 Cc1ccc2c(c1)cc(c(n2)Cl)C Amb1994494 [0,1,0,0,0,0|3,0,0]=4 805 B14R2.8239 Cc1ccc2c(c1)cc(c(n2)N)C Amb1994292 [0,1,0,0,0,0|3,0,0]=4 806 B14R2.8239 Cc1ccc2c(c1)nc(c(c2)C)Cl Amb1994496 [0,1,0,0,0,0|3,0,0]=4 807 B14R2.8239 Cc1ccc2c(c1)nc(c(c2)C)N Amb1994293 [0,1,0,0,0,0|3,0,0]=4 808 B14R2.8239 Cc1ccc2cc(O)c(Cl)cc2[n]1 Amb25116556 [0,1,0,0,0,0|3,0,0]=4 809 B14R2.8239 Clc1[n]c2ccc(Br)cc2cc1Br Amb23449321 [0,1,0,0,0,0|3,0,0]=4 810 B14R2.8239 Clc1[n]c2ccc(I)cc2cc1Br Amb23449344 [0,1,0,0,0,0|3,0,0]=4 811 B14R2.8239 Clc1cc2cc(Br)c(Cl)[n]c2cc1 Amb23449318 [0,1,0,0,0,0|3,0,0]=4 812 B14R2.8239 Clc1cc2cc(I)ccc2[n]c1Cl Amb23449343 [0,1,0,0,0,0|3,0,0]=4 813 B14R2.8239 Clc1ccc2c(c1)[nH]c(=O)c(=O)[nH]2 Amb2405481 [0,1,0,0,0,0|2,0,1]=4 814 B14R2.8239 Clc1ccc2c(c1)cc(c(c2)Cl)Cl Amb17620877 [0,1,0,0,0,0|3,0,0]=4 815 B14R2.8239 Clc1ccc2c(c1)cc(c(c2)O)Cl Amb17595771 [0,1,0,0,0,0|2,0,0]=3 816 B14R2.8239 Clc1ccc2c(c1)cc(c(n2)Br)C Amb17162527 [0,1,0,0,0,0|3,0,0]=4 817 B14R2.8239 Clc1ccc2c(c1)cc(c(n2)Cl)C Amb1994358 [0,1,0,0,0,0|3,0,0]=4 818 B14R2.8239 Clc1ccc2c(c1)cc(c(n2)N)C Amb1994290 [0,1,0,0,0,0|3,0,0]=4 819 B14R2.8239 Clc1ccc2c(c1)nc(c(c2)C)Br Amb17162526 [0,1,0,0,0,0|3,0,0]=4 820 B14R2.8239 Clc1ccc2c(c1)nc(c(c2)C)Cl Amb1994535 [0,1,0,0,0,0|3,0,0]=4 821 B14R2.8239 Clc1ccc2c(c1)nc(c(c2)C)N Amb1994291 [0,1,0,0,0,0|3,0,0]=4 822 B14R2.8239 Fc1cc2[n]c(Br)c(F)cc2cc1 Amb22547382 [0,1,0,0,0,0|3,0,0]=4 823 B14R2.8239 Fc1cc2cc(Br)c(Cl)[n]c2cc1 Amb23449322 [0,1,0,0,0,0|3,0,0]=4 824 B14R2.8239 Fc1cc2cc(Cl)c(Cl)[n]c2cc1 Amb23449323 [0,1,0,0,0,0|3,0,0]=4 825 B14R2.8239 Fc1cc2cc(Cl)ccc2[n]c1Br Amb22547362 [0,1,0,0,0,0|3,0,0]=4 826 B14R2.8239 Fc1ccc2c(c1)cc(c(n2)Br)C Amb17158882 [0,1,0,0,0,0|3,0,0]=4 827 B14R2.8239 Fc1ccc2c(c1)cc(c(n2)Cl)C Amb1994530 [0,1,0,0,0,0|3,0,0]=4 828 B14R2.8239 Fc1ccc2c(c1)cc(c(n2)N)C Amb1994296 [0,1,0,0,0,0|3,0,0]=4 829 B14R2.8239 Fc1ccc2c(c1)nc(c(c2)C)Br Amb17158881 [0,1,0,0,0,0|3,0,0]=4 830 B14R2.8239 Fc1ccc2c(c1)nc(c(c2)C)Cl Amb1994540 [0,1,0,0,0,0|3,0,0]=4 831 B14R2.8239 Fc1ccc2c(c1)nc(c(c2)C)N Amb1994297 [0,1,0,0,0,0|3,0,0]=4 832 B14R2.8239 N=C1Cc2ccc(O)cc2OC1=O Amb24544658 [0,1,0,0,0,0|1,0,1]=3 833 B14R2.8239 NC1=CC2=NC(=O)C(=O)N=C2C=C1 Amb24367324 [0,1,0,0,0,0|2,0,1]=4 834 B14R2.8239 NC1=Cc2cc(Br)ccc2OC1=O Amb25116013 [0,1,0,0,0,0|1,0,0]=2 835 B14R2.8239 NC1=Cc2cc(O)ccc2OC1=O Amb25189956 [0,1,0,0,0,0|1,0,0]=2 836 B14R2.8239 NC1=Cc2ccc(F)cc2OC1=O Amb25127899 [0,1,0,0,0,0|1,0,0]=2 837 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb19958301 [0,1,0,0,0,0|1,0,0]=2 838 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb22899519 [0,1,0,0,0,0|1,0,0]=2 839 B14R2.8239 NC1=Nc2cc(Cl)ccc2OC1=O Amb24309782 [0,1,0,0,0,0|2,0,0]=3 840 B14R2.8239 Nc1[n]c2cc(Br)ccc2[n]c1O Amb22235018 [0,1,0,0,0,0|3,0,0]=4 841 B14R2.8239 Nc1[n]c2ccc(F)cc2cc1Br Amb23449359 [0,1,0,0,0,0|3,0,0]=4 842 B14R2.8239 Nc1cc2C=C(O)C(=O)Oc2cc1 Amb24433960 [0,1,0,0,0,0|0,0,0]=1 843 B14R2.8239 Nc1cc2C=CC(=O)Oc2cc1O Amb24084294 [0,1,0,0,0,0|3,0,0]=4 844 B14R2.8239 Nc1cc2NC(=O)C(=O)Nc2cc1 Amb18038531 [0,1,0,0,0,0|2,0,1]=4 845 B14R2.8239 Nc1cc2NC(=O)C(=O)Nc2cc1 Amb21955545 [0,1,0,0,0,0|2,0,1]=4 846 B14R2.8239 Nc1cc2NC(=O)C(Br)=Cc2cc1 Amb24754098 [0,1,0,0,0,0|2,0,0]=3 847 B14R2.8239 Nc1cc2OC(=O)C=Cc2cc1O Amb24084290 [0,1,0,0,0,0|3,0,0]=4 848 B14R2.8239 Nc1cc2cc(Br)ccc2[n]c1Cl Amb24566024 [0,1,0,0,0,0|3,0,0]=4 849 B14R2.8239 Nc1cc2cc(Cl)ccc2[n]c1Cl Amb25673872 [0,1,0,0,0,0|3,0,0]=4 850 B14R2.8239 Nc1cc2ccc(Br)cc2[n]c1Cl Amb25159109 [0,1,0,0,0,0|3,0,0]=4 851 B14R2.8239 Nc1cc2ccc(Cl)cc2cc1N Amb25180841 [0,1,0,0,0,0|3,0,0]=4 852 B14R2.8239 Nc1ccc2C=C(Cl)C(=O)Nc2[n]1 Amb18130241 [0,1,0,0,0,0|3,0,0]=4 853 B14R2.8239 Nc1ccc2C=C(I)C(=O)Nc2[n]1 Amb23510058 [0,1,0,0,0,0|3,0,0]=4 854 B14R2.8239 Nc1ccc2c(c1)cc(c(n2)Cl)C Amb17064878 [0,1,0,0,0,0|3,0,0]=4 855 B14R2.8239 O=C1C=CC2=CC(=O)C(=O)C=C2O1 Amb24495020 [0,1,0,0,0,0|2,0,1]=4 856 B14R2.8239 O=C1Nc2[n]c(Cl)ccc2C=C1Cl Amb24341184 [0,1,0,0,0,0|3,0,0]=4 857 B14R2.8239 O=C1Nc2[n]c(Cl)ccc2C=C1F Amb25690864 [0,1,0,0,0,0|3,0,0]=4 858 B14R2.8239 O=C1Nc2cc(Br)ccc2NC1=O Amb18541037 [0,1,0,0,0,0|2,0,1]=4 859 B14R2.8239 O=C1Nc2cc(Cl)ccc2C=C1Br Amb24375711 [0,1,0,0,0,0|2,0,0]=3 860 B14R2.8239 O=C1Nc2cc(Cl)ccc2NC1=O Amb18043060 [0,1,0,0,0,0|2,0,1]=4 861 B14R2.8239 O=C1Nc2cc(F)ccc2C=C1F Amb22547386 [0,1,0,0,0,0|2,0,0]=3 862 B14R2.8239 O=C1Nc2cc(F)ccc2N=C1Cl Amb25738053 [0,1,0,0,0,0|3,0,0]=4 863 B14R2.8239 O=C1Nc2cc(F)ccc2NC1=O Amb18043059 [0,1,0,0,0,0|2,0,1]=4 864 B14R2.8239 O=C1Nc2cc(I)ccc2NC1=O Amb24488714 [0,1,0,0,0,0|2,0,1]=4 865 B14R2.8239 O=C1Nc2cc(S)ccc2NC1=O Amb25088247 [0,1,0,0,0,0|2,0,1]=4 866 B14R2.8239 O=C1Nc2ccc(Cl)cc2C=C1Br Amb23450241 [0,1,0,0,0,0|2,0,0]=3 867 B14R2.8239 O=C1Nc2ccc(Cl)cc2C=C1F Amb22547371 [0,1,0,0,0,0|2,0,0]=3 868 B14R2.8239 O=C1Nc2ccc(Cl)cc2N=C1Cl Amb25766506 [0,1,0,0,0,0|3,0,0]=4 869 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1Br Amb23451834 [0,1,0,0,0,0|2,0,0]=3 870 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1Cl Amb23451835 [0,1,0,0,0,0|2,0,0]=3 871 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1F Amb22641642 [0,1,0,0,0,0|2,0,0]=3 872 B14R2.8239 O=C1Oc2cc(F)ccc2C=C1Br Amb24611080 [0,1,0,0,0,0|1,0,0]=2 873 B14R2.8239 O=C1Oc2cc(F)ccc2C=C1I Amb25178755 [0,1,0,0,0,0|1,0,0]=2 874 B14R2.8239 O=C1Oc2cc(F)ccc2NC1=O Amb25245855 [0,1,0,0,0,0|1,0,1]=3 875 B14R2.8239 O=C1Oc2ccc(Cl)cc2C=C1Br Amb23580471 [0,1,0,0,0,0|1,0,0]=2 876 B14R2.8239 O=C1Oc2ccc(Cl)cc2C=C1Cl Amb24084282 [0,1,0,0,0,0|1,0,0]=2 877 B14R2.8239 O=C1Oc2ccc(Cl)cc2N=C1Cl Amb24084257 [0,1,0,0,0,0|2,0,0]=3 878 B14R2.8239 O=C1Oc2ccc(Cl)cc2NC1=O Amb25190428 [0,1,0,0,0,0|1,0,1]=3 879 B14R2.8239 O=C1Oc2ccc(Cl)cc2NC1=S Amb24490403 [0,1,0,0,0,0|1,1,0]=3 880 B14R2.8239 O=C1Oc2ccc(F)cc2C=C1Br Amb23580472 [0,1,0,0,0,0|1,0,0]=2 881 B14R2.8239 O=C1Oc2ccc(F)cc2NC1=O Amb25721183 [0,1,0,0,0,0|1,0,1]=3 882 B14R2.8239 O=C1Oc2ccc(cc2NC1C)C Amb17217251 [0,1,0,0,0,0|2,0,1]=4 883 B14R2.8239 O=C1Oc2ccc(cc2NC1C)Cl Amb17217250 [0,1,0,0,0,0|2,0,1]=4 884 B14R2.8239 OC1=Cc2cc(Br)c[n]c2NC1=O Amb25855174 [0,1,0,0,0,0|2,0,0]=3 885 B14R2.8239 OC1=Cc2cc(Br)ccc2OC1=O Amb22734842 [0,1,0,0,0,0|0,0,0]=1 886 B14R2.8239 OC1=Cc2cc(Cl)ccc2NC1=O Amb24658218 [0,1,0,0,0,0|1,0,0]=2 887 B14R2.8239 OC1=Cc2cc(F)c[n]c2NC1=O Amb25054129 [0,1,0,0,0,0|2,0,0]=3 888 B14R2.8239 OC1=Cc2cc(F)ccc2NC1=O Amb25124313 [0,1,0,0,0,0|1,0,0]=2 889 B14R2.8239 OC1=Cc2cc(I)c[n]c2NC1=O Amb25809190 [0,1,0,0,0,0|2,0,0]=3 890 B14R2.8239 OC1=Cc2ccc(Br)cc2NC1=O Amb25041039 [0,1,0,0,0,0|1,0,0]=2 891 B14R2.8239 OC1=Cc2ccc(F)cc2NC1=O Amb24443312 [0,1,0,0,0,0|1,0,0]=2 892 B14R2.8239 OC1Cc2cc(Br)ccc2NC1=O Amb22899291 [0,1,0,0,0,0|1,0,2]=4 893 B14R2.8239 OC1Cc2cc(F)ccc2NC1=O Amb24474999 [0,1,0,0,0,0|1,0,2]=4 894 B14R2.8239 OC1Cc2ccc(F)cc2NC1=O Amb25246611 [0,1,0,0,0,0|1,0,2]=4 895 B14R2.8239 O[C@@H]1Cc2cc(F)ccc2NC1=O Amb25806703 [0,1,0,0,0,0|1,0,2]=4 896 B14R2.8239 O[C@@H]1Cc2ccc(F)cc2NC1=O Amb24642426 [0,1,0,0,0,0|1,0,2]=4 897 B14R2.8239 O[C@H]1Cc2cc(F)ccc2NC1=O Amb24352306 [0,1,0,0,0,0|1,0,2]=4 898 B14R2.8239 Oc1cc2C=C(Cl)C(=O)Nc2cc1 Amb18035970 [0,1,0,0,0,0|2,0,0]=3 899 B14R2.8239 Oc1cc2C=CC(=O)Oc2cc1O Amb18511463 [0,1,0,0,0,0|2,0,1]=4 900 B14R2.8239 Oc1cc2CC(=O)C(=O)Oc2cc1 Amb24492602 [0,1,0,0,0,0|0,0,2]=3 901 B14R2.8239 Oc1cc2NC(=O)C(=O)Nc2cc1 Amb18128049 [0,1,0,0,0,0|2,0,1]=4 902 B14R2.8239 Oc1cc2OC(=O)C(=O)Nc2cc1 Amb18128302 [0,1,0,0,0,0|1,0,1]=3 903 B14R2.8239 Oc1cc2OC(=O)C(Br)=Cc2cc1 Amb24556387 [0,1,0,0,0,0|1,0,0]=2 904 B14R2.8239 Oc1cc2OC(=O)C(Cl)=Cc2cc1 Amb25280609 [0,1,0,0,0,0|1,0,0]=2 905 B14R2.8239 Oc1cc2OC(=O)C=Cc2cc1Cl Amb18652522 [0,1,0,0,0,0|3,0,0]=4 906 B14R2.8239 Oc1cc2cc(Br)c[n]c2cc1Cl Amb22396338 [0,1,0,0,0,0|3,0,0]=4 907 B14R2.8239 Oc1cc2cc(Cl)c(Cl)cc2cc1 Amb24690813 [0,1,0,0,0,0|3,0,0]=4 908 B14R2.8239 Oc1cc2cc(Cl)ccc2[n]c1Br Amb25320239 [0,1,0,0,0,0|2,0,0]=3 909 B14R2.8239 Oc1cc2cc(O)c(O)[n]c2cc1 Amb24368525 [0,1,0,0,0,0|1,0,1]=3 910 B14R2.8239 Oc1cc2ccc(F)cc2[n]c1Cl Amb24379654 [0,1,0,0,0,0|2,0,0]=3 911 B14R2.8239 Oc1cc2ccc(S)cc2cc1S Amb24706971 [0,1,0,0,0,0|1,1,0]=3 912 B14R2.8239 Oc1ccc2NC(=O)C(O)Oc2c1 Amb22168797 [0,1,0,0,0,0|2,0,1]=4 913 B14R2.8239 Oc1ccc2c(c1)cc(c(n2)Cl)C Amb17235854 [0,1,0,0,0,0|3,0,0]=4 914 B14R2.8239 Oc1ccc2c(c1)cc(c(n2)Cl)Cl Amb17241632 [0,1,0,0,0,0|3,0,0]=4 915 B14R2.28472 Brc1nc2c(cc1C)cccc2C Amb17158081 [0,1,0,0,0,0|3,0,0]=4 916 B14R2.28472 CC1=Cc2c(O)cccc2NC1=O Amb22752597 [0,1,0,0,0,0|2,0,0]=3 917 B14R2.28472 CC1=Cc2cccc(C)c2NC1=O Amb24425415 [0,1,0,0,0,0|2,0,0]=3 918 B14R2.28472 CC1=Cc2cccc(O)c2NC1=O Amb22752602 [0,1,0,0,0,0|2,0,0]=3 919 B14R2.28472 CC1=Cc2cccc(O)c2OC1=O Amb24424876 [0,1,0,0,0,0|1,0,0]=2 920 B14R2.28472 CC1=Nc2c(F)cccc2NC1=O Amb24740121 [0,1,0,0,0,0|3,0,0]=4 921 B14R2.28472 CC1=Nc2cccc(F)c2NC1=O Amb24456844 [0,1,0,0,0,0|3,0,0]=4 922 B14R2.28472 CC1Cc2cccc(O)c2OC1=O Amb24378495 [0,1,0,0,0,0|1,0,2]=4 923 B14R2.28472 Cc1[n]c2c(F)cccc2cc1Br Amb24494209 [0,1,0,0,0,0|3,0,0]=4 924 B14R2.28472 Cc1[n]c2c(F)cccc2cc1N Amb25068897 [0,1,0,0,0,0|3,0,0]=4 925 B14R2.28472 Cc1[n]c2c(N)cccc2[nH]c1=O Amb24071022 [0,1,0,0,0,0|3,0,0]=4 926 B14R2.28472 Cc1[n]c2c(O)cccc2[nH]c1=O Amb24071450 [0,1,0,0,0,0|3,0,0]=4 927 B14R2.28472 Cc1[n]c2c(O)cccc2oc1=O Amb24071451 [0,1,0,0,0,0|2,0,0]=3 928 B14R2.28472 Cc1[n]c2cccc(O)c2[nH]c1=O Amb24092311 [0,1,0,0,0,0|3,0,0]=4 929 B14R2.28472 Cc1[n]ccc2NC(=O)C(Br)=Cc21 Amb21926812 [0,1,0,0,0,0|3,0,0]=4 930 B14R2.28472 Cc1[n]ccc2NC(=O)C(I)=Cc21 Amb21927566 [0,1,0,0,0,0|3,0,0]=4 931 B14R2.28472 Cc1[n]ccc2NC(=O)C(N)=Cc21 Amb18127439 [0,1,0,0,0,0|3,0,0]=4 932 B14R2.28472 Cc1cc2C(=O)NC=Cc2cc1O Amb21963950 [0,1,0,0,0,0|3,0,0]=4 933 B14R2.28472 Cc1cc2C=CNC(=O)c2cc1O Amb18127380 [0,1,0,0,0,0|3,0,0]=4 934 B14R2.28472 Cc1cc2C=COC(=O)c2cc1O Amb18127577 [0,1,0,0,0,0|3,0,0]=4 935 B14R2.28472 Cc1cc2c(Cl)cccc2[n]c1N Amb24754371 [0,1,0,0,0,0|3,0,0]=4 936 B14R2.28472 Cc1cc2c(O)cccc2[n]c1Cl Amb24492511 [0,1,0,0,0,0|3,0,0]=4 937 B14R2.28472 Cc1cc2c(cc1O)cccc2C Amb24583086 [0,1,0,0,0,0|2,0,0]=3 938 B14R2.28472 Cc1cc2cccc(C)c2cc1O Amb24416742 [0,1,0,0,0,0|2,0,0]=3 939 B14R2.28472 Cc1cc2cccc(Cl)c2[n]c1S Amb24613180 [0,1,0,0,0,0|2,1,0]=4 940 B14R2.28472 Cc1cc2cccc(F)c2[n]c1Cl Amb24447439 [0,1,0,0,0,0|3,0,0]=4 941 B14R2.28472 Cc1cc2cccc(N)c2[n]c1C Amb24589676 [0,1,0,0,0,0|3,0,0]=4 942 B14R2.28472 Cc1cc2cccc(N)c2cc1C Amb22276891 [0,1,0,0,0,0|3,0,0]=4 943 B14R2.28472 Cc1cc2cccc(O)c2[n]c1C Amb25320736 [0,1,0,0,0,0|3,0,0]=4 944 B14R2.28472 Cc1cc2cccc(O)c2cc1C Amb25706900 [0,1,0,0,0,0|3,0,0]=4 945 B14R2.28472 Cc1cc2cccc([O-])c2[n]c1C Amb22057310 [0,1,0,0,0,0|3,0,0]=4 946 B14R2.28472 Cc1cc[n]c2cc(O)c(O)cc21 Amb24722792 [0,1,0,0,0,0|2,0,1]=4 947 B14R2.28472 Cc1cccc2C=C(F)C(=O)Nc21 Amb22547233 [0,1,0,0,0,0|2,0,0]=3 948 B14R2.28472 Cc1cccc2C=C(O)C(=O)Nc21 Amb22752607 [0,1,0,0,0,0|1,0,0]=2 949 B14R2.28472 Cc1cccc2C[C@@H](O)C(=O)Nc21 Amb24466235 [0,1,0,0,0,0|1,0,2]=4 950 B14R2.28472 Cc1cccc2NC(=O)C(O)=Cc21 Amb22752608 [0,1,0,0,0,0|1,0,0]=2 951 B14R2.28472 Cc1cccc2NC(=O)C(O)Cc21 Amb24533435 [0,1,0,0,0,0|1,0,2]=4 952 B14R2.28472 Cc1cccc2OC(=O)C(=O)Nc21 Amb25816131 [0,1,0,0,0,0|1,0,1]=3 953 B14R2.28472 Cc1cccc2OC(C)=C(N)Nc12 Amb25696077 [0,1,0,0,0,0|3,0,0]=4 954 B14R2.28472 Cc1cccc2[nH]c(=O)c(C)[n]c12 Amb24085553 [0,1,0,0,0,0|3,0,0]=4 955 B14R2.28472 Cc1cccc2[n]c(C)c(=O)[nH]c12 Amb24085611 [0,1,0,0,0,0|3,0,0]=4 956 B14R2.28472 Cc1cccc2[n]c(O)c(O)[n]c21 Amb18127607 [0,1,0,0,0,0|2,0,1]=4 957 B14R2.28472 Cc1cccc2cc(Br)c(N)[n]c21 Amb23449354 [0,1,0,0,0,0|3,0,0]=4 958 B14R2.28472 Cc1cccc2cc(N)c(N)[n]c21 Amb24727043 [0,1,0,0,0,0|3,0,0]=4 959 B14R2.28472 Clc1[n]c2c(cc1Br)cccc2Br Amb23449337 [0,1,0,0,0,0|3,0,0]=4 960 B14R2.28472 Clc1cc2c(cc1Cl)cccc2O Amb17595762 [0,1,0,0,0,0|3,0,0]=4 961 B14R2.28472 Clc1cc2cccc(Cl)c2[n]c1Cl Amb23509990 [0,1,0,0,0,0|3,0,0]=4 962 B14R2.28472 Clc1cccc2[n]c(Cl)c(Br)cc12 Amb24603849 [0,1,0,0,0,0|3,0,0]=4 963 B14R2.28472 Clc1cccc2cc(Br)c(Cl)[n]c12 Amb23450240 [0,1,0,0,0,0|3,0,0]=4 964 B14R2.28472 Clc1nc2c(cc1C)cccc2C Amb1994497 [0,1,0,0,0,0|3,0,0]=4 965 B14R2.28472 Fc1cc2cccc(Br)c2[n]c1Br Amb22547364 [0,1,0,0,0,0|3,0,0]=4 966 B14R2.28472 Fc1cccc2cc(Br)c(Cl)[n]c21 Amb24574761 [0,1,0,0,0,0|3,0,0]=4 967 B14R2.28472 Ic1cc2cccc(c2nc1Cl)Br Amb10071778 [0,1,0,0,0,0|3,0,0]=4 968 B14R2.28472 NC1=Cc2cccc(N)c2OC1=O Amb25138617 [0,1,0,0,0,0|1,0,0]=2 969 B14R2.28472 NC1=Cc2cccc(O)c2OC1=O Amb18127813 [0,1,0,0,0,0|1,0,0]=2 970 B14R2.28472 NC1=Nc2c(O)cccc2NC1=O Amb22001484 [0,1,0,0,0,0|3,0,0]=4 971 B14R2.28472 NC1=Nc2c(O)cccc2NC1=O Amb22490840 [0,1,0,0,0,0|3,0,0]=4 972 B14R2.28472 NC1=Nc2cccc(O)c2NC1=O Amb22496145 [0,1,0,0,0,0|3,0,0]=4 973 B14R2.28472 Nc1[n]c2c(Cl)cccc2cc1Br Amb23449351 [0,1,0,0,0,0|3,0,0]=4 974 B14R2.28472 Nc1cc2c(cc1Br)cccc2N Amb24354320 [0,1,0,0,0,0|3,0,0]=4 975 B14R2.28472 Nc1cc2c(cccc2Cl)[n]c1Cl Amb25241465 [0,1,0,0,0,0|3,0,0]=4 976 B14R2.28472 Nc1cc2cccc(Br)c2[n]c1Cl Amb24421846 [0,1,0,0,0,0|3,0,0]=4 977 B14R2.28472 Nc1cc2cccc(F)c2[n]c1Cl Amb24419538 [0,1,0,0,0,0|3,0,0]=4 978 B14R2.28472 Nc1cccc2C=C(O)C(=O)Oc21 Amb25274061 [0,1,0,0,0,0|0,0,0]=1 979 B14R2.28472 Nc1cccc2NC(=O)C(=O)Nc21 Amb19813318 [0,1,0,0,0,0|2,0,1]=4 980 B14R2.28472 Nc1cccc2NC(=O)C(O)=Cc21 Amb25123362 [0,1,0,0,0,0|1,0,0]=2 981 B14R2.28472 Nc1cccc2NC(=O)C(O)Cc21 Amb24738442 [0,1,0,0,0,0|1,0,2]=4 982 B14R2.28472 Nc1cccc2NC(=O)[C@@H](O)Cc21 Amb25276333 [0,1,0,0,0,0|1,0,2]=4 983 B14R2.28472 Nc1nc2c(cc1C)cccc2C Amb1994294 [0,1,0,0,0,0|3,0,0]=4 984 B14R2.28472 O=C1Nc2c(Br)cccc2C=C1F Amb22547234 [0,1,0,0,0,0|2,0,0]=3 985 B14R2.28472 O=C1Nc2c(C=C1Br)cccc2Br Amb23449338 [0,1,0,0,0,0|2,0,0]=3 986 B14R2.28472 O=C1Nc2c(C=C1F)cccc2F Amb22547161 [0,1,0,0,0,0|2,0,0]=3 987 B14R2.28472 O=C1Nc2c(Cl)cccc2C=C1Br Amb23509991 [0,1,0,0,0,0|2,0,0]=3 988 B14R2.28472 O=C1Nc2c(Cl)cccc2C=C1F Amb22547231 [0,1,0,0,0,0|2,0,0]=3 989 B14R2.28472 OC1=Cc2[n]ccc(Cl)c2NC1=O Amb25095179 [0,1,0,0,0,0|2,0,0]=3 990 B14R2.28472 OC1=Cc2[n]ccc(F)c2NC1=O Amb25311073 [0,1,0,0,0,0|2,0,0]=3 991 B14R2.28472 OC1=Cc2c(Cl)cc[n]c2NC1=O Amb25281457 [0,1,0,0,0,0|2,0,0]=3 992 B14R2.28472 OC1=Cc2c(Cl)cccc2NC1=O Amb24435883 [0,1,0,0,0,0|1,0,0]=2 993 B14R2.28472 OC1=Cc2c(cccc2O)OC1=O Amb25190281 [0,1,0,0,0,0|0,0,0]=1 994 B14R2.28472 OC1=Cc2c[n]cc(F)c2NC1=O Amb25258783 [0,1,0,0,0,0|2,0,0]=3 995 B14R2.28472 OC1=Cc2cccc(Br)c2NC1=O Amb25800197 [0,1,0,0,0,0|1,0,0]=2 996 B14R2.28472 OC1=Cc2cccc(Cl)c2NC1=S Amb25757998 [0,1,0,0,0,0|1,1,0]=3 997 B14R2.28472 OC1=Cc2cccc(F)c2NC1=O Amb24697603 [0,1,0,0,0,0|1,0,0]=2 998 B14R2.28472 O[C@@H]1Cc2c(F)cccc2NC1=O Amb25357446 [0,1,0,0,0,0|1,0,2]=4 999 B14R2.28472 Oc1[n]c2cccc(Br)c2[n]c1O Amb22371883 [0,1,0,0,0,0|2,0,1]=4 1000 B14R2.28472 Oc1[n]c2cccc(Cl)c2[n]c1O Amb25678371 [0,1,0,0,0,0|2,0,1]=4 1001 B14R2.28472 Oc1cc2C(=O)C=COc2cc1O Amb24690672 [0,1,0,0,0,0|2,0,1]=4 1002 B14R2.28472 Oc1cc2C=CNC(=O)c2cc1F Amb24059946 [0,1,0,0,0,0|3,0,0]=4 1003 B14R2.28472 Oc1cc2C=CNC(=O)c2cc1O Amb19100714 [0,1,0,0,0,0|2,0,1]=4 1004 B14R2.28472 Oc1cc2c(Cl)[n]ccc2cc1Br Amb24670762 [0,1,0,0,0,0|3,0,0]=4 1005 B14R2.28472 Oc1cc2c(cc1O)cccc2O Amb17594466 [0,1,0,0,0,0|1,0,1]=3 1006 B14R2.28472 Oc1cc2c(cccc2Cl)[n]c1Cl Amb24418525 [0,1,0,0,0,0|2,0,0]=3 1007 B14R2.28472 Oc1cc2cccc(Cl)c2[n]c1Cl Amb25063219 [0,1,0,0,0,0|2,0,0]=3 1008 B14R2.28472 Oc1cccc2NC(=O)C(=O)Nc21 Amb22234954 [0,1,0,0,0,0|2,0,1]=4 1009 B14R2.28472 Oc1cccc2NC(=O)C(Br)=Cc21 Amb21926742 [0,1,0,0,0,0|2,0,0]=3 1010 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,0,1,0,0,0|1,0,2]=4 1011 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,0,1,0,0,0|1,0,2]=4 1012 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,0,1,0,0,0|2,0,0]=3 1013 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,0,1,0,0,0|2,0,1]=4 1014 B12R1.43 C=C(Cl)C(=O)Nc1cccc[n]1 Amb25244198 [0,0,1,0,0,0|3,0,0]=4 1015 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,0,1,0,0,0|2,0,0]=3 1016 B12R1.43 C=C(F)C(=O)Oc1ccccc1 Amb25174018 [0,0,1,0,0,0|1,0,0]=2 1017 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,0,1,0,0,0|2,0,0]=3 1018 B12R1.43 C=C(Sc1ccccc1)C(N)=O Amb24739855 [0,0,1,0,0,0|3,0,0]=4 1019 B12R1.43 CC(=C)C(=O)Cc1ccc[n]c1 Amb24703221 [0,0,1,0,0,0|3,0,0]=4 1020 B12R1.43 CC(=C)C(=O)Nc1ccc[n]c1 Amb25320521 [0,0,1,0,0,0|3,0,0]=4 1021 B12R1.43 CC(=C)C(=O)Nc1cccc[n]1 Amb25035026 [0,0,1,0,0,0|3,0,0]=4 1022 B12R1.43 CC(=Cc1ccccc1)C(=O)Cl Amb24061289 [0,0,1,0,0,0|2,0,0]=3 1023 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,0,1,0,0,0|1,0,2]=4 1024 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,0,1,0,0,0|1,0,2]=4 1025 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,0,1,0,0,0|1,0,2]=4 1026 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,0,1,0,0,0|2,0,1]=4 1027 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,0,1,0,0,0|1,0,2]=4 1028 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,0,1,0,0,0|1,0,0]=2 1029 B12R1.43 CC(Br)C(=O)Oc1ccccc1 Amb24367978 [0,0,1,0,0,0|1,0,2]=4 1030 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,0,1,0,0,0|1,0,2]=4 1031 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,0,1,0,0,0|2,0,1]=4 1032 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,0,1,0,0,0|2,0,1]=4 1033 B12R1.43 CC(C(=O)Oc1ccccc1)N Amb17334632 [0,0,1,0,0,0|1,0,2]=4 1034 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,0,1,0,0,0|1,0,2]=4 1035 B12R1.43 CC(O)C(=O)Oc1ccc[n]c1 Amb25182794 [0,0,1,0,0,0|1,0,2]=4 1036 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,0,1,0,0,0|0,0,2]=3 1037 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,0,1,0,0,0|2,0,1]=4 1038 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,0,1,0,0,0|1,0,2]=4 1039 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,0,1,0,0,0|2,0,1]=4 1040 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,0,1,0,0,0|1,0,2]=4 1041 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,0,1,0,0,0|1,0,2]=4 1042 B12R1.43 C[C@@H](O)C(=O)Oc1ccc[n]c1 Amb24343534 [0,0,1,0,0,0|1,0,2]=4 1043 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,0,1,0,0,0|0,0,2]=3 1044 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,0,1,0,0,0|0,1,2]=4 1045 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,0,1,0,0,0|2,0,1]=4 1046 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,0,1,0,0,0|1,0,2]=4 1047 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,0,1,0,0,0|2,0,1]=4 1048 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,0,1,0,0,0|1,0,2]=4 1049 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,0,1,0,0,0|0,0,2]=3 1050 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,0,1,0,0,0|2,0,1]=4 1051 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,0,1,0,0,0|2,0,1]=4 1052 B12R1.43 C\C(=C/c1c[n]ccc1)\C(C)=O Amb25373091 [0,0,1,0,0,0|3,0,0]=4 1053 B12R1.43 C\C(=C/c1cc[n]cc1)\C(C)=O Amb24424922 [0,0,1,0,0,0|3,0,0]=4 1054 B12R1.43 C\C(=C/c1cccc[n]1)\C(C)=O Amb25066316 [0,0,1,0,0,0|3,0,0]=4 1055 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,0,1,0,0,0|2,0,0]=3 1056 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,0,1,0,0,0|1,0,0]=2 1057 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,0,1,0,0,0|2,0,1]=4 1058 B12R1.43 C\C(=C\c1cc[n]c[n]1)\C(O)=O Amb25383291 [0,0,1,0,0,0|3,0,0]=4 1059 B12R1.43 C\C(=C\c1ccccc1)\C(N)=O Amb24388896 [0,0,1,0,0,0|2,0,0]=3 1060 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,0,1,0,0,0|1,0,0]=2 1061 B12R1.43 C\C(=C\c1ccccc1)\[N+]([O-])=O Amb21520351 [0,0,1,0,0,0|2,0,1]=4 1062 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,0,1,0,0,0|3,0,0]=4 1063 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,0,1,0,0,0|2,0,0]=3 1064 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,0,1,0,0,0|1,0,2]=4 1065 B12R1.43 FC(=C(F)F)Oc1ccccc1 Amb10841028 [0,0,1,0,0,0|3,0,0]=4 1066 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,0,1,0,0,0|2,0,0]=3 1067 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,0,1,0,0,0|1,0,0]=2 1068 B12R1.43 NC(=N)C(=N)Oc1ccccc1 Amb24096860 [0,0,1,0,0,0|3,0,0]=4 1069 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,0,1,0,0,0|3,0,0]=4 1070 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,0,1,0,0,0|1,0,2]=4 1071 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,0,1,0,0,0|1,0,2]=4 1072 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,0,1,0,0,0|1,0,2]=4 1073 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,0,1,0,0,0|1,0,2]=4 1074 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,0,1,0,0,0|1,0,2]=4 1075 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,0,1,0,0,0|2,0,1]=4 1076 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,0,1,0,0,0|1,0,2]=4 1077 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,0,1,0,0,0|1,0,2]=4 1078 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,0,1,0,0,0|1,0,2]=4 1079 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,0,1,0,0,0|1,0,2]=4 1080 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,0,1,0,0,0|1,0,2]=4 1081 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,0,1,0,0,0|1,0,2]=4 1082 B12R1.43 N\C(=C/c1cc[n]c[n]1)\C(O)=O Amb24390213 [0,0,1,0,0,0|3,0,0]=4 1083 B12R1.43 N\C(=C\c1cc[n]c[n]1)\C(O)=O Amb24518466 [0,0,1,0,0,0|3,0,0]=4 1084 B12R1.43 N\C(=C\c1ccc[n]c1)\C(O)=O Amb25254657 [0,0,1,0,0,0|2,0,0]=3 1085 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,0,1,0,0,0|1,0,2]=4 1086 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,0,1,0,0,0|2,0,1]=4 1087 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,0,1,0,0,0|1,0,2]=4 1088 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,0,1,0,0,0|2,0,1]=4 1089 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,0,1,0,0,0|1,0,1]=3 1090 B12R1.43 O=C(Oc1ccccc1)C(F)F Amb25297093 [0,0,1,0,0,0|2,0,1]=4 1091 B12R1.43 OB(O)\C(\F)=C\c1ccccc1 Amb25667549 [0,0,1,0,0,0|2,0,1]=4 1092 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,0,1,0,0,0|1,0,2]=4 1093 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,0,1,0,0,0|1,0,2]=4 1094 B12R1.43 OC(=O)C(=S)Cc1cccc[n]1 Amb25059246 [0,0,1,0,0,0|1,1,1]=4 1095 B12R1.43 OC(=O)C(=S)Nc1cc[n]cc1 Amb24368096 [0,0,1,0,0,0|2,1,0]=4 1096 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,0,1,0,0,0|2,0,1]=4 1097 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,0,1,0,0,0|1,0,2]=4 1098 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,0,1,0,0,0|1,0,2]=4 1099 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,0,1,0,0,0|2,0,1]=4 1100 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,0,1,0,0,0|1,0,0]=2 1101 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,0,1,0,0,0|2,0,1]=4 1102 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,0,1,0,0,0|2,0,1]=4 1103 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,0,1,0,0,0|1,0,1]=3 1104 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,0,1,0,0,0|0,1,2]=4 1105 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,0,1,0,0,0|1,0,2]=4 1106 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,0,1,0,0,0|0,1,2]=4 1107 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,0,1,0,0,0|1,0,2]=4 1108 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,0,1,0,0,0|1,0,2]=4 1109 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,0,1,0,0,0|1,0,2]=4 1110 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,0,1,0,0,0|1,0,2]=4 1111 B12R1.43 OC(=O)\C(=C\c1ccccn1)\S Amb1761004 [0,0,1,0,0,0|1,1,0]=3 1112 B12R1.43 OC(=O)\C(=C\c1cccnc1)\F Amb17614474 [0,0,1,0,0,0|2,0,0]=3 1113 B12R1.43 OC(=O)\C(=C\c1cccnc1)\S Amb1761005 [0,0,1,0,0,0|1,1,0]=3 1114 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,0,1,0,0,0|1,0,0]=2 1115 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,0,1,0,0,0|1,0,0]=2 1116 B12R1.43 OC(=O)\C(\F)=C\c1cc[n]cc1 Amb24377793 [0,0,1,0,0,0|2,0,0]=3 1117 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,0,1,0,0,0|1,0,2]=4 1118 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,0,1,0,0,0|1,0,1]=3 1119 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,0,1,0,0,0|1,0,1]=3 1120 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,0,1,0,0,0|0,0,0]=1 1121 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,0,1,0,0,0|1,1,0]=3 1122 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,0,1,0,0,0|0,1,0]=2 1123 B12R1.43 S\C(=C/c1ccncc1)\C(=O)O Amb1761003 [0,0,1,0,0,0|1,1,0]=3 1124 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,0,1,0,0,0|0,1,0]=2 1125 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,0,1,0,0,0|1,0,2]=4 1126 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,0,1,0,0,0|0,0,3]=4 1127 B12R1.43 [O-][N+](=O)\C(\Br)=C\c1ccccc1 Amb22476019 [0,0,1,0,0,0|2,0,1]=4 1128 B12R1.169 CC=Cc1ccccc1OCC Amb24065593 [0,0,1,0,0,0|2,0,1]=4 1129 B12R1.169 CCOc1ccccc1C=NO Amb24083929 [0,0,1,0,0,0|2,0,1]=4 1130 B12R1.169 CCOc1ccccc1\C=N\O Amb1104882 [0,0,1,0,0,0|2,0,1]=4 1131 B12R1.169 C\C=C/c1ccccc1N=C=O Amb25159374 [0,0,1,0,0,0|2,0,1]=4 1132 B12R1.169 C\C=C\c1ccccc1OCCl Amb24612247 [0,0,1,0,0,0|2,0,1]=4 1133 B12R1.169 O=C=Nc1ccccc1\C=C\F Amb25269525 [0,0,1,0,0,0|2,0,1]=4 1134 B12R1.169 O=CCc1ccccc1NC=O Amb25288964 [0,0,1,0,0,0|1,0,2]=4 1135 B12R1.169 O=CNc1ccccc1NC=O Amb24743538 [0,0,1,0,0,0|2,0,1]=4 1136 B12R1.371 C#CC(=O)Oc1ccccc1F Amb24498038 [0,0,1,0,0,0|2,0,1]=4 1137 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [0,0,1,0,0,0|2,0,1]=4 1138 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [0,0,1,0,0,0|2,0,1]=4 1139 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [0,0,1,0,0,0|3,0,0]=4 1140 B12R1.371 C=CC(=O)Nc1ccccc1O Amb18645794 [0,0,1,0,0,0|2,0,1]=4 1141 B12R1.371 C=CC(=O)Oc1ccccc1Br Amb25156556 [0,0,1,0,0,0|2,0,0]=3 1142 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,0,1,0,0,0|1,0,2]=4 1143 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,0,1,0,0,0|2,0,1]=4 1144 B12R1.371 CCC(=O)Oc1ccccc1N Amb24743412 [0,0,1,0,0,0|2,0,1]=4 1145 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,0,1,0,0,0|2,0,1]=4 1146 B12R1.371 CN(Cc1ccccc1O)C=O Amb25349061 [0,0,1,0,0,0|2,0,1]=4 1147 B12R1.371 CNC(=O)Oc1ccccc1Cl Amb22479442 [0,0,1,0,0,0|3,0,0]=4 1148 B12R1.371 CNC(=O)Oc1ccccc1F Amb24669113 [0,0,1,0,0,0|3,0,0]=4 1149 B12R1.371 CNC(=O)Oc1ccccc1N Amb24429125 [0,0,1,0,0,0|3,0,0]=4 1150 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,0,1,0,0,0|3,0,0]=4 1151 B12R1.371 COC(=O)Oc1ccccc1N Amb25337714 [0,0,1,0,0,0|3,0,0]=4 1152 B12R1.371 C\C(\C=O)=C\c1ccccc1Br Amb24639745 [0,0,1,0,0,0|2,0,0]=3 1153 B12R1.371 C\C(\C=O)=C\c1ccccc1Cl Amb25827711 [0,0,1,0,0,0|2,0,0]=3 1154 B12R1.371 C\C(\C=O)=C\c1ccccc1F Amb25793939 [0,0,1,0,0,0|2,0,0]=3 1155 B12R1.371 C\C(\CC)=C/c1ccccc1O Amb25039084 [0,0,1,0,0,0|2,0,1]=4 1156 B12R1.371 C\C(\CO)=C/c1ccccc1O Amb25838654 [0,0,1,0,0,0|1,0,2]=4 1157 B12R1.371 C\C(\CO)=C\c1ccccc1O Amb18646032 [0,0,1,0,0,0|1,0,2]=4 1158 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [0,0,1,0,0,0|2,0,1]=4 1159 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [0,0,1,0,0,0|2,0,1]=4 1160 B12R1.371 Cc1c[n]ccc1\C=C(\C)/C=O Amb24600808 [0,0,1,0,0,0|3,0,0]=4 1161 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [0,0,1,0,0,0|2,0,1]=4 1162 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,0,1,0,0,0|1,0,2]=4 1163 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,0,1,0,0,0|1,0,2]=4 1164 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,0,1,0,0,0|1,0,2]=4 1165 B12R1.371 Cc1ccccc1OC(=O)OC Amb24474007 [0,0,1,0,0,0|2,0,1]=4 1166 B12R1.371 Cc1ccccc1O\C(\F)=C\Cl Amb25288143 [0,0,1,0,0,0|2,0,1]=4 1167 B12R1.371 Cc1ccccc1\C=C(\C)/C=O Amb25230198 [0,0,1,0,0,0|2,0,0]=3 1168 B12R1.371 Cc1ccccc1\C=C(\F)/C=O Amb24612450 [0,0,1,0,0,0|2,0,0]=3 1169 B12R1.371 ClCC(=O)Oc1ccccc1O Amb17594841 [0,0,1,0,0,0|2,0,1]=4 1170 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,0,1,0,0,0|2,0,1]=4 1171 B12R1.371 NCC(=O)Oc1ccccc1C Amb17334634 [0,0,1,0,0,0|1,0,2]=4 1172 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,0,1,0,0,0|2,0,1]=4 1173 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,0,1,0,0,0|2,0,1]=4 1174 B12R1.371 O=C(CCl)Oc1ccccc1Cl Amb24121334 [0,0,1,0,0,0|2,0,1]=4 1175 B12R1.371 O=C(CCl)Oc1ccccc1F Amb23442007 [0,0,1,0,0,0|2,0,1]=4 1176 B12R1.371 O=C\C(=C\c1ccccc1C)\C Amb17334495 [0,0,1,0,0,0|2,0,0]=3 1177 B12R1.371 O=C\C(=C\c1ccccc1Cl)\C Amb17335454 [0,0,1,0,0,0|2,0,0]=3 1178 B12R1.371 O=C\C(=C\c1ccccc1F)\C Amb17334598 [0,0,1,0,0,0|2,0,0]=3 1179 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,0,1,0,0,0|1,0,2]=4 1180 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,0,1,0,0,0|2,0,1]=4 1181 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,0,1,0,0,0|2,0,1]=4 1182 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,0,1,0,0,0|2,0,1]=4 1183 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,0,1,0,0,0|1,0,2]=4 1184 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,0,1,0,0,0|2,0,1]=4 1185 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,0,1,0,0,0|2,0,1]=4 1186 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,0,1,0,0,0|1,0,1]=3 1187 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,0,1,0,0,0|1,0,1]=3 1188 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,0,1,0,0,0|1,0,1]=3 1189 B12R1.371 ON(Cc1ccccc1Cl)C=O Amb22469654 [0,0,1,0,0,0|2,0,1]=4 1190 B12R1.371 O\C(\C=O)=C/c1ccccc1F Amb24532563 [0,0,1,0,0,0|1,0,0]=2 1191 B12R1.371 O\C(\C=O)=C\c1ccccc1F Amb24621919 [0,0,1,0,0,0|1,0,0]=2 1192 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,0,1,0,0,0|1,0,2]=4 1193 B12R1.371 Oc1ccccc1CN(O)N=O Amb25287208 [0,0,1,0,0,0|2,0,1]=4 1194 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [0,0,1,0,0,0|2,0,0]=3 1195 B12R1.385 Cc1cc(\C=C\C=O)ccc1O Amb25334911 [0,0,1,0,0,0|3,0,0]=4 1196 B12R1.385 O=C\C=C\C1=CC(=O)C(=O)C=C1 Amb24731772 [0,0,1,0,0,0|2,0,1]=4 1197 B12R1.385 Oc1cc(\C=C\C=O)ccc1O Amb24543487 [0,0,1,0,0,0|2,0,1]=4 1198 B14R3.2534 C1Cc2[n]c3ccccc3cc21 Amb24654835 [0,0,0,1,0,0|3,0,0]=4 1199 B14R3.2534 c1cccc2[n]c3ooc3[n]c21 Amb24060612 [0,0,0,1,0,0|2,0,1]=4 1200 B12R2.18 Brc1[nH]c2c(c1C)cccc2 Amb17595638 [0,0,0,0,1,0|3,0,0]=4 1201 B12R2.18 Brc1[nH]c2ccccc2c1Br Amb17672709 [0,0,0,0,1,0|3,0,0]=4 1202 B12R2.18 Brc1c(C)sc2c1cccc2 Amb10975969 [0,0,0,0,1,0|2,1,0]=4 1203 B12R2.18 Brc1c(I)[nH]c2ccccc21 Amb24627969 [0,0,0,0,1,0|3,0,0]=4 1204 B12R2.18 Brc1c2ccccc2[s]c1Br Amb21858144 [0,0,0,0,1,0|2,1,0]=4 1205 B12R2.18 Brc1c2ccccc2oc1Br Amb24105084 [0,0,0,0,1,0|2,0,0]=3 1206 B12R2.18 C=C1C(=O)Nc2ccccc12 Amb17779246 [0,0,0,0,1,0|2,0,0]=3 1207 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,0,0,0,1,0|1,0,2]=4 1208 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,0,0,0,1,0|1,0,1]=3 1209 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,0,0,0,1,0|2,0,1]=4 1210 B12R2.18 C=C1Oc2ccccc2C1O Amb25852741 [0,0,0,0,1,0|1,0,1]=3 1211 B12R2.18 CC1=Cc2ccccc2C1Br Amb24757677 [0,0,0,0,1,0|2,0,1]=4 1212 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,0,0,0,1,0|1,0,2]=4 1213 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,0,0,0,1,0|2,0,1]=4 1214 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,0,0,0,1,0|1,0,1]=3 1215 B12R2.18 CC1C(=O)Sc2ccccc21 Amb24519014 [0,0,0,0,1,0|1,1,1]=4 1216 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [0,0,0,0,1,0|1,0,2]=4 1217 B12R2.18 CC1Sc2ccccc2C1=O Amb25032373 [0,0,0,0,1,0|2,0,1]=4 1218 B12R2.18 CC=1C(=O)CN2C=CC=CC21 Amb25151212 [0,0,0,0,1,0|3,0,0]=4 1219 B12R2.18 CC=1C(=O)OC2=COC=CC21 Amb19133147 [0,0,0,0,1,0|2,0,0]=3 1220 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,0,0,0,1,0|2,0,1]=4 1221 B12R2.18 CN1C(=C)Oc2ccccc12 Amb24102381 [0,0,0,0,1,0|3,0,0]=4 1222 B12R2.18 CN1C(=O)Nc2ccccc12 Amb18537193 [0,0,0,0,1,0|3,0,0]=4 1223 B12R2.18 CN1C(=O)Oc2ccc[n]c12 Amb18407346 [0,0,0,0,1,0|3,0,0]=4 1224 B12R2.18 CN1C(=O)Oc2ccccc12 Amb18043105 [0,0,0,0,1,0|2,0,0]=3 1225 B12R2.18 CN1C(=O)Sc2ccccc12 Amb19654015 [0,0,0,0,1,0|2,1,0]=4 1226 B12R2.18 CN1C(=S)Oc2ccccc12 Amb19664828 [0,0,0,0,1,0|2,1,0]=4 1227 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,0,0,0,1,0|1,0,2]=4 1228 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [0,0,0,0,1,0|1,0,2]=4 1229 B12R2.18 C[n+]1c(C)oc2c1cccc2 Amb10573332 [0,0,0,0,1,0|3,0,0]=4 1230 B12R2.18 C[n]1[nH]c2ccccc2c1=O Amb24102205 [0,0,0,0,1,0|3,0,0]=4 1231 B12R2.18 C[n]1c(Br)cc2ccccc12 Amb22232574 [0,0,0,0,1,0|3,0,0]=4 1232 B12R2.18 C[n]1c(I)cc2ccccc12 Amb24067548 [0,0,0,0,1,0|3,0,0]=4 1233 B12R2.18 C[n]1c(N)cc2ccccc12 Amb18644284 [0,0,0,0,1,0|3,0,0]=4 1234 B12R2.18 C[n]1c(N)cc2ccccc12 Amb19944548 [0,0,0,0,1,0|3,0,0]=4 1235 B12R2.18 C[n]1c(O)cc2[n]cccc12 Amb24462412 [0,0,0,0,1,0|3,0,0]=4 1236 B12R2.18 Cc1[nH]c2c(c1C)cccc2 Amb1205252 [0,0,0,0,1,0|3,0,0]=4 1237 B12R2.18 Cc1[nH]c2c(c1I)cccc2 Amb17134452 [0,0,0,0,1,0|3,0,0]=4 1238 B12R2.18 Cc1[nH]c2ccccc2c1Cl Amb17673944 [0,0,0,0,1,0|3,0,0]=4 1239 B12R2.18 Cc1[nH]c2ccccc2c1F Amb24120604 [0,0,0,0,1,0|3,0,0]=4 1240 B12R2.18 Cc1[nH]c2ccccc2c1S Amb25119252 [0,0,0,0,1,0|2,1,0]=4 1241 B12R2.18 Cc1[s]c2ccccc2c1Cl Amb25376923 [0,0,0,0,1,0|2,1,0]=4 1242 B12R2.18 Cc1[s]c2ccccc2c1F Amb24697086 [0,0,0,0,1,0|2,1,0]=4 1243 B12R2.18 Cc1[s]c2ccccc2c1I Amb25247275 [0,0,0,0,1,0|2,1,0]=4 1244 B12R2.18 Cc1[s]c2ccccc2c1S Amb24679291 [0,0,0,0,1,0|1,2,0]=4 1245 B12R2.18 Cc1c(Br)[s]c2ccccc21 Amb22896399 [0,0,0,0,1,0|2,1,0]=4 1246 B12R2.18 Cc1c(Br)oc2ccccc21 Amb24451202 [0,0,0,0,1,0|2,0,0]=3 1247 B12R2.18 Cc1c(Cl)[nH]c2ccccc21 Amb23441609 [0,0,0,0,1,0|3,0,0]=4 1248 B12R2.18 Cc1c(Cl)[s]c2ccccc21 Amb23440525 [0,0,0,0,1,0|2,1,0]=4 1249 B12R2.18 Cc1c(F)[nH]c2ccccc21 Amb24679317 [0,0,0,0,1,0|3,0,0]=4 1250 B12R2.18 Cc1c(F)oc2ccccc21 Amb24084180 [0,0,0,0,1,0|2,0,0]=3 1251 B12R2.18 Cc1c(I)[nH]c2ccccc21 Amb24067551 [0,0,0,0,1,0|3,0,0]=4 1252 B12R2.18 Cc1c(N)[s]c2ccccc21 Amb21932910 [0,0,0,0,1,0|2,1,0]=4 1253 B12R2.18 Cc1c(N)oc2ccccc21 Amb18202306 [0,0,0,0,1,0|2,0,0]=3 1254 B12R2.18 Cc1c(O)[nH]c2ccccc21 Amb25709196 [0,0,0,0,1,0|2,0,0]=3 1255 B12R2.18 Cc1c(O)[s]c2ccccc21 Amb24574173 [0,0,0,0,1,0|2,0,0]=3 1256 B12R2.18 Cc1c2ccccc2[n][n]1O Amb24086646 [0,0,0,0,1,0|3,0,0]=4 1257 B12R2.18 Cc1c2ccccc2[s]c1C Amb22057362 [0,0,0,0,1,0|2,1,0]=4 1258 B12R2.18 Cc1c[n]2ccccc2c1N Amb18149646 [0,0,0,0,1,0|3,0,0]=4 1259 B12R2.18 Cc1cc2cccc[n]2c1Br Amb18559299 [0,0,0,0,1,0|3,0,0]=4 1260 B12R2.18 Cc1cc2cccc[n]2c1N Amb18559300 [0,0,0,0,1,0|3,0,0]=4 1261 B12R2.18 Cc1cc2ccccc2[n]1Cl Amb24628260 [0,0,0,0,1,0|3,0,0]=4 1262 B12R2.18 Cc1oc2cc[n]cc2c1Br Amb23591026 [0,0,0,0,1,0|3,0,0]=4 1263 B12R2.18 Cc1oc2cc[n]cc2c1C Amb22354959 [0,0,0,0,1,0|3,0,0]=4 1264 B12R2.18 Cc1oc2ccc[n]c2c1O Amb22263374 [0,0,0,0,1,0|2,0,0]=3 1265 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,0,0,0,1,0|2,0,0]=3 1266 B12R2.18 Clc1[nH]c2ccccc2c1Br Amb24586578 [0,0,0,0,1,0|3,0,0]=4 1267 B12R2.18 Clc1c(Br)[s]c2ccccc21 Amb25242733 [0,0,0,0,1,0|2,1,0]=4 1268 B12R2.18 Clc1c2ccccc2[nH]c1Cl Amb22263103 [0,0,0,0,1,0|3,0,0]=4 1269 B12R2.18 Clc1c2ccccc2[s]c1Cl Amb20669291 [0,0,0,0,1,0|2,1,0]=4 1270 B12R2.18 Clc1c2ccccc2oc1Cl Amb25145878 [0,0,0,0,1,0|2,0,0]=3 1271 B12R2.18 Cn1c(=O)[nH]c2c1cccc2 Amb1159144 [0,0,0,0,1,0|3,0,0]=4 1272 B12R2.18 Cn1c(=O)oc2c1cccc2 Amb1905664 [0,0,0,0,1,0|2,0,0]=3 1273 B12R2.18 Cn1c(C)cc2c1cccc2 Amb1934988 [0,0,0,0,1,0|3,0,0]=4 1274 B12R2.18 Fc1c[n]2ccccc2c1Br Amb25117904 [0,0,0,0,1,0|3,0,0]=4 1275 B12R2.18 Ic1c2ccccc2[nH]c1I Amb25790468 [0,0,0,0,1,0|3,0,0]=4 1276 B12R2.18 Ic1c2ccccc2[s]c1I Amb24092825 [0,0,0,0,1,0|2,1,0]=4 1277 B12R2.18 N=C1N=C2C=CC=CN2C1=O Amb24084422 [0,0,0,0,1,0|3,0,0]=4 1278 B12R2.18 NC1=Nc2ccccc2C1=O Amb24078927 [0,0,0,0,1,0|2,0,0]=3 1279 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,0,0,0,1,0|1,0,2]=4 1280 B12R2.18 NC1Oc2ccccc2C1=O Amb24349623 [0,0,0,0,1,0|1,0,2]=4 1281 B12R2.18 NN1C(=O)Nc2ccccc12 Amb18124952 [0,0,0,0,1,0|3,0,0]=4 1282 B12R2.18 NN1C(=O)Oc2ccccc12 Amb18644412 [0,0,0,0,1,0|2,0,0]=3 1283 B12R2.18 NN1Sc2ccccc2C1=O Amb25376699 [0,0,0,0,1,0|3,0,0]=4 1284 B12R2.18 N[C@@H]1C(=O)Nc2ccccc21 Amb24554831 [0,0,0,0,1,0|2,0,1]=4 1285 B12R2.18 N[C@@H]1C(=O)Oc2ccccc21 Amb25324246 [0,0,0,0,1,0|1,0,1]=3 1286 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,0,0,0,1,0|1,0,2]=4 1287 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,0,0,0,1,0|1,0,2]=4 1288 B12R2.18 Nc1[n]c2ccccc2[n]1O Amb24429903 [0,0,0,0,1,0|3,0,0]=4 1289 B12R2.18 Nc1[s]c2ccccc2c1Br Amb18135037 [0,0,0,0,1,0|2,1,0]=4 1290 B12R2.18 Nc1[s]c2ccccc2c1Cl Amb18129257 [0,0,0,0,1,0|2,1,0]=4 1291 B12R2.18 Nc1c(Br)[s]c2ccccc21 Amb18135010 [0,0,0,0,1,0|2,1,0]=4 1292 B12R2.18 Nc1c(Cl)[s]c2ccccc21 Amb18129290 [0,0,0,0,1,0|2,1,0]=4 1293 B12R2.18 O=C1C(=Nc2c1cccc2)Cl Amb17594117 [0,0,0,0,1,0|2,0,0]=3 1294 B12R2.18 O=C1C(=O)N=C2C=CC=CN12 Amb18528339 [0,0,0,0,1,0|2,0,1]=4 1295 B12R2.18 O=C1C(=S)Nc2c1cccc2 Amb17594053 [0,0,0,0,1,0|1,1,0]=3 1296 B12R2.18 O=C1C(Br)Oc2ccccc21 Amb25835380 [0,0,0,0,1,0|1,0,2]=4 1297 B12R2.18 O=C1C(C)Nc2c1cccc2 Amb17593674 [0,0,0,0,1,0|2,0,1]=4 1298 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,0,0,0,1,0|1,0,0]=2 1299 B12R2.18 O=C1C(Cl)Nc2ccccc21 Amb25059201 [0,0,0,0,1,0|2,0,1]=4 1300 B12R2.18 O=C1C(Cl)Oc2ccccc21 Amb24061516 [0,0,0,0,1,0|1,0,2]=4 1301 B12R2.18 O=C1C(Cl)Sc2ccccc21 Amb24533113 [0,0,0,0,1,0|2,0,1]=4 1302 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,0,0,0,1,0|1,0,2]=4 1303 B12R2.18 O=C1C(F)Sc2ccccc21 Amb24690556 [0,0,0,0,1,0|2,0,1]=4 1304 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,0,0,0,1,0|1,0,2]=4 1305 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,0,0,0,1,0|1,0,2]=4 1306 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,0,0,0,1,0|3,0,0]=4 1307 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,0,0,0,1,0|3,0,0]=4 1308 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,0,0,0,1,0|2,0,1]=4 1309 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,0,0,0,1,0|2,0,1]=4 1310 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,0,0,0,1,0|2,0,1]=4 1311 B12R2.18 O=C1Nc2c(C1=O)cccn2 Amb10976067 [0,0,0,0,1,0|2,0,1]=4 1312 B12R2.18 O=C1Nc2c(C1=O)cncc2 Amb16191932 [0,0,0,0,1,0|2,0,1]=4 1313 B12R2.18 O=C1Nc2c(C1Br)cccc2 Amb2228105 [0,0,0,0,1,0|2,0,1]=4 1314 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1052761 [0,0,0,0,1,0|2,0,1]=4 1315 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1154822 [0,0,0,0,1,0|2,0,1]=4 1316 B12R2.18 O=C1Oc2ccccc2C1Cl Amb25124107 [0,0,0,0,1,0|1,0,1]=3 1317 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,0,0,0,1,0|1,0,2]=4 1318 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,0,0,0,1,0|1,0,2]=4 1319 B12R2.18 O=C1c2[n]cccc2NC1=O Amb22753936 [0,0,0,0,1,0|2,0,1]=4 1320 B12R2.18 O=C1c2cc[n]cc2NC1=O Amb22754397 [0,0,0,0,1,0|2,0,1]=4 1321 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,0,0,0,1,0|0,0,1]=2 1322 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,0,0,0,1,0|0,0,2]=3 1323 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [0,0,0,0,1,0|1,0,1]=3 1324 B12R2.18 ON1C(=O)Cc2ccc[n]c12 Amb24082462 [0,0,0,0,1,0|3,0,0]=4 1325 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,0,0,0,1,0|2,0,0]=3 1326 B12R2.18 ON1C(=O)Nc2cc[n]cc12 Amb24742462 [0,0,0,0,1,0|3,0,0]=4 1327 B12R2.18 ON1C(=O)Nc2ccc[n]c12 Amb24595260 [0,0,0,0,1,0|3,0,0]=4 1328 B12R2.18 ON1Nc2ccccc2C1=O Amb24078896 [0,0,0,0,1,0|2,0,0]=3 1329 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,0,0,0,1,0|0,0,2]=3 1330 B12R2.18 O[C@@H]1Oc2ccccc2[C@H]1O Amb25284399 [0,0,0,0,1,0|0,0,3]=4 1331 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,0,0,0,1,0|1,0,1]=3 1332 B12R2.18 O[n]1c(Br)[n]c2ccccc12 Amb24472376 [0,0,0,0,1,0|3,0,0]=4 1333 B12R2.18 Oc1[n][n]2ccccc2c1Br Amb22235376 [0,0,0,0,1,0|3,0,0]=4 1334 B12R2.18 Oc1[s]c2ccccc2c1Cl Amb23590879 [0,0,0,0,1,0|2,0,0]=3 1335 B12R2.18 Oc1c(Br)[s]c2ccccc21 Amb25309520 [0,0,0,0,1,0|1,1,0]=3 1336 B12R2.18 Oc1c(S)[nH]c2ccccc21 Amb24085063 [0,0,0,0,1,0|1,1,0]=3 1337 B12R2.18 Oc1c(S)[s]c2ccccc21 Amb24518700 [0,0,0,0,1,0|0,2,0]=3 1338 B12R2.18 Oc1c2ccccc2oc1O Amb24060920 [0,0,0,0,1,0|0,0,1]=2 1339 B12R2.100 Cc1cc2[nH]ccc2cc1O Amb18124817 [0,0,0,0,1,0|3,0,0]=4 1340 B12R2.100 Cc1cc2cc[nH]c2cc1O Amb24329435 [0,0,0,0,1,0|3,0,0]=4 1341 B12R2.100 Cc1cc2cc[s]c2cc1O Amb25370774 [0,0,0,0,1,0|3,0,0]=4 1342 B12R2.100 Fc1cc2[nH]ccc2cc1O Amb10605724 [0,0,0,0,1,0|3,0,0]=4 1343 B12R2.100 O=C1C=C2C=CNC2=CC1=O Amb24655840 [0,0,0,0,1,0|2,0,1]=4 1344 B12R2.100 OC1=Cc2[n]c[s]c2NC1=O Amb25124484 [0,0,0,0,1,0|3,0,0]=4 1345 B12R2.100 OC1=Cc2[n]coc2NC1=O Amb24484628 [0,0,0,0,1,0|3,0,0]=4 1346 B12R2.100 OC1=Cc2[s]ccc2NC1=O Amb25756723 [0,0,0,0,1,0|2,0,0]=3 1347 B12R2.100 OC1=Cc2c[n]oc2NC1=O Amb25835084 [0,0,0,0,1,0|3,0,0]=4 1348 B12R2.100 OC1=Cc2ccoc2NC1=O Amb24538234 [0,0,0,0,1,0|2,0,0]=3 1349 B12R2.100 OC1=Cc2co[n]c2NC1=O Amb24484629 [0,0,0,0,1,0|3,0,0]=4 1350 B12R2.100 OC1=Cc2oc[n]c2NC1=O Amb25780189 [0,0,0,0,1,0|3,0,0]=4 1351 B12R2.100 Oc1cc2[nH]ccc2cc1O Amb10070899 [0,0,0,0,1,0|2,0,1]=4 1352 B12R2.100 Oc1cc2[s]c[n]c2[nH]c1=O Amb24098823 [0,0,0,0,1,0|3,0,0]=4 1353 B12R2.100 Oc1cc2cc[nH]c2[n]c1Cl Amb24328461 [0,0,0,0,1,0|3,0,0]=4 1354 B12R2.100 Oc1cc2cc[nH]c2cc1Br Amb18772112 [0,0,0,0,1,0|3,0,0]=4 1355 B12R2.100 Oc1cc2cc[s]c2cc1O Amb25046623 [0,0,0,0,1,0|2,0,1]=4 1356 B12R2.100 Oc1cc2ccoc2cc1Cl Amb24487015 [0,0,0,0,1,0|3,0,0]=4 1357 B12R2.100 Oc1cc2occc2cc1Br Amb23568419 [0,0,0,0,1,0|3,0,0]=4 1358 B12R2.100 Oc1cc2occc2cc1Cl Amb23568417 [0,0,0,0,1,0|3,0,0]=4 1359 B14R2.738 C=C1Nc2ccccc2N=C(O)N1 Amb25815750 [0,0,0,0,0,1|3,0,0]=4 1360 B14R2.738 CC1=CC(=O)Cc2ccccc2O1 Amb24646596 [0,0,0,0,0,1|1,0,2]=4 1361 B14R2.738 CC1=CC(=O)Nc2ccccc2N1 Amb17912774 [0,0,0,0,0,1|3,0,0]=4 1362 B14R2.738 CC=1CC(=O)Sc2ccccc2N1 Amb25128501 [0,0,0,0,0,1|2,1,0]=4 1363 B14R2.738 NC=1Cc2ccccc2C=C(I)N1 Amb24395002 [0,0,0,0,0,1|3,0,0]=4 1364 B14R2.738 O=C1C=C(Cl)Sc2ccccc2N1 Amb25119160 [0,0,0,0,0,1|3,0,0]=4 1365 B14R2.738 O=C1CC(=Nc2c(N1)cccc2)C Amb1396300 [0,0,0,0,0,1|3,0,0]=4 1366 B14R2.738 O=C1CC(=O)Nc2c(N1)cccc2 Amb1678046 [0,0,0,0,0,1|2,0,1]=4 1367 B14R2.738 O=C1CS(=O)Oc2ccccc2N1 Amb25689516 [0,0,0,0,0,1|2,0,1]=4 1368 B14R2.738 OC1=CC(=O)Nc2[n]cccc2N1 Amb25816909 [0,0,0,0,0,1|3,0,0]=4 1369 B14R2.738 OC1=CC(=O)Nc2[n]cccc2O1 Amb24470717 [0,0,0,0,0,1|3,0,0]=4 1370 B14R2.738 OC1=CC(=O)Nc2ccccc2O1 Amb25685946 [0,0,0,0,0,1|2,0,0]=3 1371 B14R2.741 CC1=Cc2ccccc2C=CC1=O Amb21948167 [0,0,0,0,0,1|2,0,0]=3 1372 B14R2.741 CC1=Cc2ccccc2C=CC1O Amb17843719 [0,0,0,0,0,1|2,0,1]=4 1373 B14R2.741 CC1C=Cc2ccccc2NC1=O Amb25307923 [0,0,0,0,0,1|2,0,1]=4 1374 B14R2.741 CN1C=Cc2ccccc2CC1=O Amb24496437 [0,0,0,0,0,1|3,0,0]=4 1375 B14R2.741 CN1C=Nc2ccccc2CC1=O Amb25039532 [0,0,0,0,0,1|3,0,0]=4 1376 B14R2.741 N=C1C=Cc2ccccc2C=C1O Amb24491614 [0,0,0,0,0,1|2,0,0]=3 1377 B14R2.741 NC1=Cc2ccccc2C=CC1=O Amb25760803 [0,0,0,0,0,1|2,0,0]=3 1378 B14R2.741 O=C1C=Cc2ccccc2NC1=O Amb25190176 [0,0,0,0,0,1|1,0,1]=3 1379 B14R2.741 O=C1C=Cc2ccccc2OC1=O Amb24721695 [0,0,0,0,0,1|0,0,1]=2 1380 B14R2.741 O=C1N=C2C=CC=CC2=CC=C1I Amb20240863 [0,0,0,0,0,1|2,0,0]=3 1381 B14R2.741 OC1=Cc2ccc[n]c2C=CC1=O Amb25322871 [0,0,0,0,0,1|2,0,0]=3 1382 B14R2.741 OC1CCc2ccccc2NC1=O Amb25226835 [0,0,0,0,0,1|1,0,2]=4 1383 B14R2.741 OC1COc2ccccc2NC1=O Amb25324480 [0,0,0,0,0,1|1,0,2]=4 1384 B14R2.741 O[C@@H]1COc2ccccc2NC1=O Amb24682139 [0,0,0,0,0,1|1,0,2]=4 1385 B14R2.741 O[C@H]1CCc2ccccc2NC1=O Amb24642515 [0,0,0,0,0,1|1,0,2]=4 1386 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [1,0,1,0,0,0|2,0,0]=4 1387 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [1,0,1,0,0,0|1,0,1]=4 1388 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [1,0,1,0,0,0|2,0,0]=4 1389 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [1,0,1,0,0,0|2,0,0]=4 1390 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [1,0,1,0,0,0|1,0,0]=3 1391 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [1,0,1,0,0,0|0,0,0]=2 1392 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [1,0,1,0,0,0|1,0,1]=4 1393 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [1,0,1,0,0,0|1,0,1]=4 1394 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [1,0,1,0,0,0|1,0,1]=4 1395 B11R1.40 C\C(=C\c1cc[n]cc1)\C=O Amb24366948 [1,0,1,0,0,0|2,0,0]=4 1396 B11R1.40 C\C(=C\c1cccc[n]1)\C=O Amb25149235 [1,0,1,0,0,0|2,0,0]=4 1397 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [1,0,1,0,0,0|1,0,0]=3 1398 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [1,0,1,0,0,0|2,0,0]=4 1399 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [1,0,1,0,0,0|1,0,1]=4 1400 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [1,0,1,0,0,0|1,0,1]=4 1401 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [1,0,1,0,0,0|1,0,1]=4 1402 B11R1.40 O=C(C=O)Oc1c[n]ccc1 Amb24484745 [1,0,1,0,0,0|1,0,1]=4 1403 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [1,0,1,0,0,0|0,0,1]=3 1404 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [1,0,1,0,0,0|0,0,2]=4 1405 B11R1.40 O=C\C(=C\c1ccccn1)\C Amb1014105 [1,0,1,0,0,0|2,0,0]=4 1406 B11R1.40 O=C\C(=C\c1cccnc1)\C Amb17334266 [1,0,1,0,0,0|2,0,0]=4 1407 B11R1.40 O=C\C(=C\c1ccncc1)\C Amb17334268 [1,0,1,0,0,0|2,0,0]=4 1408 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [1,0,1,0,0,0|1,0,0]=3 1409 B11R1.40 O=C\C(\Cl)=C/c1ccc[n]c1 Amb24357125 [1,0,1,0,0,0|2,0,0]=4 1410 B11R1.40 O=C\C(\Cl)=C\c1cccc[n]1 Amb18126489 [1,0,1,0,0,0|2,0,0]=4 1411 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [1,0,1,0,0,0|1,0,0]=3 1412 B11R1.40 O=C\C(\F)=C\c1cccc[n]1 Amb24689556 [1,0,1,0,0,0|2,0,0]=4 1413 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [1,0,1,0,0,0|1,0,0]=3 1414 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [1,0,1,0,0,0|2,0,0]=4 1415 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [1,0,1,0,0,0|0,0,2]=4 1416 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [1,0,1,0,0,0|1,0,1]=4 1417 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [1,0,1,0,0,0|1,0,1]=4 1418 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [1,0,1,0,0,0|0,0,1]=3 1419 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [1,0,1,0,0,0|1,0,1]=4 1420 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [1,0,1,0,0,0|1,0,0]=3 1421 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [1,0,1,0,0,0|0,0,2]=4 1422 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [1,0,1,0,0,0|0,0,0]=2 1423 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [1,0,1,0,0,0|0,0,0]=2 1424 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [1,0,1,0,0,0|1,0,1]=4 1425 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [1,0,1,0,0,0|1,0,1]=4 1426 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [1,0,1,0,0,0|2,0,0]=4 1427 B11R1.91 CC(=O)C=Cc1ccc[nH+]c1 Amb24099599 [1,0,1,0,0,0|2,0,0]=4 1428 B11R1.91 CC(=O)\C=C/c1cccc[n]1 Amb24532942 [1,0,1,0,0,0|2,0,0]=4 1429 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,0,1,0,0,0|1,0,0]=3 1430 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,1,0,0,0|1,0,0]=3 1431 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,0,1,0,0,0|2,0,0]=4 1432 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb17477757 [1,0,1,0,0,0|2,0,0]=4 1433 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb17477756 [1,0,1,0,0,0|2,0,0]=4 1434 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,0,1,0,0,0|2,0,0]=4 1435 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [1,0,1,0,0,0|1,0,1]=4 1436 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [1,0,1,0,0,0|1,0,1]=4 1437 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [1,0,1,0,0,0|2,0,0]=4 1438 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [1,0,1,0,0,0|2,0,0]=4 1439 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [1,0,1,0,0,0|2,0,0]=4 1440 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [1,0,1,0,0,0|2,0,0]=4 1441 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [1,0,1,0,0,0|1,1,0]=4 1442 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [1,0,1,0,0,0|1,0,1]=4 1443 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [1,0,1,0,0,0|1,0,1]=4 1444 B11R1.91 OC(=O)C=Cc1c[n]cc[n]1 Amb24082749 [1,0,1,0,0,0|2,0,0]=4 1445 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,0,1,0,0,0|0,0,2]=4 1446 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [1,0,1,0,0,0|1,0,1]=4 1447 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [1,0,1,0,0,0|1,0,1]=4 1448 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [1,0,1,0,0,0|1,0,1]=4 1449 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [1,0,1,0,0,0|1,0,1]=4 1450 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [1,0,1,0,0,0|1,0,1]=4 1451 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,0,1,0,0,0|0,0,2]=4 1452 B11R1.91 OC(=O)\C=C/c1[n]ccc[n]1 Amb25830337 [1,0,1,0,0,0|2,0,0]=4 1453 B11R1.91 OC(=O)\C=C/c1cc[n]cc1 Amb20622011 [1,0,1,0,0,0|1,0,0]=3 1454 B11R1.91 OC(=O)\C=C/c1ccc[n]c1 Amb25378742 [1,0,1,0,0,0|1,0,0]=3 1455 B11R1.91 OC(=O)\C=C/c1ccccn1 Amb10071558 [1,0,1,0,0,0|1,0,0]=3 1456 B11R1.91 OC(=O)\C=C\N1CC=CC=C1 Amb22015329 [1,0,1,0,0,0|1,0,1]=4 1457 B11R1.91 OC(=O)\C=C\c1cc[n][n]c1 Amb18125071 [1,0,1,0,0,0|2,0,0]=4 1458 B11R1.91 OC(=O)\C=C\c1cc[n]c[n]1 Amb25337419 [1,0,1,0,0,0|2,0,0]=4 1459 B11R1.91 OC(=O)\C=C\c1ccc[n][n]1 Amb18125070 [1,0,1,0,0,0|2,0,0]=4 1460 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [1,0,1,0,0,0|0,0,0]=2 1461 B11R1.91 OC(=O)\C=C\c1ccncc1 Amb1107607 [1,0,1,0,0,0|1,0,0]=3 1462 B11R1.91 OC(=O)\C=C\c1cnccn1 Amb10609139 [1,0,1,0,0,0|2,0,0]=4 1463 B11R1.91 OC(=O)\C=C\c1ncccn1 Amb17593721 [1,0,1,0,0,0|2,0,0]=4 1464 B11R1.91 OC(=O)\C=N/c1cc[n]cc1 Amb24068310 [1,0,1,0,0,0|2,0,0]=4 1465 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [1,0,1,0,0,0|1,0,0]=3 1466 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,0,1,0,0,0|0,0,2]=4 1467 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [1,0,1,0,0,0|0,0,1]=3 1468 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [1,0,1,0,0,0|0,0,1]=3 1469 B11R1.41 C=CCc1ccccc1C=O Amb18124788 [1,0,1,0,0,0|1,0,1]=4 1470 B11R1.41 C=COc1ccccc1CO Amb24069036 [1,0,1,0,0,0|1,0,1]=4 1471 B11R1.41 COc1ccccc1\C=C\Cl Amb24711351 [1,0,1,0,0,0|1,0,1]=4 1472 B11R1.41 C\C=C/c1ccccc1C=O Amb24430138 [1,0,1,0,0,0|1,0,0]=3 1473 B11R1.41 C\C=C\c1ccccc1C=O Amb18124786 [1,0,1,0,0,0|1,0,0]=3 1474 B11R1.41 O=CCc1ccccc1C=O Amb17593688 [1,0,1,0,0,0|0,0,2]=4 1475 B11R1.41 O=CNc1ccccc1C=O Amb18124947 [1,0,1,0,0,0|1,0,1]=4 1476 B11R1.41 O=Cc1ccccc1C=C=O Amb24070193 [1,0,1,0,0,0|0,0,2]=4 1477 B11R1.41 OCCc1ccccc1C=O Amb17593729 [1,0,1,0,0,0|0,0,2]=4 1478 B11R1.41 OCOc1ccccc1C=O Amb25833595 [1,0,1,0,0,0|1,0,1]=4 1479 B11R1.41 OCc1ccccc1NC=O Amb18791472 [1,0,1,0,0,0|1,0,1]=4 1480 B11R1.41 O\C=C/c1ccccc1C=O Amb24106774 [1,0,1,0,0,0|0,0,0]=2 1481 B11R1.41 O\N=C\c1ccccc1C=O Amb24669033 [1,0,1,0,0,0|1,0,0]=3 1482 B11R1.41 O\N=C\c1ccccc1OC Amb1646736 [1,0,1,0,0,0|1,0,1]=4 1483 B11R1.17 C=C\C=C\c1ccccc1N Amb18644207 [1,0,1,0,0,0|2,0,0]=4 1484 B11R1.17 C=C\C=C\c1ccccc1O Amb25142722 [1,0,1,0,0,0|1,0,0]=3 1485 B11R1.17 CC=CCc1ccccc1O Amb24089583 [1,0,1,0,0,0|1,0,1]=4 1486 B11R1.17 CC\C=C/c1ccccc1O Amb25713551 [1,0,1,0,0,0|1,0,1]=4 1487 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [1,0,1,0,0,0|1,0,1]=4 1488 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [1,0,1,0,0,0|2,0,0]=4 1489 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [1,0,1,0,0,0|2,0,0]=4 1490 B11R1.17 CS\C=C\c1ccccc1O Amb18646619 [1,0,1,0,0,0|2,0,0]=4 1491 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [1,0,1,0,0,0|1,0,1]=4 1492 B11R1.17 C\C=C\Oc1ccccc1O Amb25143344 [1,0,1,0,0,0|2,0,0]=4 1493 B11R1.17 Cc1c[n]ccc1\C=C\C=O Amb25298235 [1,0,1,0,0,0|2,0,0]=4 1494 B11R1.17 Cc1ccccc1O\C=C/Cl Amb25796451 [1,0,1,0,0,0|1,0,1]=4 1495 B11R1.17 N#C\C=C\c1ccccc1O Amb18644195 [1,0,1,0,0,0|1,0,1]=4 1496 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [1,0,1,0,0,0|1,0,0]=3 1497 B11R1.17 O=C/1C=CC=C\C1=C\C=C=O Amb24378989 [1,0,1,0,0,0|0,0,2]=4 1498 B11R1.17 O=C/1C=CC=C\C1=C\NC=O Amb24518470 [1,0,1,0,0,0|1,0,1]=4 1499 B11R1.17 O=C\C=C/c1ccccc1S Amb24638879 [1,0,1,0,0,0|0,1,0]=3 1500 B11R1.17 O=C\C=C\c1ccc[n]c1Cl Amb24646496 [1,0,1,0,0,0|2,0,0]=4 1501 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [1,0,1,0,0,0|1,0,0]=3 1502 B11R1.17 O=C\C=C\c1ccccc1C Amb17232007 [1,0,1,0,0,0|1,0,0]=3 1503 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [1,0,1,0,0,0|1,0,0]=3 1504 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [1,0,1,0,0,0|1,0,0]=3 1505 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [1,0,1,0,0,0|0,0,2]=4 1506 B11R1.17 Oc1ccccc1C\C=C/Cl Amb24578313 [1,0,1,0,0,0|1,0,1]=4 1507 B11R1.17 Oc1ccccc1C\C=C\Cl Amb18647090 [1,0,1,0,0,0|1,0,1]=4 1508 B11R1.17 Oc1ccccc1NCC=O Amb24096359 [1,0,1,0,0,0|1,0,1]=4 1509 B11R1.17 Oc1ccccc1SCC=O Amb25290203 [1,0,1,0,0,0|1,0,1]=4 1510 B11R1.17 Oc1ccccc1\C=C/CCl Amb24401534 [1,0,1,0,0,0|1,0,1]=4 1511 B11R1.17 Oc1ccccc1\C=C/CO Amb18125107 [1,0,1,0,0,0|0,0,2]=4 1512 B11R1.17 Oc1ccccc1\C=C\CBr Amb25225899 [1,0,1,0,0,0|1,0,1]=4 1513 B11R1.17 Oc1ccccc1\C=C\CO Amb25300470 [1,0,1,0,0,0|0,0,2]=4 1514 B11R1.17 Oc1ccccc1\C=N\C=O Amb24422424 [1,0,1,0,0,0|1,0,0]=3 1515 B11R1.17 Oc1ccccc1\N=C\C=O Amb24759135 [1,0,1,0,0,0|1,0,0]=3 1516 B11R1.86 C=C(Br)Cc1ccccc1O Amb25147877 [1,0,1,0,0,0|1,0,1]=4 1517 B11R1.86 C=C(Cl)Cc1ccccc1O Amb18126586 [1,0,1,0,0,0|1,0,1]=4 1518 B11R1.86 C=C1C=CC=CC1CC(O)=O Amb24396318 [1,0,1,0,0,0|1,0,1]=4 1519 B11R1.86 CC(=C)Cc1ccccc1O Amb18124924 [1,0,1,0,0,0|1,0,1]=4 1520 B11R1.86 CC(=C)Sc1ccccc1O Amb18646620 [1,0,1,0,0,0|2,0,0]=4 1521 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [1,0,1,0,0,0|1,0,1]=4 1522 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [1,0,1,0,0,0|2,0,0]=4 1523 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [1,0,1,0,0,0|1,0,1]=4 1524 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [1,0,1,0,0,0|1,0,1]=4 1525 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [1,0,1,0,0,0|1,0,1]=4 1526 B11R1.86 CC(=O)Oc1ccccc1N Amb18644456 [1,0,1,0,0,0|1,0,1]=4 1527 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [1,0,1,0,0,0|1,0,1]=4 1528 B11R1.86 CC(C)=Cc1ccccc1O Amb18124916 [1,0,1,0,0,0|1,0,1]=4 1529 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [1,0,1,0,0,0|1,0,1]=4 1530 B11R1.86 ClC(=O)Oc1ccccc1Cl Amb10844668 [1,0,1,0,0,0|2,0,0]=4 1531 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [1,0,1,0,0,0|2,0,0]=4 1532 B11R1.86 NC(=O)Oc1ccccc1C Amb10576081 [1,0,1,0,0,0|1,0,1]=4 1533 B11R1.86 NC(=O)Oc1ccccc1Cl Amb10575594 [1,0,1,0,0,0|2,0,0]=4 1534 B11R1.86 NC(=O)Oc1ccccc1F Amb16227453 [1,0,1,0,0,0|2,0,0]=4 1535 B11R1.86 Nc1ccccc1OC(N)=O Amb24636357 [1,0,1,0,0,0|2,0,0]=4 1536 B11R1.86 OC(=O)Cc1ccccc1Br Amb1139894 [1,0,1,0,0,0|1,0,1]=4 1537 B11R1.86 OC(=O)Cc1ccccc1O Amb2388914 [1,0,1,0,0,0|0,0,1]=3 1538 B11R1.86 OC(=O)Cc1ccccc1S Amb17616851 [1,0,1,0,0,0|0,1,1]=4 1539 B11R1.86 OC(=O)Nc1ccccc1C Amb1261710 [1,0,1,0,0,0|1,0,1]=4 1540 B11R1.86 Oc1c[n]ccc1CC(O)=O Amb25849124 [1,0,1,0,0,0|1,0,1]=4 1541 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb18125512 [1,0,1,0,0,0|1,0,1]=4 1542 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb20247882 [1,0,1,0,0,0|1,0,1]=4 1543 B11R1.86 Oc1ccccc1C=C(Cl)Cl Amb25373129 [1,0,1,0,0,0|2,0,0]=4 1544 B11R1.86 Oc1ccccc1OC(=O)Cl Amb25284326 [1,0,1,0,0,0|2,0,0]=4 1545 B11R1.1 C=C\C=C/c1ccc(O)cc1 Amb24103177 [1,0,1,0,0,0|1,0,0]=3 1546 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [1,0,1,0,0,0|2,0,0]=4 1547 B11R1.1 C=C\C=C\c1ccc(N)[n]c1 Amb24567231 [1,0,1,0,0,0|2,0,0]=4 1548 B11R1.1 C=C\C=C\c1ccc(N)cc1 Amb24673532 [1,0,1,0,0,0|2,0,0]=4 1549 B11R1.1 C=C\C=C\c1ccc(O)cc1 Amb25227603 [1,0,1,0,0,0|1,0,0]=3 1550 B11R1.24 C=C\C=C\c1cccc(Cl)c1 Amb25221723 [1,0,1,0,0,0|2,0,0]=4 1551 B11R1.24 C=C\C=C\c1cccc(F)c1 Amb24485865 [1,0,1,0,0,0|2,0,0]=4 1552 B11R1.24 C=C\C=C\c1cccc(O)c1 Amb25176416 [1,0,1,0,0,0|1,0,0]=3 1553 B11R1.24 Cc1cc(\C=C\C=C)ccc1 Amb24604764 [1,0,1,0,0,0|2,0,0]=4 1554 B11R1.24 O=C\C=C\c1cccc(c1)O Amb17334281 [1,0,1,0,0,0|2,0,0]=4 1555 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [2,0,0,0,0,0|1,0,1]=4 1556 B11R2.20 C1=Cc2c(NC1)cccc2 Amb17593383 [2,0,0,0,0,0|1,0,1]=4 1557 B11R2.20 C1C=CNc2ccccc21 Amb24700458 [2,0,0,0,0,0|1,0,1]=4 1558 B11R2.20 C1C=COc2[n]cccc21 Amb25793536 [2,0,0,0,0,0|1,0,1]=4 1559 B11R2.20 C1C=COc2c[n]ccc21 Amb24390776 [2,0,0,0,0,0|1,0,1]=4 1560 B11R2.20 C1C=COc2ccccc21 Amb24715811 [2,0,0,0,0,0|0,0,1]=3 1561 B11R2.20 C1C=CSc2ccccc21 Amb25349026 [2,0,0,0,0,0|0,1,1]=4 1562 B11R2.20 C1C=Cc2[n]cccc2O1 Amb22896485 [2,0,0,0,0,0|1,0,1]=4 1563 B11R2.20 C1C=Cc2c[n]ccc2O1 Amb24665756 [2,0,0,0,0,0|1,0,1]=4 1564 B11R2.20 C1C=Cc2cc[n]cc2O1 Amb24065645 [2,0,0,0,0,0|1,0,1]=4 1565 B11R2.20 C1Oc2ccccc2C=C1 Amb17844055 [2,0,0,0,0,0|0,0,1]=3 1566 B11R2.20 C1SC=Cc2ccccc21 Amb25231190 [2,0,0,0,0,0|2,0,0]=4 1567 B11R2.20 C=1N=CNC2=CC=COC21 Amb24564703 [2,0,0,0,0,0|2,0,0]=4 1568 B11R2.20 C=1OC=CC2=CC=CNC21 Amb25074513 [2,0,0,0,0,0|2,0,0]=4 1569 B11R2.20 [13cH]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17618237 [2,0,0,0,0,0|1,0,0]=3 1570 B11R2.20 c1[nH+]ccc2ccccc21 Amb22456232 [2,0,0,0,0,0|2,0,0]=4 1571 B11R2.20 c1[n]ccc2NC=COc21 Amb24089126 [2,0,0,0,0,0|2,0,0]=4 1572 B11R2.20 c1[n]ccc2ONC=Cc21 Amb24100803 [2,0,0,0,0,0|2,0,0]=4 1573 B11R2.20 c1[n]ccc2OOC=Cc21 Amb24060614 [2,0,0,0,0,0|2,0,0]=4 1574 B11R2.20 c1cc[13c]2[13c](c1)[13cH][13cH][13cH][13cH]2 Amb17618236 [2,0,0,0,0,0|1,0,0]=3 1575 B11R2.20 c1cc[n+]2c(c1)nccc2 Amb1630259 [2,0,0,0,0,0|2,0,0]=4 1576 B11R2.20 c1cc[n]c2OC=CNc21 Amb24089117 [2,0,0,0,0,0|2,0,0]=4 1577 B11R2.20 c1cc[n]c2ONC=Cc21 Amb24100801 [2,0,0,0,0,0|2,0,0]=4 1578 B11R2.20 c1cc[n]c2ccc[n]c21 Amb22347852 [2,0,0,0,0,0|2,0,0]=4 1579 B11R2.20 c1ccc2OOC=Cc2[n]1 Amb24060613 [2,0,0,0,0,0|2,0,0]=4 1580 B11R2.20 c1ccc2c(c1)[nH+]ccc2 Amb10839799 [2,0,0,0,0,0|1,0,0]=3 1581 B11R2.20 c1ccc2c(c1)cncc2 Amb10573326 [2,0,0,0,0,0|2,0,0]=4 1582 B11R2.20 c1ccc2c(c1)nccc2 Amb17619761 [2,0,0,0,0,0|1,0,0]=3 1583 B11R2.20 c1ccc2c(c1)nccn2 Amb2099438 [2,0,0,0,0,0|2,0,0]=4 1584 B11R2.20 c1cccc2NC=CNc21 Amb25217865 [2,0,0,0,0,0|2,0,0]=4 1585 B11R2.20 c1cccc2[13cH][13cH][13cH][13cH]c21 Amb22367374 [2,0,0,0,0,0|1,0,0]=3 1586 B11R2.20 c1cccc2[13cH]cccc21 Amb22353428 [2,0,0,0,0,0|1,0,0]=3 1587 B11R2.20 c1cccc2[14cH]cccc21 Amb22349781 [2,0,0,0,0,0|1,0,0]=3 1588 B11R2.20 c1cccc2[nH+]cccc21 Amb22411647 [2,0,0,0,0,0|1,0,0]=3 1589 B11R2.20 c1cccc2[nH+]cccc21 Amb22733403 [2,0,0,0,0,0|1,0,0]=3 1590 B11R2.20 c1cccc2[n][n]ccc21 Amb21858429 [2,0,0,0,0,0|2,0,0]=4 1591 B11R2.20 c1cccc2[n][n]ccc21 Amb22001549 [2,0,0,0,0,0|2,0,0]=4 1592 B11R2.20 c1cccc2[n]cccc21 Amb22002632 [2,0,0,0,0,0|1,0,0]=3 1593 B11R2.20 c1cccc2[n]cccc21 Amb22337856 [2,0,0,0,0,0|1,0,0]=3 1594 B11R2.20 c1cnc2c(c1)cccn2 Amb15692873 [2,0,0,0,0,0|2,0,0]=4 1595 B11R2.20 c1cnc2c(c1)nccc2 Amb1106274 [2,0,0,0,0,0|2,0,0]=4 1596 B13R1.133 Br\C(=C/c1ccc(cc1)Cl)\C(=O)C Amb2433257 [0,1,1,0,0,0|2,0,0]=4 1597 B13R1.133 C=C(Cc1ccc(Cl)cc1)C(O)=O Amb18130358 [0,1,1,0,0,0|1,0,1]=4 1598 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Br)cc1 Amb22460391 [0,1,1,0,0,0|2,0,0]=4 1599 B13R1.133 C=C(Cl)C(=O)Nc1ccc(I)cc1 Amb22460397 [0,1,1,0,0,0|2,0,0]=4 1600 B13R1.133 C=C(Cl)C(=O)Nc1ccc(O)cc1 Amb25766511 [0,1,1,0,0,0|2,0,0]=4 1601 B13R1.133 C=C(Oc1ccc(Cl)cc1)C(O)=O Amb18130544 [0,1,1,0,0,0|2,0,0]=4 1602 B13R1.133 CC(=C)C(=O)Cc1ccc(Cl)cc1 Amb25696266 [0,1,1,0,0,0|2,0,0]=4 1603 B13R1.133 CC(=C)C(=O)Cc1ccc(N)cc1 Amb25104589 [0,1,1,0,0,0|2,0,0]=4 1604 B13R1.133 CC(=C)C(=O)Nc1ccc(Br)cc1 Amb22001452 [0,1,1,0,0,0|2,0,0]=4 1605 B13R1.133 CC(=C)C(=O)Nc1ccc(N)cc1 Amb24390819 [0,1,1,0,0,0|2,0,0]=4 1606 B13R1.133 CC(=C)C(=O)Nc1ccc(O)cc1 Amb17934074 [0,1,1,0,0,0|2,0,0]=4 1607 B13R1.133 CC(=C)C(=O)Oc1ccc(Cl)cc1 Amb25138122 [0,1,1,0,0,0|1,0,0]=3 1608 B13R1.133 CC(=C)C(=O)Oc1ccc(N)cc1 Amb18127866 [0,1,1,0,0,0|1,0,0]=3 1609 B13R1.133 CC(=Cc1ccc(I)cc1)C(O)=O Amb17844105 [0,1,1,0,0,0|1,0,0]=3 1610 B13R1.133 CC(=O)C(=O)Oc1ccc(O)cc1 Amb25730163 [0,1,1,0,0,0|0,0,2]=4 1611 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Br)cc1 Amb25749588 [0,1,1,0,0,0|0,0,2]=4 1612 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25749589 [0,1,1,0,0,0|0,0,2]=4 1613 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(I)cc1 Amb25847716 [0,1,1,0,0,0|0,0,2]=4 1614 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Br)cc1 Amb24613750 [0,1,1,0,0,0|0,0,2]=4 1615 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25032716 [0,1,1,0,0,0|0,0,2]=4 1616 B13R1.133 C\C(=C/c1ccc(Br)cc1)\C(O)=O Amb25696415 [0,1,1,0,0,0|1,0,0]=3 1617 B13R1.133 C\C(=C/c1ccc(F)cc1)\C(C)=O Amb25130578 [0,1,1,0,0,0|2,0,0]=4 1618 B13R1.133 C\C(=C/c1ccc(I)cc1)\C(C)=O Amb24595205 [0,1,1,0,0,0|2,0,0]=4 1619 B13R1.133 C\C(=C/c1ccc(N)[n]c1)\C(O)=O Amb24635725 [0,1,1,0,0,0|2,0,0]=4 1620 B13R1.133 C\C(=C/c1ccc(O)cc1)\C(C)=O Amb24349357 [0,1,1,0,0,0|2,0,0]=4 1621 B13R1.133 C\C(=C/c1ccc(O)cc1)\C(O)=O Amb18128066 [0,1,1,0,0,0|1,0,0]=3 1622 B13R1.133 C\C(=C\c1ccc(F)cc1)\C(N)=O Amb24371786 [0,1,1,0,0,0|2,0,0]=4 1623 B13R1.133 C\C(=C\c1ccc(F)cc1)\C(O)=O Amb25774175 [0,1,1,0,0,0|1,0,0]=3 1624 B13R1.133 C\C(=C\c1ccc(S)cc1)\C(O)=O Amb25210469 [0,1,1,0,0,0|1,0,0]=3 1625 B13R1.133 Cc1ccc(CC(=C)C(O)=O)cc1 Amb18127720 [0,1,1,0,0,0|1,0,1]=4 1626 B13R1.133 Cc1ccc(C[C@@H](O)C(O)=O)cc1 Amb25858127 [0,1,1,0,0,0|0,0,2]=4 1627 B13R1.133 Cc1ccc(\C=C(/C)\C(C)=O)cc1 Amb25792987 [0,1,1,0,0,0|2,0,0]=4 1628 B13R1.133 Cc1ccc(\C=C(/F)\C(C)=O)cc1 Amb24553560 [0,1,1,0,0,0|2,0,0]=4 1629 B13R1.133 Cc1ccc(\C=C(/F)\C(O)=O)cc1 Amb18128596 [0,1,1,0,0,0|1,0,0]=3 1630 B13R1.133 Cc1ccc(\C=C(/S)\C(O)=O)cc1 Amb18130091 [0,1,1,0,0,0|0,1,0]=3 1631 B13R1.133 Cc1ccc(\C=C(\C)/C(O)=O)cc1 Amb25096128 [0,1,1,0,0,0|1,0,0]=3 1632 B13R1.133 Cc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb25321952 [0,1,1,0,0,0|1,0,0]=3 1633 B13R1.133 Cc1ccc(\C=C(\F)/C(O)=O)c[n]1 Amb25800275 [0,1,1,0,0,0|2,0,0]=4 1634 B13R1.133 Cc1ccc(\C=C(\F)/C(O)=O)cc1 Amb24732322 [0,1,1,0,0,0|1,0,0]=3 1635 B13R1.133 Cc1ccc(cc1)NC(=N)C(O)=O Amb25362238 [0,1,1,0,0,0|2,0,0]=4 1636 B13R1.133 Cc1ccc(cc1)NC(=O)C(=C)C Amb2410051 [0,1,1,0,0,0|2,0,0]=4 1637 B13R1.133 Cc1ccc(cc1)NC(=O)C(=C)Cl Amb22460375 [0,1,1,0,0,0|2,0,0]=4 1638 B13R1.133 Cc1ccc(cc1)NC(=S)C(O)=O Amb25320885 [0,1,1,0,0,0|1,1,0]=4 1639 B13R1.133 Cc1ccc(cc1)OC(=O)C(O)=O Amb24652452 [0,1,1,0,0,0|1,0,0]=3 1640 B13R1.133 Cc1ccc(cc1)OC(=O)[C@@H](C)O Amb25706037 [0,1,1,0,0,0|0,0,2]=4 1641 B13R1.133 Cc1ccc(cc1)\N=C(/C)\C(O)=O Amb24739492 [0,1,1,0,0,0|2,0,0]=4 1642 B13R1.133 Clc1ccc(cc1)NC(=O)C(=C)Cl Amb2444521 [0,1,1,0,0,0|2,0,0]=4 1643 B13R1.133 Nc1ccc(CC(=O)C(O)=O)cc1 Amb24433983 [0,1,1,0,0,0|0,0,2]=4 1644 B13R1.133 Nc1ccc(CC(O)C(O)=O)cc1 Amb24635658 [0,1,1,0,0,0|0,0,2]=4 1645 B13R1.133 Nc1ccc(\C=C(/F)\C(O)=O)cc1 Amb25274936 [0,1,1,0,0,0|1,0,0]=3 1646 B13R1.133 Nc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb24408981 [0,1,1,0,0,0|1,0,0]=3 1647 B13R1.133 O=C(C(=C)C)Nc1ccc(cc1)Cl Amb2406800 [0,1,1,0,0,0|2,0,0]=4 1648 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Br Amb1140012 [0,1,1,0,0,0|0,0,2]=4 1649 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)C Amb1140634 [0,1,1,0,0,0|0,0,2]=4 1650 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Cl Amb1141688 [0,1,1,0,0,0|0,0,2]=4 1651 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)F Amb1130482 [0,1,1,0,0,0|0,0,2]=4 1652 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)Cl Amb2371148 [0,1,1,0,0,0|1,0,1]=4 1653 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)N Amb1348301 [0,1,1,0,0,0|1,0,1]=4 1654 B13R1.133 OC(=O)C(=S)Cc1ccc(Cl)cc1 Amb25827120 [0,1,1,0,0,0|0,1,1]=4 1655 B13R1.133 OC(=O)C(=S)Nc1ccc(Cl)cc1 Amb25366124 [0,1,1,0,0,0|1,1,0]=4 1656 B13R1.133 OC(=O)C(O)Cc1ccc(I)cc1 Amb25079589 [0,1,1,0,0,0|0,0,2]=4 1657 B13R1.133 OC(=O)[C@@H](O)Cc1ccc(Cl)cc1 Amb25816136 [0,1,1,0,0,0|0,0,2]=4 1658 B13R1.133 OC(=O)[C@H](O)Cc1ccc(Cl)cc1 Amb25731054 [0,1,1,0,0,0|0,0,2]=4 1659 B13R1.133 OC(=O)\C(\Cl)=C/c1ccc(F)cc1 Amb24598280 [0,1,1,0,0,0|1,0,0]=3 1660 B13R1.133 OC(=O)\C(\Cl)=C\c1ccc(Cl)cc1 Amb18658048 [0,1,1,0,0,0|1,0,0]=3 1661 B13R1.133 OC(=O)\C(\F)=C\c1ccc(Cl)cc1 Amb25209028 [0,1,1,0,0,0|1,0,0]=3 1662 B13R1.133 OC(=O)\C(\F)=C\c1ccc(F)cc1 Amb25858140 [0,1,1,0,0,0|1,0,0]=3 1663 B13R1.133 OC(=O)\C(\F)=C\c1ccc(I)cc1 Amb25678331 [0,1,1,0,0,0|1,0,0]=3 1664 B13R1.133 OC(=O)\C(\S)=C\c1ccc(I)cc1 Amb24400252 [0,1,1,0,0,0|0,1,0]=3 1665 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Br Amb17159703 [0,1,1,0,0,0|0,0,2]=4 1666 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)C Amb17138950 [0,1,1,0,0,0|0,0,2]=4 1667 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Cl Amb17139824 [0,1,1,0,0,0|0,0,2]=4 1668 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)F Amb17139080 [0,1,1,0,0,0|0,0,2]=4 1669 B13R1.133 O[C@H](Cc1ccc(F)cc1)C(O)=O Amb17935902 [0,1,1,0,0,0|0,0,2]=4 1670 B13R1.133 O\C(=C/c1ccc(F)cc1)\C(O)=O Amb22549399 [0,1,1,0,0,0|0,0,0]=2 1671 B13R1.133 O\C(=C/c1ccc(cc1)C)\C(=O)O Amb2398421 [0,1,1,0,0,0|0,0,0]=2 1672 B13R1.133 Oc1ccc(C[C@@H](O)C(O)=O)cc1 Amb22388639 [0,1,1,0,0,0|0,0,2]=4 1673 B13R1.133 Oc1ccc(\C=C(/Cl)\C(O)=O)cc1 Amb25208063 [0,1,1,0,0,0|1,0,0]=3 1674 B13R1.133 Oc1ccc(\C=C(/S)\C(O)=O)cc1 Amb24112867 [0,1,1,0,0,0|0,1,0]=3 1675 B13R1.133 Oc1ccc(cc1)CC(=O)C(=O)O Amb1124591 [0,1,1,0,0,0|0,0,2]=4 1676 B13R1.133 S\C(=C/c1ccc(cc1)Br)\C(=O)O Amb1250113 [0,1,1,0,0,0|0,1,0]=3 1677 B13R1.133 S\C(=C/c1ccc(cc1)Cl)\C(=O)O Amb1250111 [0,1,1,0,0,0|0,1,0]=3 1678 B13R1.133 S\C(=C/c1ccc(cc1)F)\C(=O)O Amb1250112 [0,1,1,0,0,0|0,1,0]=3 1679 B13R1.133 S\C(=C\c1ccc(cc1)Cl)\C(=O)O Amb2550970 [0,1,1,0,0,0|0,1,0]=3 1680 B13R1.135 CC(=C=C)C(=O)Cc1ccccc1 Amb24379010 [0,1,1,0,0,0|2,0,0]=4 1681 B13R1.135 CC=C(Br)C(=O)Nc1ccccc1 Amb22460381 [0,1,1,0,0,0|2,0,0]=4 1682 B13R1.135 CCC(=C)C(=O)Nc1ccccc1 Amb25207052 [0,1,1,0,0,0|2,0,0]=4 1683 B13R1.135 CCC(=O)\C(=C/c1ccccc1)\C Amb10565329 [0,1,1,0,0,0|2,0,0]=4 1684 B13R1.135 CCC(=O)\C(\F)=C\c1ccccc1 Amb25706957 [0,1,1,0,0,0|2,0,0]=4 1685 B13R1.135 CNC(=O)\C(\S)=C/c1ccccc1 Amb24341194 [0,1,1,0,0,0|1,1,0]=4 1686 B13R1.135 COC(=C)C(=O)Nc1ccccc1 Amb25752695 [0,1,1,0,0,0|1,0,0]=3 1687 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,1,0,0,0|0,0,2]=4 1688 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,1,0,0,0|1,0,1]=4 1689 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,1,1,0,0,0|0,0,2]=4 1690 B13R1.135 COC(=O)\C(\Br)=C\c1ccccc1 Amb24331619 [0,1,1,0,0,0|1,0,0]=3 1691 B13R1.135 COC(=O)\C(\F)=C\c1ccccc1 Amb25706644 [0,1,1,0,0,0|1,0,0]=3 1692 B13R1.135 C\C(=C/C)\C(=O)Cc1ccccc1 Amb24721728 [0,1,1,0,0,0|2,0,0]=4 1693 B13R1.135 C\C(=C/C)\C(=O)Nc1ccccc1 Amb25366214 [0,1,1,0,0,0|2,0,0]=4 1694 B13R1.135 C\C(=C/c1ccccc1)\C(=N)NO Amb25827693 [0,1,1,0,0,0|2,0,0]=4 1695 B13R1.135 C\C(=C/c1ccccc1)\C(=O)C#C Amb25190525 [0,1,1,0,0,0|2,0,0]=4 1696 B13R1.135 C\C(=C/c1ccccc1)\C(=O)CF Amb25134087 [0,1,1,0,0,0|2,0,0]=4 1697 B13R1.135 C\C(=C\C)\C(=O)Cc1ccccc1 Amb25245373 [0,1,1,0,0,0|2,0,0]=4 1698 B13R1.135 C\C(=C\c1ccccc1)\C(=N)NO Amb24540269 [0,1,1,0,0,0|2,0,0]=4 1699 B13R1.135 C\C(=C\c1ccccc1)\C(=O)CF Amb25179639 [0,1,1,0,0,0|2,0,0]=4 1700 B13R1.135 C\C(=N/O)\C(=O)Cc1ccccc1 Amb24378518 [0,1,1,0,0,0|1,0,1]=4 1701 B13R1.135 C\C(=N\O)\C(=O)Nc1ccccc1 Amb25277221 [0,1,1,0,0,0|1,0,1]=4 1702 B13R1.135 C\C=C(\Br)/C(=O)Nc1ccccc1 Amb22460386 [0,1,1,0,0,0|2,0,0]=4 1703 B13R1.135 C\C=C(\Cl)/C(=O)Nc1ccccc1 Amb24462846 [0,1,1,0,0,0|2,0,0]=4 1704 B13R1.135 N=C(NO)C(=O)Cc1ccccc1 Amb25059413 [0,1,1,0,0,0|2,0,0]=4 1705 B13R1.135 N\C(=N\O)\C(=O)Nc1ccccc1 Amb19664169 [0,1,1,0,0,0|2,0,0]=4 1706 B13R1.135 O=C(CCl)\C(\F)=C/c1ccccc1 Amb24677586 [0,1,1,0,0,0|2,0,0]=4 1707 B13R1.135 O=C(CCl)\C(\F)=C\c1ccccc1 Amb25697164 [0,1,1,0,0,0|2,0,0]=4 1708 B13R1.135 O=C(Nc1ccccc1)\C(\Br)=C\Br Amb22433166 [0,1,1,0,0,0|2,0,0]=4 1709 B13R1.135 O=C(Nc1ccccc1)\C(\F)=C/F Amb25190427 [0,1,1,0,0,0|2,0,0]=4 1710 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,1,1,0,0,0|0,0,2]=4 1711 B13R1.135 O\C(=C/c1ccccc1)\C(O)CO Amb22489644 [0,1,1,0,0,0|0,0,2]=4 1712 B13R1.135 O\C=C(\Cl)/C(=O)Oc1ccccc1 Amb24412896 [0,1,1,0,0,0|1,0,0]=3 1713 B13R1.148 Brc1cccc(c1)CC(=O)C(=O)O Amb1137720 [0,1,1,0,0,0|0,0,2]=4 1714 B13R1.148 C=C(Cl)C(=O)Nc1cc(Cl)ccc1 Amb22460396 [0,1,1,0,0,0|2,0,0]=4 1715 B13R1.148 C=C(Cl)C(=O)Nc1cccc(F)c1 Amb25352790 [0,1,1,0,0,0|2,0,0]=4 1716 B13R1.148 CC(=C)C(=O)Nc1cccc(Cl)c1 Amb22461310 [0,1,1,0,0,0|2,0,0]=4 1717 B13R1.148 CC(=C)C(=O)Nc1cccc(F)c1 Amb25216149 [0,1,1,0,0,0|2,0,0]=4 1718 B13R1.148 CC(=C)C(=O)Nc1cccc(O)c1 Amb24434891 [0,1,1,0,0,0|2,0,0]=4 1719 B13R1.148 CC(=C)C(=O)Oc1cccc(Br)c1 Amb25802008 [0,1,1,0,0,0|1,0,0]=3 1720 B13R1.148 CC(=C)C(=O)Oc1cccc(Cl)c1 Amb25159034 [0,1,1,0,0,0|1,0,0]=3 1721 B13R1.148 CC(=C)C(=O)Oc1cccc(O)c1 Amb25838787 [0,1,1,0,0,0|1,0,0]=3 1722 B13R1.148 CC(O)C(=O)Oc1cccc(Br)c1 Amb24397770 [0,1,1,0,0,0|0,0,2]=4 1723 B13R1.148 CC(O)C(=O)Oc1cccc(Cl)c1 Amb25686755 [0,1,1,0,0,0|0,0,2]=4 1724 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(Cl)c1 Amb25052790 [0,1,1,0,0,0|0,0,2]=4 1725 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(I)c1 Amb25712605 [0,1,1,0,0,0|0,0,2]=4 1726 B13R1.148 C[C@H](O)C(=O)Oc1cccc(F)c1 Amb25847674 [0,1,1,0,0,0|0,0,2]=4 1727 B13R1.148 C[C@H](O)C(=O)Oc1cccc(I)c1 Amb24347608 [0,1,1,0,0,0|0,0,2]=4 1728 B13R1.148 C\C(=C/c1cc[n]c(Br)c1)\C(O)=O Amb25670093 [0,1,1,0,0,0|2,0,0]=4 1729 B13R1.148 C\C(=C/c1cccc(Br)[n]1)\C(O)=O Amb25155174 [0,1,1,0,0,0|2,0,0]=4 1730 B13R1.148 C\C(=C/c1cccc(Br)c1)\C(O)=O Amb22339395 [0,1,1,0,0,0|1,0,0]=3 1731 B13R1.148 C\C(=C/c1cccc(C)[n]1)\C(O)=O Amb25340360 [0,1,1,0,0,0|2,0,0]=4 1732 B13R1.148 C\C(=C/c1cccc(F)c1)\C(O)=O Amb24745620 [0,1,1,0,0,0|1,0,0]=3 1733 B13R1.148 C\C(=C/c1cccc(O)c1)\C(C)=O Amb25819845 [0,1,1,0,0,0|2,0,0]=4 1734 B13R1.148 C\C(=C\c1c[n]cc(Br)c1)\C(O)=O Amb25234888 [0,1,1,0,0,0|2,0,0]=4 1735 B13R1.148 C\C(=C\c1cc(O)ccc1)\C(O)=O Amb24437242 [0,1,1,0,0,0|1,0,0]=3 1736 B13R1.148 C\C(=C\c1cccc(Br)[n]1)\C(O)=O Amb25703778 [0,1,1,0,0,0|2,0,0]=4 1737 B13R1.148 C\C(=C\c1cccc(Cl)c1)\C(O)=O Amb25085710 [0,1,1,0,0,0|1,0,0]=3 1738 B13R1.148 C\C(=C\c1cccc(F)c1)\C(O)=O Amb25255814 [0,1,1,0,0,0|1,0,0]=3 1739 B13R1.148 C\C(=C\c1cccc(N)c1)\C(O)=O Amb25039479 [0,1,1,0,0,0|1,0,0]=3 1740 B13R1.148 Cc1cc(CC(=O)C(C)=C)ccc1 Amb24489752 [0,1,1,0,0,0|2,0,0]=4 1741 B13R1.148 Cc1cc(C[C@@H](O)C(O)=O)ccc1 Amb25829025 [0,1,1,0,0,0|0,0,2]=4 1742 B13R1.148 Cc1cc(C[C@H](O)C(O)=O)ccc1 Amb25295495 [0,1,1,0,0,0|0,0,2]=4 1743 B13R1.148 Cc1cc(\C=C(/C)\C(C)=O)ccc1 Amb24492365 [0,1,1,0,0,0|2,0,0]=4 1744 B13R1.148 Cc1cc(\C=C(\F)/C(O)=O)ccc1 Amb25273987 [0,1,1,0,0,0|1,0,0]=3 1745 B13R1.148 Cc1cc(\C=C(\N)/C(O)=O)cc[n]1 Amb25231390 [0,1,1,0,0,0|2,0,0]=4 1746 B13R1.148 Cc1cc(ccc1)NC(=O)C(=C)Cl Amb24622872 [0,1,1,0,0,0|2,0,0]=4 1747 B13R1.148 Cc1cc(ccc1)NC(=O)C(C)=C Amb25785229 [0,1,1,0,0,0|2,0,0]=4 1748 B13R1.148 Cc1cc(ccc1)OC(=C)C(O)=O Amb24711260 [0,1,1,0,0,0|2,0,0]=4 1749 B13R1.148 Cc1cc(ccc1)OC(=O)C(N)=O Amb24602388 [0,1,1,0,0,0|1,0,1]=4 1750 B13R1.148 Cc1cc(ccc1)OC(=O)[C@@H](C)O Amb25086184 [0,1,1,0,0,0|0,0,2]=4 1751 B13R1.148 Cc1cc(ccc1)OC(=O)[C@H](C)O Amb25032717 [0,1,1,0,0,0|0,0,2]=4 1752 B13R1.148 Cc1cccc(c1)CC(=O)C(=O)O Amb1131949 [0,1,1,0,0,0|0,0,2]=4 1753 B13R1.148 Clc1cccc(c1)CC(=O)C(=O)O Amb1135307 [0,1,1,0,0,0|0,0,2]=4 1754 B13R1.148 Fc1cccc(c1)CC(=O)C(=O)O Amb1126816 [0,1,1,0,0,0|0,0,2]=4 1755 B13R1.148 NC(=O)C(=O)Oc1cccc(Cl)c1 Amb25762869 [0,1,1,0,0,0|1,0,1]=4 1756 B13R1.148 N\C(=C\C1=CC=CC(=O)N1)\C(O)=O Amb25788285 [0,1,1,0,0,0|2,0,0]=4 1757 B13R1.148 N\C(=C\c1c[n]cc(F)c1)\C(O)=O Amb25206061 [0,1,1,0,0,0|2,0,0]=4 1758 B13R1.148 N\C(=C\c1cccc(F)c1)\C(O)=O Amb25794832 [0,1,1,0,0,0|1,0,0]=3 1759 B13R1.148 OC(=O)C(=O)Nc1cc(O)ccc1 Amb25322073 [0,1,1,0,0,0|1,0,1]=4 1760 B13R1.148 OC(=O)C(Cc1cccc(c1)Br)O Amb17159702 [0,1,1,0,0,0|0,0,2]=4 1761 B13R1.148 OC(=O)C(Cc1cccc(c1)C)O Amb17138949 [0,1,1,0,0,0|0,0,2]=4 1762 B13R1.148 OC(=O)C(Cc1cccc(c1)Cl)O Amb17139823 [0,1,1,0,0,0|0,0,2]=4 1763 B13R1.148 OC(=O)[C@@H](O)Cc1cccc(F)c1 Amb24725523 [0,1,1,0,0,0|0,0,2]=4 1764 B13R1.148 OC(=O)\C(\Cl)=C\c1cc(Cl)ccc1 Amb25261768 [0,1,1,0,0,0|1,0,0]=3 1765 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Br)c1 Amb24520960 [0,1,1,0,0,0|1,0,0]=3 1766 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Cl)c1 Amb25085473 [0,1,1,0,0,0|1,0,0]=3 1767 B13R1.148 OC(=O)\C(\F)=C\c1cccc(I)c1 Amb25277060 [0,1,1,0,0,0|1,0,0]=3 1768 B13R1.148 OC(=O)\C(\S)=C\c1cccc(F)c1 Amb25177621 [0,1,1,0,0,0|0,1,0]=3 1769 B13R1.148 Oc1cc(\C=C(/S)\C(O)=O)ccc1 Amb24115515 [0,1,1,0,0,0|0,1,0]=3 1770 B13R1.148 Oc1cccc(C[C@@H](O)C(O)=O)c1 Amb25219734 [0,1,1,0,0,0|0,0,2]=4 1771 B13R1.148 Oc1cccc(C[C@H](O)C(O)=O)c1 Amb25342679 [0,1,1,0,0,0|0,0,2]=4 1772 B13R1.148 Oc1cccc(c1)CC(=O)C(=O)O Amb1141341 [0,1,1,0,0,0|0,0,2]=4 1773 B13R1.152 BrC(C(C(=O)O)O)c1ccccc1 Amb17596766 [0,1,1,0,0,0|0,0,2]=4 1774 B13R1.152 C=C(C(Cl)C(O)=O)c1ccccc1 Amb25227445 [0,1,1,0,0,0|1,0,1]=4 1775 B13R1.152 C=C(C(N)C(O)=O)c1ccccc1 Amb18127911 [0,1,1,0,0,0|1,0,1]=4 1776 B13R1.152 C=C(C(O)C(O)=O)c1ccccc1 Amb25273986 [0,1,1,0,0,0|0,0,1]=3 1777 B13R1.152 C=C([C@H](N)c1ccccc1)C(O)=O Amb25697157 [0,1,1,0,0,0|1,0,1]=4 1778 B13R1.152 CC(=C)C(=O)C(N)c1ccccc1 Amb25153483 [0,1,1,0,0,0|2,0,0]=4 1779 B13R1.152 CC(=C)C(=O)C(O)c1ccccc1 Amb25807562 [0,1,1,0,0,0|2,0,0]=4 1780 B13R1.152 CC(=C)C(=O)[C@H](N)c1ccccc1 Amb25155665 [0,1,1,0,0,0|2,0,0]=4 1781 B13R1.152 CC(=O)C(=O)C(=O)c1ccccc1 Amb25092958 [0,1,1,0,0,0|1,0,1]=4 1782 B13R1.152 CC(=O)C(O)C(=O)c1ccccc1 Amb24467013 [0,1,1,0,0,0|1,0,1]=4 1783 B13R1.152 CC(=O)N(O)C(=O)c1ccccc1 Amb24073570 [0,1,1,0,0,0|2,0,0]=4 1784 B13R1.152 CC(=O)\C(\Br)=C(\N)/c1ccccc1 Amb25680603 [0,1,1,0,0,0|2,0,0]=4 1785 B13R1.152 CC(C(=C)C(O)=O)c1ccccc1 Amb24634053 [0,1,1,0,0,0|1,0,1]=4 1786 B13R1.152 CC(C(=C)c1ccccc1)C(O)=O Amb18127713 [0,1,1,0,0,0|1,0,1]=4 1787 B13R1.152 CC(C(C(=O)O)O)c1ccccc1 Amb10549583 [0,1,1,0,0,0|0,0,2]=4 1788 B13R1.152 CC(C(O)=O)C(=O)c1ccccc1 Amb18128110 [0,1,1,0,0,0|1,0,1]=4 1789 B13R1.152 CC(c1ccccc1)C(=O)C(O)=O Amb18648106 [0,1,1,0,0,0|0,0,2]=4 1790 B13R1.152 C[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25697174 [0,1,1,0,0,0|0,0,2]=4 1791 B13R1.152 C[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb25708376 [0,1,1,0,0,0|0,0,2]=4 1792 B13R1.152 C[C@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25363181 [0,1,1,0,0,0|0,0,2]=4 1793 B13R1.152 C\C(=C(\F)/C(O)=O)\c1cc[n]cc1 Amb25206464 [0,1,1,0,0,0|2,0,0]=4 1794 B13R1.152 C\C(=C(\F)/C(O)=O)\c1ccccc1 Amb18128594 [0,1,1,0,0,0|1,0,0]=3 1795 B13R1.152 C\C(=C(\N)/c1ccccc1)\C(C)=O Amb25360965 [0,1,1,0,0,0|2,0,0]=4 1796 B13R1.152 C\C(\C(=O)c1ccccc1)=C(/C)\O Amb25128952 [0,1,1,0,0,0|2,0,0]=4 1797 B13R1.152 C\C(\C(=O)c1ccccc1)=C(\C)/O Amb24378973 [0,1,1,0,0,0|2,0,0]=4 1798 B13R1.152 C\C(\C(C)=O)=C(\C)/c1ccccc1 Amb25730281 [0,1,1,0,0,0|2,0,0]=4 1799 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccc[n]c1 Amb25788477 [0,1,1,0,0,0|2,0,0]=4 1800 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccccc1 Amb18127724 [0,1,1,0,0,0|1,0,0]=3 1801 B13R1.152 ClC(C(C(=O)O)O)c1ccccc1 Amb17595327 [0,1,1,0,0,0|0,0,2]=4 1802 B13R1.152 NC(=O)C(=O)C(=O)c1ccccc1 Amb24602358 [0,1,1,0,0,0|1,0,1]=4 1803 B13R1.152 NC(C(O)C(O)=O)c1ccccc1 Amb22552502 [0,1,1,0,0,0|0,0,2]=4 1804 B13R1.152 NC(c1ccccc1)C(=O)C(O)=O Amb24693899 [0,1,1,0,0,0|0,0,2]=4 1805 B13R1.152 N[C@@H](C(O)C(O)=O)c1ccccc1 Amb24677811 [0,1,1,0,0,0|0,0,2]=4 1806 B13R1.152 N[C@@H]([C@@H](C(=O)O)O)c1ccccc1 Amb17619345 [0,1,1,0,0,0|0,0,2]=4 1807 B13R1.152 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb17779638 [0,1,1,0,0,0|0,0,2]=4 1808 B13R1.152 N[C@@H]([C@H](C(=O)O)O)c1ccccc1 Amb17619344 [0,1,1,0,0,0|0,0,2]=4 1809 B13R1.152 N[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb22745018 [0,1,1,0,0,0|0,0,2]=4 1810 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb10601661 [0,1,1,0,0,0|0,0,2]=4 1811 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb16231605 [0,1,1,0,0,0|0,0,2]=4 1812 B13R1.152 O=C(C(=C)C(=O)C)c1ccccc1 Amb17594383 [0,1,1,0,0,0|2,0,0]=4 1813 B13R1.152 OC(=O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,1,1,0,0,0|0,0,2]=4 1814 B13R1.152 OC(=O)C(=O)C(Cl)c1ccccc1 Amb25292830 [0,1,1,0,0,0|0,0,2]=4 1815 B13R1.152 OC(=O)\C(\Cl)=C(\Cl)/c1ccccc1 Amb18658046 [0,1,1,0,0,0|1,0,0]=3 1816 B13R1.152 OC(=O)\C(\F)=C(/F)\c1ccccc1 Amb18129295 [0,1,1,0,0,0|1,0,0]=3 1817 B13R1.152 OC(=O)\C(\F)=C(\F)/c1ccccc1 Amb25173140 [0,1,1,0,0,0|1,0,0]=3 1818 B13R1.152 OC(=O)\C(\I)=C(/I)\c1ccccc1 Amb22438965 [0,1,1,0,0,0|1,0,0]=3 1819 B13R1.152 O\C(=C(/C(=O)C)\C)\c1ccccc1 Amb17594481 [0,1,1,0,0,0|2,0,0]=4 1820 B13R1.202 C=C(Cc1ccccc1Cl)C(O)=O Amb24426262 [0,1,1,0,0,0|1,0,1]=4 1821 B13R1.202 C=C(Cc1ccccc1O)C(O)=O Amb18128088 [0,1,1,0,0,0|1,0,1]=4 1822 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1Br Amb24630627 [0,1,1,0,0,0|2,0,0]=4 1823 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1Cl Amb22460395 [0,1,1,0,0,0|2,0,0]=4 1824 B13R1.202 C=C(Oc1ccccc1O)C(O)=O Amb18128536 [0,1,1,0,0,0|2,0,0]=4 1825 B13R1.202 CC(=C)C(=O)Cc1ccccc1Cl Amb25180911 [0,1,1,0,0,0|2,0,0]=4 1826 B13R1.202 CC(=C)C(=O)Nc1ccccc1O Amb18127847 [0,1,1,0,0,0|2,0,0]=4 1827 B13R1.202 CC(=C)C(=O)Oc1ccccc1Cl Amb25159245 [0,1,1,0,0,0|1,0,0]=3 1828 B13R1.202 CC(=C)C(=O)Oc1ccccc1F Amb25192592 [0,1,1,0,0,0|1,0,0]=3 1829 B13R1.202 CC(=C)C(=O)Oc1ccccc1I Amb24368864 [0,1,1,0,0,0|1,0,0]=3 1830 B13R1.202 CC(=C)C(=O)Oc1ccccc1O Amb18128071 [0,1,1,0,0,0|1,0,0]=3 1831 B13R1.202 CC(O)C(=O)Oc1ccccc1Br Amb24703827 [0,1,1,0,0,0|0,0,2]=4 1832 B13R1.202 CC(O)C(=O)Oc1ccccc1I Amb25167397 [0,1,1,0,0,0|0,0,2]=4 1833 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1Br Amb25093332 [0,1,1,0,0,0|0,0,2]=4 1834 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1I Amb24347460 [0,1,1,0,0,0|0,0,2]=4 1835 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1Cl Amb25032718 [0,1,1,0,0,0|0,0,2]=4 1836 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1F Amb25145260 [0,1,1,0,0,0|0,0,2]=4 1837 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1I Amb25829837 [0,1,1,0,0,0|0,0,2]=4 1838 B13R1.202 C\C(=C/c1c[n]ccc1N)\C(O)=O Amb25762504 [0,1,1,0,0,0|2,0,0]=4 1839 B13R1.202 C\C(=C/c1ccccc1Br)\C(C)=O Amb25365894 [0,1,1,0,0,0|2,0,0]=4 1840 B13R1.202 C\C(=C/c1ccccc1C)\C(C)=O Amb25034275 [0,1,1,0,0,0|2,0,0]=4 1841 B13R1.202 C\C(=C/c1ccccc1Cl)\C(C)=O Amb25764101 [0,1,1,0,0,0|2,0,0]=4 1842 B13R1.202 C\C(=C/c1ccccc1F)\C(C)=O Amb25212780 [0,1,1,0,0,0|2,0,0]=4 1843 B13R1.202 C\C(=C/c1ccccc1I)\C(O)=O Amb25755911 [0,1,1,0,0,0|1,0,0]=3 1844 B13R1.202 C\C(=C/c1ccccc1N)\C(C)=O Amb24678150 [0,1,1,0,0,0|2,0,0]=4 1845 B13R1.202 C\C(=C/c1ccccc1O)\C(C)=O Amb24449768 [0,1,1,0,0,0|2,0,0]=4 1846 B13R1.202 C\C(=C\c1c[n]ccc1N)\C(O)=O Amb25349470 [0,1,1,0,0,0|2,0,0]=4 1847 B13R1.202 C\C(=C\c1ccccc1Cl)\C(O)=O Amb25696241 [0,1,1,0,0,0|1,0,0]=3 1848 B13R1.202 C\C(=C\c1ccccc1O)\C(O)=O Amb24710649 [0,1,1,0,0,0|1,0,0]=3 1849 B13R1.202 C\C(=N\c1ccccc1C)\C(O)=O Amb24567996 [0,1,1,0,0,0|2,0,0]=4 1850 B13R1.202 Cc1c[n]ccc1\C=C(\C)/C(O)=O Amb24583338 [0,1,1,0,0,0|2,0,0]=4 1851 B13R1.202 Cc1c[n]ccc1\C=C(\F)/C(O)=O Amb24570665 [0,1,1,0,0,0|2,0,0]=4 1852 B13R1.202 Cc1cc[n]cc1\C=C(\F)/C(O)=O Amb25083878 [0,1,1,0,0,0|2,0,0]=4 1853 B13R1.202 Cc1ccccc1C[C@@H](O)C(O)=O Amb24355345 [0,1,1,0,0,0|0,0,2]=4 1854 B13R1.202 Cc1ccccc1C[C@H](O)C(O)=O Amb24726327 [0,1,1,0,0,0|0,0,2]=4 1855 B13R1.202 Cc1ccccc1NC(=N)C(O)=O Amb25210557 [0,1,1,0,0,0|2,0,0]=4 1856 B13R1.202 Cc1ccccc1NC(=O)C(C)=C Amb25123849 [0,1,1,0,0,0|2,0,0]=4 1857 B13R1.202 Cc1ccccc1OC(=O)C(N)=O Amb24526596 [0,1,1,0,0,0|1,0,1]=4 1858 B13R1.202 Cc1ccccc1\C=C(/S)\C(O)=O Amb24115487 [0,1,1,0,0,0|0,1,0]=3 1859 B13R1.202 N\C(=C\c1cc[n]cc1F)\C(O)=O Amb24644675 [0,1,1,0,0,0|2,0,0]=4 1860 B13R1.202 N\C(=C\c1ccccc1F)\C(O)=O Amb24353633 [0,1,1,0,0,0|1,0,0]=3 1861 B13R1.202 Nc1ccccc1NC(=O)C(O)=O Amb18954495 [0,1,1,0,0,0|1,0,1]=4 1862 B13R1.202 OC(=O)C(=O)Cc1ccccc1C Amb1125804 [0,1,1,0,0,0|0,0,2]=4 1863 B13R1.202 OC(=O)C(=O)Cc1ccccc1Cl Amb1135873 [0,1,1,0,0,0|0,0,2]=4 1864 B13R1.202 OC(=O)C(=O)Nc1ccccc1O Amb18128783 [0,1,1,0,0,0|1,0,1]=4 1865 B13R1.202 OC(=O)C(Cc1ccccc1C)O Amb17138948 [0,1,1,0,0,0|0,0,2]=4 1866 B13R1.202 OC(=O)C(Cc1ccccc1Cl)O Amb17139822 [0,1,1,0,0,0|0,0,2]=4 1867 B13R1.202 OC(=O)C(Cc1ccccc1F)O Amb17139079 [0,1,1,0,0,0|0,0,2]=4 1868 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1Cl Amb24469361 [0,1,1,0,0,0|0,0,2]=4 1869 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1F Amb25708392 [0,1,1,0,0,0|0,0,2]=4 1870 B13R1.202 OC(=O)\C(=C/c1ccccc1Cl)\S Amb2550971 [0,1,1,0,0,0|0,1,0]=3 1871 B13R1.202 OC(=O)\C(\Cl)=C\c1ccccc1Cl Amb25063158 [0,1,1,0,0,0|1,0,0]=3 1872 B13R1.202 OC(=O)\C(\F)=C\c1ccccc1Cl Amb25256125 [0,1,1,0,0,0|1,0,0]=3 1873 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1Cl Amb18657758 [0,1,1,0,0,0|0,1,0]=3 1874 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1F Amb24495340 [0,1,1,0,0,0|0,1,0]=3 1875 B13R1.202 Oc1ccccc1CC(O)C(O)=O Amb24692674 [0,1,1,0,0,0|0,0,2]=4 1876 B13R1.202 Oc1ccccc1C[C@H](O)C(O)=O Amb25065347 [0,1,1,0,0,0|0,0,2]=4 1877 B13R1.202 Oc1ccccc1\C=C(/Cl)\C(O)=O Amb25701738 [0,1,1,0,0,0|1,0,0]=3 1878 B13R1.353 OS(=O)(=O)\C(\Cl)=C\c1ccccc1 Amb22364621 [0,1,1,0,0,0|2,0,0]=4 1879 B13R1.353 OS(=O)(=O)\C(\Cl)=C\c1ccccc1 Amb25339745 [0,1,1,0,0,0|2,0,0]=4 1880 B13R1.418 C=C\C(=C/c1ccccc1)\C(O)=O Amb18127222 [0,1,1,0,0,0|1,0,0]=3 1881 B13R1.418 CC(=O)\C(=C/c1ccccc1)\OC Amb24588864 [0,1,1,0,0,0|1,0,0]=3 1882 B13R1.418 CC(=O)\C(=C\O)\Sc1ccccc1 Amb25796355 [0,1,1,0,0,0|2,0,0]=4 1883 B13R1.418 CC(=O)\C(\C=C)=C\c1ccccc1 Amb25713046 [0,1,1,0,0,0|2,0,0]=4 1884 B13R1.418 CC(=O)\C(\CC)=C/c1ccccc1 Amb25034468 [0,1,1,0,0,0|2,0,0]=4 1885 B13R1.418 CC(=O)\C(\CC)=C\c1ccccc1 Amb25285770 [0,1,1,0,0,0|2,0,0]=4 1886 B13R1.418 CC(=O)\C(\CO)=C\c1ccccc1 Amb24469181 [0,1,1,0,0,0|1,0,0]=3 1887 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\O Amb24752497 [0,1,1,0,0,0|1,0,1]=4 1888 B13R1.418 CC(=O)\C(\Cc1ccccc1)=N\O Amb24620100 [0,1,1,0,0,0|1,0,1]=4 1889 B13R1.418 CC(=O)\C(\Nc1ccccc1)=N\O Amb24540818 [0,1,1,0,0,0|2,0,0]=4 1890 B13R1.418 CC(O)\C(\CO)=C\c1ccccc1 Amb25847028 [0,1,1,0,0,0|1,0,1]=4 1891 B13R1.418 CC\C(=C/c1ccccc1)\C(N)=O Amb24634133 [0,1,1,0,0,0|2,0,0]=4 1892 B13R1.418 CC\C(=C\c1ccccc1)\C(O)=O Amb24702993 [0,1,1,0,0,0|1,0,0]=3 1893 B13R1.418 COC(Cc1ccccc1)C(O)=O Amb18128650 [0,1,1,0,0,0|0,0,2]=4 1894 B13R1.418 CO[C@@H](Cc1ccccc1)C(O)=O Amb22747352 [0,1,1,0,0,0|0,0,2]=4 1895 B13R1.418 CO\C(=C/c1ccccc1)\C(=O)O Amb1945718 [0,1,1,0,0,0|0,0,0]=2 1896 B13R1.418 CS\C(=C/c1ccccn1)\C(=O)O Amb1761007 [0,1,1,0,0,0|1,1,0]=4 1897 B13R1.418 CS\C(=C/c1cccnc1)\C(=O)O Amb1761008 [0,1,1,0,0,0|1,1,0]=4 1898 B13R1.418 CS\C(=C/c1ccncc1)\C(=O)O Amb1761006 [0,1,1,0,0,0|1,1,0]=4 1899 B13R1.418 CS\C(=C\c1c[n]ccc1)\C(O)=O Amb22455522 [0,1,1,0,0,0|1,1,0]=4 1900 B13R1.418 CS\C(=C\c1ccccc1)\C(O)=O Amb18130097 [0,1,1,0,0,0|0,1,0]=3 1901 B13R1.418 C\C=C(/Sc1ccccc1)\C(O)=O Amb18651957 [0,1,1,0,0,0|2,0,0]=4 1902 B13R1.418 C\C=C(\Cc1ccccc1)/C(O)=O Amb24711241 [0,1,1,0,0,0|1,0,1]=4 1903 B13R1.418 N#CC(=Cc1ccccc1)C(=O)Cl Amb17143094 [0,1,1,0,0,0|2,0,0]=4 1904 B13R1.418 N#CC(=Cc1ccccc1)C(=O)O Amb17224284 [0,1,1,0,0,0|1,0,0]=3 1905 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)Cl Amb24108099 [0,1,1,0,0,0|2,0,0]=4 1906 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)N Amb2222555 [0,1,1,0,0,0|2,0,0]=4 1907 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb1207396 [0,1,1,0,0,0|1,0,0]=3 1908 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb16205839 [0,1,1,0,0,0|1,0,0]=3 1909 B13R1.418 N#C\C(=C/c1cccnc1)\C(=O)O Amb1133348 [0,1,1,0,0,0|2,0,0]=4 1910 B13R1.418 N#C\C(=C/c1ccncc1)\C(=O)O Amb1125727 [0,1,1,0,0,0|2,0,0]=4 1911 B13R1.418 N#C\C(=C\c1cccnc1)\C(=O)O Amb10068989 [0,1,1,0,0,0|2,0,0]=4 1912 B13R1.418 NC(=O)\C(=N\O)\Sc1ccccc1 Amb25100934 [0,1,1,0,0,0|2,0,0]=4 1913 B13R1.418 NC(=O)\C(\Nc1ccccc1)=N\O Amb25320278 [0,1,1,0,0,0|2,0,0]=4 1914 B13R1.418 NC\C(=C/c1ccccc1)\C(O)=O Amb24526933 [0,1,1,0,0,0|1,0,0]=3 1915 B13R1.418 NC\C(=C\c1cc[n]cc1)\C(O)=O Amb25322106 [0,1,1,0,0,0|2,0,0]=4 1916 B13R1.418 NO[C@@H](C(=O)O)Cc1ccccc1 Amb10070584 [0,1,1,0,0,0|0,0,2]=4 1917 B13R1.418 NO[C@H](C(=O)O)Cc1ccccc1 Amb10070583 [0,1,1,0,0,0|0,0,2]=4 1918 B13R1.418 OC(=O)C(CO)Nc1ccccc1 Amb25684833 [0,1,1,0,0,0|1,0,1]=4 1919 B13R1.418 OC(=O)\C(=C\Cl)\Oc1ccccc1 Amb24627055 [0,1,1,0,0,0|2,0,0]=4 1920 B13R1.418 OC(=O)\C(\CBr)=C\c1ccccc1 Amb22360134 [0,1,1,0,0,0|1,0,0]=3 1921 B13R1.418 OC(=O)\C(\CCl)=C\c1ccccc1 Amb24635754 [0,1,1,0,0,0|1,0,0]=3 1922 B13R1.418 OC(=O)\C(\CO)=C/c1ccccc1 Amb20671516 [0,1,1,0,0,0|0,0,0]=2 1923 B13R1.418 OC(=O)\C(\Cc1cc[n]cc1)=N/O Amb23603652 [0,1,1,0,0,0|1,0,1]=4 1924 B13R1.418 OC(=O)\C(\Cc1ccc[n]c1)=N/O Amb23603650 [0,1,1,0,0,0|1,0,1]=4 1925 B13R1.418 OC(=O)\C(\Cc1cccc[n]1)=N/O Amb23603651 [0,1,1,0,0,0|1,0,1]=4 1926 B13R1.418 [NH3+]OC(Cc1ccccc1)C(O)=O Amb22471708 [0,1,1,0,0,0|0,0,2]=4 1927 B13R1.418 [O-][N+](=O)\C(\CO)=C\c1ccccc1 Amb25131649 [0,1,1,0,0,0|1,0,1]=4 1928 B13R1.1073 CC(O)(Oc1ccccc1)C(O)=O Amb24563350 [0,1,1,0,0,0|1,0,1]=4 1929 B13R1.1073 OC(=O)C(Cc1ccccc1)(O)C Amb10067052 [0,1,1,0,0,0|0,0,2]=4 1930 B13R1.1073 OC(=O)C(O)(O)Cc1ccccc1 Amb25100992 [0,1,1,0,0,0|0,0,2]=4 1931 B13R1.1073 OC(=O)[C@@](Cc1ccccc1)(O)C Amb10067053 [0,1,1,0,0,0|0,0,2]=4 1932 B13R1.380 Br\C=C\c1ccccc1NC(=O)C Amb2237495 [0,1,1,0,0,0|2,0,0]=4 1933 B13R1.380 OC(=O)Cc1ccccc1NC=O Amb18992618 [0,1,1,0,0,0|1,0,1]=4 1934 B13R1.380 OC(=O)Cc1ccccc1\C=N/O Amb25189803 [0,1,1,0,0,0|2,0,0]=4 1935 B13R1.382 C\C(=C/C)\c1ccccc1NC=O Amb24440810 [0,1,1,0,0,0|2,0,0]=4 1936 B13R1.485 N#C\C=C\c1ccccc1NC=O Amb24464199 [0,1,1,0,0,0|2,0,0]=4 1937 B13R1.40 C\C(\C=O)=C\c1cccc(Br)c1F Amb25232355 [0,1,1,0,0,0|2,0,0]=4 1938 B13R1.40 C\C(\C=O)=C\c1cccc(Cl)c1Cl Amb24533945 [0,1,1,0,0,0|2,0,0]=4 1939 B13R1.40 Cc1cccc(OC(=O)CO)c1C Amb25107573 [0,1,1,0,0,0|0,0,2]=4 1940 B13R1.40 Cc1cccc(\C=C(/C)\C=O)c1O Amb23596358 [0,1,1,0,0,0|1,0,0]=3 1941 B13R1.40 Cc1cccc(\C=C(\C)/C=O)c1C Amb24436078 [0,1,1,0,0,0|2,0,0]=4 1942 B13R1.40 OCC(=O)Oc1cccc(Cl)c1F Amb25122443 [0,1,1,0,0,0|1,0,1]=4 1943 B13R1.91 CCC(=O)Oc1ccccc1C=O Amb17129203 [0,1,1,0,0,0|1,0,1]=4 1944 B13R1.91 COc1ccccc1NC(=O)C=O Amb18128350 [0,1,1,0,0,0|1,0,1]=4 1945 B13R1.91 COc1ccccc1\C=C(/F)\C=O Amb24490341 [0,1,1,0,0,0|1,0,0]=3 1946 B13R1.91 C\C(\C=C)=C\c1ccccc1CO Amb25107646 [0,1,1,0,0,0|2,0,0]=4 1947 B13R1.91 C\C(\C=O)=C\c1ccccc1C#N Amb25117688 [0,1,1,0,0,0|2,0,0]=4 1948 B13R1.91 C\C(\C=O)=C\c1ccccc1CC Amb25690014 [0,1,1,0,0,0|2,0,0]=4 1949 B13R1.91 C\C(\C=O)=C\c1ccccc1OC Amb25088650 [0,1,1,0,0,0|1,0,0]=3 1950 B13R1.91 ClCC(=O)Oc1ccccc1C=O Amb17129248 [0,1,1,0,0,0|1,0,1]=4 1951 B13R1.91 O=C\C(=C\c1ccccc1OC)\C Amb17335111 [0,1,1,0,0,0|1,0,0]=3 1952 B13R1.335 CC\C(=C/c1ccccc1C)\C=O Amb17334989 [0,1,1,0,0,0|2,0,0]=4 1953 B13R1.335 CC\C(=C/c1ccccc1Cl)\C=O Amb17336897 [0,1,1,0,0,0|2,0,0]=4 1954 B13R1.335 CC\C(=C/c1ccccc1F)\C=O Amb17335219 [0,1,1,0,0,0|2,0,0]=4 1955 B13R1.335 CC\C(\C=O)=C\c1ccccc1F Amb25209879 [0,1,1,0,0,0|2,0,0]=4 1956 B13R1.335 CC\C(\CO)=C\c1ccccc1O Amb18648129 [0,1,1,0,0,0|1,0,1]=4 1957 B13R1.335 Cc1ccccc1\C=C(\CC)/C=O Amb24489763 [0,1,1,0,0,0|2,0,0]=4 1958 B13R1.335 N#C\C(\C=O)=C/c1ccccc1Cl Amb25768518 [0,1,1,0,0,0|2,0,0]=4 1959 B13R1.335 O=CC(=Cc1ccccc1Cl)C=O Amb18130139 [0,1,1,0,0,0|1,0,1]=4 1960 B13R1.335 Oc1ccccc1C=C(C=O)C=O Amb18127566 [0,1,1,0,0,0|0,0,1]=3 1961 B13R1.470 C\C(=C\c1ccccc1O)\NC=O Amb24342300 [0,1,1,0,0,0|1,0,0]=3 1962 B13R1.470 C\C(\CC=C)=C\c1ccccc1O Amb25298532 [0,1,1,0,0,0|2,0,0]=4 1963 B13R1.470 C\C=C\C(=O)Oc1ccccc1F Amb24502526 [0,1,1,0,0,0|2,0,0]=4 1964 B13R1.470 C\C=C\C(=O)Oc1ccccc1I Amb24502527 [0,1,1,0,0,0|2,0,0]=4 1965 B13R1.470 C\C=C\C(=O)Oc1ccccc1O Amb24583610 [0,1,1,0,0,0|2,0,0]=4 1966 B13R1.470 O\N=C\C(=O)Nc1ccccc1Br Amb1223214 [0,1,1,0,0,0|2,0,0]=4 1967 B13R1.696 CC(C=O)C(=O)c1ccccc1O Amb18128086 [0,1,1,0,0,0|1,0,1]=4 1968 B13R1.696 C\C(=C\O)\C(=O)c1ccccc1O Amb24456571 [0,1,1,0,0,0|1,0,1]=4 1969 B13R1.696 C\C(\C=O)=C(\Cl)/c1ccccc1F Amb25192511 [0,1,1,0,0,0|2,0,0]=4 1970 B13R1.2679 C=CC(=O)Oc1ccc(Cl)cc1Cl Amb24732092 [0,1,1,0,0,0|2,0,0]=4 1971 B13R1.2679 C\C(\C=O)=C\c1ccc(Br)cc1Cl Amb25673623 [0,1,1,0,0,0|2,0,0]=4 1972 B13R1.2679 C\C(\C=O)=C\c1ccc(Cl)cc1Br Amb25180865 [0,1,1,0,0,0|2,0,0]=4 1973 B13R1.2679 C\C(\C=O)=C\c1ccc(Cl)cc1F Amb25159219 [0,1,1,0,0,0|2,0,0]=4 1974 B13R1.2679 C\C(\C=O)=C\c1ccc(F)cc1Br Amb24579952 [0,1,1,0,0,0|2,0,0]=4 1975 B13R1.2679 C\C(\C=O)=C\c1ccc(F)cc1Cl Amb25366020 [0,1,1,0,0,0|2,0,0]=4 1976 B13R1.2679 Cc1cc(Br)ccc1OC(=O)CO Amb25730940 [0,1,1,0,0,0|0,0,2]=4 1977 B13R1.2679 Cc1cc(Cl)ccc1OC(=O)CO Amb24352046 [0,1,1,0,0,0|0,0,2]=4 1978 B13R1.2679 Cc1cc(Cl)ccc1\C=C(\C)/C=O Amb25678161 [0,1,1,0,0,0|2,0,0]=4 1979 B13R1.2679 Cc1ccc(OC(=O)C=C)c(C)c1 Amb24405908 [0,1,1,0,0,0|1,0,1]=4 1980 B13R1.2679 Cc1ccc(OC(=O)CO)c(Br)c1 Amb24476292 [0,1,1,0,0,0|1,0,1]=4 1981 B13R1.2679 Cc1ccc(OC(=O)CO)c(Cl)c1 Amb25032981 [0,1,1,0,0,0|1,0,1]=4 1982 B13R1.2679 Cc1ccc(OC(=O)CO)c(I)c1 Amb25833282 [0,1,1,0,0,0|1,0,1]=4 1983 B13R1.2679 OCC(=O)Oc1ccc(Br)cc1Br Amb25787076 [0,1,1,0,0,0|1,0,1]=4 1984 B13R1.2679 OCC(=O)Oc1ccc(Br)cc1F Amb25279619 [0,1,1,0,0,0|1,0,1]=4 1985 B13R1.2679 OCC(=O)Oc1ccc(Cl)cc1Br Amb24685925 [0,1,1,0,0,0|1,0,1]=4 1986 B13R1.2679 OCC(=O)Oc1ccc(Cl)cc1Cl Amb25083954 [0,1,1,0,0,0|1,0,1]=4 1987 B13R1.2679 OCC(=O)Oc1ccc(F)cc1Br Amb24703419 [0,1,1,0,0,0|1,0,1]=4 1988 B13R1.2679 OCC(=O)Oc1ccc(F)cc1F Amb24347740 [0,1,1,0,0,0|1,0,1]=4 1989 B13R1.2679 O\C(\C=O)=C/c1ccc(F)cc1F Amb25834403 [0,1,1,0,0,0|1,0,0]=3 1990 B13R1.2679 O\C(\C=O)=C\c1ccc(F)cc1F Amb24604810 [0,1,1,0,0,0|1,0,0]=3 1991 B13R1.2872 C\C(\C=O)=C\c1cc(Br)ccc1Cl Amb24718888 [0,1,1,0,0,0|2,0,0]=4 1992 B13R1.2872 C\C(\C=O)=C\c1cc(Br)ccc1F Amb25180917 [0,1,1,0,0,0|2,0,0]=4 1993 B13R1.2872 C\C(\C=O)=C\c1cc(Cl)ccc1Cl Amb25160926 [0,1,1,0,0,0|2,0,0]=4 1994 B13R1.2872 C\C(\C=O)=C\c1cc(Cl)ccc1F Amb25159218 [0,1,1,0,0,0|2,0,0]=4 1995 B13R1.2872 C\C(\C=O)=C\c1cc(Cl)ccc1O Amb23483418 [0,1,1,0,0,0|1,0,0]=3 1996 B13R1.2872 C\C(\C=O)=C\c1cc(F)ccc1F Amb25670063 [0,1,1,0,0,0|2,0,0]=4 1997 B13R1.2872 Cc1cc(OC(=O)CO)c(C)cc1 Amb25143658 [0,1,1,0,0,0|0,0,2]=4 1998 B13R1.2872 Cc1cc(OC(=O)CO)c(F)cc1 Amb24721091 [0,1,1,0,0,0|1,0,1]=4 1999 B13R1.2872 Cc1ccc(Cl)cc1OC(=O)CO Amb25032896 [0,1,1,0,0,0|0,0,2]=4 2000 B13R1.2872 Cc1ccc(F)cc1\C=C(\C)/C=O Amb24533307 [0,1,1,0,0,0|2,0,0]=4 2001 B13R1.2872 Cc1ccc(I)cc1OC(=O)CO Amb24448673 [0,1,1,0,0,0|0,0,2]=4 2002 B13R1.2872 N\C(\C=O)=C\c1cc(Cl)ccc1O Amb18034042 [0,1,1,0,0,0|1,0,0]=3 2003 B13R1.2872 OCC(=O)Oc1cc(Br)ccc1Cl Amb25056449 [0,1,1,0,0,0|1,0,1]=4 2004 B13R1.2872 OCC(=O)Oc1cc(Br)ccc1F Amb25749213 [0,1,1,0,0,0|1,0,1]=4 2005 B13R1.2872 OCC(=O)Oc1cc(Cl)ccc1F Amb25749214 [0,1,1,0,0,0|1,0,1]=4 2006 B13R1.2872 OCC(=O)Oc1cc(F)ccc1F Amb24406463 [0,1,1,0,0,0|1,0,1]=4 2007 B13R1.2872 Oc1ccc(Cl)cc1\C=C(/Cl)\C=O Amb24424541 [0,1,1,0,0,0|1,0,0]=3 2008 B13R1.2872 Oc1ccc(cc1C=C(C=O)Cl)Cl Amb17143680 [0,1,1,0,0,0|1,0,0]=3 2009 B13R1.4928 C\C(\C=O)=C\c1c(F)cccc1Br Amb24607678 [0,1,1,0,0,0|2,0,0]=4 2010 B13R1.4928 O=C\C(=C\c1c(F)cccc1Cl)\C Amb17337353 [0,1,1,0,0,0|2,0,0]=4 2011 B13R1.4928 O\C(\C=O)=C/c1c(F)cccc1F Amb25729191 [0,1,1,0,0,0|1,0,0]=3 2012 B13R1.4928 O\C(\C=O)=C\c1c(F)cccc1F Amb24512561 [0,1,1,0,0,0|1,0,0]=3 2013 B13R2.32 Brc1c(I)ccc2ccccc21 Amb24535463 [1,1,0,0,0,0|2,0,0]=4 2014 B13R2.32 Brc1c[n]c2ccccc2c1I Amb24096835 [1,1,0,0,0,0|2,0,0]=4 2015 B13R2.32 Brc1ccc2c(c1F)cccc2 Amb16186009 [1,1,0,0,0,0|2,0,0]=4 2016 B13R2.32 Brc1ccc2c(c1N)cccc2 Amb17596049 [1,1,0,0,0,0|2,0,0]=4 2017 B13R2.32 Brc1ccc2ccccc2c1Br Amb24060608 [1,1,0,0,0,0|2,0,0]=4 2018 B13R2.32 Brc1ccc2ccccc2c1I Amb24594397 [1,1,0,0,0,0|2,0,0]=4 2019 B13R2.32 C=C1C(O)COc2ccccc21 Amb25734457 [1,1,0,0,0,0|0,0,2]=4 2020 B13R2.32 C=C1COc2ccccc2C1=O Amb18063792 [1,1,0,0,0,0|1,0,1]=4 2021 B13R2.32 CC1=CNc2ccccc2C1=O Amb21811680 [1,1,0,0,0,0|2,0,0]=4 2022 B13R2.32 CC1=COc2ccccc2C1=O Amb18048475 [1,1,0,0,0,0|1,0,0]=3 2023 B13R2.32 CC1=CSc2ccccc2C1=S Amb24070341 [1,1,0,0,0,0|1,1,0]=4 2024 B13R2.32 CN1C(=O)C=Cc2c[n]ccc12 Amb22491898 [1,1,0,0,0,0|2,0,0]=4 2025 B13R2.32 CN1C(=O)C=Cc2cc[n]cc12 Amb25707761 [1,1,0,0,0,0|2,0,0]=4 2026 B13R2.32 CN1C(=O)C=Cc2ccccc12 Amb19116112 [1,1,0,0,0,0|1,0,0]=3 2027 B13R2.32 CN1C(=O)N=Cc2ccccc12 Amb24079785 [1,1,0,0,0,0|2,0,0]=4 2028 B13R2.32 CN1C(=S)C=Cc2ccccc12 Amb19651670 [1,1,0,0,0,0|1,1,0]=4 2029 B13R2.32 C[n+]1c(C)ccc2c1cccc2 Amb2540178 [1,1,0,0,0,0|2,0,0]=4 2030 B13R2.32 C[n+]1c(I)ccc2ccccc12 Amb22485663 [1,1,0,0,0,0|2,0,0]=4 2031 B13R2.32 C[n+]1c(N)ccc2c1cccc2 Amb10553827 [1,1,0,0,0,0|2,0,0]=4 2032 B13R2.32 Cc1c(Br)c[n]c2ccccc21 Amb22263020 [1,1,0,0,0,0|2,0,0]=4 2033 B13R2.32 Cc1c(Br)ccc2ccccc21 Amb21929204 [1,1,0,0,0,0|2,0,0]=4 2034 B13R2.32 Cc1c(Cl)c[n]c2ccccc21 Amb24078686 [1,1,0,0,0,0|2,0,0]=4 2035 B13R2.32 Cc1c(O)c[n]c2ccccc21 Amb18645166 [1,1,0,0,0,0|1,0,0]=3 2036 B13R2.32 Cc1c(O)ccc2[n]cccc21 Amb18645164 [1,1,0,0,0,0|2,0,0]=4 2037 B13R2.32 Cc1c(O)ccc2ccc[n]c21 Amb18645163 [1,1,0,0,0,0|2,0,0]=4 2038 B13R2.32 Cc1c[n]c2ccccc2c1O Amb18560317 [1,1,0,0,0,0|2,0,0]=4 2039 B13R2.32 Cc1ccc2c(c1N)cccc2 Amb2429201 [1,1,0,0,0,0|2,0,0]=4 2040 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [1,1,0,0,0,0|2,0,0]=4 2041 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [1,1,0,0,0,0|2,0,0]=4 2042 B13R2.32 Cc1cnc2ccccc2c1Cl Amb17739750 [1,1,0,0,0,0|2,0,0]=4 2043 B13R2.32 Clc1c(Br)ccc2ccccc21 Amb24444356 [1,1,0,0,0,0|2,0,0]=4 2044 B13R2.32 Clc1c(I)c[n]c2ccccc21 Amb22002439 [1,1,0,0,0,0|2,0,0]=4 2045 B13R2.32 Clc1c[n]c2ccccc2c1I Amb24099930 [1,1,0,0,0,0|2,0,0]=4 2046 B13R2.32 Clc1ccc2c(c1N)cccc2 Amb17594523 [1,1,0,0,0,0|2,0,0]=4 2047 B13R2.32 Clc1ccc2c(c1O)cccc2 Amb17594568 [1,1,0,0,0,0|2,0,0]=4 2048 B13R2.32 Clc1ccc2ccccc2c1Br Amb25082370 [1,1,0,0,0,0|2,0,0]=4 2049 B13R2.32 Clc1ccc2ccccc2c1Cl Amb25189491 [1,1,0,0,0,0|2,0,0]=4 2050 B13R2.32 Clc1ccc2ccccc2c1I Amb25309391 [1,1,0,0,0,0|2,0,0]=4 2051 B13R2.32 Clc1cnc2c(c1Br)cccc2 Amb10808171 [1,1,0,0,0,0|2,0,0]=4 2052 B13R2.32 Clc1cnc2c(c1Cl)cccc2 Amb10241203 [1,1,0,0,0,0|2,0,0]=4 2053 B13R2.32 Clc1cnc2c(c1N)cccc2 Amb10808268 [1,1,0,0,0,0|2,0,0]=4 2054 B13R2.32 Clc1cnc2c(c1O)cccc2 Amb10241101 [1,1,0,0,0,0|2,0,0]=4 2055 B13R2.32 Fc1c(Br)c[n]c2ccccc21 Amb25751891 [1,1,0,0,0,0|2,0,0]=4 2056 B13R2.32 Fc1c(Cl)ccc2ccccc21 Amb25696316 [1,1,0,0,0,0|2,0,0]=4 2057 B13R2.32 Fc1c(I)ccc2ccccc21 Amb22547558 [1,1,0,0,0,0|2,0,0]=4 2058 B13R2.32 Fc1c[n]c2ccccc2c1Br Amb22547375 [1,1,0,0,0,0|2,0,0]=4 2059 B13R2.32 Fc1c[n]c2ccccc2c1I Amb24099978 [1,1,0,0,0,0|2,0,0]=4 2060 B13R2.32 Fc1ccc2c(c1N)cccc2 Amb17594017 [1,1,0,0,0,0|2,0,0]=4 2061 B13R2.32 Fc1ccc2ccccc2c1Br Amb25068848 [1,1,0,0,0,0|2,0,0]=4 2062 B13R2.32 Fc1ccc2ccccc2c1Cl Amb25232022 [1,1,0,0,0,0|2,0,0]=4 2063 B13R2.32 Fc1ccc2ccccc2c1F Amb24607338 [1,1,0,0,0,0|2,0,0]=4 2064 B13R2.32 NC1=COc2ccccc2C1=O Amb23399677 [1,1,0,0,0,0|1,0,0]=3 2065 B13R2.32 NC1=CSc2ccccc2C1=O Amb18648055 [1,1,0,0,0,0|1,1,0]=4 2066 B13R2.32 NC1C(O)=COc2ccccc21 Amb24427767 [1,1,0,0,0,0|0,0,1]=3 2067 B13R2.32 NN1C(=N)C=Cc2ccccc12 Amb19894845 [1,1,0,0,0,0|2,0,0]=4 2068 B13R2.32 Nc1c(I)c[n]c2ccccc21 Amb24463620 [1,1,0,0,0,0|2,0,0]=4 2069 B13R2.32 Nc1c(I)ccc2ccccc21 Amb22491989 [1,1,0,0,0,0|2,0,0]=4 2070 B13R2.32 Nc1c(O)[n][n]c2ccccc21 Amb25101560 [1,1,0,0,0,0|2,0,0]=4 2071 B13R2.32 Nc1c(O)[n]cc2ccccc21 Amb25249568 [1,1,0,0,0,0|2,0,0]=4 2072 B13R2.32 Nc1c(O)c[n]c2ccccc21 Amb24707816 [1,1,0,0,0,0|1,0,0]=3 2073 B13R2.32 Nc1c(O)cc[n+]2ccccc21 Amb24309281 [1,1,0,0,0,0|2,0,0]=4 2074 B13R2.32 Nc1c(O)ccc2c[n]ccc21 Amb24071034 [1,1,0,0,0,0|2,0,0]=4 2075 B13R2.32 Nc1c(O)ccc2cc[n]cc21 Amb18830216 [1,1,0,0,0,0|2,0,0]=4 2076 B13R2.32 Nc1c(O)ccc2ccc[n]c21 Amb23440835 [1,1,0,0,0,0|2,0,0]=4 2077 B13R2.32 Nc1c[n]c2ccccc2c1Cl Amb18128300 [1,1,0,0,0,0|2,0,0]=4 2078 B13R2.32 Nc1c[n]c2ccccc2c1O Amb23402467 [1,1,0,0,0,0|2,0,0]=4 2079 B13R2.32 Nc1ccc2c(c1C)cccc2 Amb17593938 [1,1,0,0,0,0|2,0,0]=4 2080 B13R2.32 Nc1ccc2c(c1N)cccc2 Amb16191900 [1,1,0,0,0,0|2,0,0]=4 2081 B13R2.32 Nc1ccc2c(c1O)cccc2 Amb17593980 [1,1,0,0,0,0|2,0,0]=4 2082 B13R2.32 Nc1ccc2ccccc2c1Br Amb19374680 [1,1,0,0,0,0|2,0,0]=4 2083 B13R2.32 Nc1ccc2ccccc2c1F Amb22497545 [1,1,0,0,0,0|2,0,0]=4 2084 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [1,1,0,0,0,0|2,0,0]=4 2085 B13R2.32 Nc1ccc2ccccc2c1S Amb18647914 [1,1,0,0,0,0|2,0,0]=4 2086 B13R2.32 Nn1c(=O)ccc2c1cccc2 Amb10553630 [1,1,0,0,0,0|1,0,0]=3 2087 B13R2.32 O=C1C(Br)=COc2ccccc21 Amb19664799 [1,1,0,0,0,0|1,0,0]=3 2088 B13R2.32 O=C1C(Br)=CSc2ccccc21 Amb21859134 [1,1,0,0,0,0|1,1,0]=4 2089 B13R2.32 O=C1C(F)=COc2ccccc21 Amb24079250 [1,1,0,0,0,0|1,0,0]=3 2090 B13R2.32 O=C1C(I)=COc2ccccc21 Amb19887490 [1,1,0,0,0,0|1,0,0]=3 2091 B13R2.32 O=C1C=Cc2cc[n]cc2C1=O Amb25066405 [1,1,0,0,0,0|2,0,0]=4 2092 B13R2.32 O=C1C=Nc2ccccc2C1=O Amb24722889 [1,1,0,0,0,0|1,0,1]=4 2093 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [1,1,0,0,0,0|2,0,0]=4 2094 B13R2.32 O=C1NC=C2C=CC=CC2=C1I Amb25238851 [1,1,0,0,0,0|2,0,0]=4 2095 B13R2.32 O=C1c2ccc[n]c2C=CC1=O Amb24081305 [1,1,0,0,0,0|2,0,0]=4 2096 B13R2.32 O=C1c2ccccc2OCC1=O Amb24662280 [1,1,0,0,0,0|0,0,2]=4 2097 B13R2.32 O=C1c2ccccc2ONC1=O Amb24408306 [1,1,0,0,0,0|1,0,1]=4 2098 B13R2.32 OC1=CSc2ccccc2C1=O Amb20252018 [1,1,0,0,0,0|0,1,0]=3 2099 B13R2.32 OC=1C(=O)NC=C2C=CC=CC21 Amb24632621 [1,1,0,0,0,0|2,0,0]=4 2100 B13R2.32 ON1C(=O)C=Cc2ccccc12 Amb22723451 [1,1,0,0,0,0|1,0,0]=3 2101 B13R2.32 ON1C=Cc2ccccc2C1=O Amb24099107 [1,1,0,0,0,0|2,0,0]=4 2102 B13R2.32 O[C@H]1COc2ccccc2C1=O Amb24691679 [1,1,0,0,0,0|0,0,2]=4 2103 B13R2.32 Oc1[n]cc2ccccc2c1Br Amb21858372 [1,1,0,0,0,0|2,0,0]=4 2104 B13R2.32 Oc1c(F)c[n]c2ccccc21 Amb24650731 [1,1,0,0,0,0|2,0,0]=4 2105 B13R2.32 Oc1c(F)ccc2ccccc21 Amb18645623 [1,1,0,0,0,0|2,0,0]=4 2106 B13R2.32 Oc1c(I)c[n]c2ccccc21 Amb22491992 [1,1,0,0,0,0|2,0,0]=4 2107 B13R2.32 Oc1c(S)ccc2ccccc21 Amb18647979 [1,1,0,0,0,0|1,1,0]=4 2108 B13R2.32 Oc1c[n]c2ccccc2c1Cl Amb18648301 [1,1,0,0,0,0|1,0,0]=3 2109 B13R2.32 Oc1c[n]c2ccccc2c1I Amb22752326 [1,1,0,0,0,0|1,0,0]=3 2110 B13R2.32 Oc1c[n]c2ccccc2c1S Amb18127892 [1,1,0,0,0,0|1,0,0]=3 2111 B13R2.32 Oc1ccc2[n]cccc2c1Br Amb18658841 [1,1,0,0,0,0|2,0,0]=4 2112 B13R2.32 Oc1ccc2[n]cccc2c1Cl Amb22757138 [1,1,0,0,0,0|2,0,0]=4 2113 B13R2.32 Oc1ccc2[n]cccc2c1F Amb22728877 [1,1,0,0,0,0|2,0,0]=4 2114 B13R2.32 Oc1ccc2[n]cccc2c1I Amb23437325 [1,1,0,0,0,0|2,0,0]=4 2115 B13R2.32 Oc1ccc2c(c1Cl)cccc2 Amb17594574 [1,1,0,0,0,0|1,0,0]=3 2116 B13R2.32 Oc1ccc2c(c1Cl)cncc2 Amb17594597 [1,1,0,0,0,0|2,0,0]=4 2117 B13R2.32 Oc1ccc2c(c1N)cccc2 Amb1088955 [1,1,0,0,0,0|1,0,0]=3 2118 B13R2.32 Oc1ccc2c(c1O)nccc2 Amb10604387 [1,1,0,0,0,0|2,0,0]=4 2119 B13R2.32 Oc1ccc2c[n]ccc2c1Cl Amb24081481 [1,1,0,0,0,0|2,0,0]=4 2120 B13R2.32 Oc1ccc2c[n]ccc2c1I Amb24463823 [1,1,0,0,0,0|2,0,0]=4 2121 B13R2.32 Oc1ccc2cc[n]cc2c1Br Amb23441146 [1,1,0,0,0,0|2,0,0]=4 2122 B13R2.32 Oc1ccc2ccc[n]c2c1Br Amb21864974 [1,1,0,0,0,0|2,0,0]=4 2123 B13R2.32 Oc1ccc2ccc[n]c2c1Cl Amb23437336 [1,1,0,0,0,0|2,0,0]=4 2124 B13R2.32 Oc1ccc2ccc[n]c2c1F Amb23437338 [1,1,0,0,0,0|2,0,0]=4 2125 B13R2.32 Oc1ccc2ccc[n]c2c1I Amb23437337 [1,1,0,0,0,0|2,0,0]=4 2126 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [1,1,0,0,0,0|1,0,0]=3 2127 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [1,1,0,0,0,0|1,0,0]=3 2128 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [1,1,0,0,0,0|1,0,0]=3 2129 B13R2.32 Oc1cnc2c(c1I)nccc2 Amb13890076 [1,1,0,0,0,0|2,0,0]=4 2130 B13R2.32 Sc1c(Br)c[n]c2ccccc21 Amb24727560 [1,1,0,0,0,0|2,0,0]=4 2131 B13R2.32 Sc1ccc2c(c1N)cccc2 Amb17594453 [1,1,0,0,0,0|1,1,0]=4 2132 B13R2.32 [NH3+]c1c(O)ccc2ccccc21 Amb22489532 [1,1,0,0,0,0|1,0,0]=3 2133 B13R2.32 [O-][n+]1c(N)ccc2c1cccc2 Amb10565848 [1,1,0,0,0,0|2,0,0]=4 2134 B13R2.32 [O-]c1c(O)c[o+]c2ccccc21 Amb24682985 [1,1,0,0,0,0|0,0,1]=3 2135 B13R2.57 BrCc1cc2ccccc2[n]c1 Amb24061934 [1,1,0,0,0,0|2,0,0]=4 2136 B13R2.57 BrCc1ccc2ccccc2[n]1 Amb21857522 [1,1,0,0,0,0|2,0,0]=4 2137 B13R2.57 Br[Mg]c1cc2ccccc2[n]c1 Amb22000563 [1,1,0,0,0,0|2,0,0]=4 2138 B13R2.57 Br[Mg]c1cc2ccccc2cc1 Amb22000543 [1,1,0,0,0,0|2,0,0]=4 2139 B13R2.57 Br[Mg]c1ccc2ccccc2[n]1 Amb22897388 [1,1,0,0,0,0|2,0,0]=4 2140 B13R2.57 Br[Zn]c1cc2ccccc2cc1 Amb22897855 [1,1,0,0,0,0|2,0,0]=4 2141 B13R2.57 Br[Zn]c1ccc2ccccc2[n]1 Amb22897906 [1,1,0,0,0,0|2,0,0]=4 2142 B13R2.57 Br[Zn]c1cnc2c(c1)cccc2 Amb13890846 [1,1,0,0,0,0|2,0,0]=4 2143 B13R2.57 C#Cc1ccc2c(c1)cccc2 Amb10071054 [1,1,0,0,0,0|2,0,0]=4 2144 B13R2.57 C#Cc1ccc2ccccc2[n]1 Amb22490538 [1,1,0,0,0,0|2,0,0]=4 2145 B13R2.57 C=Cc1ccc2c(n1)cccc2 Amb10071967 [1,1,0,0,0,0|2,0,0]=4 2146 B13R2.57 CCc1ccc2ccccc2[n]1 Amb20667571 [1,1,0,0,0,0|2,0,0]=4 2147 B13R2.57 CCc1ccc2ccccc2[n]1 Amb22282219 [1,1,0,0,0,0|2,0,0]=4 2148 B13R2.57 CCc1cnc2c(c1)cccc2 Amb15691863 [1,1,0,0,0,0|2,0,0]=4 2149 B13R2.57 CNc1cc2ccccc2[n]c1 Amb18948972 [1,1,0,0,0,0|2,0,0]=4 2150 B13R2.57 CO[n+]1ccc2c(c1)cccc2 Amb10553833 [1,1,0,0,0,0|2,0,0]=4 2151 B13R2.57 CO[n+]1ccc2c(c1)cccc2 Amb10553841 [1,1,0,0,0,0|2,0,0]=4 2152 B13R2.57 COc1c[n]c2ccc[n]c2c1 Amb21959422 [1,1,0,0,0,0|2,0,0]=4 2153 B13R2.57 COc1c[n]c2ccccc2[n]1 Amb24105763 [1,1,0,0,0,0|2,0,0]=4 2154 B13R2.57 COc1cc2[n]cccc2cc1 Amb24183299 [1,1,0,0,0,0|2,0,0]=4 2155 B13R2.57 COc1cc2cc[n]cc2cc1 Amb22236031 [1,1,0,0,0,0|2,0,0]=4 2156 B13R2.57 COc1cc2ccccc2[n]c1 Amb19957896 [1,1,0,0,0,0|1,0,0]=3 2157 B13R2.57 COc1ccc2c(c1)cccn2 Amb1156981 [1,1,0,0,0,0|2,0,0]=4 2158 B13R2.57 COc1ccc2c(c1)ccnc2 Amb10071944 [1,1,0,0,0,0|2,0,0]=4 2159 B13R2.57 COc1ccc2c(c1)cncc2 Amb10610318 [1,1,0,0,0,0|2,0,0]=4 2160 B13R2.57 COc1ccc2c(c1)nccc2 Amb17617089 [1,1,0,0,0,0|2,0,0]=4 2161 B13R2.57 COc1ccc2ccccc2[n]1 Amb20171196 [1,1,0,0,0,0|1,0,1]=4 2162 B13R2.57 CSC1=COc2ccccc2N1 Amb24615656 [1,1,0,0,0,0|1,1,0]=4 2163 B13R2.57 ClCC=1COc2ccccc2C1 Amb24470057 [1,1,0,0,0,0|1,0,1]=4 2164 B13R2.57 ClCc1cc2ccccc2[n]c1 Amb19375278 [1,1,0,0,0,0|2,0,0]=4 2165 B13R2.57 ClCc1ccc2ccccc2[nH+]1 Amb24113853 [1,1,0,0,0,0|2,0,0]=4 2166 B13R2.57 FCc1ccc2ccccc2[n]1 Amb25060619 [1,1,0,0,0,0|2,0,0]=4 2167 B13R2.57 ICc1cc2ccccc2[n]c1 Amb25034891 [1,1,0,0,0,0|2,0,0]=4 2168 B13R2.57 ICc1cc2ccccc2cc1 Amb24060884 [1,1,0,0,0,0|2,0,0]=4 2169 B13R2.57 N#CC1=Cc2c(OC1)cccc2 Amb1106140 [1,1,0,0,0,0|1,0,1]=4 2170 B13R2.57 N#Cc1ccc2c(n1)cccc2 Amb1063463 [1,1,0,0,0,0|2,0,0]=4 2171 B13R2.57 N#Cc1cnc2c(c1)cccc2 Amb2390028 [1,1,0,0,0,0|2,0,0]=4 2172 B13R2.57 N#[N+]c1ccc2ccccc2c1 Amb17674243 [1,1,0,0,0,0|2,0,0]=4 2173 B13R2.57 NCC1=COc2ccccc2O1 Amb18645814 [1,1,0,0,0,0|2,0,0]=4 2174 B13R2.57 NCC=1COc2ccccc2C1 Amb22642376 [1,1,0,0,0,0|1,0,1]=4 2175 B13R2.57 NCc1cc2ccccc2cc1 Amb19957972 [1,1,0,0,0,0|2,0,0]=4 2176 B13R2.57 NCc1ccc2c(c1)cccc2 Amb1120053 [1,1,0,0,0,0|2,0,0]=4 2177 B13R2.57 NCc1ccc2c(n1)cccc2 Amb1139476 [1,1,0,0,0,0|2,0,0]=4 2178 B13R2.57 NCc1ccc2c(n1)cccc2 Amb15695438 [1,1,0,0,0,0|2,0,0]=4 2179 B13R2.57 NCc1cnc2c(c1)cccc2 Amb10576326 [1,1,0,0,0,0|2,0,0]=4 2180 B13R2.57 NCc1cnc2c(c1)cccc2 Amb10610461 [1,1,0,0,0,0|2,0,0]=4 2181 B13R2.57 NCc1cnc2c(c1)cccc2 Amb1995347 [1,1,0,0,0,0|2,0,0]=4 2182 B13R2.57 NNc1cc2ccccc2[n]c1 Amb18645202 [1,1,0,0,0,0|2,0,0]=4 2183 B13R2.57 NNc1cc2ccccc2[n]c1 Amb22467310 [1,1,0,0,0,0|2,0,0]=4 2184 B13R2.57 NNc1ccc2c(c1)cccc2 Amb1772358 [1,1,0,0,0,0|2,0,0]=4 2185 B13R2.57 NNc1ccc2c(n1)cccc2 Amb1105542 [1,1,0,0,0,0|2,0,0]=4 2186 B13R2.57 NOc1cc2ccc[n]c2cc1 Amb24397483 [1,1,0,0,0,0|2,0,0]=4 2187 B13R2.57 NOc1cc2ccccc2cc1 Amb18645172 [1,1,0,0,0,0|1,0,0]=3 2188 B13R2.57 O=CC1=COc2ccccc2O1 Amb25348637 [1,1,0,0,0,0|1,0,0]=3 2189 B13R2.57 O=CC1=CSc2ccccc2O1 Amb25202028 [1,1,0,0,0,0|1,0,0]=3 2190 B13R2.57 O=CC1=Cc2c(OC1)cccc2 Amb1158025 [1,1,0,0,0,0|0,0,2]=4 2191 B13R2.57 O=CC1C=Cc2ccccc2O1 Amb24756718 [1,1,0,0,0,0|0,0,1]=3 2192 B13R2.57 O=CC=1Cc2ccccc2NC1 Amb25152519 [1,1,0,0,0,0|2,0,0]=4 2193 B13R2.57 O=CC=1Cc2ccccc2OC1 Amb18645283 [1,1,0,0,0,0|0,0,2]=4 2194 B13R2.57 O=CN1Cc2ccccc2C=C1 Amb24060793 [1,1,0,0,0,0|2,0,0]=4 2195 B13R2.57 O=Cc1[n]c2ccccc2c[n]1 Amb24105409 [1,1,0,0,0,0|2,0,0]=4 2196 B13R2.57 O=Cc1ccc2[n]cccc2[n]1 Amb25292132 [1,1,0,0,0,0|2,0,0]=4 2197 B13R2.57 O=Cc1ccc2c(c1)cccn2 Amb1266161 [1,1,0,0,0,0|2,0,0]=4 2198 B13R2.57 O=Cc1ccc2c(c1)nccc2 Amb2548373 [1,1,0,0,0,0|2,0,0]=4 2199 B13R2.57 O=Cc1ccc2c(n1)nccc2 Amb1323330 [1,1,0,0,0,0|2,0,0]=4 2200 B13R2.57 O=Cc1ccc2cc[n]cc2[n]1 Amb22498133 [1,1,0,0,0,0|2,0,0]=4 2201 B13R2.57 O=Cc1cnc2c(c1)cccc2 Amb1995106 [1,1,0,0,0,0|1,0,1]=4 2202 B13R2.57 O=Nc1[n]c2ccccc2c[n]1 Amb24682974 [1,1,0,0,0,0|2,0,0]=4 2203 B13R2.57 OCC1=CCc2ccccc2O1 Amb25346125 [1,1,0,0,0,0|0,0,2]=4 2204 B13R2.57 OCC1=CNc2ccccc2N1 Amb24309070 [1,1,0,0,0,0|2,0,0]=4 2205 B13R2.57 OCC1=COc2ccccc2O1 Amb25283194 [1,1,0,0,0,0|1,0,0]=3 2206 B13R2.57 OCC1=Cc2ccccc2CN1 Amb25152553 [1,1,0,0,0,0|2,0,0]=4 2207 B13R2.57 OCC=1CCc2ccccc2C1 Amb25266375 [1,1,0,0,0,0|1,0,1]=4 2208 B13R2.57 OCC=1CNc2ccccc2C1 Amb24338248 [1,1,0,0,0,0|1,0,1]=4 2209 B13R2.57 OCC=1COc2ccc[n]c2C1 Amb25788971 [1,1,0,0,0,0|1,0,1]=4 2210 B13R2.57 OCC=1Cc2ccccc2CC1 Amb24733421 [1,1,0,0,0,0|1,0,1]=4 2211 B13R2.57 OCc1cc2[n]cccc2[n]c1 Amb21959456 [1,1,0,0,0,0|2,0,0]=4 2212 B13R2.57 OCc1cc2[n]cccc2cc1 Amb19105058 [1,1,0,0,0,0|2,0,0]=4 2213 B13R2.57 OCc1cc2c[n]ccc2cc1 Amb19104916 [1,1,0,0,0,0|2,0,0]=4 2214 B13R2.57 OCc1cc2cc[n]cc2[n]c1 Amb24425484 [1,1,0,0,0,0|2,0,0]=4 2215 B13R2.57 OCc1cc2ccc[n]c2[n]c1 Amb25068002 [1,1,0,0,0,0|2,0,0]=4 2216 B13R2.57 OCc1cc2ccccc2[n]c1 Amb20668047 [1,1,0,0,0,0|1,0,0]=3 2217 B13R2.57 OCc1ccc2c(c1)cccc2 Amb2389960 [1,1,0,0,0,0|1,0,0]=3 2218 B13R2.57 OCc1ccc2c(c1)cccn2 Amb1995120 [1,1,0,0,0,0|2,0,0]=4 2219 B13R2.57 OCc1ccc2c(c1)ccnc2 Amb10070398 [1,1,0,0,0,0|2,0,0]=4 2220 B13R2.57 OCc1ccc2c(n1)cccc2 Amb1154605 [1,1,0,0,0,0|1,0,1]=4 2221 B13R2.57 OCc1ccc2ccccc2[n]1 Amb21857708 [1,1,0,0,0,0|1,0,1]=4 2222 B13R2.57 OCc1cnc2c(c1)cccc2 Amb1995109 [1,1,0,0,0,0|1,0,0]=3 2223 B13R2.57 ONc1c[n]c2ccccc2[n]1 Amb25356591 [1,1,0,0,0,0|2,0,0]=4 2224 B13R2.57 ONc1cc2ccc[n]c2cc1 Amb24363728 [1,1,0,0,0,0|2,0,0]=4 2225 B13R2.57 ONc1cc2ccccc2cc1 Amb24567681 [1,1,0,0,0,0|1,0,0]=3 2226 B13R2.57 ONc1ccc2ccccc2[n]1 Amb25705559 [1,1,0,0,0,0|1,0,1]=4 2227 B13R2.57 SCc1cc2ccccc2[n]c1 Amb25083301 [1,1,0,0,0,0|1,1,0]=4 2228 B13R2.57 SCc1cc2ccccc2cc1 Amb21943705 [1,1,0,0,0,0|1,1,0]=4 2229 B13R2.57 [C-]#[N+]c1cc2ccccc2[n]c1 Amb25320374 [1,1,0,0,0,0|2,0,0]=4 2230 B13R2.57 [C-]#[N+]c1cc2ccccc2cc1 Amb22348022 [1,1,0,0,0,0|2,0,0]=4 2231 B13R2.155 Brc1cc2[n]c(Br)ccc2cc1 Amb22000956 [1,1,0,0,0,0|2,0,0]=4 2232 B13R2.155 Brc1cc2[n]c(I)ccc2cc1 Amb25217538 [1,1,0,0,0,0|2,0,0]=4 2233 B13R2.155 Brc1cc2cc(Br)c[n]c2cc1 Amb21964475 [1,1,0,0,0,0|2,0,0]=4 2234 B13R2.155 Brc1cc2cc(I)c[n]c2cc1 Amb24179183 [1,1,0,0,0,0|2,0,0]=4 2235 B13R2.155 Brc1cc2cc(I)ccc2cc1 Amb24758917 [1,1,0,0,0,0|2,0,0]=4 2236 B13R2.155 Brc1ccc2c(c1)[nH]c(=O)nc2 Amb10603909 [1,1,0,0,0,0|2,0,0]=4 2237 B13R2.155 Brc1ccc2c(c1)cc(cn2)C Amb1994327 [1,1,0,0,0,0|2,0,0]=4 2238 B13R2.155 Brc1ccc2c(c1)cc(cn2)N Amb1994332 [1,1,0,0,0,0|2,0,0]=4 2239 B13R2.155 Brc1ccc2c(c1)cc(cn2)O Amb1994333 [1,1,0,0,0,0|1,0,0]=3 2240 B13R2.155 Brc1ccc2c(c1)cc(nc2)O Amb16185816 [1,1,0,0,0,0|2,0,0]=4 2241 B13R2.155 Brc1ccc2c(c1)nc(cc2)C Amb1994793 [1,1,0,0,0,0|2,0,0]=4 2242 B13R2.155 Brc1ccc2c(c1)nc(cc2)Cl Amb1994309 [1,1,0,0,0,0|2,0,0]=4 2243 B13R2.155 Brc1ccc2c(c1)nc(cc2)N Amb16234051 [1,1,0,0,0,0|2,0,0]=4 2244 B13R2.155 CC1=CC2=CC(=O)NC=C2C=C1 Amb22371048 [1,1,0,0,0,0|2,0,0]=4 2245 B13R2.155 Cc1c[n]c2C=CC(=O)Nc2c1 Amb24556512 [1,1,0,0,0,0|2,0,0]=4 2246 B13R2.155 Cc1cc2NC(=O)C=Cc2cc1 Amb21857833 [1,1,0,0,0,0|1,0,0]=3 2247 B13R2.155 Cc1cc2NC(=O)N=Cc2cc1 Amb24468183 [1,1,0,0,0,0|2,0,0]=4 2248 B13R2.155 Cc1cc2OC(=O)C=Cc2cc1 Amb18511476 [1,1,0,0,0,0|0,0,0]=2 2249 B13R2.155 Cc1cc2[nH]c(=O)c[n]c2cc1 Amb24092175 [1,1,0,0,0,0|2,0,0]=4 2250 B13R2.155 Cc1cc2[n]c(Br)ccc2cc1 Amb23589166 [1,1,0,0,0,0|2,0,0]=4 2251 B13R2.155 Cc1cc2[n]c(C)ccc2cc1 Amb22002033 [1,1,0,0,0,0|2,0,0]=4 2252 B13R2.155 Cc1cc2[n]c(Cl)ccc2cc1 Amb22007944 [1,1,0,0,0,0|2,0,0]=4 2253 B13R2.155 Cc1cc2[n]c(S)ccc2cc1 Amb23536151 [1,1,0,0,0,0|1,1,0]=4 2254 B13R2.155 Cc1cc2cc(Br)c[n]c2cc1 Amb24054480 [1,1,0,0,0,0|2,0,0]=4 2255 B13R2.155 Cc1cc2cc(Br)ccc2cc1 Amb21864772 [1,1,0,0,0,0|2,0,0]=4 2256 B13R2.155 Cc1cc2cc(Cl)c[n]c2cc1 Amb25149994 [1,1,0,0,0,0|2,0,0]=4 2257 B13R2.155 Cc1cc2cc(Cl)ccc2[n]c1 Amb22755381 [1,1,0,0,0,0|2,0,0]=4 2258 B13R2.155 Cc1cc2cc(Cl)ccc2cc1 Amb24626109 [1,1,0,0,0,0|2,0,0]=4 2259 B13R2.155 Cc1cc2cc(F)ccc2[n]c1 Amb22494177 [1,1,0,0,0,0|2,0,0]=4 2260 B13R2.155 Cc1cc2cc(F)ccc2cc1 Amb24429006 [1,1,0,0,0,0|2,0,0]=4 2261 B13R2.155 Cc1cc2cc(I)c[n]c2cc1 Amb24610937 [1,1,0,0,0,0|2,0,0]=4 2262 B13R2.155 Cc1cc2cc(N)ccc2cc1 Amb24707712 [1,1,0,0,0,0|2,0,0]=4 2263 B13R2.155 Cc1cc2cc(O)[n]cc2cc1 Amb18645160 [1,1,0,0,0,0|2,0,0]=4 2264 B13R2.155 Cc1cc2cc(O)ccc2[n]c1 Amb25204459 [1,1,0,0,0,0|2,0,0]=4 2265 B13R2.155 Cc1cc2cc(O)ccc2c[n]1 Amb24102430 [1,1,0,0,0,0|2,0,0]=4 2266 B13R2.155 Cc1cc2cc(O)ccc2cc1 Amb18645051 [1,1,0,0,0,0|1,0,0]=3 2267 B13R2.155 Cc1ccc2c(c1)cc(cn2)C Amb17334418 [1,1,0,0,0,0|2,0,0]=4 2268 B13R2.155 Cc1ccc2c(c1)cc(cn2)N Amb17157131 [1,1,0,0,0,0|2,0,0]=4 2269 B13R2.155 Cc1ccc2ccc(N)cc2[n]1 Amb18645063 [1,1,0,0,0,0|2,0,0]=4 2270 B13R2.155 Cc1ccc2ccc(O)cc2[n]1 Amb18353419 [1,1,0,0,0,0|2,0,0]=4 2271 B13R2.155 Clc1cc2OC(=O)CNc2cc1 Amb2234255 [1,1,0,0,0,0|1,0,1]=4 2272 B13R2.155 Clc1cc2[n]c(Br)ccc2cc1 Amb22304235 [1,1,0,0,0,0|2,0,0]=4 2273 B13R2.155 Clc1cc2[n]c(Cl)ccc2cc1 Amb20239455 [1,1,0,0,0,0|2,0,0]=4 2274 B13R2.155 Clc1cc2cc(Br)c[n]c2cc1 Amb22899265 [1,1,0,0,0,0|2,0,0]=4 2275 B13R2.155 Clc1cc2cc(Br)ccc2[n]c1 Amb22751168 [1,1,0,0,0,0|2,0,0]=4 2276 B13R2.155 Clc1cc2cc(I)ccc2cc1 Amb25790503 [1,1,0,0,0,0|2,0,0]=4 2277 B13R2.155 Clc1ccc2c(c1)cc(cn2)N Amb17157138 [1,1,0,0,0,0|2,0,0]=4 2278 B13R2.155 Clc1ccc2c(c1)nc(cc2)C Amb2371819 [1,1,0,0,0,0|2,0,0]=4 2279 B13R2.155 Clc1ccc2c(c1)nc(cc2)O Amb10603917 [1,1,0,0,0,0|1,0,1]=4 2280 B13R2.155 Fc1cc2[n]c(Br)ccc2cc1 Amb23401192 [1,1,0,0,0,0|2,0,0]=4 2281 B13R2.155 Fc1cc2[n]c(Cl)ccc2cc1 Amb19148834 [1,1,0,0,0,0|2,0,0]=4 2282 B13R2.155 Fc1cc2cc(Br)c[n]c2cc1 Amb22899327 [1,1,0,0,0,0|2,0,0]=4 2283 B13R2.155 Fc1cc2cc(Br)ccc2[n]c1 Amb22899328 [1,1,0,0,0,0|2,0,0]=4 2284 B13R2.155 Fc1cc2cc(Br)ccc2cc1 Amb25365032 [1,1,0,0,0,0|2,0,0]=4 2285 B13R2.155 Fc1cc2cc(Cl)ccc2[n]c1 Amb24553217 [1,1,0,0,0,0|2,0,0]=4 2286 B13R2.155 Fc1cc2cc(F)c[n]c2cc1 Amb25793547 [1,1,0,0,0,0|2,0,0]=4 2287 B13R2.155 Fc1cc2cc(F)ccc2cc1 Amb25347384 [1,1,0,0,0,0|2,0,0]=4 2288 B13R2.155 Fc1cc2cc(I)c[n]c2cc1 Amb25739549 [1,1,0,0,0,0|2,0,0]=4 2289 B13R2.155 Fc1cc2cc(I)ccc2cc1 Amb24483667 [1,1,0,0,0,0|2,0,0]=4 2290 B13R2.155 Fc1ccc2c(c1)cc(cn2)N Amb17157137 [1,1,0,0,0,0|2,0,0]=4 2291 B13R2.155 Fc1ccc2c(c1)cc(cn2)N Amb17621721 [1,1,0,0,0,0|2,0,0]=4 2292 B13R2.155 Ic1ccc2c(c1)cc(cn2)Br Amb15693012 [1,1,0,0,0,0|2,0,0]=4 2293 B13R2.155 NC1=CC=C2C=CC(=O)N=C2N1 Amb22386908 [1,1,0,0,0,0|2,0,0]=4 2294 B13R2.155 Nc1cc2NC(=O)C=Cc2c[n]1 Amb24400239 [1,1,0,0,0,0|2,0,0]=4 2295 B13R2.155 Nc1cc2NC(=O)C=Cc2cc1 Amb18545106 [1,1,0,0,0,0|1,0,0]=3 2296 B13R2.155 Nc1cc2NC(=O)C=Nc2cc1 Amb19789097 [1,1,0,0,0,0|2,0,0]=4 2297 B13R2.155 Nc1cc2OC(=O)C=Cc2cc1 Amb19130409 [1,1,0,0,0,0|0,0,0]=2 2298 B13R2.155 Nc1cc2OC(=O)NCc2cc1 Amb24514255 [1,1,0,0,0,0|1,0,1]=4 2299 B13R2.155 Nc1cc2[n]c(Br)ccc2cc1 Amb23412023 [1,1,0,0,0,0|2,0,0]=4 2300 B13R2.155 Nc1cc2[n]c(Cl)ccc2cc1 Amb23412022 [1,1,0,0,0,0|2,0,0]=4 2301 B13R2.155 Nc1cc2[n]c(N)ccc2cc1 Amb18645199 [1,1,0,0,0,0|2,0,0]=4 2302 B13R2.155 Nc1cc2cc(Cl)c[n]c2cc1 Amb22586586 [1,1,0,0,0,0|2,0,0]=4 2303 B13R2.155 Nc1cc2cc(F)c[n]c2cc1 Amb22899391 [1,1,0,0,0,0|2,0,0]=4 2304 B13R2.155 Nc1cc2cc(I)c[n]c2cc1 Amb24359099 [1,1,0,0,0,0|2,0,0]=4 2305 B13R2.155 Nc1cc2cc(I)ccc2cc1 Amb25280657 [1,1,0,0,0,0|2,0,0]=4 2306 B13R2.155 Nc1cc2cc(N)c[n]c2cc1 Amb24085601 [1,1,0,0,0,0|2,0,0]=4 2307 B13R2.155 Nc1cc2cc(O)[n]cc2cc1 Amb22735994 [1,1,0,0,0,0|2,0,0]=4 2308 B13R2.155 Nc1cc2cc(O)c[n]c2cc1 Amb24183776 [1,1,0,0,0,0|1,0,0]=3 2309 B13R2.155 Nc1cc2cc(O)ccc2[n]c1 Amb23580321 [1,1,0,0,0,0|2,0,0]=4 2310 B13R2.155 Nc1cc2cc(O)ccc2cc1 Amb21955697 [1,1,0,0,0,0|1,0,0]=3 2311 B13R2.155 Nc1ccc2C=CC(=O)Nc2[n]1 Amb19516712 [1,1,0,0,0,0|2,0,0]=4 2312 B13R2.155 Nc1ccc2C=CC(=O)Nc2[n]1 Amb22284727 [1,1,0,0,0,0|2,0,0]=4 2313 B13R2.155 Nc1ccc2OCC(O)=Nc2c1 Amb17914492 [1,1,0,0,0,0|1,0,1]=4 2314 B13R2.155 Nc1ccc2c(c1)cc(cc2)Br Amb17596044 [1,1,0,0,0,0|2,0,0]=4 2315 B13R2.155 Nc1ccc2c(c1)cc(cc2)Cl Amb17594515 [1,1,0,0,0,0|2,0,0]=4 2316 B13R2.155 Nc1ccc2c(c1)cc(cn2)Br Amb1101979 [1,1,0,0,0,0|2,0,0]=4 2317 B13R2.155 Nc1ccc2ccc(Cl)cc2[n]1 Amb18648193 [1,1,0,0,0,0|2,0,0]=4 2318 B13R2.155 Nc1ccc2ccc(F)cc2[n]1 Amb25121338 [1,1,0,0,0,0|2,0,0]=4 2319 B13R2.155 O=C1C=C2C=C(Br)C=CC2=CN1 Amb22371047 [1,1,0,0,0,0|2,0,0]=4 2320 B13R2.155 O=C1C=C2C=C(Cl)C=CC2=CN1 Amb24723301 [1,1,0,0,0,0|2,0,0]=4 2321 B13R2.155 O=C1C=C2C=C(Cl)C=CN2C=C1 Amb25373379 [1,1,0,0,0,0|2,0,0]=4 2322 B13R2.155 O=C1C=Cc2[n]cc(Br)cc2N1 Amb22739841 [1,1,0,0,0,0|2,0,0]=4 2323 B13R2.155 O=C1C=Cc2[n]cc(Cl)cc2N1 Amb22235070 [1,1,0,0,0,0|2,0,0]=4 2324 B13R2.155 O=C1C=Cc2[n]cc(F)cc2N1 Amb22234515 [1,1,0,0,0,0|2,0,0]=4 2325 B13R2.155 O=C1C=Cc2c[n]c(Br)cc2N1 Amb24563123 [1,1,0,0,0,0|2,0,0]=4 2326 B13R2.155 O=C1C=Cc2c[n]c(F)cc2N1 Amb22494138 [1,1,0,0,0,0|2,0,0]=4 2327 B13R2.155 O=C1C=Cc2ccc(Br)cc2N1 Amb20248087 [1,1,0,0,0,0|1,0,0]=3 2328 B13R2.155 O=C1C=Cc2ccc(Cl)cc2N1 Amb19894727 [1,1,0,0,0,0|1,0,0]=3 2329 B13R2.155 O=C1C=Cc2ccc(F)[n]c2N1 Amb22386916 [1,1,0,0,0,0|2,0,0]=4 2330 B13R2.155 O=C1C=Cc2ccc(F)cc2N1 Amb23412015 [1,1,0,0,0,0|1,0,0]=3 2331 B13R2.155 O=C1C=Cc2ccc(F)cc2O1 Amb24736406 [1,1,0,0,0,0|0,0,0]=2 2332 B13R2.155 O=C1C=Nc2ccc(Br)cc2N1 Amb19789102 [1,1,0,0,0,0|2,0,0]=4 2333 B13R2.155 O=C1C=Nc2ccc(Cl)cc2N1 Amb19889641 [1,1,0,0,0,0|2,0,0]=4 2334 B13R2.155 O=C1C=Nc2ccc(F)cc2N1 Amb23557642 [1,1,0,0,0,0|2,0,0]=4 2335 B13R2.155 O=C1C=Nc2ccc(I)cc2N1 Amb25178643 [1,1,0,0,0,0|2,0,0]=4 2336 B13R2.155 O=C1CCc2ccc(Br)cc2O1 Amb21928269 [1,1,0,0,0,0|0,0,2]=4 2337 B13R2.155 O=C1CNc2ccc(F)cc2O1 Amb25208047 [1,1,0,0,0,0|1,0,1]=4 2338 B13R2.155 O=C1Nc2cc(Br)ccc2C=N1 Amb21963258 [1,1,0,0,0,0|2,0,0]=4 2339 B13R2.155 O=C1OCc2ccc(F)cc2O1 Amb25350783 [1,1,0,0,0,0|1,0,1]=4 2340 B13R2.155 O[13c]1[13cH][13cH][13c]2C=CC(=O)O[13c]2[13cH]1 Amb19132572 [1,1,0,0,0,0|0,0,0]=2 2341 B13R2.155 O[13c]1ccc2C=CC(=O)O[13c]2[13cH]1 Amb19132571 [1,1,0,0,0,0|0,0,0]=2 2342 B13R2.155 Oc1cc2NC(=O)C=Cc2cc1 Amb18645438 [1,1,0,0,0,0|1,0,0]=3 2343 B13R2.155 Oc1cc2OC(=O)C=Cc2cc1 Amb18511480 [1,1,0,0,0,0|0,0,0]=2 2344 B13R2.155 Oc1cc2[n]c(F)ccc2cc1 Amb24485536 [1,1,0,0,0,0|2,0,0]=4 2345 B13R2.155 Oc1cc2cc(Br)c[n]c2cc1 Amb21964255 [1,1,0,0,0,0|2,0,0]=4 2346 B13R2.155 Oc1cc2cc(Cl)[n]cc2cc1 Amb22735856 [1,1,0,0,0,0|2,0,0]=4 2347 B13R2.155 Oc1cc2cc(Cl)c[n]c2cc1 Amb22497692 [1,1,0,0,0,0|2,0,0]=4 2348 B13R2.155 Oc1cc2cc(Cl)ccc2[n]c1 Amb22494760 [1,1,0,0,0,0|1,0,0]=3 2349 B13R2.155 Oc1cc2cc(F)c[n]c2cc1 Amb22899330 [1,1,0,0,0,0|2,0,0]=4 2350 B13R2.155 Oc1cc2cc(F)ccc2[n]c1 Amb22494761 [1,1,0,0,0,0|1,0,0]=3 2351 B13R2.155 Oc1cc2cc(F)ccc2c[n]1 Amb20171182 [1,1,0,0,0,0|2,0,0]=4 2352 B13R2.155 Oc1cc2cc(F)ccc2cc1 Amb24589653 [1,1,0,0,0,0|1,0,0]=3 2353 B13R2.155 Oc1cc2cc(I)c[n]c2cc1 Amb22494723 [1,1,0,0,0,0|2,0,0]=4 2354 B13R2.155 Oc1cc2cc(I)ccc2[n]c1 Amb22494758 [1,1,0,0,0,0|1,0,0]=3 2355 B13R2.155 Oc1cc2cc(I)ccc2cc1 Amb24429632 [1,1,0,0,0,0|1,0,0]=3 2356 B13R2.155 Oc1cc2cc(O)c[n]c2[n]c1 Amb25152458 [1,1,0,0,0,0|2,0,0]=4 2357 B13R2.155 Oc1cc2cc(O)c[n]c2cc1 Amb24485547 [1,1,0,0,0,0|1,0,0]=3 2358 B13R2.155 Oc1ccc2C=CC(=O)Oc2[n]1 Amb18645755 [1,1,0,0,0,0|1,0,0]=3 2359 B13R2.155 Oc1ccc2c(c1)cc(cc2)Br Amb17596083 [1,1,0,0,0,0|1,0,0]=3 2360 B13R2.155 Oc1ccc2c(c1)cc(cc2)Cl Amb17594576 [1,1,0,0,0,0|1,0,0]=3 2361 B13R2.155 Oc1ccc2c(c1)nc(cc2)O Amb10602568 [1,1,0,0,0,0|1,0,1]=4 2362 B13R2.155 Oc1ccc2ccc(Br)cc2[n]1 Amb22284792 [1,1,0,0,0,0|1,0,1]=4 2363 B13R2.155 Oc1ccc2ccc(I)cc2[n]1 Amb24605587 [1,1,0,0,0,0|1,0,1]=4 2364 B13R2.155 Sc1cc2cc(S)ccc2cc1 Amb21954230 [1,1,0,0,0,0|1,1,0]=4 2365 B13R2.155 Sc1ccc2ccc(Br)cc2[n]1 Amb23536159 [1,1,0,0,0,0|1,1,0]=4 2366 B13R2.155 Sc1ccc2ccc(Cl)cc2[n]1 Amb23536154 [1,1,0,0,0,0|1,1,0]=4 2367 B13R2.162 Brc1cc2c(I)cccc2cc1 Amb24663180 [1,1,0,0,0,0|2,0,0]=4 2368 B13R2.162 Brc1cc2c(cc1)cccc2Br Amb24367292 [1,1,0,0,0,0|2,0,0]=4 2369 B13R2.162 Brc1ccc2c(c1)c(N)ccc2 Amb17596047 [1,1,0,0,0,0|2,0,0]=4 2370 B13R2.162 Brc1ccc2c(c1)c(O)ccc2 Amb17596078 [1,1,0,0,0,0|2,0,0]=4 2371 B13R2.162 Brc1ccc2c(n1)c(Br)ccc2 Amb10808403 [1,1,0,0,0,0|2,0,0]=4 2372 B13R2.162 Brc1cnc2c(c1)c(Br)ccc2 Amb15693009 [1,1,0,0,0,0|2,0,0]=4 2373 B13R2.162 CC1=CC=CC2=CNC(=O)C=C21 Amb23401154 [1,1,0,0,0,0|2,0,0]=4 2374 B13R2.162 Cc1c[n]c2cccc(Br)c2c1 Amb22001832 [1,1,0,0,0,0|2,0,0]=4 2375 B13R2.162 Cc1c[n]c2cccc(N)c2c1 Amb24102419 [1,1,0,0,0,0|2,0,0]=4 2376 B13R2.162 Cc1c[n]c2cccc(O)c2c1 Amb24102421 [1,1,0,0,0,0|2,0,0]=4 2377 B13R2.162 Cc1cc2c(Cl)cccc2cc1 Amb24707706 [1,1,0,0,0,0|2,0,0]=4 2378 B13R2.162 Cc1cc2c(F)cccc2cc1 Amb24425397 [1,1,0,0,0,0|2,0,0]=4 2379 B13R2.162 Cc1cc2c(N)cccc2cc1 Amb22751119 [1,1,0,0,0,0|2,0,0]=4 2380 B13R2.162 Cc1ccc2c(n1)c(Br)ccc2 Amb2234931 [1,1,0,0,0,0|2,0,0]=4 2381 B13R2.162 Cc1ccc2c(n1)c(C)ccc2 Amb13883939 [1,1,0,0,0,0|2,0,0]=4 2382 B13R2.162 Cc1ccc2c(n1)c(C)ccc2 Amb1994369 [1,1,0,0,0,0|2,0,0]=4 2383 B13R2.162 Cc1ccc2c(n1)c(F)ccc2 Amb17578178 [1,1,0,0,0,0|2,0,0]=4 2384 B13R2.162 Cc1ccc2c(n1)c(O)ccc2 Amb1210122 [1,1,0,0,0,0|2,0,0]=4 2385 B13R2.162 Cc1ccc2cccc(O)c2[n]1 Amb24081196 [1,1,0,0,0,0|2,0,0]=4 2386 B13R2.162 Cc1ccc2cccc(O)c2c1 Amb17689149 [1,1,0,0,0,0|2,0,0]=4 2387 B13R2.162 Cc1ccc2cccc([O-])c2[n]1 Amb22057282 [1,1,0,0,0,0|2,0,0]=4 2388 B13R2.162 Cc1ccc2cccc([O-])c2[n]1 Amb22057309 [1,1,0,0,0,0|2,0,0]=4 2389 B13R2.162 Cc1cccc2C=CC(=O)Nc21 Amb18546019 [1,1,0,0,0,0|1,0,0]=3 2390 B13R2.162 Cc1cccc2[n]cc(=O)[nH]c21 Amb24092329 [1,1,0,0,0,0|2,0,0]=4 2391 B13R2.162 Cc1cccc2[n]cc(O)cc21 Amb25696317 [1,1,0,0,0,0|1,0,0]=3 2392 B13R2.162 Cc1cccc2ccc(Br)[n]c21 Amb20171133 [1,1,0,0,0,0|2,0,0]=4 2393 B13R2.162 Cc1cccc2ccc(Br)cc21 Amb25771803 [1,1,0,0,0,0|2,0,0]=4 2394 B13R2.162 Cc1cccc2ccc(Cl)[n]c21 Amb20171142 [1,1,0,0,0,0|2,0,0]=4 2395 B13R2.162 Cc1cccc2ccc(Cl)cc21 Amb25849279 [1,1,0,0,0,0|2,0,0]=4 2396 B13R2.162 Cc1cccc2ccc(F)cc21 Amb24390185 [1,1,0,0,0,0|2,0,0]=4 2397 B13R2.162 Cc1cccc2ccc(N)[n]c21 Amb22886500 [1,1,0,0,0,0|2,0,0]=4 2398 B13R2.162 Cc1cccc2ccc(N)cc21 Amb22751121 [1,1,0,0,0,0|2,0,0]=4 2399 B13R2.162 Cc1cnc2cccc(C)c2c1 Amb17689455 [1,1,0,0,0,0|2,0,0]=4 2400 B13R2.162 Clc1c[n]c2cccc(Br)c2c1 Amb22899337 [1,1,0,0,0,0|2,0,0]=4 2401 B13R2.162 Clc1cc2c(Br)cccc2cc1 Amb24451031 [1,1,0,0,0,0|2,0,0]=4 2402 B13R2.162 Clc1cc2c(cc1)cccc2Cl Amb25731654 [1,1,0,0,0,0|2,0,0]=4 2403 B13R2.162 Clc1ccc2c(c1)c(N)ccc2 Amb17594520 [1,1,0,0,0,0|2,0,0]=4 2404 B13R2.162 Clc1ccc2c(c1)c(O)ccc2 Amb17594572 [1,1,0,0,0,0|2,0,0]=4 2405 B13R2.162 Clc1ccc2c(n1)c(Br)ccc2 Amb13883519 [1,1,0,0,0,0|2,0,0]=4 2406 B13R2.162 Clc1cccc2[n]cc(Br)cc21 Amb22757130 [1,1,0,0,0,0|2,0,0]=4 2407 B13R2.162 Clc1cccc2ccc(Br)[n]c21 Amb20171122 [1,1,0,0,0,0|2,0,0]=4 2408 B13R2.162 Clc1cccc2ccc(Br)cc21 Amb24079753 [1,1,0,0,0,0|2,0,0]=4 2409 B13R2.162 Clc1cccc2ccc(I)cc21 Amb24537718 [1,1,0,0,0,0|2,0,0]=4 2410 B13R2.162 Fc1c[n]c2cccc(Br)c2c1 Amb22292331 [1,1,0,0,0,0|2,0,0]=4 2411 B13R2.162 Fc1cc2c(Br)cccc2cc1 Amb25150060 [1,1,0,0,0,0|2,0,0]=4 2412 B13R2.162 Fc1cc2c(I)cccc2cc1 Amb24616468 [1,1,0,0,0,0|2,0,0]=4 2413 B13R2.162 Fc1cccc2[n]cc(Br)cc21 Amb22899332 [1,1,0,0,0,0|2,0,0]=4 2414 B13R2.162 Fc1cccc2ccc(Cl)[n]c21 Amb20171130 [1,1,0,0,0,0|2,0,0]=4 2415 B13R2.162 Fc1cccc2ccc(Cl)cc21 Amb25104805 [1,1,0,0,0,0|2,0,0]=4 2416 B13R2.162 Fc1cccc2ccc(I)cc21 Amb25148957 [1,1,0,0,0,0|2,0,0]=4 2417 B13R2.162 Fc1cccc2ccc(S)[n]c21 Amb23536127 [1,1,0,0,0,0|1,1,0]=4 2418 B13R2.162 Nc1c[n]c2cccc(Br)c2c1 Amb22494701 [1,1,0,0,0,0|2,0,0]=4 2419 B13R2.162 Nc1c[n]c2cccc(Br)c2c1 Amb22495103 [1,1,0,0,0,0|2,0,0]=4 2420 B13R2.162 Nc1c[n]c2cccc(Cl)c2c1 Amb24183747 [1,1,0,0,0,0|2,0,0]=4 2421 B13R2.162 Nc1c[n]c2cccc(F)c2c1 Amb22899331 [1,1,0,0,0,0|2,0,0]=4 2422 B13R2.162 Nc1c[n]c2cccc(N)c2c1 Amb24085564 [1,1,0,0,0,0|2,0,0]=4 2423 B13R2.162 Nc1c[n]c2cccc(O)c2c1 Amb22899338 [1,1,0,0,0,0|2,0,0]=4 2424 B13R2.162 Nc1c[n]cc2ccc(O)cc21 Amb24564129 [1,1,0,0,0,0|2,0,0]=4 2425 B13R2.162 Nc1cc2c(F)cccc2cc1 Amb24400529 [1,1,0,0,0,0|2,0,0]=4 2426 B13R2.162 Nc1cc2c(I)cccc2cc1 Amb25778164 [1,1,0,0,0,0|2,0,0]=4 2427 B13R2.162 Nc1cc[n]c2ccc(O)cc21 Amb25312815 [1,1,0,0,0,0|2,0,0]=4 2428 B13R2.162 Nc1ccc2c(c1)c(Cl)ccc2 Amb17594514 [1,1,0,0,0,0|2,0,0]=4 2429 B13R2.162 Nc1ccc2c(c1)c(N)ccc2 Amb17593961 [1,1,0,0,0,0|2,0,0]=4 2430 B13R2.162 Nc1ccc2c(c1)c(O)ccc2 Amb17593982 [1,1,0,0,0,0|2,0,0]=4 2431 B13R2.162 Nc1ccc2cccc(Br)c2[n]1 Amb20668795 [1,1,0,0,0,0|2,0,0]=4 2432 B13R2.162 Nc1ccc2cccc(Cl)c2[n]1 Amb18648198 [1,1,0,0,0,0|2,0,0]=4 2433 B13R2.162 Nc1ccc2cccc(F)c2[n]1 Amb22899302 [1,1,0,0,0,0|2,0,0]=4 2434 B13R2.162 Nc1ccc2cccc(I)c2[n]1 Amb24452556 [1,1,0,0,0,0|2,0,0]=4 2435 B13R2.162 Nc1ccc2cccc(N)c2[n]1 Amb23401122 [1,1,0,0,0,0|2,0,0]=4 2436 B13R2.162 Nc1cccc2C=CC(=O)Nc21 Amb18645297 [1,1,0,0,0,0|1,0,0]=3 2437 B13R2.162 Nc1cccc2C=CC(=O)Nc21 Amb22548256 [1,1,0,0,0,0|1,0,0]=3 2438 B13R2.162 Nc1cccc2C=CC(=O)Oc21 Amb18547323 [1,1,0,0,0,0|0,0,0]=2 2439 B13R2.162 Nc1cccc2C=CC(=S)Nc21 Amb25216356 [1,1,0,0,0,0|1,1,0]=4 2440 B13R2.162 Nc1cccc2COC(=O)Oc21 Amb24514261 [1,1,0,0,0,0|1,0,1]=4 2441 B13R2.162 Nc1cccc2[n]cc(Br)cc21 Amb22899398 [1,1,0,0,0,0|2,0,0]=4 2442 B13R2.162 Nc1cccc2[n]cc(Cl)cc21 Amb22755312 [1,1,0,0,0,0|2,0,0]=4 2443 B13R2.162 Nc1cccc2[n]cc(F)cc21 Amb22899389 [1,1,0,0,0,0|2,0,0]=4 2444 B13R2.162 Nc1cccc2[n]cc(O)cc21 Amb22899411 [1,1,0,0,0,0|1,0,0]=3 2445 B13R2.162 Nc1cccc2c[n]c(O)cc21 Amb22735993 [1,1,0,0,0,0|2,0,0]=4 2446 B13R2.162 Nc1cccc2ccc(Br)[n]c21 Amb23399861 [1,1,0,0,0,0|2,0,0]=4 2447 B13R2.162 Nc1cccc2ccc(Cl)[n]c21 Amb21618807 [1,1,0,0,0,0|2,0,0]=4 2448 B13R2.162 Nc1cccc2ccc(F)cc21 Amb24465110 [1,1,0,0,0,0|2,0,0]=4 2449 B13R2.162 Nc1cccc2ccc(I)cc21 Amb25784705 [1,1,0,0,0,0|2,0,0]=4 2450 B13R2.162 Nc1cccc2ccc(O)cc12 Amb17750263 [1,1,0,0,0,0|1,0,0]=3 2451 B13R2.162 O=C1C=Cc2c[n]cc(Br)c2N1 Amb22043947 [1,1,0,0,0,0|2,0,0]=4 2452 B13R2.162 O=C1C=Cc2cccc(Br)c2N1 Amb17933211 [1,1,0,0,0,0|1,0,0]=3 2453 B13R2.162 O=C1C=Cc2cccc(Br)c2O1 Amb19957580 [1,1,0,0,0,0|0,0,0]=2 2454 B13R2.162 O=C1C=Cc2cccc(F)c2N1 Amb18546026 [1,1,0,0,0,0|1,0,0]=3 2455 B13R2.162 O=C1C=Cc2cccc(I)c2N1 Amb24579898 [1,1,0,0,0,0|1,0,0]=3 2456 B13R2.162 O=C1C=Cc2cccc(I)c2O1 Amb25206611 [1,1,0,0,0,0|0,0,0]=2 2457 B13R2.162 O=C1C=Nc2cccc(Br)c2N1 Amb21963796 [1,1,0,0,0,0|2,0,0]=4 2458 B13R2.162 O=C1OCc2cccc(F)c2O1 Amb24558948 [1,1,0,0,0,0|1,0,1]=4 2459 B13R2.162 O=c1c[n]c2cccc(F)c2[nH]1 Amb24092306 [1,1,0,0,0,0|2,0,0]=4 2460 B13R2.162 O=c1ccc2c([nH]1)c(Br)cnc2 Amb10807973 [1,1,0,0,0,0|2,0,0]=4 2461 B13R2.162 O=c1ccc2c([nH]1)c(O)ccc2 Amb2137263 [1,1,0,0,0,0|1,0,0]=3 2462 B13R2.162 O=c1ccc2cccc(Br)c2o1 Amb22230172 [1,1,0,0,0,0|0,0,0]=2 2463 B13R2.162 Oc1c[n]c2cccc(Br)c2c1 Amb22494956 [1,1,0,0,0,0|1,0,0]=3 2464 B13R2.162 Oc1c[n]c2cccc(Cl)c2[n]1 Amb22496025 [1,1,0,0,0,0|2,0,0]=4 2465 B13R2.162 Oc1c[n]c2cccc(Cl)c2c1 Amb24183754 [1,1,0,0,0,0|1,0,0]=3 2466 B13R2.162 Oc1c[n]c2cccc(F)c2c1 Amb24183767 [1,1,0,0,0,0|1,0,0]=3 2467 B13R2.162 Oc1cc2C(=O)C=CSc2cc1 Amb25714254 [1,1,0,0,0,0|2,0,0]=4 2468 B13R2.162 Oc1cc2C(=O)NC=Cc2cc1 Amb18645442 [1,1,0,0,0,0|2,0,0]=4 2469 B13R2.162 Oc1cc2C(=O)OC=Cc2cc1 Amb25347575 [1,1,0,0,0,0|2,0,0]=4 2470 B13R2.162 Oc1cc2c(Br)cccc2c[n]1 Amb21857983 [1,1,0,0,0,0|2,0,0]=4 2471 B13R2.162 Oc1cc2c(Cl)[n]ccc2cc1 Amb22001578 [1,1,0,0,0,0|2,0,0]=4 2472 B13R2.162 Oc1cc2c(Cl)cccc2c[n]1 Amb23401156 [1,1,0,0,0,0|2,0,0]=4 2473 B13R2.162 Oc1cc2c(F)cccc2c[n]1 Amb23401157 [1,1,0,0,0,0|2,0,0]=4 2474 B13R2.162 Oc1cc2c(F)cccc2cc1 Amb18645622 [1,1,0,0,0,0|1,0,0]=3 2475 B13R2.162 Oc1cc2c(I)[n]ccc2cc1 Amb24497761 [1,1,0,0,0,0|2,0,0]=4 2476 B13R2.162 Oc1cc2c(I)cccc2cc1 Amb25148831 [1,1,0,0,0,0|1,0,0]=3 2477 B13R2.162 Oc1cc2c(S)cccc2cc1 Amb18127683 [1,1,0,0,0,0|1,0,0]=3 2478 B13R2.162 Oc1cc2c(cc1)[n]ccc2O Amb18645439 [1,1,0,0,0,0|2,0,0]=4 2479 B13R2.162 Oc1ccc2c(c1)c(=O)cco2 Amb1304863 [1,1,0,0,0,0|2,0,0]=4 2480 B13R2.162 Oc1ccc2c(c1)c(Br)ccc2 Amb16231039 [1,1,0,0,0,0|1,0,0]=3 2481 B13R2.162 Oc1ccc2c(c1)c(Br)ccn2 Amb15691602 [1,1,0,0,0,0|2,0,0]=4 2482 B13R2.162 Oc1ccc2c(c1)c(C)ccn2 Amb17593985 [1,1,0,0,0,0|2,0,0]=4 2483 B13R2.162 Oc1ccc2c(c1)c(Cl)ccc2 Amb17594577 [1,1,0,0,0,0|1,0,0]=3 2484 B13R2.162 Oc1ccc2c(c1)c(Cl)ccn2 Amb15692139 [1,1,0,0,0,0|2,0,0]=4 2485 B13R2.162 Oc1ccc2cccc(Br)c2[n]1 Amb22371957 [1,1,0,0,0,0|1,0,1]=4 2486 B13R2.162 Oc1ccc2cccc(Cl)c2[n]1 Amb22235418 [1,1,0,0,0,0|1,0,1]=4 2487 B13R2.162 Oc1cccc2C=CC(=O)Nc21 Amb18038432 [1,1,0,0,0,0|1,0,0]=3 2488 B13R2.162 Oc1cccc2C=CC(=O)Oc21 Amb18645571 [1,1,0,0,0,0|0,0,0]=2 2489 B13R2.162 Oc1cccc2CNC(=O)Oc21 Amb25287566 [1,1,0,0,0,0|1,0,1]=4 2490 B13R2.162 Oc1cccc2NCC(=O)Oc21 Amb25247281 [1,1,0,0,0,0|1,0,1]=4 2491 B13R2.162 Oc1cccc2[n]cc(=O)[nH]c21 Amb24092310 [1,1,0,0,0,0|2,0,0]=4 2492 B13R2.162 Oc1cccc2[n]cc(Br)cc21 Amb21963515 [1,1,0,0,0,0|2,0,0]=4 2493 B13R2.162 Oc1cccc2[n]cc(Cl)cc21 Amb22494666 [1,1,0,0,0,0|2,0,0]=4 2494 B13R2.162 Oc1cccc2[n]cc(F)cc21 Amb22899341 [1,1,0,0,0,0|2,0,0]=4 2495 B13R2.162 Oc1cccc2[n]cc(I)cc21 Amb22494878 [1,1,0,0,0,0|2,0,0]=4 2496 B13R2.162 Oc1cccc2ccc(Br)[n]c21 Amb22501093 [1,1,0,0,0,0|2,0,0]=4 2497 B13R2.162 Oc1cccc2ccc(F)[n]c21 Amb25793521 [1,1,0,0,0,0|2,0,0]=4 2498 B13R2.162 Oc1cccc2ccc(F)cc21 Amb18559372 [1,1,0,0,0,0|2,0,0]=4 2499 B13R2.162 Oc1cccc2ccc(I)[n]c21 Amb25080980 [1,1,0,0,0,0|2,0,0]=4 2500 B13R2.162 Sc1ccc2c(n1)c(O)ccc2 Amb17322674 [1,1,0,0,0,0|1,1,0]=4 2501 B13R2.162 Sc1ccc2cccc(Br)c2[n]1 Amb23536158 [1,1,0,0,0,0|1,1,0]=4 2502 B13R2.162 Sc1ccc2cccc(Cl)c2[n]1 Amb23536153 [1,1,0,0,0,0|1,1,0]=4 2503 B13R2.162 Sc1cccc2[n]cc(Br)cc21 Amb24619232 [1,1,0,0,0,0|2,0,0]=4 2504 B13R2.222 CC1(C)C=Cc2ccccc2O1 Amb22324894 [1,1,0,0,0,0|1,0,1]=4 2505 B13R2.328 Brc1cc2ccccc2[n+](c1)C Amb10572953 [1,1,0,0,0,0|2,0,0]=4 2506 B13R2.328 Brc1cc2ccccc2c(Br)c1 Amb24060654 [1,1,0,0,0,0|2,0,0]=4 2507 B13R2.328 Brc1cc2ccccc2c(c1)N Amb17596048 [1,1,0,0,0,0|2,0,0]=4 2508 B13R2.328 Brc1cc2ccccc2c(c1)O Amb17596075 [1,1,0,0,0,0|2,0,0]=4 2509 B13R2.328 C=C1NC(=O)Nc2ccccc21 Amb25150937 [1,1,0,0,0,0|2,0,0]=4 2510 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [1,1,0,0,0,0|2,0,0]=4 2511 B13R2.328 C=C1SC(=O)Nc2ccccc21 Amb25241617 [1,1,0,0,0,0|2,0,0]=4 2512 B13R2.328 CC1=CC(=O)C=C2C=CC=CN21 Amb24380800 [1,1,0,0,0,0|2,0,0]=4 2513 B13R2.328 CC1=CC(=O)N=C2C=CC=CN21 Amb20655584 [1,1,0,0,0,0|2,0,0]=4 2514 B13R2.328 CC1=CC(=O)Nc2cc[n]cc21 Amb18015580 [1,1,0,0,0,0|2,0,0]=4 2515 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [1,1,0,0,0,0|1,0,0]=3 2516 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [1,1,0,0,0,0|0,0,0]=2 2517 B13R2.328 CC1=CC(=O)c2ccc[n]c2O1 Amb24408396 [1,1,0,0,0,0|2,0,0]=4 2518 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [1,1,0,0,0,0|2,0,0]=4 2519 B13R2.328 CC1=CC(=O)c2ccccc2O1 Amb19666848 [1,1,0,0,0,0|1,0,0]=3 2520 B13R2.328 CC1=CC(=O)c2ccccc2S1 Amb20414518 [1,1,0,0,0,0|1,1,0]=4 2521 B13R2.328 CC1=CC(=S)Nc2ccccc21 Amb18010309 [1,1,0,0,0,0|1,1,0]=4 2522 B13R2.328 CC1=CC(=S)Oc2ccccc21 Amb19200772 [1,1,0,0,0,0|0,1,0]=3 2523 B13R2.328 CC1=CC(=S)c2ccccc2S1 Amb20651777 [1,1,0,0,0,0|1,1,0]=4 2524 B13R2.328 CC1NC(=O)Oc2ccccc21 Amb25823463 [1,1,0,0,0,0|1,0,1]=4 2525 B13R2.328 CC=1NC(=O)C=C2C=CC=CC21 Amb22371049 [1,1,0,0,0,0|2,0,0]=4 2526 B13R2.328 CC=1NC(=O)N=C2C=CC=CC21 Amb22493795 [1,1,0,0,0,0|2,0,0]=4 2527 B13R2.328 Cc1[n]c(O)cc2ccccc21 Amb18645161 [1,1,0,0,0,0|2,0,0]=4 2528 B13R2.328 Cc1cc(Br)[n]c2ccccc21 Amb18355120 [1,1,0,0,0,0|2,0,0]=4 2529 B13R2.328 Cc1cc(Cl)c2ccccc2[n]1 Amb20234731 [1,1,0,0,0,0|2,0,0]=4 2530 B13R2.328 Cc1cc(Cl)c2ccccc2[n]1 Amb22496125 [1,1,0,0,0,0|2,0,0]=4 2531 B13R2.328 Cc1cc(F)[n]c2ccccc21 Amb25196536 [1,1,0,0,0,0|2,0,0]=4 2532 B13R2.328 Cc1cc(I)c2ccccc2[n]1 Amb22756186 [1,1,0,0,0,0|2,0,0]=4 2533 B13R2.328 Cc1cc(I)cc2ccccc21 Amb24427637 [1,1,0,0,0,0|2,0,0]=4 2534 B13R2.328 Cc1cc(N)c2c(n1)cccc2 Amb11032603 [1,1,0,0,0,0|2,0,0]=4 2535 B13R2.328 Cc1cc(N)c2c(n1)cccc2 Amb1204080 [1,1,0,0,0,0|2,0,0]=4 2536 B13R2.328 Cc1cc(N)c2ccccc2[n]1 Amb24065825 [1,1,0,0,0,0|2,0,0]=4 2537 B13R2.328 Cc1cc(N)cc2ccccc21 Amb18126074 [1,1,0,0,0,0|2,0,0]=4 2538 B13R2.328 Cc1cc(O)c2c(n1)cccc2 Amb1796824 [1,1,0,0,0,0|2,0,0]=4 2539 B13R2.328 Cc1cc(O)cc2ccc[n]c21 Amb23437329 [1,1,0,0,0,0|2,0,0]=4 2540 B13R2.328 Cc1cc(O)cc2ccccc21 Amb18645052 [1,1,0,0,0,0|1,0,0]=3 2541 B13R2.328 Cc1cc2ccccc2[n](=O)c1 Amb20247263 [1,1,0,0,0,0|2,0,0]=4 2542 B13R2.328 Cc1cc2ccccc2c(Br)c1 Amb20669369 [1,1,0,0,0,0|2,0,0]=4 2543 B13R2.328 Cc1cc2ccccc2c(F)c1 Amb25204458 [1,1,0,0,0,0|2,0,0]=4 2544 B13R2.328 Cc1cc2ccccc2c(N)c1 Amb18644932 [1,1,0,0,0,0|2,0,0]=4 2545 B13R2.328 Cc1cc2ccccc2c(O)c1 Amb18645049 [1,1,0,0,0,0|2,0,0]=4 2546 B13R2.328 Clc1cc(Br)[n]c2ccccc21 Amb22263015 [1,1,0,0,0,0|2,0,0]=4 2547 B13R2.328 Clc1cc(Br)c2ccccc2[n]1 Amb25150013 [1,1,0,0,0,0|2,0,0]=4 2548 B13R2.328 Clc1cc(Br)cc2ccccc21 Amb22641869 [1,1,0,0,0,0|2,0,0]=4 2549 B13R2.328 Clc1cc(C)c2c(n1)cccc2 Amb1351694 [1,1,0,0,0,0|2,0,0]=4 2550 B13R2.328 Clc1cc(I)[n]c2ccccc21 Amb25232256 [1,1,0,0,0,0|2,0,0]=4 2551 B13R2.328 Clc1cc(I)cc2ccccc21 Amb25217612 [1,1,0,0,0,0|2,0,0]=4 2552 B13R2.328 Clc1cc2ccccc2c(I)c1 Amb24718958 [1,1,0,0,0,0|2,0,0]=4 2553 B13R2.328 Clc1cc2ccccc2c(c1)N Amb17594522 [1,1,0,0,0,0|2,0,0]=4 2554 B13R2.328 Clc1cc2ccccc2c(c1)O Amb17594569 [1,1,0,0,0,0|2,0,0]=4 2555 B13R2.328 Fc1cc(Br)[n]c2ccccc21 Amb24483726 [1,1,0,0,0,0|2,0,0]=4 2556 B13R2.328 Fc1cc(Cl)[n]c2ccccc21 Amb24064934 [1,1,0,0,0,0|2,0,0]=4 2557 B13R2.328 Fc1cc(I)cc2ccccc21 Amb22547559 [1,1,0,0,0,0|2,0,0]=4 2558 B13R2.328 Fc1cc2ccccc2c(Cl)c1 Amb25121500 [1,1,0,0,0,0|2,0,0]=4 2559 B13R2.328 Ic1cc2ccccc2c(I)c1 Amb25848812 [1,1,0,0,0,0|2,0,0]=4 2560 B13R2.328 N=C1NC(=O)Cc2ccccc21 Amb25309609 [1,1,0,0,0,0|2,0,0]=4 2561 B13R2.328 NC1=CC(=O)N=C2C=CC=CN21 Amb18645474 [1,1,0,0,0,0|2,0,0]=4 2562 B13R2.328 NC1=CC(=O)Nc2ccccc21 Amb18645325 [1,1,0,0,0,0|1,0,0]=3 2563 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [1,1,0,0,0,0|0,0,0]=2 2564 B13R2.328 NC1=CC(=O)c2c[n]ccc2O1 Amb25783927 [1,1,0,0,0,0|2,0,0]=4 2565 B13R2.328 NC1=CC(=O)c2ccc[n]c2O1 Amb18048480 [1,1,0,0,0,0|2,0,0]=4 2566 B13R2.328 NC1=CC(=O)c2ccccc2N1 Amb21856421 [1,1,0,0,0,0|2,0,0]=4 2567 B13R2.328 NC1=CC(=O)c2ccccc2O1 Amb19870090 [1,1,0,0,0,0|1,0,0]=3 2568 B13R2.328 NC1=CC(=O)c2ccccc2S1 Amb25097114 [1,1,0,0,0,0|1,1,0]=4 2569 B13R2.328 NC1=NC(=O)Oc2ccccc21 Amb25751273 [1,1,0,0,0,0|1,0,0]=3 2570 B13R2.328 NC1CC(=O)Oc2ccccc21 Amb25249264 [1,1,0,0,0,0|0,0,2]=4 2571 B13R2.328 NC=1NC(=O)C=C2C=CC=CC21 Amb24511574 [1,1,0,0,0,0|2,0,0]=4 2572 B13R2.328 NC=1NC(=O)N=C2C=CC=CC21 Amb22015224 [1,1,0,0,0,0|2,0,0]=4 2573 B13R2.328 Nc1cc(Br)[n]c2ccccc21 Amb20248088 [1,1,0,0,0,0|2,0,0]=4 2574 B13R2.328 Nc1cc(Br)c2c(n1)cccc2 Amb10070902 [1,1,0,0,0,0|2,0,0]=4 2575 B13R2.328 Nc1cc(C)c2c(n1)cccc2 Amb1994857 [1,1,0,0,0,0|2,0,0]=4 2576 B13R2.328 Nc1cc(C)c2c(n1)cccc2 Amb1994874 [1,1,0,0,0,0|2,0,0]=4 2577 B13R2.328 Nc1cc(Cl)[n]c2ccccc21 Amb18648199 [1,1,0,0,0,0|2,0,0]=4 2578 B13R2.328 Nc1cc(Cl)[n]c2ccccc21 Amb22275993 [1,1,0,0,0,0|2,0,0]=4 2579 B13R2.328 Nc1cc(Cl)c2ccccc2[n]1 Amb18648192 [1,1,0,0,0,0|2,0,0]=4 2580 B13R2.328 Nc1cc(F)c2ccccc2[n]1 Amb25760167 [1,1,0,0,0,0|2,0,0]=4 2581 B13R2.328 Nc1cc(O)cc2[n]cccc21 Amb25709274 [1,1,0,0,0,0|2,0,0]=4 2582 B13R2.328 Nc1cc(O)cc2ccccc21 Amb18048469 [1,1,0,0,0,0|1,0,0]=3 2583 B13R2.328 Nc1cc2ccccc2c(F)c1 Amb22497546 [1,1,0,0,0,0|2,0,0]=4 2584 B13R2.328 Nc1cc2ccccc2c(c1)Br Amb17596046 [1,1,0,0,0,0|2,0,0]=4 2585 B13R2.328 Nc1cc2ccccc2c(c1)Cl Amb17594518 [1,1,0,0,0,0|2,0,0]=4 2586 B13R2.328 Nc1cc2ccccc2c(c1)N Amb17593963 [1,1,0,0,0,0|2,0,0]=4 2587 B13R2.328 Nc1cc2ccccc2c(c1)O Amb17593981 [1,1,0,0,0,0|2,0,0]=4 2588 B13R2.328 O=C1C=C(Br)c2ccccc2N1 Amb21520307 [1,1,0,0,0,0|1,0,0]=3 2589 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [1,1,0,0,0,0|0,0,0]=2 2590 B13R2.328 O=C1C=C(Cl)Nc2ccccc21 Amb22500808 [1,1,0,0,0,0|2,0,0]=4 2591 B13R2.328 O=C1C=C(Cl)c2ccc[n]c2N1 Amb22753696 [1,1,0,0,0,0|2,0,0]=4 2592 B13R2.328 O=C1C=C(Cl)c2ccccc2N1 Amb19516664 [1,1,0,0,0,0|1,0,0]=3 2593 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [1,1,0,0,0,0|0,0,0]=2 2594 B13R2.328 O=C1C=C(Cl)c2ccccc2S1 Amb20663397 [1,1,0,0,0,0|0,1,0]=3 2595 B13R2.328 O=C1C=C(F)c2ccccc2O1 Amb24553071 [1,1,0,0,0,0|0,0,0]=2 2596 B13R2.328 O=C1C=C(S)Nc2ccccc21 Amb25197872 [1,1,0,0,0,0|1,1,0]=4 2597 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [1,1,0,0,0,0|0,0,0]=2 2598 B13R2.328 O=C1C=C2C=CC=CC2=C(Cl)N1 Amb25364291 [1,1,0,0,0,0|2,0,0]=4 2599 B13R2.328 O=C1CC(=O)Nc2ccccc12 Amb22263121 [1,1,0,0,0,0|1,0,1]=4 2600 B13R2.328 O=C1CC(=O)Oc2ccccc12 Amb19748567 [1,1,0,0,0,0|0,0,1]=3 2601 B13R2.328 O=C1CC(=O)Sc2ccccc12 Amb24633520 [1,1,0,0,0,0|0,1,1]=4 2602 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [1,1,0,0,0,0|2,0,0]=4 2603 B13R2.328 O=C1NC(=O)Oc2c[n]ccc12 Amb24367257 [1,1,0,0,0,0|2,0,0]=4 2604 B13R2.328 O=C1NC(=O)Oc2ccccc12 Amb20243206 [1,1,0,0,0,0|1,0,0]=3 2605 B13R2.328 O=C1NC(=O)Sc2ccccc12 Amb22036855 [1,1,0,0,0,0|1,1,0]=4 2606 B13R2.328 O=C1NC(=O)c2c(C1)cccc2 Amb1221580 [1,1,0,0,0,0|2,0,0]=4 2607 B13R2.328 O=C1NC(=S)c2ccccc2S1 Amb24341894 [1,1,0,0,0,0|1,1,0]=4 2608 B13R2.328 O=C1Nc2ccccc2C(=O)N1 Amb18005794 [1,1,0,0,0,0|2,0,0]=4 2609 B13R2.328 O=C1Nc2ccccc2C(Cl)=N1 Amb22371858 [1,1,0,0,0,0|2,0,0]=4 2610 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [1,1,0,0,0,0|2,0,0]=4 2611 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [1,1,0,0,0,0|2,0,0]=4 2612 B13R2.328 O=c1[nH]c(=O)oc2ccc[n]c12 Amb24065646 [1,1,0,0,0,0|2,0,0]=4 2613 B13R2.328 O=c1[nH]c2ccccc2c(=O)[nH]1 Amb1157217 [1,1,0,0,0,0|2,0,0]=4 2614 B13R2.328 O=c1[s]c(=O)[nH]c2ccccc12 Amb24065644 [1,1,0,0,0,0|2,0,0]=4 2615 B13R2.328 O=c1cc(N)c2c(o1)cccc2 Amb2388638 [1,1,0,0,0,0|0,0,0]=2 2616 B13R2.328 O=c1cc(O)c2c([nH]1)cccc2 Amb1146861 [1,1,0,0,0,0|1,0,0]=3 2617 B13R2.328 O=c1cc(O)c2c([nH]1)nccc2 Amb2388686 [1,1,0,0,0,0|2,0,0]=4 2618 B13R2.328 O=c1cc(O)c2c(o1)cccc2 Amb1151858 [1,1,0,0,0,0|0,0,0]=2 2619 B13R2.328 O=c1nc(O)c2c(s1)cccc2 Amb2502845 [1,1,0,0,0,0|1,1,0]=4 2620 B13R2.328 OC1=CC(=O)N=C2C=CC=CN21 Amb19932151 [1,1,0,0,0,0|2,0,0]=4 2621 B13R2.328 OC1=CC(=O)Nc2[n]cccc21 Amb20662029 [1,1,0,0,0,0|2,0,0]=4 2622 B13R2.328 OC1=CC(=O)Nc2c[n]ccc21 Amb22494124 [1,1,0,0,0,0|2,0,0]=4 2623 B13R2.328 OC1=CC(=O)Nc2ccc[n]c21 Amb22372203 [1,1,0,0,0,0|2,0,0]=4 2624 B13R2.328 OC1=CC(=O)Nc2ccccc21 Amb18002636 [1,1,0,0,0,0|1,0,0]=3 2625 B13R2.328 OC1=CC(=O)Oc2ccccc21 Amb18372000 [1,1,0,0,0,0|0,0,0]=2 2626 B13R2.328 OC1=CC(=O)Sc2ccccc21 Amb19517275 [1,1,0,0,0,0|0,1,0]=3 2627 B13R2.328 OC1=CC(=S)Oc2ccccc21 Amb24572900 [1,1,0,0,0,0|0,1,0]=3 2628 B13R2.328 OC1=CC(O)Oc2ccccc12 Amb24474149 [1,1,0,0,0,0|0,0,2]=4 2629 B13R2.328 OC1=NC(=O)Sc2ccccc21 Amb20651211 [1,1,0,0,0,0|1,1,0]=4 2630 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [1,1,0,0,0,0|1,0,1]=4 2631 B13R2.328 OC=1Cc2ccccc2C(=O)C1 Amb24060177 [1,1,0,0,0,0|1,0,1]=4 2632 B13R2.328 Oc1c[n+]([O-])c2c(n1)cccc2 Amb17594025 [1,1,0,0,0,0|2,0,0]=4 2633 B13R2.328 Oc1cc(=O)oc2ccccc21 Amb24078542 [1,1,0,0,0,0|0,0,0]=2 2634 B13R2.328 Oc1cc(Br)[n]c2ccccc21 Amb22500448 [1,1,0,0,0,0|2,0,0]=4 2635 B13R2.328 Oc1cc(Cl)[n]c2ccccc21 Amb19957815 [1,1,0,0,0,0|2,0,0]=4 2636 B13R2.328 Oc1cc(Cl)c2ccc[n]c2c1 Amb24417802 [1,1,0,0,0,0|2,0,0]=4 2637 B13R2.328 Oc1cc(I)[n]c2ccccc21 Amb25148687 [1,1,0,0,0,0|2,0,0]=4 2638 B13R2.328 Oc1cc(I)c2ccc[n]c2c1 Amb25729835 [1,1,0,0,0,0|2,0,0]=4 2639 B13R2.328 Oc1cc(I)c2ccccc2[n]1 Amb25148736 [1,1,0,0,0,0|1,0,1]=4 2640 B13R2.328 Oc1cc(O)c2c(n1)cccc2 Amb1104174 [1,1,0,0,0,0|1,0,1]=4 2641 B13R2.328 Oc1cc2[n]cccc2c(O)c1 Amb24484214 [1,1,0,0,0,0|2,0,0]=4 2642 B13R2.328 Oc1cc2cc[n]cc2c(O)c1 Amb24497362 [1,1,0,0,0,0|2,0,0]=4 2643 B13R2.328 Oc1cc2ccc[n]c2c(Br)c1 Amb22752323 [1,1,0,0,0,0|2,0,0]=4 2644 B13R2.328 Oc1cc2ccc[n]c2c(F)c1 Amb23437326 [1,1,0,0,0,0|2,0,0]=4 2645 B13R2.328 Oc1cc2ccc[n]c2c(I)c1 Amb23437340 [1,1,0,0,0,0|2,0,0]=4 2646 B13R2.328 Oc1cc2ccccc2[n+](c1)C Amb10553826 [1,1,0,0,0,0|1,0,0]=3 2647 B13R2.328 Oc1cc2ccccc2c(c1)Br Amb17596081 [1,1,0,0,0,0|1,0,0]=3 2648 B13R2.328 S=C1NC(=S)Oc2ccccc12 Amb24680256 [1,1,0,0,0,0|1,1,0]=4 2649 B13R2.328 S=c1cc(C)c2c([nH]1)cccc2 Amb2468572 [1,1,0,0,0,0|1,1,0]=4 2650 B13R2.328 Sc1cc(C)c2c(n1)cccc2 Amb1104121 [1,1,0,0,0,0|1,1,0]=4 2651 B13R2.328 [NH-][n+]1cc(Br)cc2ccccc12 Amb24110830 [1,1,0,0,0,0|2,0,0]=4 2652 B13R2.328 [O-]C1=CC(=O)Nc2cccc[n+]21 Amb20415253 [1,1,0,0,0,0|2,0,0]=4 2653 B13R2.328 [O-]C1=CC(=O)Nc2ccccc21 Amb22731733 [1,1,0,0,0,0|1,0,0]=3 2654 B13R2.328 [O-]c1cc(O)[n]c2ccccc21 Amb22336461 [1,1,0,0,0,0|1,0,1]=4 2655 B13R2.328 [O-]c1cc2ccccc2[n+](c1)C Amb10553820 [1,1,0,0,0,0|1,0,1]=4 2656 B13R2.3683 Brc1cc2ccc(Br)[n]c2cc1 Amb22263970 [1,1,0,0,0,0|2,0,0]=4 2657 B13R2.3683 Brc1cc2ccc(Br)cc2[n]c1 Amb22495197 [1,1,0,0,0,0|2,0,0]=4 2658 B13R2.3683 Brc1cc2ccc(I)cc2cc1 Amb21858593 [1,1,0,0,0,0|2,0,0]=4 2659 B13R2.3683 Brc1ccc2c(c1)ccc(n2)N Amb1994325 [1,1,0,0,0,0|2,0,0]=4 2660 B13R2.3683 Brc1ccc2c(c1)ccc(n2)O Amb1994326 [1,1,0,0,0,0|1,0,1]=4 2661 B13R2.3683 Brc1ccc2c(c1)cnc(=O)[nH]2 Amb10603001 [1,1,0,0,0,0|2,0,0]=4 2662 B13R2.3683 Brc1ccc2c(c1)cnc(c2)O Amb16185814 [1,1,0,0,0,0|2,0,0]=4 2663 B13R2.3683 Brc1ccc2c(c1)ncc(c2)N Amb17621718 [1,1,0,0,0,0|2,0,0]=4 2664 B13R2.3683 Brc1ccc2cc(I)ccc2[n]1 Amb24497539 [1,1,0,0,0,0|2,0,0]=4 2665 B13R2.3683 CC1C=Cc2c(O1)ccc(c2)O Amb2221141 [1,1,0,0,0,0|1,0,1]=4 2666 B13R2.3683 Cc1cc2C=CC(=O)Nc2[n]c1 Amb24379463 [1,1,0,0,0,0|2,0,0]=4 2667 B13R2.3683 Cc1cc2C=CC(=O)Nc2cc1 Amb18546035 [1,1,0,0,0,0|1,0,0]=3 2668 B13R2.3683 Cc1cc2C=CC(=O)Oc2cc1 Amb18511482 [1,1,0,0,0,0|0,0,0]=2 2669 B13R2.3683 Cc1cc2C=CC(=O)Sc2cc1 Amb24084308 [1,1,0,0,0,0|0,1,0]=3 2670 B13R2.3683 Cc1cc2C=CC(=S)Sc2cc1 Amb24084309 [1,1,0,0,0,0|0,2,0]=4 2671 B13R2.3683 Cc1cc2C=NC(=O)Nc2cc1 Amb24741810 [1,1,0,0,0,0|2,0,0]=4 2672 B13R2.3683 Cc1cc2CCC(=O)Oc2cc1 Amb21928518 [1,1,0,0,0,0|0,0,2]=4 2673 B13R2.3683 Cc1cc2[n]cc(Cl)cc2cc1 Amb25794087 [1,1,0,0,0,0|2,0,0]=4 2674 B13R2.3683 Cc1cc2[n]cc(N)cc2cc1 Amb20239508 [1,1,0,0,0,0|2,0,0]=4 2675 B13R2.3683 Cc1cc2[n]cc(N)cc2cc1 Amb25233126 [1,1,0,0,0,0|2,0,0]=4 2676 B13R2.3683 Cc1cc2[n]cc(O)cc2cc1 Amb24407164 [1,1,0,0,0,0|1,0,0]=3 2677 B13R2.3683 Cc1cc2[n]cc(S)cc2cc1 Amb25369519 [1,1,0,0,0,0|1,1,0]=4 2678 B13R2.3683 Cc1cc2ccc(Br)cc2[n]c1 Amb24368689 [1,1,0,0,0,0|2,0,0]=4 2679 B13R2.3683 Cc1cc2ccc(Br)cc2cc1 Amb24065421 [1,1,0,0,0,0|2,0,0]=4 2680 B13R2.3683 Cc1cc2ccc(Cl)cc2[n]c1 Amb22007945 [1,1,0,0,0,0|2,0,0]=4 2681 B13R2.3683 Cc1cc2ccc(F)cc2[n]c1 Amb24358980 [1,1,0,0,0,0|2,0,0]=4 2682 B13R2.3683 Cc1cc2ccc(N)cc2cc1 Amb22490950 [1,1,0,0,0,0|2,0,0]=4 2683 B13R2.3683 Cc1cc2ccc(O)cc2[n]c1 Amb25046100 [1,1,0,0,0,0|2,0,0]=4 2684 B13R2.3683 Cc1cc2ccc(O)cc2c[n]1 Amb18645159 [1,1,0,0,0,0|2,0,0]=4 2685 B13R2.3683 Cc1cc2ccc(O)cc2cc1 Amb21964548 [1,1,0,0,0,0|1,0,0]=3 2686 B13R2.3683 Cc1cc2ccc(S)[n]c2cc1 Amb23536152 [1,1,0,0,0,0|1,1,0]=4 2687 B13R2.3683 Cc1ccc2OC(=O)C=Cc2[n]1 Amb24373042 [1,1,0,0,0,0|1,0,0]=3 2688 B13R2.3683 Cc1ccc2OC(=O)NCc2c1 Amb24417945 [1,1,0,0,0,0|1,0,1]=4 2689 B13R2.3683 Cc1ccc2c(c1)ccc(n2)C Amb1152516 [1,1,0,0,0,0|2,0,0]=4 2690 B13R2.3683 Cc1ccc2c(c1)ncc(n2)O Amb10068722 [1,1,0,0,0,0|2,0,0]=4 2691 B13R2.3683 Cc1ccc2cc(N)ccc2[n]1 Amb24084889 [1,1,0,0,0,0|2,0,0]=4 2692 B13R2.3683 Cc1cnc2c(c1)ccc(c2)C Amb17334417 [1,1,0,0,0,0|2,0,0]=4 2693 B13R2.3683 Clc1cc2[n]cc(Br)cc2cc1 Amb21856471 [1,1,0,0,0,0|2,0,0]=4 2694 B13R2.3683 Clc1cc2ccc(Br)[n]c2cc1 Amb22494045 [1,1,0,0,0,0|2,0,0]=4 2695 B13R2.3683 Clc1cc2ccc(Br)cc2[n]c1 Amb21858959 [1,1,0,0,0,0|2,0,0]=4 2696 B13R2.3683 Clc1cc2ccc(Br)cc2cc1 Amb22054542 [1,1,0,0,0,0|2,0,0]=4 2697 B13R2.3683 Clc1cc2ccc(Cl)cc2[n]c1 Amb22055067 [1,1,0,0,0,0|2,0,0]=4 2698 B13R2.3683 Clc1cc2ccc(I)cc2cc1 Amb24594378 [1,1,0,0,0,0|2,0,0]=4 2699 B13R2.3683 Clc1ccc2c(c1)ccc(n2)O Amb13883523 [1,1,0,0,0,0|1,0,1]=4 2700 B13R2.3683 Fc1cc2[n]cc(Br)cc2cc1 Amb22899304 [1,1,0,0,0,0|2,0,0]=4 2701 B13R2.3683 Fc1cc2[n]cc(I)cc2cc1 Amb24183792 [1,1,0,0,0,0|2,0,0]=4 2702 B13R2.3683 Fc1cc2ccc(Br)[n]c2cc1 Amb23448576 [1,1,0,0,0,0|2,0,0]=4 2703 B13R2.3683 Fc1cc2ccc(Br)cc2[n]c1 Amb22899360 [1,1,0,0,0,0|2,0,0]=4 2704 B13R2.3683 Fc1cc2ccc(Cl)[n]c2cc1 Amb20171071 [1,1,0,0,0,0|2,0,0]=4 2705 B13R2.3683 Fc1cc2ccc(Cl)cc2cc1 Amb24707840 [1,1,0,0,0,0|2,0,0]=4 2706 B13R2.3683 Fc1cc2ccc(I)cc2cc1 Amb24743550 [1,1,0,0,0,0|2,0,0]=4 2707 B13R2.3683 Fc1cc2ccc(S)[n]c2cc1 Amb23536133 [1,1,0,0,0,0|1,1,0]=4 2708 B13R2.3683 Fc1ccc2c(c1)ccc(c2)Br Amb16231048 [1,1,0,0,0,0|2,0,0]=4 2709 B13R2.3683 Fc1ccc2c(c1)ncc(c2)N Amb17621722 [1,1,0,0,0,0|2,0,0]=4 2710 B13R2.3683 Ic1cc2ccc(I)cc2cc1 Amb25148656 [1,1,0,0,0,0|2,0,0]=4 2711 B13R2.3683 Ic1ccc2c(c1)ccc(n2)C Amb17586361 [1,1,0,0,0,0|2,0,0]=4 2712 B13R2.3683 Nc1cc2C=CC(=O)Nc2cc1 Amb18545101 [1,1,0,0,0,0|1,0,0]=3 2713 B13R2.3683 Nc1cc2C=CC(=O)Oc2cc1 Amb18943698 [1,1,0,0,0,0|0,0,0]=2 2714 B13R2.3683 Nc1cc2C=CC(=O)Oc2cc1 Amb22732663 [1,1,0,0,0,0|0,0,0]=2 2715 B13R2.3683 Nc1cc2C=CC(=O)Sc2cc1 Amb18825000 [1,1,0,0,0,0|0,1,0]=3 2716 B13R2.3683 Nc1cc2CCC(=O)Oc2cc1 Amb25114635 [1,1,0,0,0,0|0,0,2]=4 2717 B13R2.3683 Nc1cc2N=CC(=O)Nc2cc1 Amb22233899 [1,1,0,0,0,0|2,0,0]=4 2718 B13R2.3683 Nc1cc2NCC(=O)Oc2cc1 Amb25150883 [1,1,0,0,0,0|1,0,1]=4 2719 B13R2.3683 Nc1cc2[n]cc(Br)cc2cc1 Amb22899267 [1,1,0,0,0,0|2,0,0]=4 2720 B13R2.3683 Nc1cc2[n]cc(Cl)cc2cc1 Amb22899380 [1,1,0,0,0,0|2,0,0]=4 2721 B13R2.3683 Nc1cc2[n]cc(F)cc2cc1 Amb22899379 [1,1,0,0,0,0|2,0,0]=4 2722 B13R2.3683 Nc1cc2[n]cc(O)cc2cc1 Amb22899407 [1,1,0,0,0,0|1,0,0]=3 2723 B13R2.3683 Nc1cc2c[n]c(O)cc2cc1 Amb22735997 [1,1,0,0,0,0|2,0,0]=4 2724 B13R2.3683 Nc1cc2ccc(Br)[n]c2cc1 Amb23412018 [1,1,0,0,0,0|2,0,0]=4 2725 B13R2.3683 Nc1cc2ccc(Br)cc2[n]c1 Amb22235016 [1,1,0,0,0,0|2,0,0]=4 2726 B13R2.3683 Nc1cc2ccc(Br)cc2cc1 Amb22234013 [1,1,0,0,0,0|2,0,0]=4 2727 B13R2.3683 Nc1cc2ccc(Cl)[n]c2cc1 Amb21963603 [1,1,0,0,0,0|2,0,0]=4 2728 B13R2.3683 Nc1cc2ccc(Cl)cc2[n]c1 Amb19889367 [1,1,0,0,0,0|2,0,0]=4 2729 B13R2.3683 Nc1cc2ccc(F)cc2[n]c1 Amb22899303 [1,1,0,0,0,0|2,0,0]=4 2730 B13R2.3683 Nc1cc2ccc(F)cc2cc1 Amb22234014 [1,1,0,0,0,0|2,0,0]=4 2731 B13R2.3683 Nc1cc2ccc(I)cc2cc1 Amb25309310 [1,1,0,0,0,0|2,0,0]=4 2732 B13R2.3683 Nc1cc2ccc(O)cc2c[n]1 Amb24085843 [1,1,0,0,0,0|2,0,0]=4 2733 B13R2.3683 Nc1cc2ccc(S)cc2cc1 Amb18647917 [1,1,0,0,0,0|1,1,0]=4 2734 B13R2.3683 Nc1ccc2OC(=O)OCc2c1 Amb25222777 [1,1,0,0,0,0|1,0,1]=4 2735 B13R2.3683 Nc1ccc2c(c1)OCC(=N2)O Amb10238293 [1,1,0,0,0,0|1,0,1]=4 2736 B13R2.3683 Nc1ccc2c(c1)ccc(c2)Br Amb1348322 [1,1,0,0,0,0|2,0,0]=4 2737 B13R2.3683 Nc1ccc2c(c1)ccc(c2)Cl Amb17594516 [1,1,0,0,0,0|2,0,0]=4 2738 B13R2.3683 Nc1ccc2c(c1)ccc(n2)C Amb1034891 [1,1,0,0,0,0|2,0,0]=4 2739 B13R2.3683 Nc1ccc2cc(I)ccc2[n]1 Amb25255122 [1,1,0,0,0,0|2,0,0]=4 2740 B13R2.3683 Nc1ccc2cc(N)ccc2c1 Amb17843067 [1,1,0,0,0,0|2,0,0]=4 2741 B13R2.3683 Nc1ccc2cc(O)ccc2[n]1 Amb24106193 [1,1,0,0,0,0|2,0,0]=4 2742 B13R2.3683 Nc1ccc2cc(O)ccc2c1 Amb17843066 [1,1,0,0,0,0|1,0,0]=3 2743 B13R2.3683 O=C1C=C2C=CC(=O)NC2=CN1 Amb25725975 [1,1,0,0,0,0|2,0,0]=4 2744 B13R2.3683 O=C1C=C2C=CC(Cl)=CC2=CN1 Amb22491672 [1,1,0,0,0,0|2,0,0]=4 2745 B13R2.3683 O=C1C=CC2=CC(=O)C=CC2=C1 Amb17778320 [1,1,0,0,0,0|1,0,0]=3 2746 B13R2.3683 O=C1C=Cc2[n]c(Cl)ccc2N1 Amb24717025 [1,1,0,0,0,0|2,0,0]=4 2747 B13R2.3683 O=C1C=Cc2cc(Br)c[n]c2N1 Amb19664780 [1,1,0,0,0,0|2,0,0]=4 2748 B13R2.3683 O=C1C=Cc2cc(Br)ccc2N1 Amb17933294 [1,1,0,0,0,0|1,0,0]=3 2749 B13R2.3683 O=C1C=Cc2cc(Br)ccc2O1 Amb19957650 [1,1,0,0,0,0|0,0,0]=2 2750 B13R2.3683 O=C1C=Cc2cc(Cl)[n]cc2N1 Amb22002290 [1,1,0,0,0,0|2,0,0]=4 2751 B13R2.3683 O=C1C=Cc2cc(Cl)c[n]c2N1 Amb19959273 [1,1,0,0,0,0|2,0,0]=4 2752 B13R2.3683 O=C1C=Cc2cc(Cl)ccc2N1 Amb18044542 [1,1,0,0,0,0|1,0,0]=3 2753 B13R2.3683 O=C1C=Cc2cc(Cl)ccc2O1 Amb21995657 [1,1,0,0,0,0|0,0,0]=2 2754 B13R2.3683 O=C1C=Cc2cc(F)ccc2N1 Amb17933800 [1,1,0,0,0,0|1,0,0]=3 2755 B13R2.3683 O=C1C=Cc2cc(S)ccc2O1 Amb25096220 [1,1,0,0,0,0|0,0,0]=2 2756 B13R2.3683 O=C1C=Nc2cc(Br)ccc2N1 Amb20241318 [1,1,0,0,0,0|2,0,0]=4 2757 B13R2.3683 O=C1C=Nc2cc(Cl)ccc2N1 Amb19957505 [1,1,0,0,0,0|2,0,0]=4 2758 B13R2.3683 O=C1C=Nc2cc(F)ccc2N1 Amb19957557 [1,1,0,0,0,0|2,0,0]=4 2759 B13R2.3683 O=C1CCc2c(O1)ccc(c2)Br Amb10603027 [1,1,0,0,0,0|0,0,2]=4 2760 B13R2.3683 O=C1CCc2cc(Cl)ccc2O1 Amb24071938 [1,1,0,0,0,0|0,0,2]=4 2761 B13R2.3683 O=C1CNc2cc(Cl)ccc2O1 Amb25323925 [1,1,0,0,0,0|1,0,1]=4 2762 B13R2.3683 O=C1NCc2cc(Br)ccc2O1 Amb21858217 [1,1,0,0,0,0|1,0,1]=4 2763 B13R2.3683 O=C1NCc2cc(Cl)ccc2O1 Amb24084254 [1,1,0,0,0,0|1,0,1]=4 2764 B13R2.3683 O=C1NCc2cc(F)ccc2O1 Amb25195069 [1,1,0,0,0,0|1,0,1]=4 2765 B13R2.3683 O=C1Nc2ccc(Br)cc2C=N1 Amb21858215 [1,1,0,0,0,0|2,0,0]=4 2766 B13R2.3683 OC1C=Cc2cc(F)ccc2O1 Amb24363573 [1,1,0,0,0,0|0,0,2]=4 2767 B13R2.3683 Oc1c[n]c2cc(Br)ccc2[n]1 Amb18659002 [1,1,0,0,0,0|2,0,0]=4 2768 B13R2.3683 Oc1c[n]c2cc(I)ccc2[n]1 Amb24358798 [1,1,0,0,0,0|2,0,0]=4 2769 B13R2.3683 Oc1cc2C=CC(=O)Nc2cc1 Amb18645437 [1,1,0,0,0,0|1,0,0]=3 2770 B13R2.3683 Oc1cc2C=CC(=O)Oc2cc1 Amb18511478 [1,1,0,0,0,0|0,0,0]=2 2771 B13R2.3683 Oc1cc2CCC(=O)Oc2cc1 Amb24097420 [1,1,0,0,0,0|0,0,2]=4 2772 B13R2.3683 Oc1cc2NCC(=O)Oc2cc1 Amb25249393 [1,1,0,0,0,0|1,0,1]=4 2773 B13R2.3683 Oc1cc2[n]cc(Br)cc2cc1 Amb22491312 [1,1,0,0,0,0|2,0,0]=4 2774 B13R2.3683 Oc1cc2[n]cc(Cl)cc2cc1 Amb22494665 [1,1,0,0,0,0|2,0,0]=4 2775 B13R2.3683 Oc1cc2[n]cc(F)cc2cc1 Amb24102179 [1,1,0,0,0,0|2,0,0]=4 2776 B13R2.3683 Oc1cc2[n]cc(I)cc2cc1 Amb22494874 [1,1,0,0,0,0|2,0,0]=4 2777 B13R2.3683 Oc1cc2[n]cc(O)[n]c2cc1 Amb18645590 [1,1,0,0,0,0|2,0,0]=4 2778 B13R2.3683 Oc1cc2c[n]c(Cl)cc2cc1 Amb22735857 [1,1,0,0,0,0|2,0,0]=4 2779 B13R2.3683 Oc1cc2c[n]c(O)cc2cc1 Amb25158215 [1,1,0,0,0,0|2,0,0]=4 2780 B13R2.3683 Oc1cc2ccc(Br)[n]c2cc1 Amb22501097 [1,1,0,0,0,0|2,0,0]=4 2781 B13R2.3683 Oc1cc2ccc(Br)cc2[n][n]1 Amb22499432 [1,1,0,0,0,0|2,0,0]=4 2782 B13R2.3683 Oc1cc2ccc(Br)cc2[n]c1 Amb22494957 [1,1,0,0,0,0|1,0,0]=3 2783 B13R2.3683 Oc1cc2ccc(Cl)[n]c2cc1 Amb21856139 [1,1,0,0,0,0|2,0,0]=4 2784 B13R2.3683 Oc1cc2ccc(Cl)[n]c2cc1 Amb22501096 [1,1,0,0,0,0|2,0,0]=4 2785 B13R2.3683 Oc1cc2ccc(Cl)cc2[n]c1 Amb24183780 [1,1,0,0,0,0|1,0,0]=3 2786 B13R2.3683 Oc1cc2ccc(F)cc2[n]c1 Amb24183788 [1,1,0,0,0,0|1,0,0]=3 2787 B13R2.3683 Oc1cc2ccc(F)cc2c[n]1 Amb25127158 [1,1,0,0,0,0|2,0,0]=4 2788 B13R2.3683 Oc1cc2ccc(F)cc2cc1 Amb22751763 [1,1,0,0,0,0|1,0,0]=3 2789 B13R2.3683 Oc1cc2ccc(I)cc2cc1 Amb25669689 [1,1,0,0,0,0|1,0,0]=3 2790 B13R2.3683 Oc1ccc2OC(=O)OCc2c1 Amb25228168 [1,1,0,0,0,0|1,0,1]=4 2791 B13R2.3683 Oc1ccc2c(c1)ccc(c2)Br Amb1333685 [1,1,0,0,0,0|1,0,0]=3 2792 B13R2.3683 Oc1ccc2c(c1)ccc(c2)S Amb17594487 [1,1,0,0,0,0|1,0,0]=3 2793 B13R2.3683 Oc1ccc2cc(Cl)ccc2c1 Amb17777189 [1,1,0,0,0,0|1,0,0]=3 2794 B13R2.3683 Oc1ccc2cc(I)ccc2[n]1 Amb19958372 [1,1,0,0,0,0|1,0,1]=4 2795 B13R2.3683 Sc1cc2ccc(Cl)cc2cc1 Amb20620763 [1,1,0,0,0,0|1,1,0]=4 2796 B13R2.3683 Sc1cc2ccc(S)cc2cc1 Amb21954243 [1,1,0,0,0,0|1,1,0]=4 2797 B13R2.3683 Sc1ccc2cc(Br)ccc2[n]1 Amb23536160 [1,1,0,0,0,0|1,1,0]=4 2798 B13R2.3683 Sc1ccc2cc(Cl)ccc2[n]1 Amb23536156 [1,1,0,0,0,0|1,1,0]=4 2799 B13R2.3683 [CH2+]c1ccc2cc(O)ccc2[n]1 Amb25768381 [1,1,0,0,0,0|2,0,0]=4 2800 B13R2.3683 [NH3+]c1cc2C=CC(=O)Oc2cc1 Amb24113859 [1,1,0,0,0,0|0,0,0]=2 2801 B13R2.3683 [O-][n+]1cc2C=CC(=O)Nc2cc1 Amb25268300 [1,1,0,0,0,0|2,0,0]=4 2802 B13R2.5179 Brc1cc2cccc(Br)c2cc1 Amb22899601 [1,1,0,0,0,0|2,0,0]=4 2803 B13R2.5179 Brc1cc2cccc(I)c2[n]c1 Amb22584153 [1,1,0,0,0,0|2,0,0]=4 2804 B13R2.5179 Brc1cc2cccc(I)c2cc1 Amb24696576 [1,1,0,0,0,0|2,0,0]=4 2805 B13R2.5179 Brc1ccc2c(I)cccc2[n]1 Amb23412035 [1,1,0,0,0,0|2,0,0]=4 2806 B13R2.5179 Brc1ccc2c(c1)cccc2O Amb17596077 [1,1,0,0,0,0|2,0,0]=4 2807 B13R2.5179 Brc1cccc2[n]c(Br)ccc12 Amb22371944 [1,1,0,0,0,0|2,0,0]=4 2808 B13R2.5179 Brc1cccc2cc(I)c[n]c21 Amb22170457 [1,1,0,0,0,0|2,0,0]=4 2809 B13R2.5179 CC1=CC=C2C(=S)C=CC=C2N1 Amb24357986 [1,1,0,0,0,0|2,0,0]=4 2810 B13R2.5179 CC1=CC=CC2=CC(=O)NC=C21 Amb22011731 [1,1,0,0,0,0|2,0,0]=4 2811 B13R2.5179 CC1=CC=CC2=NC(=O)C=CN21 Amb22411657 [1,1,0,0,0,0|2,0,0]=4 2812 B13R2.5179 CC1=COc2c(O1)cccc2N Amb17570074 [1,1,0,0,0,0|2,0,0]=4 2813 B13R2.5179 Cc1[n]ccc2NC(=O)C=Cc21 Amb21927041 [1,1,0,0,0,0|2,0,0]=4 2814 B13R2.5179 Cc1c[n]cc2cc(O)ccc21 Amb24497223 [1,1,0,0,0,0|2,0,0]=4 2815 B13R2.5179 Cc1cc2cccc(C)c2cc1 Amb22731155 [1,1,0,0,0,0|2,0,0]=4 2816 B13R2.5179 Cc1cc2cccc(F)c2[n]c1 Amb24611006 [1,1,0,0,0,0|2,0,0]=4 2817 B13R2.5179 Cc1cc2cccc(F)c2cc1 Amb25760151 [1,1,0,0,0,0|2,0,0]=4 2818 B13R2.5179 Cc1cc2cccc(N)c2[n]c1 Amb22899667 [1,1,0,0,0,0|2,0,0]=4 2819 B13R2.5179 Cc1cc2cccc(O)c2[n]c1 Amb22750809 [1,1,0,0,0,0|2,0,0]=4 2820 B13R2.5179 Cc1cc2cccc(O)c2cc1 Amb18559380 [1,1,0,0,0,0|2,0,0]=4 2821 B13R2.5179 Cc1cc[n]c2cc(O)ccc21 Amb18645155 [1,1,0,0,0,0|2,0,0]=4 2822 B13R2.5179 Cc1ccc2c(Br)cccc2[n]1 Amb21857879 [1,1,0,0,0,0|2,0,0]=4 2823 B13R2.5179 Cc1ccc2c(F)cccc2[n]1 Amb23448557 [1,1,0,0,0,0|2,0,0]=4 2824 B13R2.5179 Cc1ccc2c(O)cccc2[n]1 Amb18353422 [1,1,0,0,0,0|2,0,0]=4 2825 B13R2.5179 Cc1ccc2c(c1)cccc2N Amb17593939 [1,1,0,0,0,0|2,0,0]=4 2826 B13R2.5179 Cc1cccc2NC(=O)C=Cc21 Amb24103760 [1,1,0,0,0,0|1,0,0]=3 2827 B13R2.5179 Cc1cccc2OC(=O)NCc21 Amb25178458 [1,1,0,0,0,0|1,0,1]=4 2828 B13R2.5179 Cc1cccc2OC(=O)OCc21 Amb25238546 [1,1,0,0,0,0|1,0,1]=4 2829 B13R2.5179 Cc1cccc2[nH]c(=O)c[n]c21 Amb24071546 [1,1,0,0,0,0|2,0,0]=4 2830 B13R2.5179 Cc1cccc2[n]c(Br)ccc21 Amb23448578 [1,1,0,0,0,0|2,0,0]=4 2831 B13R2.5179 Cc1cccc2[n]c(C)ccc12 Amb21858709 [1,1,0,0,0,0|2,0,0]=4 2832 B13R2.5179 Cc1cccc2cc(Br)c[n]c21 Amb25152656 [1,1,0,0,0,0|2,0,0]=4 2833 B13R2.5179 Cc1cccc2cc(Cl)c[n]c21 Amb25056407 [1,1,0,0,0,0|2,0,0]=4 2834 B13R2.5179 Cc1cccc2cc(N)ccc21 Amb22751120 [1,1,0,0,0,0|2,0,0]=4 2835 B13R2.5179 Cc1cccc2cc(O)ccc21 Amb24062966 [1,1,0,0,0,0|1,0,0]=3 2836 B13R2.5179 Cc1cnc2c(c1)cccc2C Amb17334416 [1,1,0,0,0,0|2,0,0]=4 2837 B13R2.5179 Clc1cc2cccc(I)c2cc1 Amb25743943 [1,1,0,0,0,0|2,0,0]=4 2838 B13R2.5179 Clc1ccc2c(c1)cccc2N Amb17594521 [1,1,0,0,0,0|2,0,0]=4 2839 B13R2.5179 Clc1ccc2c(c1)cccc2O Amb17594571 [1,1,0,0,0,0|2,0,0]=4 2840 B13R2.5179 Clc1ccc2c(n1)cccc2Br Amb1994308 [1,1,0,0,0,0|2,0,0]=4 2841 B13R2.5179 Clc1ccc2c(n1)cccc2I Amb10601553 [1,1,0,0,0,0|2,0,0]=4 2842 B13R2.5179 Clc1cccc2[n]c(Br)ccc21 Amb23448581 [1,1,0,0,0,0|2,0,0]=4 2843 B13R2.5179 Clc1cccc2cc(Br)c[n]c21 Amb24183732 [1,1,0,0,0,0|2,0,0]=4 2844 B13R2.5179 Clc1cccc2cc(I)c[n]c21 Amb19515722 [1,1,0,0,0,0|2,0,0]=4 2845 B13R2.5179 Clc1cccc2cc(I)ccc21 Amb25148787 [1,1,0,0,0,0|2,0,0]=4 2846 B13R2.5179 Fc1cc2cccc(Br)c2[n]c1 Amb22547350 [1,1,0,0,0,0|2,0,0]=4 2847 B13R2.5179 Fc1cc2cccc(Cl)c2cc1 Amb25360850 [1,1,0,0,0,0|2,0,0]=4 2848 B13R2.5179 Fc1cc2cccc(F)c2cc1 Amb24649575 [1,1,0,0,0,0|2,0,0]=4 2849 B13R2.5179 Fc1cc2cccc(I)c2cc1 Amb25063229 [1,1,0,0,0,0|2,0,0]=4 2850 B13R2.5179 Fc1cc2cccc(S)c2[n]c1 Amb24632632 [1,1,0,0,0,0|2,0,0]=4 2851 B13R2.5179 Fc1cccc2[n]c(Br)ccc21 Amb23448580 [1,1,0,0,0,0|2,0,0]=4 2852 B13R2.5179 Fc1cccc2[n]c(Cl)ccc21 Amb23401568 [1,1,0,0,0,0|2,0,0]=4 2853 B13R2.5179 Fc1cccc2cc(Br)c[n]c21 Amb22899268 [1,1,0,0,0,0|2,0,0]=4 2854 B13R2.5179 Fc1cccc2cc(I)c[n]c21 Amb17933793 [1,1,0,0,0,0|2,0,0]=4 2855 B13R2.5179 Ic1cc2cccc(I)c2cc1 Amb24448388 [1,1,0,0,0,0|2,0,0]=4 2856 B13R2.5179 Nc1[n]ccc2cc(O)ccc21 Amb24531531 [1,1,0,0,0,0|2,0,0]=4 2857 B13R2.5179 Nc1cc2cccc(Br)c2[n]c1 Amb22494702 [1,1,0,0,0,0|2,0,0]=4 2858 B13R2.5179 Nc1cc2cccc(Cl)c2[n]c1 Amb22753383 [1,1,0,0,0,0|2,0,0]=4 2859 B13R2.5179 Nc1cc2cccc(Cl)c2[n]c1 Amb22753414 [1,1,0,0,0,0|2,0,0]=4 2860 B13R2.5179 Nc1cc2cccc(F)c2[n]c1 Amb22899402 [1,1,0,0,0,0|2,0,0]=4 2861 B13R2.5179 Nc1cc2cccc(O)c2[n]c1 Amb24557383 [1,1,0,0,0,0|2,0,0]=4 2862 B13R2.5179 Nc1cc2cccc(S)c2[n]c1 Amb24525729 [1,1,0,0,0,0|2,0,0]=4 2863 B13R2.5179 Nc1cc[n]c2cc(O)ccc21 Amb24738429 [1,1,0,0,0,0|2,0,0]=4 2864 B13R2.5179 Nc1ccc2c(Br)cccc2[n]1 Amb22751754 [1,1,0,0,0,0|2,0,0]=4 2865 B13R2.5179 Nc1ccc2c(Cl)cccc2[n]1 Amb18648194 [1,1,0,0,0,0|2,0,0]=4 2866 B13R2.5179 Nc1ccc2c(O)cccc2[n]1 Amb24485546 [1,1,0,0,0,0|2,0,0]=4 2867 B13R2.5179 Nc1ccc2c(c1)cccc2Br Amb17596045 [1,1,0,0,0,0|2,0,0]=4 2868 B13R2.5179 Nc1ccc2c(c1)cccc2Cl Amb17594517 [1,1,0,0,0,0|2,0,0]=4 2869 B13R2.5179 Nc1ccc2c(c1)cccc2N Amb17593962 [1,1,0,0,0,0|2,0,0]=4 2870 B13R2.5179 Nc1cccc2NC(=O)C=Cc21 Amb22500953 [1,1,0,0,0,0|1,0,0]=3 2871 B13R2.5179 Nc1cccc2NC(=O)C=Nc21 Amb22233900 [1,1,0,0,0,0|2,0,0]=4 2872 B13R2.5179 Nc1cccc2OC(=O)C=Cc21 Amb24626083 [1,1,0,0,0,0|0,0,0]=2 2873 B13R2.5179 Nc1cccc2OC(=O)NCc21 Amb25228064 [1,1,0,0,0,0|1,0,1]=4 2874 B13R2.5179 Nc1cccc2[n]c(Br)ccc21 Amb23412019 [1,1,0,0,0,0|2,0,0]=4 2875 B13R2.5179 Nc1cccc2[n]c(Cl)ccc21 Amb22755337 [1,1,0,0,0,0|2,0,0]=4 2876 B13R2.5179 Nc1cccc2[n]c(N)ccc12 Amb22011897 [1,1,0,0,0,0|2,0,0]=4 2877 B13R2.5179 Nc1cccc2[n]c(O)ccc21 Amb22501142 [1,1,0,0,0,0|1,0,1]=4 2878 B13R2.5179 Nc1cccc2cc(Br)c[n]c21 Amb21962760 [1,1,0,0,0,0|2,0,0]=4 2879 B13R2.5179 Nc1cccc2cc(Br)ccc21 Amb25073486 [1,1,0,0,0,0|2,0,0]=4 2880 B13R2.5179 Nc1cccc2cc(Cl)c[n]c21 Amb22584113 [1,1,0,0,0,0|2,0,0]=4 2881 B13R2.5179 Nc1cccc2cc(F)c[n]c21 Amb22899387 [1,1,0,0,0,0|2,0,0]=4 2882 B13R2.5179 Nc1cccc2cc(F)ccc21 Amb22497264 [1,1,0,0,0,0|2,0,0]=4 2883 B13R2.5179 Nc1cccc2cc(I)c[n]c21 Amb21927513 [1,1,0,0,0,0|2,0,0]=4 2884 B13R2.5179 Nc1cccc2cc(I)ccc21 Amb24410696 [1,1,0,0,0,0|2,0,0]=4 2885 B13R2.5179 Nc1cccc2cc(O)[n]cc21 Amb22735996 [1,1,0,0,0,0|2,0,0]=4 2886 B13R2.5179 Nc1cccc2cc(O)c[n]c21 Amb24183774 [1,1,0,0,0,0|1,0,0]=3 2887 B13R2.5179 Nc1cnc2c(c1)cccc2Br Amb17621719 [1,1,0,0,0,0|2,0,0]=4 2888 B13R2.5179 Nc1cnc2c(c1)cccc2C Amb17157128 [1,1,0,0,0,0|2,0,0]=4 2889 B13R2.5179 Nc1cnc2c(c1)cccc2F Amb17621723 [1,1,0,0,0,0|2,0,0]=4 2890 B13R2.5179 O=C1C=C2C=CC=C(Br)C2=CN1 Amb22371046 [1,1,0,0,0,0|2,0,0]=4 2891 B13R2.5179 O=C1C=Cc2c(Br)[n]ccc2N1 Amb22754891 [1,1,0,0,0,0|2,0,0]=4 2892 B13R2.5179 O=C1C=Cc2c(Br)cccc2N1 Amb22263039 [1,1,0,0,0,0|1,0,0]=3 2893 B13R2.5179 O=C1C=Cc2c(Br)cccc2O1 Amb24682464 [1,1,0,0,0,0|0,0,0]=2 2894 B13R2.5179 O=C1C=Cc2c(Cl)[n]ccc2N1 Amb24658274 [1,1,0,0,0,0|2,0,0]=4 2895 B13R2.5179 O=C1C=Cc2c(Cl)cccc2O1 Amb24368459 [1,1,0,0,0,0|0,0,0]=2 2896 B13R2.5179 O=C1C=Cc2c(F)cccc2O1 Amb24675426 [1,1,0,0,0,0|0,0,0]=2 2897 B13R2.5179 O=C1CCc2c(Cl)cccc2O1 Amb25130472 [1,1,0,0,0,0|0,0,2]=4 2898 B13R2.5179 O=C1Nc2cccc(Cl)c2C=N1 Amb24532716 [1,1,0,0,0,0|2,0,0]=4 2899 B13R2.5179 O=c1c[n]c2c(F)cccc2[nH]1 Amb24071365 [1,1,0,0,0,0|2,0,0]=4 2900 B13R2.5179 OC1=Nc2c(OC1)c(Cl)ccc2 Amb2451752 [1,1,0,0,0,0|1,0,1]=4 2901 B13R2.5179 Oc1c[n]c2c(Cl)cccc2[n]1 Amb22496024 [1,1,0,0,0,0|2,0,0]=4 2902 B13R2.5179 Oc1c[n]cc2NC(=O)C=Cc21 Amb18645583 [1,1,0,0,0,0|2,0,0]=4 2903 B13R2.5179 Oc1cc2C=CNC(=O)c2cc1 Amb19100709 [1,1,0,0,0,0|2,0,0]=4 2904 B13R2.5179 Oc1cc2NC=CC(=O)c2cc1 Amb19372691 [1,1,0,0,0,0|2,0,0]=4 2905 B13R2.5179 Oc1cc2OC=CC(=O)c2cc1 Amb18645572 [1,1,0,0,0,0|2,0,0]=4 2906 B13R2.5179 Oc1cc2[n]ccc(Br)c2cc1 Amb21858698 [1,1,0,0,0,0|2,0,0]=4 2907 B13R2.5179 Oc1cc2[n]ccc(Cl)c2[n]c1 Amb25084296 [1,1,0,0,0,0|2,0,0]=4 2908 B13R2.5179 Oc1cc2cccc(Br)c2[n]c1 Amb22494958 [1,1,0,0,0,0|1,0,0]=3 2909 B13R2.5179 Oc1cc2cccc(Cl)c2[n]c1 Amb24183739 [1,1,0,0,0,0|1,0,0]=3 2910 B13R2.5179 Oc1cc2cccc(Cl)c2c[n]1 Amb18648302 [1,1,0,0,0,0|2,0,0]=4 2911 B13R2.5179 Oc1cc2cccc(F)c2[n]c1 Amb22899408 [1,1,0,0,0,0|1,0,0]=3 2912 B13R2.5179 Oc1cc2cccc(F)c2c[n]1 Amb24389770 [1,1,0,0,0,0|2,0,0]=4 2913 B13R2.5179 Oc1cc2cccc(I)c2[n]c1 Amb25377058 [1,1,0,0,0,0|1,0,0]=3 2914 B13R2.5179 Oc1cc2cccc(S)c2cc1 Amb25320037 [1,1,0,0,0,0|1,0,0]=3 2915 B13R2.5179 Oc1ccc2c(Br)cccc2[n]1 Amb22371958 [1,1,0,0,0,0|1,0,1]=4 2916 B13R2.5179 Oc1ccc2c(Cl)cccc2[n]1 Amb24725156 [1,1,0,0,0,0|1,0,1]=4 2917 B13R2.5179 Oc1ccc2c(F)cccc2[n]1 Amb23448556 [1,1,0,0,0,0|1,0,1]=4 2918 B13R2.5179 Oc1ccc2c(I)cccc2[n]1 Amb23401167 [1,1,0,0,0,0|1,0,1]=4 2919 B13R2.5179 Oc1ccc2c(c1)cccc2Br Amb17596082 [1,1,0,0,0,0|1,0,0]=3 2920 B13R2.5179 Oc1ccc2c(c1)cccc2Cl Amb17594575 [1,1,0,0,0,0|1,0,0]=3 2921 B13R2.5179 Oc1ccc2c(c1)nccc2Cl Amb15692116 [1,1,0,0,0,0|2,0,0]=4 2922 B13R2.5179 Oc1ccc2c(c1)nccc2O Amb10729394 [1,1,0,0,0,0|2,0,0]=4 2923 B13R2.5179 Oc1cccc2NC(=O)C=Cc21 Amb17933814 [1,1,0,0,0,0|1,0,0]=3 2924 B13R2.5179 Oc1cccc2OC(=O)C=Cc21 Amb24118089 [1,1,0,0,0,0|0,0,0]=2 2925 B13R2.5179 Oc1cccc2OC(=O)CNc21 Amb24564667 [1,1,0,0,0,0|1,0,1]=4 2926 B13R2.5179 Oc1cccc2OC(=O)NCc21 Amb22491592 [1,1,0,0,0,0|1,0,1]=4 2927 B13R2.5179 Oc1cccc2OC(=O)OCc21 Amb24708113 [1,1,0,0,0,0|1,0,1]=4 2928 B13R2.5179 Oc1cccc2[nH]c(=O)c[n]c21 Amb24071444 [1,1,0,0,0,0|2,0,0]=4 2929 B13R2.5179 Oc1cccc2[n]c(Br)ccc21 Amb25364902 [1,1,0,0,0,0|2,0,0]=4 2930 B13R2.5179 Oc1cccc2[n]c(Cl)ccc21 Amb20171608 [1,1,0,0,0,0|2,0,0]=4 2931 B13R2.5179 Oc1cccc2cc(Br)c[n]c21 Amb22491313 [1,1,0,0,0,0|2,0,0]=4 2932 B13R2.5179 Oc1cccc2cc(Cl)c[n]c21 Amb22499642 [1,1,0,0,0,0|2,0,0]=4 2933 B13R2.5179 Oc1cccc2cc(F)c[n]c21 Amb22899348 [1,1,0,0,0,0|2,0,0]=4 2934 B13R2.5179 Oc1ncc2c(c1)cccc2Br Amb10604312 [1,1,0,0,0,0|2,0,0]=4 2935 B13R2.5179 SN1C=Cc2c(Cl)cccc2O1 Amb25148931 [1,1,0,0,0,0|1,1,0]=4 2936 B13R2.5179 Sc1ccc2c(Br)cccc2[n]1 Amb23536162 [1,1,0,0,0,0|1,1,0]=4 2937 B13R2.5179 Sc1ccc2c(Cl)cccc2[n]1 Amb23536157 [1,1,0,0,0,0|1,1,0]=4 2938 B13R2.5179 Sc1cccc2cc(Br)c[n]c21 Amb24097302 [1,1,0,0,0,0|2,0,0]=4 2939 B13R2.5179 Sc1cccc2cc(Cl)c[n]c21 Amb24553694 [1,1,0,0,0,0|2,0,0]=4 2940 B13R2.5179 [O-][n+]1cccc2cc(O)ccc12 Amb23448831 [1,1,0,0,0,0|2,0,0]=4 2941 B13R2.45 CC1=C(Cc2ccccc21)C=O Amb25276375 [0,1,0,0,1,0|2,0,0]=4 2942 B13R2.45 CCC1=Nc2ccccc2C1=O Amb24753327 [0,1,0,0,1,0|2,0,0]=4 2943 B13R2.45 CCc1[s]c2ccccc2c1O Amb24727753 [0,1,0,0,1,0|1,1,0]=4 2944 B13R2.45 CCc1oc2c(c1Br)cccc2 Amb10569511 [0,1,0,0,1,0|2,0,0]=4 2945 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,0,1,0|0,0,2]=4 2946 B13R2.45 COC1Oc2ccccc2C1=O Amb24061519 [0,1,0,0,1,0|1,0,1]=4 2947 B13R2.45 COc1oc2ccccc2c1N Amb24061875 [0,1,0,0,1,0|1,0,1]=4 2948 B13R2.45 CSC1=Nc2ccccc2C1=O Amb25136885 [0,1,0,0,1,0|1,1,0]=4 2949 B13R2.45 C[n]1c(CO)cc2ccccc12 Amb22224825 [0,1,0,0,1,0|2,0,0]=4 2950 B13R2.45 C\C=C/1\Cc2ccccc2C1=O Amb24602951 [0,1,0,0,1,0|1,0,1]=4 2951 B13R2.45 C\C=C\1/Oc2ccccc2C1=O Amb24408418 [0,1,0,0,1,0|1,0,1]=4 2952 B13R2.45 C\C=C\1/Sc2ccccc2C1=O Amb25773427 [0,1,0,0,1,0|2,0,0]=4 2953 B13R2.45 C\N=C\1/Nc2ccccc2C1=O Amb25130630 [0,1,0,0,1,0|2,0,0]=4 2954 B13R2.45 Cc1c(C=C)oc2ccccc21 Amb24102391 [0,1,0,0,1,0|2,0,0]=4 2955 B13R2.45 Cc1c(CCl)oc2ccccc21 Amb19649864 [0,1,0,0,1,0|2,0,0]=4 2956 B13R2.45 Cc1c(CO)[nH]c2ccccc21 Amb24373615 [0,1,0,0,1,0|2,0,0]=4 2957 B13R2.45 Cc1c(CO)oc2ccccc21 Amb18554026 [0,1,0,0,1,0|1,0,1]=4 2958 B13R2.45 Cc1c(cc2cccc[n]12)OC Amb25224119 [0,1,0,0,1,0|2,0,0]=4 2959 B13R2.45 Cc1c2ccccc2oc1CC Amb22233704 [0,1,0,0,1,0|2,0,0]=4 2960 B13R2.45 N#Cc1oc2c(c1C)cccc2 Amb1152069 [0,1,0,0,1,0|2,0,0]=4 2961 B13R2.45 N#Cc1oc2c(c1N)cccc2 Amb1099163 [0,1,0,0,1,0|2,0,0]=4 2962 B13R2.45 N#Cc1oc2ccccc2c1I Amb25060859 [0,1,0,0,1,0|2,0,0]=4 2963 B13R2.45 N#Cc1sc2c(c1O)cccc2 Amb2424154 [0,1,0,0,1,0|1,1,0]=4 2964 B13R2.45 NCc1oc2c(c1C)cccc2 Amb15701585 [0,1,0,0,1,0|2,0,0]=4 2965 B13R2.45 N\C=C/1\Cc2ccccc2C1=O Amb24553059 [0,1,0,0,1,0|1,0,1]=4 2966 B13R2.45 N\C=C/1\Oc2ccccc2C1=O Amb24061513 [0,1,0,0,1,0|1,0,1]=4 2967 B13R2.45 N\N=C\1/Cc2ccccc2C1=O Amb24364156 [0,1,0,0,1,0|1,0,1]=4 2968 B13R2.45 Nc1c(C=O)[s]c2ccccc21 Amb18825002 [0,1,0,0,1,0|1,1,0]=4 2969 B13R2.45 Nc1c(C=O)oc2ccccc21 Amb18830111 [0,1,0,0,1,0|1,0,0]=3 2970 B13R2.45 Nc1c(C=S)oc2ccccc21 Amb25710770 [0,1,0,0,1,0|1,1,0]=4 2971 B13R2.45 Nc1c(CO)[s]c2ccccc21 Amb23403643 [0,1,0,0,1,0|2,0,0]=4 2972 B13R2.45 Nc1c(CO)c[n]2ccccc21 Amb24488650 [0,1,0,0,1,0|2,0,0]=4 2973 B13R2.45 O=C1C(C=O)Oc2ccccc12 Amb18645580 [0,1,0,0,1,0|0,0,2]=4 2974 B13R2.45 O=C1c2ccccc2N=C1C=O Amb18645133 [0,1,0,0,1,0|1,0,1]=4 2975 B13R2.45 O=CC=1Cc2ccccc2C1Cl Amb18128299 [0,1,0,0,1,0|2,0,0]=4 2976 B13R2.45 O=Cc1[nH]c2ccccc2c1I Amb19895276 [0,1,0,0,1,0|2,0,0]=4 2977 B13R2.45 O=Cc1[s]c2ccccc2c1Br Amb18156446 [0,1,0,0,1,0|1,1,0]=4 2978 B13R2.45 O=Cc1[s]c2ccccc2c1I Amb22751335 [0,1,0,0,1,0|1,1,0]=4 2979 B13R2.45 O=Cc1oc2[n]cccc2c1Br Amb18160779 [0,1,0,0,1,0|2,0,0]=4 2980 B13R2.45 O=Cc1oc2[n]cccc2c1Cl Amb18648559 [0,1,0,0,1,0|2,0,0]=4 2981 B13R2.45 O=Cc1oc2cc[n]cc2c1Cl Amb18823882 [0,1,0,0,1,0|2,0,0]=4 2982 B13R2.45 O=Cc1oc2ccc[n]c2c1Br Amb18160777 [0,1,0,0,1,0|2,0,0]=4 2983 B13R2.45 O=Cc1oc2ccc[n]c2c1Cl Amb18648560 [0,1,0,0,1,0|2,0,0]=4 2984 B13R2.45 O=Cc1oc2ccccc2c1Br Amb18134589 [0,1,0,0,1,0|1,0,0]=3 2985 B13R2.45 OC1\C(=C\Cl)\Oc2ccccc21 Amb24588414 [0,1,0,0,1,0|1,0,1]=4 2986 B13R2.45 OCC1Cc2ccccc2C1=O Amb25205765 [0,1,0,0,1,0|0,0,2]=4 2987 B13R2.45 OCC1Oc2ccccc2C1=O Amb24061515 [0,1,0,0,1,0|1,0,1]=4 2988 B13R2.45 OCN1Sc2ccccc2C1=O Amb24554829 [0,1,0,0,1,0|2,0,0]=4 2989 B13R2.45 OCc1[nH]c2ccccc2c1Br Amb24541270 [0,1,0,0,1,0|2,0,0]=4 2990 B13R2.45 OCc1[s]c2ccccc2c1I Amb25208698 [0,1,0,0,1,0|2,0,0]=4 2991 B13R2.45 OCc1oc2ccccc2c1Br Amb24743941 [0,1,0,0,1,0|1,0,1]=4 2992 B13R2.45 OCc1sc2c(c1Cl)cccc2 Amb1157146 [0,1,0,0,1,0|2,0,0]=4 2993 B13R2.45 O[C@@H]1C(C=O)=Cc2ccccc21 Amb25086607 [0,1,0,0,1,0|1,0,1]=4 2994 B13R2.45 O[C@H]1C(C=O)=Cc2ccccc21 Amb25713566 [0,1,0,0,1,0|1,0,1]=4 2995 B13R2.45 O\C=C/1\Nc2ccccc2C1=O Amb24078912 [0,1,0,0,1,0|1,0,0]=3 2996 B13R2.45 O\C=C/1\Sc2ccccc2C1=O Amb24655534 [0,1,0,0,1,0|1,0,0]=3 2997 B13R2.45 O\C=C\1/Cc2ccccc2C1=O Amb19665720 [0,1,0,0,1,0|0,0,1]=3 2998 B13R2.45 O\C=C\1/Nc2[n]cccc2C1=O Amb25277875 [0,1,0,0,1,0|2,0,0]=4 2999 B13R2.45 O\N=C/1\Oc2ccccc2C1=O Amb24633442 [0,1,0,0,1,0|1,0,0]=3 3000 B13R2.45 O\N=C/1\Sc2ccccc2C1=O Amb25205813 [0,1,0,0,1,0|1,0,0]=3 3001 B13R2.45 O\N=C\1/Cc2ccccc2C1=O Amb22348033 [0,1,0,0,1,0|0,0,1]=3 3002 B13R2.45 O\N=C\1/Oc2ccccc2C1=O Amb25205426 [0,1,0,0,1,0|1,0,0]=3 3003 B13R2.45 O\N=C\1/Sc2ccccc2C1=O Amb24532704 [0,1,0,0,1,0|1,0,0]=3 3004 B13R2.45 Oc1c(C=O)[nH]c2ccccc21 Amb18830110 [0,1,0,0,1,0|1,0,0]=3 3005 B13R2.45 Oc1c2ccccc2oc1CO Amb25135298 [0,1,0,0,1,0|0,0,1]=3 3006 B13R2.45 [N-]=[N+]=C1Cc2c(C1=O)cccc2 Amb17593950 [0,1,0,0,1,0|1,0,1]=4 3007 B13R2.45 [O-]C=C1Cc2ccccc2C1=O Amb20669424 [0,1,0,0,1,0|0,0,2]=4 3008 B13R2.135 C=C1Oc2ccccc2C1CO Amb25806105 [0,1,0,0,1,0|1,0,1]=4 3009 B13R2.135 CC/1=Nc2ccccc2\C1=N\O Amb25751222 [0,1,0,0,1,0|2,0,0]=4 3010 B13R2.135 CCC1C(=O)Oc2ccccc21 Amb24103815 [0,1,0,0,1,0|1,0,1]=4 3011 B13R2.135 CCN1C(=O)Oc2ccccc12 Amb17992087 [0,1,0,0,1,0|2,0,0]=4 3012 B13R2.135 CCc1c(Br)oc2ccccc21 Amb18754591 [0,1,0,0,1,0|2,0,0]=4 3013 B13R2.135 COC1C(=O)Nc2ccccc21 Amb24648884 [0,1,0,0,1,0|1,0,1]=4 3014 B13R2.135 CON1C(=O)Nc2ccccc12 Amb25368420 [0,1,0,0,1,0|2,0,0]=4 3015 B13R2.135 COc1c(I)[s]c2ccccc21 Amb22008794 [0,1,0,0,1,0|1,1,0]=4 3016 B13R2.135 COc1c(O)[nH]c2ccccc21 Amb24574181 [0,1,0,0,1,0|1,0,1]=4 3017 B13R2.135 C\C=C/1\C(=O)Nc2ccccc21 Amb24487101 [0,1,0,0,1,0|2,0,0]=4 3018 B13R2.135 C\N=C\1/C(=O)Nc2c1cccc2 Amb1042382 [0,1,0,0,1,0|2,0,0]=4 3019 B13R2.135 Cc1c[n]2ccccc2c1C=O Amb25081518 [0,1,0,0,1,0|2,0,0]=4 3020 B13R2.135 Cc1cc2cccc[n]2c1C=O Amb18061680 [0,1,0,0,1,0|2,0,0]=4 3021 B13R2.135 Cc1cc2ccccc2[n]1C=O Amb25793459 [0,1,0,0,1,0|2,0,0]=4 3022 B13R2.135 Cc1oc2ccccc2c1C#C Amb24535483 [0,1,0,0,1,0|2,0,0]=4 3023 B13R2.135 Cc1oc2ccccc2c1C=C Amb24084754 [0,1,0,0,1,0|2,0,0]=4 3024 B13R2.135 Cc1oc2ccccc2c1CC Amb24102093 [0,1,0,0,1,0|2,0,0]=4 3025 B13R2.135 Cc1oc2ccccc2c1CN Amb24061887 [0,1,0,0,1,0|2,0,0]=4 3026 B13R2.135 Cc1oc2ccccc2c1CO Amb22011694 [0,1,0,0,1,0|1,0,0]=3 3027 B13R2.135 Cc1oc2ccccc2c1OC Amb24102324 [0,1,0,0,1,0|1,0,0]=3 3028 B13R2.135 N=Cc1c(O)[s]c2ccccc21 Amb25376422 [0,1,0,0,1,0|2,0,0]=4 3029 B13R2.135 N\C=C/1\C(=O)Sc2ccccc21 Amb24485637 [0,1,0,0,1,0|1,1,0]=4 3030 B13R2.135 N\N=C/1\C(=O)Cc2ccccc12 Amb24723936 [0,1,0,0,1,0|2,0,0]=4 3031 B13R2.135 N\N=C/1\C(=O)Nc2c1cccc2 Amb2550333 [0,1,0,0,1,0|2,0,0]=4 3032 B13R2.135 N\N=C/1\C(=O)Sc2ccccc21 Amb24579786 [0,1,0,0,1,0|1,1,0]=4 3033 B13R2.135 N\N=C\1/C(=O)Cc2ccccc12 Amb24633409 [0,1,0,0,1,0|2,0,0]=4 3034 B13R2.135 N\N=C\1/C(=O)Nc2ccccc21 Amb22492050 [0,1,0,0,1,0|2,0,0]=4 3035 B13R2.135 N\N=C\1/C(=O)Sc2ccccc21 Amb19134061 [0,1,0,0,1,0|1,1,0]=4 3036 B13R2.135 Nc1[nH]c2ccccc2c1C=O Amb18830279 [0,1,0,0,1,0|2,0,0]=4 3037 B13R2.135 Nc1[s]c2ccccc2c1C=O Amb18825001 [0,1,0,0,1,0|2,0,0]=4 3038 B13R2.135 Nc1oc2ccccc2c1C#N Amb22749461 [0,1,0,0,1,0|2,0,0]=4 3039 B13R2.135 Nc1oc2ccccc2c1C=O Amb18830101 [0,1,0,0,1,0|1,0,1]=4 3040 B13R2.135 O=C1Nc2ccccc2C1=S=O Amb25764428 [0,1,0,0,1,0|1,0,1]=4 3041 B13R2.135 O=C1Oc2ccccc2N1CCl Amb19773104 [0,1,0,0,1,0|2,0,0]=4 3042 B13R2.135 O=Cc1c(Br)[nH]c2ccccc21 Amb18134342 [0,1,0,0,1,0|2,0,0]=4 3043 B13R2.135 O=Cc1c(Br)[s]c2ccccc21 Amb18661020 [0,1,0,0,1,0|2,0,0]=4 3044 B13R2.135 O=Cc1c(C)oc2c1cccc2 Amb1003032 [0,1,0,0,1,0|1,0,1]=4 3045 B13R2.135 O=Cc1c(C)sc2c1cccc2 Amb10569109 [0,1,0,0,1,0|2,0,0]=4 3046 B13R2.135 O=Cc1c(Cl)[nH]c2c1cccc2 Amb1153968 [0,1,0,0,1,0|2,0,0]=4 3047 B13R2.135 O=Cc1c(Cl)[s]c2ccccc21 Amb18675050 [0,1,0,0,1,0|2,0,0]=4 3048 B13R2.135 O=Cc1c(F)cc2cccc[n]21 Amb24714581 [0,1,0,0,1,0|2,0,0]=4 3049 B13R2.135 O=Cc1c(I)[nH]c2ccccc21 Amb24067889 [0,1,0,0,1,0|2,0,0]=4 3050 B13R2.135 O=Cc1c(S)[nH]c2ccccc21 Amb18825011 [0,1,0,0,1,0|1,1,0]=4 3051 B13R2.135 OCC1=C(Cl)Cc2ccccc12 Amb24462035 [0,1,0,0,1,0|2,0,0]=4 3052 B13R2.135 OCC1C(=O)Nc2ccccc21 Amb24084324 [0,1,0,0,1,0|1,0,1]=4 3053 B13R2.135 OCN1C(=O)Nc2ccccc12 Amb25273874 [0,1,0,0,1,0|2,0,0]=4 3054 B13R2.135 OCN1C(=O)Oc2ccccc12 Amb19806606 [0,1,0,0,1,0|1,0,0]=3 3055 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb21961868 [0,1,0,0,1,0|1,1,0]=4 3056 B13R2.135 OCN1C(=O)Sc2ccccc12 Amb22343799 [0,1,0,0,1,0|1,1,0]=4 3057 B13R2.135 OCN1C(=S)Oc2ccccc12 Amb19773178 [0,1,0,0,1,0|1,1,0]=4 3058 B13R2.135 OCN1C(=S)Oc2ccccc12 Amb22358015 [0,1,0,0,1,0|1,1,0]=4 3059 B13R2.135 OCc1c(Br)[nH]c2ccccc21 Amb24549433 [0,1,0,0,1,0|2,0,0]=4 3060 B13R2.135 OCc1c(F)[nH]c2ccccc21 Amb24682951 [0,1,0,0,1,0|2,0,0]=4 3061 B13R2.135 OCn1c(=O)oc2c1cccc2 Amb1006641 [0,1,0,0,1,0|1,0,0]=3 3062 B13R2.135 OCn1c(=O)sc2c1cccc2 Amb16205274 [0,1,0,0,1,0|1,1,0]=4 3063 B13R2.135 OCn1c(=S)oc2c1cccc2 Amb16205263 [0,1,0,0,1,0|1,1,0]=4 3064 B13R2.135 O\C=C/1\C(=O)Cc2ccccc12 Amb24518375 [0,1,0,0,1,0|1,0,0]=3 3065 B13R2.135 O\C=C/1\C(=O)N=C2C=CC=CN21 Amb24068486 [0,1,0,0,1,0|2,0,0]=4 3066 B13R2.135 O\C=C\1/C(=O)Nc2ccccc21 Amb22494713 [0,1,0,0,1,0|1,0,0]=3 3067 B13R2.135 O\N=C/1\C(=O)Nc2c1cccc2 Amb2221666 [0,1,0,0,1,0|1,0,0]=3 3068 B13R2.135 O\N=C/1\C(=O)Oc2ccccc21 Amb24757993 [0,1,0,0,1,0|0,0,0]=2 3069 B13R2.135 O\N=C\1/C(=O)Nc2c1cccc2 Amb1922919 [0,1,0,0,1,0|1,0,0]=3 3070 B13R2.135 O\N=C\1/C(=O)Nc2c1cccn2 Amb10565728 [0,1,0,0,1,0|2,0,0]=4 3071 B13R2.135 O\N=C\1/C(=O)Nc2ccccc21 Amb22725440 [0,1,0,0,1,0|1,0,0]=3 3072 B13R2.135 Oc1[nH]c2ccccc2c1C=O Amb18645450 [0,1,0,0,1,0|1,0,0]=3 3073 B13R2.135 Oc1[n]c2cccc[n]2c1C=O Amb25032456 [0,1,0,0,1,0|2,0,0]=4 3074 B13R2.135 Oc1[s]c2ccccc2c1C=O Amb18128171 [0,1,0,0,1,0|1,0,0]=3 3075 B13R2.135 Oc1[s]c2ccccc2c1N=O Amb24656620 [0,1,0,0,1,0|1,0,0]=3 3076 B13R2.135 Oc1oc2ccccc2c1C=O Amb24061878 [0,1,0,0,1,0|1,0,0]=3 3077 B13R2.135 [O-]\[NH+]=C\1/C(=O)Nc2ccccc21 Amb23501675 [0,1,0,0,1,0|1,0,1]=4 3078 B13R2.243 CC1(O)Cc2ccccc2C1=O Amb17778835 [0,1,0,0,1,0|0,0,2]=4 3079 B13R2.243 CC1(O)Nc2ccccc2C1=O Amb25054632 [0,1,0,0,1,0|1,0,1]=4 3080 B13R2.243 CC1(O)Oc2ccccc2C1=O Amb24380835 [0,1,0,0,1,0|1,0,1]=4 3081 B13R2.243 OC1(O)Nc2ccccc2C1=O Amb24497053 [0,1,0,0,1,0|1,0,1]=4 3082 B13R2.359 CC1(O)C(=O)Nc2ccccc12 Amb22059446 [0,1,0,0,1,0|1,0,1]=4 3083 B13R2.359 C[C@@]1(O)C(=O)Cc2ccccc12 Amb24341855 [0,1,0,0,1,0|1,0,1]=4 3084 B13R2.359 C[C@]1(O)C(=O)Cc2ccccc12 Amb24432232 [0,1,0,0,1,0|1,0,1]=4 3085 B13R2.359 NC1(O)C(=O)Nc2ccccc12 Amb24429071 [0,1,0,0,1,0|1,0,1]=4 3086 B13R2.359 OC1(O)C(=O)Nc2ccccc12 Amb24561080 [0,1,0,0,1,0|1,0,1]=4 3087 B13R2.3028 Brc1ccc2c(c1)C(=O)C(=N2)O Amb1351906 [0,1,0,0,1,0|1,0,0]=3 3088 B13R2.3028 C=C1Cc2ccc(Br)cc2C1=O Amb18063783 [0,1,0,0,1,0|1,0,1]=4 3089 B13R2.3028 C=C1Cc2ccc(Cl)cc2C1=O Amb18063782 [0,1,0,0,1,0|1,0,1]=4 3090 B13R2.3028 C=C1Cc2ccc(F)cc2C1=O Amb18063781 [0,1,0,0,1,0|1,0,1]=4 3091 B13R2.3028 C=C1Oc2ccc(Cl)cc2C1O Amb25226367 [0,1,0,0,1,0|1,0,1]=4 3092 B13R2.3028 CC1=Cc2ccc(Cl)cc2C1=O Amb22753539 [0,1,0,0,1,0|1,0,0]=3 3093 B13R2.3028 CC=1C(=O)OC2=COC(C)=CC12 Amb19131977 [0,1,0,0,1,0|2,0,0]=4 3094 B13R2.3028 CN1C(=O)Oc2ccc(Br)cc12 Amb18539364 [0,1,0,0,1,0|2,0,0]=4 3095 B13R2.3028 CN1C(=O)Oc2ccc(Cl)cc12 Amb18036634 [0,1,0,0,1,0|2,0,0]=4 3096 B13R2.3028 CN1C(=O)Oc2ccc(F)cc12 Amb18539350 [0,1,0,0,1,0|2,0,0]=4 3097 B13R2.3028 CN1C(=O)Oc2ccc(N)cc12 Amb18015310 [0,1,0,0,1,0|2,0,0]=4 3098 B13R2.3028 CN1C(=O)Oc2ccc(O)cc12 Amb24722825 [0,1,0,0,1,0|2,0,0]=4 3099 B13R2.3028 CN1C(=O)Oc2ccc(S)cc12 Amb25800828 [0,1,0,0,1,0|2,0,0]=4 3100 B13R2.3028 Cc1[s]c2ccc(Cl)cc2c1O Amb24623857 [0,1,0,0,1,0|1,1,0]=4 3101 B13R2.3028 Cc1[s]c2ccc(I)cc2c1O Amb25239694 [0,1,0,0,1,0|1,1,0]=4 3102 B13R2.3028 Cc1[s]c2ccc(N)cc2c1O Amb24605744 [0,1,0,0,1,0|1,1,0]=4 3103 B13R2.3028 Cc1[s]c2ccc(S)cc2c1O Amb24698052 [0,1,0,0,1,0|1,1,0]=4 3104 B13R2.3028 Cc1c(Br)oc2ccc(F)cc21 Amb18755598 [0,1,0,0,1,0|2,0,0]=4 3105 B13R2.3028 Cc1c(O)[s]c2ccc(Br)cc21 Amb25261096 [0,1,0,0,1,0|2,0,0]=4 3106 B13R2.3028 Cc1c(O)[s]c2ccc(Cl)cc21 Amb25230352 [0,1,0,0,1,0|2,0,0]=4 3107 B13R2.3028 Cc1c(O)[s]c2ccc(S)cc21 Amb25203535 [0,1,0,0,1,0|2,0,0]=4 3108 B13R2.3028 Cc1c2cc(Br)ccc2oc1C Amb22904302 [0,1,0,0,1,0|2,0,0]=4 3109 B13R2.3028 Cc1c2cc(Cl)ccc2oc1C Amb24071102 [0,1,0,0,1,0|2,0,0]=4 3110 B13R2.3028 Cc1c2cc(F)ccc2oc1C Amb24071372 [0,1,0,0,1,0|2,0,0]=4 3111 B13R2.3028 Cc1c2cc(N)ccc2oc1C Amb18645489 [0,1,0,0,1,0|2,0,0]=4 3112 B13R2.3028 Cc1c2cc(O)ccc2oc1C Amb18645637 [0,1,0,0,1,0|2,0,0]=4 3113 B13R2.3028 Cc1cc2C(=C)C(=O)Nc2cc1 Amb25150884 [0,1,0,0,1,0|2,0,0]=4 3114 B13R2.3028 Cc1cc2C(=O)C(=C)Cc2cc1 Amb18561519 [0,1,0,0,1,0|1,0,1]=4 3115 B13R2.3028 Cc1cc2c(CC(=O)C2=O)cc1 Amb22230094 [0,1,0,0,1,0|0,0,2]=4 3116 B13R2.3028 Cc1cc2c(F)c(O)[s]c2cc1 Amb25214724 [0,1,0,0,1,0|2,0,0]=4 3117 B13R2.3028 Cc1cc2c(N)c(O)[s]c2cc1 Amb24603994 [0,1,0,0,1,0|2,0,0]=4 3118 B13R2.3028 Cc1cc2c(O)c(C)[s]c2cc1 Amb25239653 [0,1,0,0,1,0|1,1,0]=4 3119 B13R2.3028 Cc1cc2c(O)c(I)[s]c2cc1 Amb24616157 [0,1,0,0,1,0|1,1,0]=4 3120 B13R2.3028 Cc1cc2c(O)c(N)[s]c2cc1 Amb24609385 [0,1,0,0,1,0|1,1,0]=4 3121 B13R2.3028 Cc1cc2c(O)c(S)[s]c2cc1 Amb24744970 [0,1,0,0,1,0|0,2,0]=4 3122 B13R2.3028 Cc1cc2c(cc1)NC(=O)N2O Amb25350745 [0,1,0,0,1,0|2,0,0]=4 3123 B13R2.3028 Cc1cc2c(cc1)[s]c(O)c2C Amb25364701 [0,1,0,0,1,0|2,0,0]=4 3124 B13R2.3028 Cc1cc2c(cc1)[s]c(O)c2O Amb24758024 [0,1,0,0,1,0|0,1,1]=4 3125 B13R2.3028 Cc1ccc2OC(=O)C(C)c2c1 Amb24085550 [0,1,0,0,1,0|1,0,1]=4 3126 B13R2.3028 Cc1ccc2OC(=O)N(C)c2c1 Amb18036628 [0,1,0,0,1,0|2,0,0]=4 3127 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=N2)Cl Amb17594603 [0,1,0,0,1,0|2,0,0]=4 3128 B13R2.3028 Cc1oc2ccc(O)cc2c1N Amb18829458 [0,1,0,0,1,0|2,0,0]=4 3129 B13R2.3028 Ic1ccc2c(c1)C(=O)C(=O)N2 Amb1038277 [0,1,0,0,1,0|1,0,1]=4 3130 B13R2.3028 N=C1C(=O)Nc2ccc(F)cc21 Amb24653603 [0,1,0,0,1,0|2,0,0]=4 3131 B13R2.3028 Nc1[s]c2ccc(Cl)cc2c1O Amb24758017 [0,1,0,0,1,0|1,1,0]=4 3132 B13R2.3028 Nc1[s]c2ccc(F)cc2c1O Amb25237923 [0,1,0,0,1,0|1,1,0]=4 3133 B13R2.3028 Nc1[s]c2ccc(S)cc2c1O Amb25326453 [0,1,0,0,1,0|1,1,0]=4 3134 B13R2.3028 Nc1c(O)[s]c2ccc(F)cc21 Amb25202958 [0,1,0,0,1,0|2,0,0]=4 3135 B13R2.3028 Nc1c(O)[s]c2ccc(S)cc21 Amb24641831 [0,1,0,0,1,0|2,0,0]=4 3136 B13R2.3028 Nc1c2cc(F)ccc2oc1F Amb24383003 [0,1,0,0,1,0|2,0,0]=4 3137 B13R2.3028 Nc1cc2C(O)C(=O)Nc2cc1 Amb24390352 [0,1,0,0,1,0|1,0,1]=4 3138 B13R2.3028 Nc1cc2c(Br)c(O)[s]c2cc1 Amb24541779 [0,1,0,0,1,0|2,0,0]=4 3139 B13R2.3028 Nc1cc2c(O)c(Br)[s]c2cc1 Amb24598531 [0,1,0,0,1,0|1,1,0]=4 3140 B13R2.3028 Nc1cc2c(O)c(F)[s]c2cc1 Amb25203090 [0,1,0,0,1,0|1,1,0]=4 3141 B13R2.3028 Nc1cc2c(O)c(I)[s]c2cc1 Amb24760523 [0,1,0,0,1,0|1,1,0]=4 3142 B13R2.3028 Nc1cc2c(O)c(S)[s]c2cc1 Amb24603667 [0,1,0,0,1,0|0,2,0]=4 3143 B13R2.3028 Nc1cc2c(cc1)[s]c(O)c2O Amb24539565 [0,1,0,0,1,0|0,1,1]=4 3144 B13R2.3028 O=C1c2cc(Br)ccc2CC1=O Amb24493250 [0,1,0,0,1,0|0,0,2]=4 3145 B13R2.3028 O=C1c2cc(Br)ccc2SC1=O Amb24081430 [0,1,0,0,1,0|0,1,1]=4 3146 B13R2.3028 O=C1c2cc(F)ccc2SC1=O Amb24695558 [0,1,0,0,1,0|0,1,1]=4 3147 B13R2.3028 OC1=Nc2ccc(F)cc2C1=O Amb19860944 [0,1,0,0,1,0|1,0,0]=3 3148 B13R2.3028 ON1C(=O)Nc2ccc(Cl)cc12 Amb24742571 [0,1,0,0,1,0|2,0,0]=4 3149 B13R2.3028 ON1C(=O)Nc2ccc(F)cc12 Amb24559393 [0,1,0,0,1,0|2,0,0]=4 3150 B13R2.3028 Oc1[s]c2ccc(Br)cc2c1F Amb24571791 [0,1,0,0,1,0|2,0,0]=4 3151 B13R2.3028 Oc1[s]c2ccc(Cl)cc2c1Cl Amb25277432 [0,1,0,0,1,0|2,0,0]=4 3152 B13R2.3028 Oc1[s]c2ccc(Cl)cc2c1F Amb25199521 [0,1,0,0,1,0|2,0,0]=4 3153 B13R2.3028 Oc1[s]c2ccc(F)cc2c1Cl Amb25199516 [0,1,0,0,1,0|2,0,0]=4 3154 B13R2.3028 Oc1[s]c2ccc(F)cc2c1I Amb25366712 [0,1,0,0,1,0|2,0,0]=4 3155 B13R2.3028 Oc1c(Br)[s]c2ccc(Cl)cc21 Amb25342606 [0,1,0,0,1,0|1,1,0]=4 3156 B13R2.3028 Oc1c(Br)[s]c2ccc(F)cc21 Amb25224649 [0,1,0,0,1,0|1,1,0]=4 3157 B13R2.3028 Oc1c(Cl)[s]c2ccc(Br)cc21 Amb24742321 [0,1,0,0,1,0|1,1,0]=4 3158 B13R2.3028 Oc1c(Cl)[s]c2ccc(S)cc21 Amb24668124 [0,1,0,0,1,0|1,1,0]=4 3159 B13R2.3028 Oc1c(F)[s]c2ccc(Br)cc21 Amb24561151 [0,1,0,0,1,0|1,1,0]=4 3160 B13R2.3028 Oc1c(F)[s]c2ccc(I)cc21 Amb24597189 [0,1,0,0,1,0|1,1,0]=4 3161 B13R2.3028 Oc1c(I)[s]c2ccc(Br)cc21 Amb25289477 [0,1,0,0,1,0|1,1,0]=4 3162 B13R2.3028 Oc1c(I)[s]c2ccc(S)cc21 Amb24561805 [0,1,0,0,1,0|1,1,0]=4 3163 B13R2.3028 Oc1c2cc(Br)ccc2[s]c1O Amb25224518 [0,1,0,0,1,0|0,1,1]=4 3164 B13R2.3028 Oc1c2cc(Cl)ccc2[s]c1Cl Amb25289347 [0,1,0,0,1,0|1,1,0]=4 3165 B13R2.3028 Oc1c2cc(Cl)ccc2[s]c1O Amb24537547 [0,1,0,0,1,0|0,1,1]=4 3166 B13R2.3028 Oc1c2cc(I)ccc2[s]c1O Amb25254603 [0,1,0,0,1,0|0,1,1]=4 3167 B13R2.3028 Oc1c2cc(S)ccc2[s]c1O Amb24541925 [0,1,0,0,1,0|0,1,1]=4 3168 B13R2.3028 Oc1cc2c(Br)c(O)[s]c2cc1 Amb25239842 [0,1,0,0,1,0|2,0,0]=4 3169 B13R2.3028 Oc1cc2c(Cl)c(O)[s]c2cc1 Amb24640588 [0,1,0,0,1,0|2,0,0]=4 3170 B13R2.3028 Oc1cc2c(S)c(O)[s]c2cc1 Amb25207301 [0,1,0,0,1,0|1,1,0]=4 3171 B13R2.3028 Oc1cc2c(cc1)NC(=O)C2=O Amb24083459 [0,1,0,0,1,0|1,0,1]=4 3172 B13R2.3028 Oc1cc2c(cc1)[s]c(Cl)c2O Amb24549655 [0,1,0,0,1,0|1,1,0]=4 3173 B13R2.3085 BrC1C(=O)c2c(C1=O)cccc2 Amb10071900 [0,1,0,0,1,0|1,0,1]=4 3174 B13R2.3085 C=C1c2ccccc2C(=O)N1N Amb25708998 [0,1,0,0,1,0|2,0,0]=4 3175 B13R2.3085 CC1=C(N)c2ccccc2C1=N Amb25152587 [0,1,0,0,1,0|2,0,0]=4 3176 B13R2.3085 CC1C(=C)c2ccccc2C1=O Amb25128210 [0,1,0,0,1,0|1,0,1]=4 3177 B13R2.3085 CC=1C(=O)c2ccccc2C1Cl Amb24378539 [0,1,0,0,1,0|1,0,0]=3 3178 B13R2.3085 CN1C(=O)N(O)c2ccccc12 Amb25174132 [0,1,0,0,1,0|2,0,0]=4 3179 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb24073758 [0,1,0,0,1,0|2,0,0]=4 3180 B13R2.3085 NC1C(=O)N(O)c2ccccc21 Amb25059235 [0,1,0,0,1,0|2,0,0]=4 3181 B13R2.3085 NC1C(=O)c2ccccc2C1=O Amb18645446 [0,1,0,0,1,0|1,0,1]=4 3182 B13R2.3085 NC=1c2ccccc2C(=O)C1N Amb25775073 [0,1,0,0,1,0|1,0,0]=3 3183 B13R2.3085 NN1C(=O)c2c(C1=O)cccc2 Amb1151859 [0,1,0,0,1,0|2,0,0]=4 3184 B13R2.3085 NN1C(=O)c2c(C1=O)cccc2 Amb13884859 [0,1,0,0,1,0|2,0,0]=4 3185 B13R2.3085 N[C@@H]1[C@@H](O)C(=O)c2ccccc21 Amb24670508 [0,1,0,0,1,0|0,0,2]=4 3186 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,1,0,0,1,0|0,0,1]=3 3187 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,1,0,0,1,0|0,0,1]=3 3188 B13R2.3085 O=C1C(Cl)C(=O)c2ccccc12 Amb19988287 [0,1,0,0,1,0|1,0,1]=4 3189 B13R2.3085 O=C1c2ccccc2C(=O)N1[K] Amb21520437 [0,1,0,0,1,0|2,0,0]=4 3190 B13R2.3085 O=C1c2ccccc2C(=O)[15N]1[K] Amb22353262 [0,1,0,0,1,0|2,0,0]=4 3191 B13R2.3085 O=c1n(O)c2c(n1O)cccc2 Amb1042148 [0,1,0,0,1,0|2,0,0]=4 3192 B13R2.3085 OC1C(=O)c2ccccc2N1O Amb24583105 [0,1,0,0,1,0|1,0,1]=4 3193 B13R2.3085 OC1C(O)c2ccccc2C1=O Amb24625369 [0,1,0,0,1,0|0,0,2]=4 3194 B13R2.3085 OC=1c2ccccc2C(=O)C1O Amb25667606 [0,1,0,0,1,0|0,0,0]=2 3195 B13R2.3085 ON1C(=O)N(O)c2ccccc12 Amb19802633 [0,1,0,0,1,0|2,0,0]=4 3196 B13R2.3085 ON1C(=O)c2c(C1=O)cccc2 Amb1351864 [0,1,0,0,1,0|1,0,0]=3 3197 B13R2.3085 ON1C(=O)c2c[n]ccc2C1=O Amb22234711 [0,1,0,0,1,0|2,0,0]=4 3198 B13R2.3085 ON1C(=O)c2ccc[n]c2C1=O Amb22001038 [0,1,0,0,1,0|2,0,0]=4 3199 B13R2.3085 O[C@@H]1C(=O)N(O)c2ccccc21 Amb24748466 [0,1,0,0,1,0|1,0,1]=4 3200 B13R2.3085 O[C@H]1C(=O)N(O)c2ccccc21 Amb24524815 [0,1,0,0,1,0|1,0,1]=4 3201 B13R2.3085 [O-]N1C(=O)c2c(C1=O)cccc2 Amb16224795 [0,1,0,0,1,0|1,0,1]=4 3202 B13R2.4825 C=C1Cc2c(Br)cccc2C1=O Amb18063784 [0,1,0,0,1,0|1,0,1]=4 3203 B13R2.4825 C=C1Cc2c(Cl)cccc2C1=O Amb18063771 [0,1,0,0,1,0|1,0,1]=4 3204 B13R2.4825 C=C1Cc2c(F)cccc2C1=O Amb18063726 [0,1,0,0,1,0|1,0,1]=4 3205 B13R2.4825 CC1=Cc2c(cccc2C)C1=O Amb24537584 [0,1,0,0,1,0|1,0,0]=3 3206 B13R2.4825 CC1C(=O)Oc2c(O)cccc21 Amb24408353 [0,1,0,0,1,0|1,0,1]=4 3207 B13R2.4825 CC=1OC=CC=2C1OC(=O)C2C Amb19131978 [0,1,0,0,1,0|2,0,0]=4 3208 B13R2.4825 CN1C(=O)Oc2c(Br)cccc12 Amb18547407 [0,1,0,0,1,0|2,0,0]=4 3209 B13R2.4825 CN1C(=O)Oc2c(Cl)cccc12 Amb18046758 [0,1,0,0,1,0|2,0,0]=4 3210 B13R2.4825 CN1C(=O)Oc2c(F)cccc12 Amb18046735 [0,1,0,0,1,0|2,0,0]=4 3211 B13R2.4825 CN1C(=O)Oc2c(N)cccc12 Amb18015311 [0,1,0,0,1,0|2,0,0]=4 3212 B13R2.4825 Cc1[s]c2c(Cl)cccc2c1O Amb25255070 [0,1,0,0,1,0|1,1,0]=4 3213 B13R2.4825 Cc1[s]c2c(S)cccc2c1O Amb25228582 [0,1,0,0,1,0|1,1,0]=4 3214 B13R2.4825 Cc1[s]c2c(cccc2O)c1O Amb24598490 [0,1,0,0,1,0|1,1,0]=4 3215 B13R2.4825 Cc1c(Br)oc2c(F)cccc21 Amb18161576 [0,1,0,0,1,0|2,0,0]=4 3216 B13R2.4825 Cc1c(N)oc2c(Br)cccc21 Amb18160647 [0,1,0,0,1,0|2,0,0]=4 3217 B13R2.4825 Cc1c(O)[s]c2c(Cl)cccc21 Amb25777213 [0,1,0,0,1,0|2,0,0]=4 3218 B13R2.4825 Cc1c(O)[s]c2c(S)cccc21 Amb24568122 [0,1,0,0,1,0|2,0,0]=4 3219 B13R2.4825 Cc1cccc2C(=O)C(=C)Cc21 Amb18063786 [0,1,0,0,1,0|1,0,1]=4 3220 B13R2.4825 Cc1cccc2C(C)C(=O)Oc12 Amb24085604 [0,1,0,0,1,0|1,0,1]=4 3221 B13R2.4825 Cc1cccc2C(O)C(=O)Nc21 Amb18792463 [0,1,0,0,1,0|1,0,1]=4 3222 B13R2.4825 Cc1cccc2c(I)c(O)[s]c21 Amb24728625 [0,1,0,0,1,0|2,0,0]=4 3223 B13R2.4825 Cc1cccc2c(O)c(Br)[s]c21 Amb25294056 [0,1,0,0,1,0|1,1,0]=4 3224 B13R2.4825 Cc1cccc2c(O)c(Cl)[s]c21 Amb24561297 [0,1,0,0,1,0|1,1,0]=4 3225 B13R2.4825 Cc1cccc2c(O)c(N)[s]c21 Amb25197028 [0,1,0,0,1,0|1,1,0]=4 3226 B13R2.4825 Cc1cccc2c(O)c(S)[s]c21 Amb24585277 [0,1,0,0,1,0|0,2,0]=4 3227 B13R2.4825 Cc1cccc2c1OC(=O)N2C Amb18547328 [0,1,0,0,1,0|2,0,0]=4 3228 B13R2.4825 Cc1cccc2c1SC(=O)C2=O Amb25821462 [0,1,0,0,1,0|0,1,1]=4 3229 B13R2.4825 Cc1cccc2c1oc(C)c2C Amb25152346 [0,1,0,0,1,0|2,0,0]=4 3230 B13R2.4825 Cc1oc2c(Br)cccc2c1C Amb25148644 [0,1,0,0,1,0|2,0,0]=4 3231 B13R2.4825 Cc1oc2c(Cl)cccc2c1C Amb24092038 [0,1,0,0,1,0|2,0,0]=4 3232 B13R2.4825 Cc1oc2c(F)cccc2c1C Amb24092084 [0,1,0,0,1,0|2,0,0]=4 3233 B13R2.4825 Cc1oc2c(N)cccc2c1C Amb25751191 [0,1,0,0,1,0|2,0,0]=4 3234 B13R2.4825 Cc1oc2c(O)cccc2c1C Amb18645639 [0,1,0,0,1,0|2,0,0]=4 3235 B13R2.4825 Nc1[s]c2c(Br)cccc2c1O Amb24541797 [0,1,0,0,1,0|1,1,0]=4 3236 B13R2.4825 Nc1[s]c2c(Cl)cccc2c1O Amb25218613 [0,1,0,0,1,0|1,1,0]=4 3237 B13R2.4825 Nc1c2cccc(O)c2[s]c1O Amb25309948 [0,1,0,0,1,0|2,0,0]=4 3238 B13R2.4825 Nc1cccc2c(O)c(S)[s]c21 Amb24616659 [0,1,0,0,1,0|0,2,0]=4 3239 B13R2.4825 Nc1cccc2c1[s]c(O)c2N Amb25290678 [0,1,0,0,1,0|2,0,0]=4 3240 B13R2.4825 O=C1Nc2c(C1=O)cccc2Br Amb1103377 [0,1,0,0,1,0|1,0,1]=4 3241 B13R2.4825 O=C1Nc2c(C1=O)cccc2I Amb1129186 [0,1,0,0,1,0|1,0,1]=4 3242 B13R2.4825 O=C1Sc2c(F)cccc2C1=O Amb25082920 [0,1,0,0,1,0|0,1,1]=4 3243 B13R2.4825 OC1C(=O)Nc2c(Br)cccc21 Amb24706346 [0,1,0,0,1,0|1,0,1]=4 3244 B13R2.4825 OC1C(=O)Nc2c(Cl)cccc21 Amb19045341 [0,1,0,0,1,0|1,0,1]=4 3245 B13R2.4825 OC1C(=O)Nc2c(F)cccc21 Amb18177845 [0,1,0,0,1,0|1,0,1]=4 3246 B13R2.4825 ON1C(=O)Cc2c(I)cccc12 Amb24531537 [0,1,0,0,1,0|2,0,0]=4 3247 B13R2.4825 Oc1[s]c2c(Br)cccc2c1I Amb24669378 [0,1,0,0,1,0|2,0,0]=4 3248 B13R2.4825 Oc1[s]c2c(Cl)cccc2c1I Amb24759614 [0,1,0,0,1,0|2,0,0]=4 3249 B13R2.4825 Oc1[s]c2c(Cl)cccc2c1O Amb24537548 [0,1,0,0,1,0|0,1,1]=4 3250 B13R2.4825 Oc1[s]c2c(F)cccc2c1Br Amb25254541 [0,1,0,0,1,0|2,0,0]=4 3251 B13R2.4825 Oc1[s]c2c(F)cccc2c1I Amb25259355 [0,1,0,0,1,0|2,0,0]=4 3252 B13R2.4825 Oc1[s]c2c(F)cccc2c1O Amb25216649 [0,1,0,0,1,0|0,1,1]=4 3253 B13R2.4825 Oc1[s]c2c(I)cccc2c1O Amb24758142 [0,1,0,0,1,0|0,1,1]=4 3254 B13R2.4825 Oc1[s]c2c(S)cccc2c1Cl Amb24604099 [0,1,0,0,1,0|2,0,0]=4 3255 B13R2.4825 Oc1[s]c2c(S)cccc2c1F Amb25367442 [0,1,0,0,1,0|2,0,0]=4 3256 B13R2.4825 Oc1[s]c2c(cccc2Br)c1Br Amb25325435 [0,1,0,0,1,0|2,0,0]=4 3257 B13R2.4825 Oc1[s]c2c(cccc2Cl)c1Cl Amb24586653 [0,1,0,0,1,0|2,0,0]=4 3258 B13R2.4825 Oc1c(Br)[s]c2c(I)cccc21 Amb24572599 [0,1,0,0,1,0|1,1,0]=4 3259 B13R2.4825 Oc1c(Br)[s]c2c(S)cccc21 Amb25338578 [0,1,0,0,1,0|1,1,0]=4 3260 B13R2.4825 Oc1c(Cl)[s]c2c(Br)cccc21 Amb25224593 [0,1,0,0,1,0|1,1,0]=4 3261 B13R2.4825 Oc1c(Cl)[s]c2c(F)cccc21 Amb25254460 [0,1,0,0,1,0|1,1,0]=4 3262 B13R2.4825 Oc1c(I)[s]c2c(Cl)cccc21 Amb25216661 [0,1,0,0,1,0|1,1,0]=4 3263 B13R2.4825 Oc1c(S)[s]c2c(Br)cccc21 Amb24540044 [0,1,0,0,1,0|0,2,0]=4 3264 B13R2.4825 Oc1c(S)[s]c2c(Cl)cccc21 Amb25230338 [0,1,0,0,1,0|0,2,0]=4 3265 B13R2.4825 Oc1c(S)[s]c2c(F)cccc21 Amb24745924 [0,1,0,0,1,0|0,2,0]=4 3266 B13R2.4825 Oc1c(S)[s]c2c(I)cccc21 Amb24597257 [0,1,0,0,1,0|0,2,0]=4 3267 B13R2.4825 Oc1c2cccc(Br)c2[s]c1Br Amb24639518 [0,1,0,0,1,0|1,1,0]=4 3268 B13R2.4825 Oc1cccc2c(Cl)c(O)[s]c12 Amb25237829 [0,1,0,0,1,0|2,0,0]=4 3269 B13R2.4825 Oc1cccc2c(I)c(O)[s]c12 Amb25293306 [0,1,0,0,1,0|2,0,0]=4 3270 B13R2.4825 Oc1cccc2c(S)c(O)[s]c12 Amb24542085 [0,1,0,0,1,0|1,1,0]=4 3271 B13R2.4825 Oc1cccc2c1CC(O)C2=O Amb25767021 [0,1,0,0,1,0|0,0,2]=4 3272 B13R2.4825 Oc1cccc2c1CN(O)C2=O Amb24497070 [0,1,0,0,1,0|1,0,1]=4 3273 B13R2.4825 Oc1cccc2c1[s]c(I)c2O Amb25289685 [0,1,0,0,1,0|1,1,0]=4 3274 B13R2.4825 Oc1cccc2c1[s]c(S)c2O Amb24542091 [0,1,0,0,1,0|0,2,0]=4 3275 B13R2.4856 CC1C(=O)Oc2cccc(O)c21 Amb24070370 [0,1,0,0,1,0|1,0,1]=4 3276 B13R2.4856 CN1C(=O)Oc2cccc(N)c12 Amb18102350 [0,1,0,0,1,0|2,0,0]=4 3277 B13R2.4856 Cc1[s]c2cccc(F)c2c1O Amb24547663 [0,1,0,0,1,0|1,1,0]=4 3278 B13R2.4856 Cc1[s]c2cccc(O)c2c1O Amb24759608 [0,1,0,0,1,0|1,1,0]=4 3279 B13R2.4856 Cc1c(Br)oc2cccc(Cl)c21 Amb18717902 [0,1,0,0,1,0|2,0,0]=4 3280 B13R2.4856 Cc1c(Br)oc2cccc(F)c21 Amb18161575 [0,1,0,0,1,0|2,0,0]=4 3281 B13R2.4856 Cc1c(O)[s]c2cccc(F)c21 Amb24670664 [0,1,0,0,1,0|2,0,0]=4 3282 B13R2.4856 Cc1c(O)[s]c2cccc(I)c21 Amb25259399 [0,1,0,0,1,0|2,0,0]=4 3283 B13R2.4856 Cc1c2c(Br)cccc2oc1C Amb18754579 [0,1,0,0,1,0|2,0,0]=4 3284 B13R2.4856 Cc1c2c(N)cccc2oc1C Amb24079011 [0,1,0,0,1,0|2,0,0]=4 3285 B13R2.4856 Cc1c2c(O)cccc2oc1C Amb18645636 [0,1,0,0,1,0|2,0,0]=4 3286 B13R2.4856 Cc1cccc2[s]c(Br)c(O)c21 Amb25255031 [0,1,0,0,1,0|1,1,0]=4 3287 B13R2.4856 Cc1cccc2[s]c(O)c(S)c21 Amb25367469 [0,1,0,0,1,0|1,1,0]=4 3288 B13R2.4856 Cc1cccc2oc(=O)[n](C)c12 Amb24082757 [0,1,0,0,1,0|2,0,0]=4 3289 B13R2.4856 ClC1=Nc2c(C1=O)c(C)ccc2 Amb17594602 [0,1,0,0,1,0|2,0,0]=4 3290 B13R2.4856 ClC1=Nc2c(C1=O)c(Cl)ccc2 Amb17595294 [0,1,0,0,1,0|2,0,0]=4 3291 B13R2.4856 Nc1[s]c2cccc(Br)c2c1O Amb24541794 [0,1,0,0,1,0|1,1,0]=4 3292 B13R2.4856 Nc1[s]c2cccc(F)c2c1O Amb25202800 [0,1,0,0,1,0|1,1,0]=4 3293 B13R2.4856 Nc1[s]c2cccc(I)c2c1O Amb24604158 [0,1,0,0,1,0|1,1,0]=4 3294 B13R2.4856 Nc1c(O)[s]c2cccc(F)c21 Amb25240378 [0,1,0,0,1,0|2,0,0]=4 3295 B13R2.4856 Nc1cccc2OC(=O)C(O)c21 Amb24483702 [0,1,0,0,1,0|0,0,1]=3 3296 B13R2.4856 Nc1cccc2[s]c(Cl)c(O)c21 Amb25219122 [0,1,0,0,1,0|1,1,0]=4 3297 B13R2.4856 Nc1cccc2[s]c(N)c(O)c12 Amb25293252 [0,1,0,0,1,0|1,1,0]=4 3298 B13R2.4856 Nc1cccc2[s]c(O)c(Br)c21 Amb24541956 [0,1,0,0,1,0|2,0,0]=4 3299 B13R2.4856 Nc1cccc2[s]c(O)c(N)c12 Amb24605210 [0,1,0,0,1,0|2,0,0]=4 3300 B13R2.4856 Nc1cccc2[s]c(S)c(O)c21 Amb24603666 [0,1,0,0,1,0|0,2,0]=4 3301 B13R2.4856 OC1C(=O)Nc2cccc(Cl)c21 Amb19045343 [0,1,0,0,1,0|1,0,1]=4 3302 B13R2.4856 ON1C(=O)Nc2cccc(F)c12 Amb24708070 [0,1,0,0,1,0|2,0,0]=4 3303 B13R2.4856 Oc1[s]c2cccc(Br)c2c1Cl Amb25203185 [0,1,0,0,1,0|2,0,0]=4 3304 B13R2.4856 Oc1[s]c2cccc(Br)c2c1F Amb24603494 [0,1,0,0,1,0|2,0,0]=4 3305 B13R2.4856 Oc1[s]c2cccc(Br)c2c1I Amb24616563 [0,1,0,0,1,0|2,0,0]=4 3306 B13R2.4856 Oc1[s]c2cccc(Cl)c2c1Br Amb24605431 [0,1,0,0,1,0|2,0,0]=4 3307 B13R2.4856 Oc1[s]c2cccc(F)c2c1Cl Amb24603550 [0,1,0,0,1,0|2,0,0]=4 3308 B13R2.4856 Oc1[s]c2cccc(F)c2c1F Amb25290479 [0,1,0,0,1,0|2,0,0]=4 3309 B13R2.4856 Oc1[s]c2cccc(F)c2c1I Amb24698021 [0,1,0,0,1,0|2,0,0]=4 3310 B13R2.4856 Oc1[s]c2cccc(F)c2c1S Amb25366716 [0,1,0,0,1,0|1,1,0]=4 3311 B13R2.4856 Oc1[s]c2cccc(I)c2c1Cl Amb24604512 [0,1,0,0,1,0|2,0,0]=4 3312 B13R2.4856 Oc1[s]c2cccc(I)c2c1I Amb25253884 [0,1,0,0,1,0|2,0,0]=4 3313 B13R2.4856 Oc1[s]c2cccc(I)c2c1S Amb25379012 [0,1,0,0,1,0|1,1,0]=4 3314 B13R2.4856 Oc1[s]c2cccc(S)c2c1Br Amb25230309 [0,1,0,0,1,0|2,0,0]=4 3315 B13R2.4856 Oc1[s]c2cccc(S)c2c1I Amb24587584 [0,1,0,0,1,0|2,0,0]=4 3316 B13R2.4856 Oc1c(Br)[s]c2cccc(Cl)c21 Amb25254998 [0,1,0,0,1,0|1,1,0]=4 3317 B13R2.4856 Oc1c(Br)[s]c2cccc(S)c21 Amb25313507 [0,1,0,0,1,0|1,1,0]=4 3318 B13R2.4856 Oc1c(Cl)[s]c2cccc(F)c21 Amb24561414 [0,1,0,0,1,0|1,1,0]=4 3319 B13R2.4856 Oc1c(F)[s]c2cccc(S)c21 Amb24584916 [0,1,0,0,1,0|1,1,0]=4 3320 B13R2.4856 Oc1c(I)[s]c2cccc(F)c21 Amb24617983 [0,1,0,0,1,0|1,1,0]=4 3321 B13R2.4856 Oc1c(S)[s]c2cccc(F)c21 Amb25329077 [0,1,0,0,1,0|0,2,0]=4 3322 B13R2.4856 Oc1c(S)[s]c2cccc(I)c21 Amb24655275 [0,1,0,0,1,0|0,2,0]=4 3323 B13R2.4856 Oc1c2c(S)cccc2[s]c1O Amb24541924 [0,1,0,0,1,0|0,1,1]=4 3324 B13R2.4856 Oc1c2c(cccc2Br)[s]c1Br Amb25254284 [0,1,0,0,1,0|1,1,0]=4 3325 B13R2.4856 Oc1cccc2NC(=O)C(=O)c21 Amb22490791 [0,1,0,0,1,0|1,0,1]=4 3326 B13R2.4856 Oc1cccc2OC(O)C(=O)c12 Amb25737018 [0,1,0,0,1,0|1,0,1]=4 3327 B13R2.4856 Oc1cccc2[s]c(O)c(Br)c12 Amb25216593 [0,1,0,0,1,0|2,0,0]=4 3328 B13R2.4856 Oc1cccc2[s]c(O)c(F)c12 Amb25209171 [0,1,0,0,1,0|2,0,0]=4 3329 B13R2.4856 Oc1cccc2[s]c(O)c(I)c12 Amb25218729 [0,1,0,0,1,0|2,0,0]=4 3330 B13R2.4856 Oc1cccc2[s]c(S)c(O)c12 Amb24542087 [0,1,0,0,1,0|0,2,0]=4 3331 B13R2.5190 C=C1C(=O)Nc2cc(Cl)ccc21 Amb24419769 [0,1,0,0,1,0|2,0,0]=4 3332 B13R2.5190 CC1=Cc2cc(Cl)ccc2C1=O Amb25323825 [0,1,0,0,1,0|1,0,0]=3 3333 B13R2.5190 CN1C(=O)Oc2cc(Br)ccc12 Amb18034499 [0,1,0,0,1,0|2,0,0]=4 3334 B13R2.5190 CN1C(=O)Oc2cc(I)ccc12 Amb21927504 [0,1,0,0,1,0|2,0,0]=4 3335 B13R2.5190 CN1C(=O)Oc2cc(N)ccc12 Amb18015307 [0,1,0,0,1,0|2,0,0]=4 3336 B13R2.5190 CN1C(=O)Oc2cc(O)ccc12 Amb25319967 [0,1,0,0,1,0|2,0,0]=4 3337 B13R2.5190 CN1C(=O)Oc2cc(S)ccc12 Amb18809482 [0,1,0,0,1,0|2,0,0]=4 3338 B13R2.5190 Cc1[s]c2cc(Cl)ccc2c1O Amb25230353 [0,1,0,0,1,0|1,1,0]=4 3339 B13R2.5190 Cc1c(Br)oc2cc(Cl)ccc21 Amb18717901 [0,1,0,0,1,0|2,0,0]=4 3340 B13R2.5190 Cc1c(Br)oc2cc(F)ccc21 Amb18161512 [0,1,0,0,1,0|2,0,0]=4 3341 B13R2.5190 Cc1c2ccc(Br)cc2oc1C Amb24587075 [0,1,0,0,1,0|2,0,0]=4 3342 B13R2.5190 Cc1c2ccc(N)cc2oc1C Amb24101600 [0,1,0,0,1,0|2,0,0]=4 3343 B13R2.5190 Cc1c2ccc(O)cc2oc1C Amb18645638 [0,1,0,0,1,0|2,0,0]=4 3344 B13R2.5190 Cc1cc2C=C(C)C(=O)c2cc1 Amb25086599 [0,1,0,0,1,0|1,0,0]=3 3345 B13R2.5190 Cc1cc2NC(=O)N(O)c2cc1 Amb25174190 [0,1,0,0,1,0|2,0,0]=4 3346 B13R2.5190 Cc1cc2OC(=O)C(=O)c2cc1 Amb25059612 [0,1,0,0,1,0|0,0,1]=3 3347 B13R2.5190 Cc1cc2[s]c(Br)c(O)c2cc1 Amb25261095 [0,1,0,0,1,0|1,1,0]=4 3348 B13R2.5190 Cc1cc2[s]c(N)c(O)c2cc1 Amb25197027 [0,1,0,0,1,0|1,1,0]=4 3349 B13R2.5190 Cc1cc2[s]c(O)c(F)c2cc1 Amb24698056 [0,1,0,0,1,0|2,0,0]=4 3350 B13R2.5190 Cc1cc2[s]c(O)c(I)c2cc1 Amb24574478 [0,1,0,0,1,0|2,0,0]=4 3351 B13R2.5190 Cc1cc2[s]c(O)c(N)c2cc1 Amb25197025 [0,1,0,0,1,0|2,0,0]=4 3352 B13R2.5190 Cc1cc2[s]c(O)c(S)c2cc1 Amb25252402 [0,1,0,0,1,0|1,1,0]=4 3353 B13R2.5190 Cc1cc2oc(Br)c(C)c2cc1 Amb18754577 [0,1,0,0,1,0|2,0,0]=4 3354 B13R2.5190 Cc1ccc2C(=O)C(=C)Cc2c1 Amb25839302 [0,1,0,0,1,0|1,0,1]=4 3355 B13R2.5190 Cc1ccc2c(c1)N=C(C2=O)Cl Amb17594604 [0,1,0,0,1,0|2,0,0]=4 3356 B13R2.5190 Cc1ccc2c(c1)NC(=O)C2=O Amb1887200 [0,1,0,0,1,0|1,0,1]=4 3357 B13R2.5190 Cc1ccc2c(c1)OC(=O)N2C Amb25245433 [0,1,0,0,1,0|2,0,0]=4 3358 B13R2.5190 Cc1oc2cc(O)ccc2c1O Amb25059688 [0,1,0,0,1,0|1,0,0]=3 3359 B13R2.5190 Clc1ccc2c(c1)N=C(C2=O)Cl Amb17595295 [0,1,0,0,1,0|2,0,0]=4 3360 B13R2.5190 Fc1ccc2c(c1)NC(=O)C2=O Amb1155086 [0,1,0,0,1,0|1,0,1]=4 3361 B13R2.5190 N=C1C(=O)Nc2cc(Cl)ccc21 Amb25122720 [0,1,0,0,1,0|2,0,0]=4 3362 B13R2.5190 NC1=Nc2cc(F)ccc2C1=O Amb24078929 [0,1,0,0,1,0|2,0,0]=4 3363 B13R2.5190 Nc1[s]c2cc(Br)ccc2c1O Amb24571832 [0,1,0,0,1,0|1,1,0]=4 3364 B13R2.5190 Nc1[s]c2cc(O)ccc2c1O Amb25277551 [0,1,0,0,1,0|1,1,0]=4 3365 B13R2.5190 Nc1[s]c2cc(S)ccc2c1O Amb25202883 [0,1,0,0,1,0|1,1,0]=4 3366 B13R2.5190 Nc1c(O)[s]c2cc(S)ccc21 Amb25202885 [0,1,0,0,1,0|2,0,0]=4 3367 B13R2.5190 Nc1cc2NC(=O)C(=O)c2cc1 Amb22498682 [0,1,0,0,1,0|1,0,1]=4 3368 B13R2.5190 Nc1cc2[s]c(Br)c(O)c2cc1 Amb24605213 [0,1,0,0,1,0|1,1,0]=4 3369 B13R2.5190 Nc1cc2[s]c(Cl)c(O)c2cc1 Amb25219123 [0,1,0,0,1,0|1,1,0]=4 3370 B13R2.5190 Nc1cc2[s]c(F)c(O)c2cc1 Amb24574924 [0,1,0,0,1,0|1,1,0]=4 3371 B13R2.5190 Nc1cc2[s]c(I)c(O)c2cc1 Amb25294104 [0,1,0,0,1,0|1,1,0]=4 3372 B13R2.5190 Nc1cc2[s]c(O)c(Br)c2cc1 Amb24561185 [0,1,0,0,1,0|2,0,0]=4 3373 B13R2.5190 Nc1cc2[s]c(O)c(I)c2cc1 Amb24668177 [0,1,0,0,1,0|2,0,0]=4 3374 B13R2.5190 Nc1cc2[s]c(O)c(S)c2cc1 Amb25203006 [0,1,0,0,1,0|1,1,0]=4 3375 B13R2.5190 O=C1c2ccc(F)cc2SC1=O Amb24468396 [0,1,0,0,1,0|0,1,1]=4 3376 B13R2.5190 OC1C(=O)Nc2cc(Cl)ccc21 Amb19045342 [0,1,0,0,1,0|1,0,1]=4 3377 B13R2.5190 Oc1[s]c2cc(Br)ccc2c1F Amb24542523 [0,1,0,0,1,0|2,0,0]=4 3378 B13R2.5190 Oc1[s]c2cc(Cl)ccc2c1Cl Amb24586652 [0,1,0,0,1,0|2,0,0]=4 3379 B13R2.5190 Oc1[s]c2cc(Cl)ccc2c1S Amb25313544 [0,1,0,0,1,0|1,1,0]=4 3380 B13R2.5190 Oc1[s]c2cc(F)ccc2c1F Amb24666985 [0,1,0,0,1,0|2,0,0]=4 3381 B13R2.5190 Oc1[s]c2cc(I)ccc2c1Cl Amb25325547 [0,1,0,0,1,0|2,0,0]=4 3382 B13R2.5190 Oc1[s]c2cc(I)ccc2c1F Amb24622019 [0,1,0,0,1,0|2,0,0]=4 3383 B13R2.5190 Oc1[s]c2cc(S)ccc2c1Br Amb24616944 [0,1,0,0,1,0|2,0,0]=4 3384 B13R2.5190 Oc1[s]c2cc(S)ccc2c1I Amb25245556 [0,1,0,0,1,0|2,0,0]=4 3385 B13R2.5190 Oc1c(Br)[s]c2cc(I)ccc21 Amb25250220 [0,1,0,0,1,0|1,1,0]=4 3386 B13R2.5190 Oc1c(Cl)[s]c2cc(F)ccc21 Amb24539626 [0,1,0,0,1,0|1,1,0]=4 3387 B13R2.5190 Oc1c(Cl)[s]c2cc(I)ccc21 Amb25218572 [0,1,0,0,1,0|1,1,0]=4 3388 B13R2.5190 Oc1c(F)[s]c2cc(Cl)ccc21 Amb25325542 [0,1,0,0,1,0|1,1,0]=4 3389 B13R2.5190 Oc1c(F)[s]c2cc(S)ccc21 Amb25265056 [0,1,0,0,1,0|1,1,0]=4 3390 B13R2.5190 Oc1c(I)[s]c2cc(S)ccc21 Amb25378078 [0,1,0,0,1,0|1,1,0]=4 3391 B13R2.5190 Oc1c(S)[s]c2cc(Cl)ccc21 Amb25313545 [0,1,0,0,1,0|0,2,0]=4 3392 B13R2.5190 Oc1c(S)[s]c2cc(I)ccc21 Amb24550829 [0,1,0,0,1,0|0,2,0]=4 3393 B13R2.5190 Oc1c2ccc(Cl)cc2[s]c1O Amb24549653 [0,1,0,0,1,0|0,1,1]=4 3394 B13R2.5190 Oc1c2ccc(F)cc2[s]c1O Amb24574839 [0,1,0,0,1,0|0,1,1]=4 3395 B13R2.5190 Oc1c2ccc(I)cc2[s]c1I Amb25253852 [0,1,0,0,1,0|1,1,0]=4 3396 B13R2.5190 Oc1cc2OC(=O)C(=O)c2cc1 Amb24723982 [0,1,0,0,1,0|0,0,1]=3 3397 B13R2.5190 Oc1cc2[s]c(O)c(F)c2cc1 Amb24586862 [0,1,0,0,1,0|2,0,0]=4 3398 B13R2.5190 Oc1cc2[s]c(O)c(I)c2cc1 Amb24571889 [0,1,0,0,1,0|2,0,0]=4 3399 B13R2.5190 Oc1cc2[s]c(S)c(O)c2cc1 Amb24542090 [0,1,0,0,1,0|0,2,0]=4 3400 B13R2.599 COC1=Cc2occc2NC1=O Amb25835851 [0,1,0,0,1,0|2,0,0]=4 3401 B13R2.599 Oc1cc2[s]ccc2cc1C=O Amb18824897 [0,1,0,0,1,0|2,0,0]=4 3402 B13R2.599 Oc1cc2ccoc2cc1C=O Amb18645578 [0,1,0,0,1,0|2,0,0]=4 3403 B13R2.599 Oc1cc2occc2cc1C=O Amb18645569 [0,1,0,0,1,0|2,0,0]=4 3404 B13R2.4899 CC=1C(=O)C(O)=CC2=NC=CC21 Amb25334891 [0,1,0,0,1,0|2,0,0]=4 3405 B13R2.11634 Oc1cc2C=CC(=O)c2cc1O Amb24672885 [0,1,0,0,1,0|1,0,1]=4 3406 B15R2.2097 CCC1=Cc2ccccc2CC(=O)N1 Amb25685838 [0,1,0,0,0,1|2,0,0]=4 3407 B15R2.8448 O=C1C=C(Cl)C(=O)c2ccccc2N1 Amb24668997 [0,1,0,0,0,1|2,0,0]=4 3408 B15R2.8448 OC1=CC(=O)Nc2ccccc2C1=O Amb25366186 [0,1,0,0,0,1|1,0,0]=3 3409 B15R2.1846 CCC1=Cc2ccccc2C=CC1=O Amb21948173 [0,1,0,0,0,1|2,0,0]=4 3410 B15R2.1846 CNC1=Cc2ccccc2C=CC1=O Amb24348165 [0,1,0,0,0,1|2,0,0]=4 3411 B15R2.1846 COC1=Cc2ccccc2C=CC1=O Amb20247046 [0,1,0,0,0,1|1,0,0]=3 3412 B15R2.1846 O=C1C=Cc2ccccc2C=C1C=O Amb25678630 [0,1,0,0,0,1|1,0,1]=4 3413 B15R2.2114 O=C1Nc2ccccc2NC=C1C#N Amb17750302 [0,1,0,0,0,1|2,0,0]=4 3414 B15R2.13167 NC1=CC(=O)c2ccccc2NC1=O Amb25664314 [0,1,0,0,0,1|2,0,0]=4 3415 B15R2.13167 O=C1C=C(Cl)C(=O)Nc2ccccc12 Amb25366136 [0,1,0,0,0,1|2,0,0]=4 3416 B15R2.15770 NC=1C(=O)C(O)=CC=C2C=CC=CC21 Amb24738317 [0,1,0,0,0,1|1,0,0]=3 3417 B15R2.15770 O=C1COc2c(C(=O)N1C)cccc2 Amb1761776 [0,1,0,0,0,1|2,0,0]=4 3418 B15R2.13983 Cc1cc2C=CC(=O)C=Cc2cc1O Amb24342595 [0,1,0,0,0,1|2,0,0]=4 3419 B15R2.13883 CC1(O)C(=O)Nc2ccccc2C1=O Amb24671341 [0,2,0,0,0,0|1,0,1]=4 3420 B15R2.117 CNc1[n]c2ccccc2cc1CO Amb18959344 [0,2,0,0,0,0|2,0,0]=4 3421 B15R2.117 COc1[n]c2ccccc2[n]c1C=O Amb18649775 [0,2,0,0,0,0|2,0,0]=4 3422 B15R2.117 COc1[n]c2ccccc2cc1OC Amb25134014 [0,2,0,0,0,0|1,0,1]=4 3423 B15R2.117 COc1cc2ccc[n]c2cc1C=O Amb24422471 [0,2,0,0,0,0|2,0,0]=4 3424 B15R2.117 COc1cc2ccccc2cc1C#N Amb18129220 [0,2,0,0,0,0|2,0,0]=4 3425 B15R2.117 COc1cc2ccccc2cc1C=O Amb18649283 [0,2,0,0,0,0|1,0,0]=3 3426 B15R2.117 COc1cc2ccccc2cc1CN Amb18909616 [0,2,0,0,0,0|2,0,0]=4 3427 B15R2.117 COc1cc2ccccc2cc1CO Amb22348066 [0,2,0,0,0,0|1,0,1]=4 3428 B15R2.117 COc1cc2ccccc2cc1OC Amb20247703 [0,2,0,0,0,0|1,0,1]=4 3429 B15R2.117 COc1nc2ccccc2cc1C=O Amb1839681 [0,2,0,0,0,0|2,0,0]=4 3430 B15R2.117 CSc1[n]c2ccccc2cc1CO Amb24474376 [0,2,0,0,0,0|1,1,0]=4 3431 B15R2.117 CSc1cc2ccccc2cc1C=O Amb24708002 [0,2,0,0,0,0|1,1,0]=4 3432 B15R2.117 N#Cc1cc2ccccc2[n]c1C=O Amb25689101 [0,2,0,0,0,0|2,0,0]=4 3433 B15R2.117 NNc1[n]c2ccccc2cc1CO Amb19077741 [0,2,0,0,0,0|2,0,0]=4 3434 B15R2.117 O=Cc1cc2ccccc2cc1C=O Amb10844779 [0,2,0,0,0,0|1,0,1]=4 3435 B15R2.117 O=Cc1cc2ccccc2cc1CBr Amb25784688 [0,2,0,0,0,0|2,0,0]=4 3436 B15R2.117 O=Cc1cc2ccccc2cc1CCl Amb25312206 [0,2,0,0,0,0|2,0,0]=4 3437 B15R2.117 OCc1cc2ccccc2[n]c1C=O Amb25035760 [0,2,0,0,0,0|1,0,0]=3 3438 B15R2.117 OCc1cc2ccccc2cc1C=O Amb18649281 [0,2,0,0,0,0|1,0,0]=3 3439 B15R2.274 C=C1C(C#N)=C(N)Oc2ccccc21 Amb24382106 [0,2,0,0,0,0|2,0,0]=4 3440 B15R2.274 CC1=C(C#N)C(=N)Oc2ccccc21 Amb23526965 [0,2,0,0,0,0|2,0,0]=4 3441 B15R2.274 CC1=C(C#N)C(=O)Nc2ccccc21 Amb18648878 [0,2,0,0,0,0|2,0,0]=4 3442 B15R2.274 CC1=C(C#N)C(=O)Oc2ccccc21 Amb18001225 [0,2,0,0,0,0|1,0,0]=3 3443 B15R2.274 CC1=C(C=C)C(=O)Nc2ccccc21 Amb25338066 [0,2,0,0,0,0|2,0,0]=4 3444 B15R2.274 CC1=C(C=O)C(=O)Oc2ccccc21 Amb24506510 [0,2,0,0,0,0|0,0,1]=3 3445 B15R2.274 CC1=C(CN)C(=O)Nc2ccccc21 Amb23571584 [0,2,0,0,0,0|2,0,0]=4 3446 B15R2.274 CC=1Oc2ccccc2C(=O)C1C=O Amb18649738 [0,2,0,0,0,0|1,0,1]=4 3447 B15R2.274 CC=1Oc2ccccc2C(=O)C1OC Amb22753597 [0,2,0,0,0,0|1,0,0]=3 3448 B15R2.274 CC=1c2ccccc2NC(=O)C1OC Amb25772910 [0,2,0,0,0,0|1,0,0]=3 3449 B15R2.274 CC=1c2ccccc2NC(=O)C1SC Amb25324545 [0,2,0,0,0,0|1,1,0]=4 3450 B15R2.274 CCC1=C(N)c2ccccc2NC1=O Amb18649966 [0,2,0,0,0,0|2,0,0]=4 3451 B15R2.274 CCC1=C(O)c2ccccc2NC1=O Amb19667948 [0,2,0,0,0,0|2,0,0]=4 3452 B15R2.274 CCC1=C(O)c2ccccc2OC1=O Amb19665339 [0,2,0,0,0,0|1,0,0]=3 3453 B15R2.274 CCC=1C(=O)Nc2ccccc2C1Cl Amb25691429 [0,2,0,0,0,0|2,0,0]=4 3454 B15R2.274 CCC=1C(=O)Oc2ccccc2C1Cl Amb25665625 [0,2,0,0,0,0|1,0,0]=3 3455 B15R2.274 CCC=1C(=O)c2ccccc2OC1S Amb24079249 [0,2,0,0,0,0|1,1,0]=4 3456 B15R2.274 CC[n]1c(=O)oc2ccccc2c1=S Amb24102109 [0,2,0,0,0,0|2,0,0]=4 3457 B15R2.274 COC1=C(N)c2ccccc2NC1=O Amb20579508 [0,2,0,0,0,0|1,0,0]=3 3458 B15R2.274 COC=1C(=O)Oc2ccccc2C1O Amb22753606 [0,2,0,0,0,0|0,0,0]=2 3459 B15R2.274 COc1c(O)c2ccccc2cc1Cl Amb22172127 [0,2,0,0,0,0|2,0,0]=4 3460 B15R2.274 CSC1=C(O)c2ccccc2NC1=O Amb25035735 [0,2,0,0,0,0|1,1,0]=4 3461 B15R2.274 Cc1[n]c2ccccc2c(N)c1CO Amb18649924 [0,2,0,0,0,0|2,0,0]=4 3462 B15R2.274 Cc1c2ccccc2cc(Br)c1OC Amb23448508 [0,2,0,0,0,0|2,0,0]=4 3463 B15R2.274 Cc1cc2ccccc2c(C)c1CO Amb22480518 [0,2,0,0,0,0|2,0,0]=4 3464 B15R2.274 N#CC1=C(O)c2ccccc2NC1=O Amb19665378 [0,2,0,0,0,0|2,0,0]=4 3465 B15R2.274 N#CC=1C(=O)Nc2ccccc2C1Cl Amb19894803 [0,2,0,0,0,0|2,0,0]=4 3466 B15R2.274 N#CC=1C(=O)Oc2ccccc2C1Cl Amb18655179 [0,2,0,0,0,0|1,0,0]=3 3467 B15R2.274 N=C/1Nc2ccccc2C(=O)\C1=N/O Amb24613845 [0,2,0,0,0,0|2,0,0]=4 3468 B15R2.274 N=C/1Nc2ccccc2C(=O)\C1=N\O Amb24336434 [0,2,0,0,0,0|2,0,0]=4 3469 B15R2.274 NC1=C(C#N)C(=O)Nc2ccccc21 Amb18548454 [0,2,0,0,0,0|2,0,0]=4 3470 B15R2.274 NC1=C(C=O)C(=O)Oc2ccccc21 Amb21948591 [0,2,0,0,0,0|0,0,1]=3 3471 B15R2.274 NC=1Oc2ccccc2C(=O)C1C=O Amb19650639 [0,2,0,0,0,0|1,0,1]=4 3472 B15R2.274 NC=1Oc2ccccc2C(=O)C1CO Amb18278230 [0,2,0,0,0,0|1,0,0]=3 3473 B15R2.274 Nc1c(CO)c(Cl)[n]c2ccccc21 Amb25165768 [0,2,0,0,0,0|2,0,0]=4 3474 B15R2.274 O=C1Oc2ccccc2C(Cl)=C1C=O Amb18528898 [0,2,0,0,0,0|0,0,1]=3 3475 B15R2.274 O=Cc1c(=O)oc2c(c1O)cccc2 Amb1968227 [0,2,0,0,0,0|0,0,1]=3 3476 B15R2.274 OC1=C(C=O)C(=O)Nc2ccccc21 Amb18650081 [0,2,0,0,0,0|1,0,1]=4 3477 B15R2.274 OC1=C(C=O)C(=O)Oc2ccccc21 Amb18650315 [0,2,0,0,0,0|0,0,1]=3 3478 B15R2.274 OCc1c(Br)[n]c2ccccc2c1Br Amb25669100 [0,2,0,0,0,0|2,0,0]=4 3479 B15R2.274 O\N=C\1/C(=O)Nc2ccccc2C1=O Amb22520701 [0,2,0,0,0,0|1,0,0]=3 3480 B15R2.274 O\N=C\1/C(=O)c2ccc[n]c2NC1=O Amb21934692 [0,2,0,0,0,0|2,0,0]=4 3481 B15R2.274 Oc1[n]c2ccccc2c(Cl)c1C=O Amb22753733 [0,2,0,0,0,0|2,0,0]=4 3482 B15R2.274 Oc1cc2ccccc2c(O)c1N=O Amb24737458 [0,2,0,0,0,0|1,0,0]=3 3483 B15R2.888 C=CCC1=Cc2ccccc2OC1=O Amb24638419 [0,2,0,0,0,0|1,0,0]=3 3484 B15R2.888 C=CCc1cc2ccccc2cc1O Amb25142630 [0,2,0,0,0,0|2,0,0]=4 3485 B15R2.888 CCNc1cc2ccccc2cc1O Amb24358091 [0,2,0,0,0,0|2,0,0]=4 3486 B15R2.888 CCOC1=Cc2ccccc2NC1=O Amb25289170 [0,2,0,0,0,0|1,0,0]=3 3487 B15R2.888 CCOC1=Nc2ccccc2NC1=O Amb19651674 [0,2,0,0,0,0|2,0,0]=4 3488 B15R2.888 CCOc1[n]c2ccccc2cc1O Amb24648936 [0,2,0,0,0,0|1,0,1]=4 3489 B15R2.888 CCOc1cc2ccccc2cc1Br Amb24578822 [0,2,0,0,0,0|2,0,0]=4 3490 B15R2.888 CCOc1cc2ccccc2cc1I Amb24517309 [0,2,0,0,0,0|2,0,0]=4 3491 B15R2.888 CNCC1=Cc2ccccc2NC1=O Amb18563363 [0,2,0,0,0,0|2,0,0]=4 3492 B15R2.888 CNCc1cc2ccccc2cc1O Amb25208618 [0,2,0,0,0,0|2,0,0]=4 3493 B15R2.888 COCc1cc2ccccc2[n]c1Cl Amb25164672 [0,2,0,0,0,0|2,0,0]=4 3494 B15R2.888 COCc1cc2ccccc2[n]c1N Amb18284875 [0,2,0,0,0,0|2,0,0]=4 3495 B15R2.888 CO\N=C/1\Sc2ccccc2NC1=O Amb25178112 [0,2,0,0,0,0|2,0,0]=4 3496 B15R2.888 C\N=C\C1=Cc2ccccc2NC1=O Amb19778274 [0,2,0,0,0,0|2,0,0]=4 3497 B15R2.888 C\N=C\c1cc2ccccc2cc1O Amb24567935 [0,2,0,0,0,0|2,0,0]=4 3498 B15R2.888 Cc1[n]c2ccccc2cc1CCO Amb25769351 [0,2,0,0,0,0|2,0,0]=4 3499 B15R2.888 N#CCC1=Cc2ccccc2NC1=O Amb18528574 [0,2,0,0,0,0|2,0,0]=4 3500 B15R2.888 N#CCC1=Cc2ccccc2OC1=O Amb25178617 [0,2,0,0,0,0|1,0,0]=3 3501 B15R2.888 N#CCc1cc2ccccc2cc1O Amb25828992 [0,2,0,0,0,0|2,0,0]=4 3502 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18010538 [0,2,0,0,0,0|2,0,0]=4 3503 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18909682 [0,2,0,0,0,0|2,0,0]=4 3504 B15R2.888 NCCc1cc2ccccc2cc1O Amb25664915 [0,2,0,0,0,0|2,0,0]=4 3505 B15R2.888 NSCC1=Cc2ccccc2OC1=N Amb21948589 [0,2,0,0,0,0|1,1,0]=4 3506 B15R2.888 NSCC1=Cc2ccccc2OC1=O Amb21948590 [0,2,0,0,0,0|0,1,0]=3 3507 B15R2.888 Nc1[n]c2ccccc2cc1\C=N\O Amb24498380 [0,2,0,0,0,0|2,0,0]=4 3508 B15R2.888 O=C1Nc2ccccc2C=C1CCCl Amb22723323 [0,2,0,0,0,0|2,0,0]=4 3509 B15R2.888 O=C1Oc2ccccc2C=C1CCBr Amb22347714 [0,2,0,0,0,0|1,0,0]=3 3510 B15R2.888 O=C1Oc2ccccc2C=C1CCCl Amb25771071 [0,2,0,0,0,0|1,0,0]=3 3511 B15R2.888 O=C1Oc2ccccc2C=C1CCS Amb25312626 [0,2,0,0,0,0|0,1,0]=3 3512 B15R2.888 O=C1Oc2ccccc2C=C1NC=O Amb24596421 [0,2,0,0,0,0|0,0,1]=3 3513 B15R2.888 OCCC1=Nc2ccccc2NC1=O Amb20245615 [0,2,0,0,0,0|2,0,0]=4 3514 B15R2.888 OCCC1Cc2ccccc2OC1=O Amb25681375 [0,2,0,0,0,0|0,0,2]=4 3515 B15R2.888 OCSC1=Cc2ccccc2OC1=O Amb25352102 [0,2,0,0,0,0|0,0,0]=2 3516 B15R2.888 ON=Cc1cc2ccccc2nc1Cl Amb11209112 [0,2,0,0,0,0|2,0,0]=4 3517 B15R2.888 ON\C=C/1\C=c2ccccc2=NC1=O Amb22270131 [0,2,0,0,0,0|1,0,0]=3 3518 B15R2.888 O\N=C\C1=Cc2ccccc2NC1=O Amb19372570 [0,2,0,0,0,0|1,0,0]=3 3519 B15R2.888 O\N=C\C1=Cc2ccccc2NC1=S Amb24753918 [0,2,0,0,0,0|1,1,0]=4 3520 B15R2.888 O\N=C\c1cc2ccccc2nc1Cl Amb1152653 [0,2,0,0,0,0|2,0,0]=4 3521 B15R2.888 Oc1[n]c2ccccc2cc1CNO Amb25680219 [0,2,0,0,0,0|1,0,1]=4 3522 B15R2.888 Oc1cc2ccccc2cc1CCO Amb18129768 [0,2,0,0,0,0|1,0,1]=4 3523 B15R2.888 Oc1cc2ccccc2cc1N=C=O Amb25040006 [0,2,0,0,0,0|1,0,0]=3 3524 B15R2.888 Oc1cc2ccccc2cc1\C=N\O Amb25707038 [0,2,0,0,0,0|1,0,1]=4 3525 B15R2.888 [N-]=[N+]=NC1=Cc2ccccc2OC1=O Amb25258788 [0,2,0,0,0,0|1,0,0]=3 3526 B15R2.984 C=C(F)C1=Cc2ccccc2OC1=O Amb24638286 [0,2,0,0,0,0|1,0,0]=3 3527 B15R2.984 CC(=O)C1=Cc2ccccc2OC1=O Amb18364021 [0,2,0,0,0,0|0,0,1]=3 3528 B15R2.984 CC(=O)c1cc2ccccc2[n]c1O Amb22396163 [0,2,0,0,0,0|2,0,0]=4 3529 B15R2.984 CC(=O)c1cc2ccccc2cc1N Amb18129530 [0,2,0,0,0,0|2,0,0]=4 3530 B15R2.984 CC(=O)c1cc2ccccc2cc1O Amb18129613 [0,2,0,0,0,0|1,0,0]=3 3531 B15R2.984 CC(=O)c1cc2ccccc2oc1=O Amb1211906 [0,2,0,0,0,0|0,0,1]=3 3532 B15R2.984 CC(Br)C1=Cc2ccccc2OC1=O Amb24708432 [0,2,0,0,0,0|1,0,0]=3 3533 B15R2.984 CC(O)C1=Cc2ccccc2NC1=O Amb18015645 [0,2,0,0,0,0|1,0,0]=3 3534 B15R2.984 CC(O)C1=Cc2ccccc2OC1=O Amb25215355 [0,2,0,0,0,0|0,0,0]=2 3535 B15R2.984 CC(O)c1[n]c2ccccc2cc1O Amb24403904 [0,2,0,0,0,0|1,0,1]=4 3536 B15R2.984 CC1Oc2ccccc2C=C1C(O)=O Amb24331389 [0,2,0,0,0,0|1,0,1]=4 3537 B15R2.984 CC=1Cc2ccccc2OC1C(O)=O Amb24395639 [0,2,0,0,0,0|1,0,1]=4 3538 B15R2.984 CC=1Oc2ccccc2CC1C(O)=O Amb19148851 [0,2,0,0,0,0|1,0,1]=4 3539 B15R2.984 C[C@@H](N)c1[n]c2ccccc2cc1O Amb25068323 [0,2,0,0,0,0|2,0,0]=4 3540 B15R2.984 C[C@H](N)c1[n]c2ccccc2cc1O Amb25739013 [0,2,0,0,0,0|2,0,0]=4 3541 B15R2.984 Cc1cc2ccccc2[n]c1C(C)=O Amb22498218 [0,2,0,0,0,0|2,0,0]=4 3542 B15R2.984 Cc1cc2ccccc2[n]c1C(N)=O Amb22498478 [0,2,0,0,0,0|2,0,0]=4 3543 B15R2.984 Cc1cc2ccccc2[n]c1C(O)=O Amb18649515 [0,2,0,0,0,0|2,0,0]=4 3544 B15R2.984 Cc1cc2ccccc2cc1[N+]([O-])=O Amb22483990 [0,2,0,0,0,0|2,0,0]=4 3545 B15R2.984 ClC(=O)c1cc2ccccc2cc1O Amb17595532 [0,2,0,0,0,0|1,0,0]=3 3546 B15R2.984 NC(=O)C1=Cc2[n]cccc2OC1=O Amb25724967 [0,2,0,0,0,0|1,0,1]=4 3547 B15R2.984 NC(=O)C1=Cc2ccccc2OC1=N Amb19751870 [0,2,0,0,0,0|1,0,1]=4 3548 B15R2.984 NC(=O)C1=Cc2ccccc2OC1=O Amb19186060 [0,2,0,0,0,0|0,0,1]=3 3549 B15R2.984 NC(=O)C1=Cc2ccccc2SC1=O Amb24084310 [0,2,0,0,0,0|0,1,1]=4 3550 B15R2.984 NC(=O)C=1Nc2ccccc2NC1O Amb25322052 [0,2,0,0,0,0|2,0,0]=4 3551 B15R2.984 NC(=O)c1[n]c2ccccc2cc1Br Amb25851541 [0,2,0,0,0,0|2,0,0]=4 3552 B15R2.984 NC(=O)c1[n]c2ccccc2cc1O Amb24390909 [0,2,0,0,0,0|1,0,0]=3 3553 B15R2.984 NC(=O)c1cc2cc[n]cc2cc1O Amb24756902 [0,2,0,0,0,0|2,0,0]=4 3554 B15R2.984 NC(=O)c1cc2ccccc2[n]c1O Amb18649762 [0,2,0,0,0,0|2,0,0]=4 3555 B15R2.984 NC(=O)c1cc2ccccc2cc1Cl Amb24393479 [0,2,0,0,0,0|2,0,0]=4 3556 B15R2.984 NC(=S)C1=Cc2ccccc2OC1=N Amb21862611 [0,2,0,0,0,0|1,1,0]=4 3557 B15R2.984 NC(=S)C1=Cc2ccccc2OC1=O Amb18108354 [0,2,0,0,0,0|0,1,0]=3 3558 B15R2.984 NC(=S)C1=Cc2ccccc2SC1=O Amb24661359 [0,2,0,0,0,0|0,2,0]=4 3559 B15R2.984 NC(=S)c1cc2ccccc2cc1O Amb24506488 [0,2,0,0,0,0|1,1,0]=4 3560 B15R2.984 NC(=[NH2+])C1=Cc2ccccc2OC1=O Amb20661198 [0,2,0,0,0,0|1,0,0]=3 3561 B15R2.984 NC(=[Se])C1=Cc2ccccc2OC1=N Amb22357639 [0,2,0,0,0,0|1,1,0]=4 3562 B15R2.984 Nc1cc2ccccc2[n]c1C(N)=O Amb23400354 [0,2,0,0,0,0|2,0,0]=4 3563 B15R2.984 Nc1cc2ccccc2[n]c1C(O)=O Amb23401877 [0,2,0,0,0,0|2,0,0]=4 3564 B15R2.984 Nc1cc2ccccc2cc1C(N)=O Amb18944638 [0,2,0,0,0,0|2,0,0]=4 3565 B15R2.984 Nc1nc2ccccc2cc1C(O)=O Amb17777636 [0,2,0,0,0,0|2,0,0]=4 3566 B15R2.984 O=C(Cl)c1cc2ccccc2cc1Cl Amb25301466 [0,2,0,0,0,0|2,0,0]=4 3567 B15R2.984 O=C(Cl)c1cc2ccccc2cc1F Amb24336383 [0,2,0,0,0,0|2,0,0]=4 3568 B15R2.984 O=C1Oc2ccccc2C=C1C(=O)Cl Amb20246903 [0,2,0,0,0,0|0,0,1]=3 3569 B15R2.984 OB(O)C1=Cc2ccccc2NC1=O Amb22372294 [0,2,0,0,0,0|1,0,0]=3 3570 B15R2.984 OB(O)c1cc2ccccc2[n]c1Br Amb22000914 [0,2,0,0,0,0|2,0,0]=4 3571 B15R2.984 OB(O)c1cc2ccccc2cc1I Amb24382670 [0,2,0,0,0,0|2,0,0]=4 3572 B15R2.984 OB(c1cc2ccccc2nc1O)O Amb13883542 [0,2,0,0,0,0|1,0,1]=4 3573 B15R2.984 OC(=O)C1=Cc2[n]cccc2OC1=O Amb18650694 [0,2,0,0,0,0|1,0,0]=3 3574 B15R2.984 OC(=O)C1=Cc2c[n]ccc2NC1=O Amb23440666 [0,2,0,0,0,0|2,0,0]=4 3575 B15R2.984 OC(=O)C1=Cc2cc[n]cc2OC1=O Amb18650693 [0,2,0,0,0,0|1,0,0]=3 3576 B15R2.984 OC(=O)C1=Cc2ccc[n]c2NC1=O Amb18023998 [0,2,0,0,0,0|2,0,0]=4 3577 B15R2.984 OC(=O)C1=Cc2ccc[n]c2SC1=O Amb24342764 [0,2,0,0,0,0|1,1,0]=4 3578 B15R2.984 OC(=O)C1=Cc2ccccc2NC1=O Amb17933901 [0,2,0,0,0,0|1,0,0]=3 3579 B15R2.984 OC(=O)C1=Cc2ccccc2OC1=O Amb17988932 [0,2,0,0,0,0|0,0,0]=2 3580 B15R2.984 OC(=O)C1=Cc2ccccc2SC1=O Amb25309495 [0,2,0,0,0,0|0,1,0]=3 3581 B15R2.984 OC(=O)C1=Nc2c[n]ccc2OC1=O Amb24330706 [0,2,0,0,0,0|2,0,0]=4 3582 B15R2.984 OC(=O)C1=Nc2ccc[n]c2OC1=O Amb24330705 [0,2,0,0,0,0|2,0,0]=4 3583 B15R2.984 OC(=O)C1=Nc2ccccc2NC1=O Amb19957530 [0,2,0,0,0,0|2,0,0]=4 3584 B15R2.984 OC(=O)C1Cc2ccccc2OC1=O Amb18651015 [0,2,0,0,0,0|0,0,2]=4 3585 B15R2.984 OC(=O)c1[n]c2ccccc2cc1Br Amb25732803 [0,2,0,0,0,0|2,0,0]=4 3586 B15R2.984 OC(=O)c1[n]c2ccccc2cc1Cl Amb25183686 [0,2,0,0,0,0|2,0,0]=4 3587 B15R2.984 OC(=O)c1[n]c2ccccc2cc1F Amb22547385 [0,2,0,0,0,0|2,0,0]=4 3588 B15R2.984 OC(=O)c1[n]c2ccccc2cc1S Amb18655001 [0,2,0,0,0,0|1,1,0]=4 3589 B15R2.984 OC(=O)c1cc2ccccc2[n]c1S Amb22396122 [0,2,0,0,0,0|1,1,0]=4 3590 B15R2.984 OC(=O)c1cc2ccccc2cc1Br Amb18667010 [0,2,0,0,0,0|2,0,0]=4 3591 B15R2.984 OC(=O)c1cc2ccccc2cc1C Amb10844302 [0,2,0,0,0,0|2,0,0]=4 3592 B15R2.984 OC(=O)c1cc2ccccc2cc1Cl Amb18130974 [0,2,0,0,0,0|2,0,0]=4 3593 B15R2.984 OC(=O)c1cc2ccccc2cc1N Amb1207395 [0,2,0,0,0,0|2,0,0]=4 3594 B15R2.984 OC(=O)c1cc2ccccc2cc1S Amb17595442 [0,2,0,0,0,0|1,1,0]=4 3595 B15R2.984 OC(=O)c1cc2ccccc2nc1C Amb1107297 [0,2,0,0,0,0|2,0,0]=4 3596 B15R2.984 OC(=O)c1cc2ccccc2nc1Cl Amb1106612 [0,2,0,0,0,0|2,0,0]=4 3597 B15R2.984 OC(=O)c1cc2ccccc2nc1O Amb17665422 [0,2,0,0,0,0|1,0,1]=4 3598 B15R2.984 OC(=O)c1cc2ccccc2oc1=O Amb1148997 [0,2,0,0,0,0|0,0,0]=2 3599 B15R2.984 OC(=O)c1nc2ccccc2nc1O Amb1076430 [0,2,0,0,0,0|2,0,0]=4 3600 B15R2.984 OC(=S)C1=Cc2ccccc2OC1=O Amb24651403 [0,2,0,0,0,0|0,0,0]=2 3601 B15R2.984 OC(O)=C1N=C2C=CC=CC2=CC1=O Amb24359537 [0,2,0,0,0,0|2,0,0]=4 3602 B15R2.984 Oc1[n]c2ccccc2[n]c1C(=O)Cl Amb25254894 [0,2,0,0,0,0|2,0,0]=4 3603 B15R2.984 Oc1cc2[n]cccc2cc1C(=O)Cl Amb25364028 [0,2,0,0,0,0|2,0,0]=4 3604 B15R2.984 Oc1cc2[n]cccc2cc1C(O)=O Amb22304679 [0,2,0,0,0,0|2,0,0]=4 3605 B15R2.984 Oc1cc2ccc[n]c2[n]c1C(O)=O Amb25241521 [0,2,0,0,0,0|2,0,0]=4 3606 B15R2.984 Oc1cc2ccc[n]c2cc1C(=O)Cl Amb24468316 [0,2,0,0,0,0|2,0,0]=4 3607 B15R2.984 Oc1cc2ccc[n]c2cc1C(O)=O Amb23448900 [0,2,0,0,0,0|2,0,0]=4 3608 B15R2.984 Oc1cc2ccccc2[n]c1C(O)=O Amb17933802 [0,2,0,0,0,0|1,0,0]=3 3609 B15R2.984 Oc1cc2ccccc2cc1B(O)O Amb20171354 [0,2,0,0,0,0|1,0,1]=4 3610 B15R2.984 [O-]C(=O)c1cc2ccccc2cc1O Amb22547753 [0,2,0,0,0,0|1,0,0]=3 3611 B15R2.984 [O-][N+](=O)C1=Cc2ccccc2OC1=O Amb19665106 [0,2,0,0,0,0|0,0,1]=3 3612 B15R2.984 [O-][N+](=O)c1cc2ccccc2cc1Cl Amb25168071 [0,2,0,0,0,0|2,0,0]=4 3613 B15R2.984 [O-][N+](=O)c1cc2ccccc2cc1I Amb21954251 [0,2,0,0,0,0|2,0,0]=4 3614 B15R2.1754 COC1=Cc2ccc(O)cc2OC1=O Amb18651005 [0,2,0,0,0,0|0,0,0]=2 3615 B15R2.1754 COC1=Nc2ccc(Cl)cc2NC1=O Amb25137150 [0,2,0,0,0,0|2,0,0]=4 3616 B15R2.1754 COc1[n]c2ccc(N)cc2[nH]c1=O Amb24091988 [0,2,0,0,0,0|2,0,0]=4 3617 B15R2.1754 Cc1cc2NC(=O)C(=Cc2cc1)C#N Amb18527855 [0,2,0,0,0,0|2,0,0]=4 3618 B15R2.1754 Cc1cc2NC(=O)C(=Cc2cc1)C=O Amb18014584 [0,2,0,0,0,0|1,0,1]=4 3619 B15R2.1754 Cc1cc2NC(=O)C(C=C)=Cc2cc1 Amb25332632 [0,2,0,0,0,0|2,0,0]=4 3620 B15R2.1754 Cc1cc2NC(=O)C(CCl)=Cc2cc1 Amb18015273 [0,2,0,0,0,0|2,0,0]=4 3621 B15R2.1754 Cc1cc2NC(=O)C(CN)=Cc2cc1 Amb18015330 [0,2,0,0,0,0|2,0,0]=4 3622 B15R2.1754 Cc1cc2NC(=O)C(CO)=Cc2cc1 Amb18015651 [0,2,0,0,0,0|1,0,0]=3 3623 B15R2.1754 Cc1cc2OC(=O)C(=Cc2cc1)C#N Amb18022765 [0,2,0,0,0,0|1,0,0]=3 3624 B15R2.1754 Cc1cc2cc(Br)ccc2[n]c1C=O Amb24378913 [0,2,0,0,0,0|2,0,0]=4 3625 B15R2.1754 Cc1cc2cc(C)c(C=O)[n]c2cc1 Amb25071433 [0,2,0,0,0,0|2,0,0]=4 3626 B15R2.1754 Cc1cc2cc(O)c(cc2cc1)OC Amb25807605 [0,2,0,0,0,0|1,0,1]=4 3627 B15R2.1754 N#CC1=Cc2ccc(Br)cc2NC1=O Amb18527868 [0,2,0,0,0,0|2,0,0]=4 3628 B15R2.1754 N#CC1=Cc2ccc(Cl)cc2NC1=O Amb18527862 [0,2,0,0,0,0|2,0,0]=4 3629 B15R2.1754 N#CC1=Cc2ccc(F)cc2NC1=O Amb18014603 [0,2,0,0,0,0|2,0,0]=4 3630 B15R2.1754 N#CC1=Cc2ccc(F)cc2OC1=O Amb22049820 [0,2,0,0,0,0|1,0,0]=3 3631 B15R2.1754 N#CC1=Cc2ccc(O)cc2OC1=O Amb20242396 [0,2,0,0,0,0|1,0,0]=3 3632 B15R2.1754 NCC1=Cc2ccc(Br)cc2NC1=O Amb18528499 [0,2,0,0,0,0|2,0,0]=4 3633 B15R2.1754 NCC1=Cc2ccc(Cl)cc2NC1=O Amb18015334 [0,2,0,0,0,0|2,0,0]=4 3634 B15R2.1754 NCC1=Cc2ccc(F)cc2NC1=O Amb18528495 [0,2,0,0,0,0|2,0,0]=4 3635 B15R2.1754 NCC1=Cc2ccc(F)cc2NC1=O Amb22586863 [0,2,0,0,0,0|2,0,0]=4 3636 B15R2.1754 Nc1cc2NC(=O)C(=Cc2cc1)C#N Amb25794187 [0,2,0,0,0,0|2,0,0]=4 3637 B15R2.1754 Nc1cc2NC(=O)C(CCl)=Cc2cc1 Amb24427708 [0,2,0,0,0,0|2,0,0]=4 3638 B15R2.1754 Nc1cc2NC(=O)C(CO)=Cc2cc1 Amb25759173 [0,2,0,0,0,0|1,0,0]=3 3639 B15R2.1754 Nc1cc2OC(=O)C(=Cc2cc1)C#N Amb24662996 [0,2,0,0,0,0|1,0,0]=3 3640 B15R2.1754 O=C1Nc2cc(Br)ccc2C=C1C=O Amb18527825 [0,2,0,0,0,0|1,0,1]=4 3641 B15R2.1754 O=C1Nc2cc(Br)ccc2C=C1CCl Amb18528567 [0,2,0,0,0,0|2,0,0]=4 3642 B15R2.1754 O=C1Nc2cc(Cl)ccc2C=C1C=O Amb18014594 [0,2,0,0,0,0|1,0,1]=4 3643 B15R2.1754 O=C1Nc2cc(Cl)ccc2C=C1CCl Amb18528560 [0,2,0,0,0,0|2,0,0]=4 3644 B15R2.1754 O=C1Nc2cc(F)ccc2C=C1C=O Amb18014591 [0,2,0,0,0,0|1,0,1]=4 3645 B15R2.1754 O=C1Nc2cc(F)ccc2C=C1CCl Amb18015369 [0,2,0,0,0,0|2,0,0]=4 3646 B15R2.1754 OCC1=Cc2ccc(Br)cc2NC1=O Amb18528802 [0,2,0,0,0,0|1,0,0]=3 3647 B15R2.1754 OCC1=Cc2ccc(Cl)cc2NC1=O Amb18015646 [0,2,0,0,0,0|1,0,0]=3 3648 B15R2.1754 OCC1=Cc2ccc(F)cc2NC1=O Amb18528800 [0,2,0,0,0,0|1,0,0]=3 3649 B15R2.1754 OCc1cc2ccc(cc2nc1Cl)C Amb1111362 [0,2,0,0,0,0|2,0,0]=4 3650 B15R2.1754 Oc1cc2NC(=O)C(=Cc2cc1)C=O Amb25758044 [0,2,0,0,0,0|1,0,1]=4 3651 B15R2.1824 Brc1cc2cc(C#N)c(=N)oc2cc1 Amb10070614 [0,2,0,0,0,0|2,0,0]=4 3652 B15R2.1824 CCc1cc2cc(O)ccc2cc1O Amb24633675 [0,2,0,0,0,0|2,0,0]=4 3653 B15R2.1824 COC1=Cc2cc(Br)ccc2NC1=O Amb25106004 [0,2,0,0,0,0|1,0,0]=3 3654 B15R2.1824 COC1=Cc2cc(Cl)c[n]c2NC1=O Amb25287819 [0,2,0,0,0,0|2,0,0]=4 3655 B15R2.1824 COC1=Cc2cc(I)c[n]c2NC1=O Amb25758937 [0,2,0,0,0,0|2,0,0]=4 3656 B15R2.1824 COc1cc2cc(F)ccc2[n]c1Cl Amb25262354 [0,2,0,0,0,0|2,0,0]=4 3657 B15R2.1824 Cc1c[n]c2NC(=O)C(=Cc2c1)OC Amb24668734 [0,2,0,0,0,0|2,0,0]=4 3658 B15R2.1824 Cc1cc2C=C(C#N)C(=N)Oc2cc1 Amb19943010 [0,2,0,0,0,0|2,0,0]=4 3659 B15R2.1824 Cc1cc2C=C(C#N)C(=O)Nc2cc1 Amb18527831 [0,2,0,0,0,0|2,0,0]=4 3660 B15R2.1824 Cc1cc2C=C(C#N)C(=O)Oc2cc1 Amb18022764 [0,2,0,0,0,0|1,0,0]=3 3661 B15R2.1824 Cc1cc2C=C(C=O)C(=O)Nc2cc1 Amb18014585 [0,2,0,0,0,0|1,0,1]=4 3662 B15R2.1824 Cc1cc2C=C(CCl)C(=O)Nc2cc1 Amb18528428 [0,2,0,0,0,0|2,0,0]=4 3663 B15R2.1824 Cc1cc2C=C(CN)C(=O)Nc2cc1 Amb18015331 [0,2,0,0,0,0|2,0,0]=4 3664 B15R2.1824 Cc1cc2C=C(CN)C(=O)Nc2cc1 Amb18909677 [0,2,0,0,0,0|2,0,0]=4 3665 B15R2.1824 Cc1cc2C=C(CO)C(=O)Nc2cc1 Amb18015682 [0,2,0,0,0,0|1,0,0]=3 3666 B15R2.1824 Cc1cc2C=C(NC)C(=O)Oc2cc1 Amb25114611 [0,2,0,0,0,0|1,0,0]=3 3667 B15R2.1824 Cc1cc2[n]c(C=O)c(C)cc2cc1 Amb24718261 [0,2,0,0,0,0|2,0,0]=4 3668 B15R2.1824 Cc1cc2cc(OC)c(O)cc2cc1 Amb25263558 [0,2,0,0,0,0|1,0,1]=4 3669 B15R2.1824 Cc1cc2ccc(Cl)cc2[n]c1C=O Amb25694150 [0,2,0,0,0,0|2,0,0]=4 3670 B15R2.1824 Cc1cc2ccc(F)cc2[n]c1C=O Amb25028878 [0,2,0,0,0,0|2,0,0]=4 3671 B15R2.1824 N#CC1=Cc2cc(Br)ccc2NC1=O Amb18527869 [0,2,0,0,0,0|2,0,0]=4 3672 B15R2.1824 N#CC1=Cc2cc(Br)ccc2OC1=O Amb18022770 [0,2,0,0,0,0|1,0,0]=3 3673 B15R2.1824 N#CC1=Cc2cc(Cl)ccc2NC1=O Amb18527863 [0,2,0,0,0,0|2,0,0]=4 3674 B15R2.1824 N#CC1=Cc2cc(Cl)ccc2OC1=O Amb18022769 [0,2,0,0,0,0|1,0,0]=3 3675 B15R2.1824 N#CC1=Cc2cc(F)ccc2NC1=O Amb18527860 [0,2,0,0,0,0|2,0,0]=4 3676 B15R2.1824 N#CC1=Cc2cc(O)ccc2NC1=O Amb25125836 [0,2,0,0,0,0|2,0,0]=4 3677 B15R2.1824 N#CC1=Cc2cc(O)ccc2OC1=O Amb24446809 [0,2,0,0,0,0|1,0,0]=3 3678 B15R2.1824 N=C1Oc2ccc(Br)cc2C=C1C#N Amb19894962 [0,2,0,0,0,0|2,0,0]=4 3679 B15R2.1824 NCC1=Cc2cc(Br)ccc2NC1=O Amb18528500 [0,2,0,0,0,0|2,0,0]=4 3680 B15R2.1824 NCC1=Cc2cc(Cl)ccc2NC1=O Amb18015335 [0,2,0,0,0,0|2,0,0]=4 3681 B15R2.1824 NCC1=Cc2cc(Cl)ccc2OC1=O Amb18913832 [0,2,0,0,0,0|1,0,0]=3 3682 B15R2.1824 NCC1=Cc2cc(F)ccc2NC1=O Amb18528496 [0,2,0,0,0,0|2,0,0]=4 3683 B15R2.1824 Nc1cc2ccc(Br)cc2[n]c1C=O Amb23400483 [0,2,0,0,0,0|2,0,0]=4 3684 B15R2.1824 O=C1Nc2ccc(Br)cc2C=C1C=O Amb18372852 [0,2,0,0,0,0|1,0,1]=4 3685 B15R2.1824 O=C1Nc2ccc(Br)cc2C=C1CCl Amb18528568 [0,2,0,0,0,0|2,0,0]=4 3686 B15R2.1824 O=C1Nc2ccc(Cl)cc2C=C1C=O Amb18014595 [0,2,0,0,0,0|1,0,1]=4 3687 B15R2.1824 O=C1Nc2ccc(Cl)cc2C=C1CBr Amb24427585 [0,2,0,0,0,0|2,0,0]=4 3688 B15R2.1824 O=C1Nc2ccc(Cl)cc2C=C1CCl Amb18363950 [0,2,0,0,0,0|2,0,0]=4 3689 B15R2.1824 O=C1Nc2ccc(F)cc2C=C1C=O Amb18014592 [0,2,0,0,0,0|1,0,1]=4 3690 B15R2.1824 O=C1Nc2ccc(F)cc2C=C1CCl Amb18015374 [0,2,0,0,0,0|2,0,0]=4 3691 B15R2.1824 O=C1Oc2ccc(Br)cc2C=C1CCl Amb24732183 [0,2,0,0,0,0|1,0,0]=3 3692 B15R2.1824 O=C1Oc2ccc(Cl)cc2C=C1CCl Amb25761218 [0,2,0,0,0,0|1,0,0]=3 3693 B15R2.1824 O=C1Oc2ccc(F)cc2C=C1CCl Amb25683475 [0,2,0,0,0,0|1,0,0]=3 3694 B15R2.1824 OCC1=Cc2cc(Br)ccc2NC1=O Amb18528803 [0,2,0,0,0,0|1,0,0]=3 3695 B15R2.1824 OCC1=Cc2cc(Cl)ccc2NC1=O Amb18015647 [0,2,0,0,0,0|1,0,0]=3 3696 B15R2.1824 OCC1=Cc2cc(F)ccc2NC1=O Amb18528763 [0,2,0,0,0,0|1,0,0]=3 3697 B15R2.1824 Oc1cc2C=C(C=O)C(=O)Oc2cc1 Amb25699164 [0,2,0,0,0,0|0,0,1]=3 3698 B15R2.1824 Oc1cc2cc(C#N)c(=N)oc2cc1 Amb16227384 [0,2,0,0,0,0|2,0,0]=4 3699 B15R2.1824 Oc1cc2cc(C=O)c(O)cc2cc1 Amb25371851 [0,2,0,0,0,0|1,0,0]=3 3700 B15R2.1824 Oc1cc2ccc(Br)cc2cc1C=O Amb24638391 [0,2,0,0,0,0|1,0,0]=3 3701 B15R2.1824 Oc1cc2ccc(Cl)cc2cc1C=O Amb25234243 [0,2,0,0,0,0|1,0,0]=3 3702 B15R2.2039 COC1=Cc2cccc(Br)c2NC1=O Amb24507901 [0,2,0,0,0,0|1,0,0]=3 3703 B15R2.2039 COc1cc2cccc(F)c2[n]c1Cl Amb25844955 [0,2,0,0,0,0|2,0,0]=4 3704 B15R2.2039 Cc1cccc2C=C(C#N)C(=O)Nc21 Amb18527854 [0,2,0,0,0,0|2,0,0]=4 3705 B15R2.2039 Cc1cccc2C=C(C#N)C(=O)Oc21 Amb18022766 [0,2,0,0,0,0|1,0,0]=3 3706 B15R2.2039 Cc1cccc2C=C(C=O)C(=O)Nc21 Amb18014583 [0,2,0,0,0,0|1,0,1]=4 3707 B15R2.2039 Cc1cccc2C=C(CCl)C(=O)Nc21 Amb18015385 [0,2,0,0,0,0|2,0,0]=4 3708 B15R2.2039 Cc1cccc2C=C(CN)C(=O)Nc21 Amb18015329 [0,2,0,0,0,0|2,0,0]=4 3709 B15R2.2039 Cc1cccc2C=C(CO)C(=O)Nc21 Amb18015689 [0,2,0,0,0,0|1,0,0]=3 3710 B15R2.2039 N#CC1=Cc2cccc(Br)c2NC1=O Amb18527867 [0,2,0,0,0,0|2,0,0]=4 3711 B15R2.2039 N#CC1=Cc2cccc(Cl)c2NC1=O Amb18527861 [0,2,0,0,0,0|2,0,0]=4 3712 B15R2.2039 N#CC1=Cc2cccc(F)c2NC1=O Amb18527859 [0,2,0,0,0,0|2,0,0]=4 3713 B15R2.2039 N#CC1=Cc2cccc(O)c2OC1=O Amb18129661 [0,2,0,0,0,0|1,0,0]=3 3714 B15R2.2039 N=C1Oc2c(O)cccc2C=C1C#N Amb25373021 [0,2,0,0,0,0|2,0,0]=4 3715 B15R2.2039 NCC1=Cc2cccc(Br)c2NC1=O Amb18528498 [0,2,0,0,0,0|2,0,0]=4 3716 B15R2.2039 NCC1=Cc2cccc(Cl)c2NC1=O Amb18015333 [0,2,0,0,0,0|2,0,0]=4 3717 B15R2.2039 NCC1=Cc2cccc(F)c2NC1=O Amb18528494 [0,2,0,0,0,0|2,0,0]=4 3718 B15R2.2039 Nc1cccc2C=C(CO)C(=O)Oc21 Amb25664265 [0,2,0,0,0,0|0,0,0]=2 3719 B15R2.2039 O=C1Nc2c(Br)cccc2C=C1C=O Amb18527824 [0,2,0,0,0,0|1,0,1]=4 3720 B15R2.2039 O=C1Nc2c(Br)cccc2C=C1CCl Amb18528566 [0,2,0,0,0,0|2,0,0]=4 3721 B15R2.2039 O=C1Nc2c(C=C1CCl)cccc2Cl Amb18015379 [0,2,0,0,0,0|2,0,0]=4 3722 B15R2.2039 O=C1Nc2c(Cl)cccc2C=C1C=O Amb18014593 [0,2,0,0,0,0|1,0,1]=4 3723 B15R2.2039 O=C1Nc2c(F)cccc2C=C1C=O Amb18014590 [0,2,0,0,0,0|1,0,1]=4 3724 B15R2.2039 O=C1Nc2c(F)cccc2C=C1CCl Amb18015350 [0,2,0,0,0,0|2,0,0]=4 3725 B15R2.2039 OCc1cc2cccc(c2nc1Cl)C Amb1111428 [0,2,0,0,0,0|2,0,0]=4 3726 B15R2.2393 C=CC1=Cc2c(O)cccc2OC1=O Amb24380772 [0,2,0,0,0,0|1,0,0]=3 3727 B15R2.2393 COC1=Cc2c(Br)cccc2NC1=O Amb25832776 [0,2,0,0,0,0|1,0,0]=3 3728 B15R2.2393 COC1=Cc2c(Cl)cc[n]c2NC1=O Amb24556115 [0,2,0,0,0,0|2,0,0]=4 3729 B15R2.2393 COC1=Cc2c(Cl)cccc2NC1=O Amb25779420 [0,2,0,0,0,0|1,0,0]=3 3730 B15R2.2393 COC1=Cc2c(I)cc[n]c2NC1=O Amb24389720 [0,2,0,0,0,0|2,0,0]=4 3731 B15R2.2393 COc1cc2c(F)cccc2[n]c1Cl Amb25081527 [0,2,0,0,0,0|2,0,0]=4 3732 B15R2.2393 Cc1cc2cccc(Cl)c2[n]c1C=O Amb24643927 [0,2,0,0,0,0|2,0,0]=4 3733 B15R2.2393 Cc1cc2cccc(F)c2[n]c1C=O Amb25716902 [0,2,0,0,0,0|2,0,0]=4 3734 B15R2.2393 Cc1cccc2NC(=O)C(=Cc12)OC Amb25806022 [0,2,0,0,0,0|1,0,0]=3 3735 B15R2.2393 N=C1Oc2cccc(O)c2C=C1C#N Amb24357149 [0,2,0,0,0,0|2,0,0]=4 3736 B15R2.2393 O=Cc1nc2c(C)cccc2cc1C Amb17594785 [0,2,0,0,0,0|2,0,0]=4 3737 B15R2.21243 CC1=C(C=O)Oc2ccccc2C1=O Amb18649746 [0,2,0,0,0,0|1,0,0]=3 3738 B15R2.21243 CC=1C(=O)c2ccccc2OC1SC Amb25780986 [0,2,0,0,0,0|1,1,0]=4 3739 B15R2.21243 CCC1=Cc2ccccc2N(C)C1=O Amb25814513 [0,2,0,0,0,0|2,0,0]=4 3740 B15R2.21243 CN1C(=O)C(=Cc2ccccc12)C#N Amb18528835 [0,2,0,0,0,0|2,0,0]=4 3741 B15R2.21243 CN1C(=O)C(CCl)=Cc2ccccc12 Amb19516787 [0,2,0,0,0,0|2,0,0]=4 3742 B15R2.21243 CN1C(=O)C(CN)=Cc2ccccc12 Amb18280924 [0,2,0,0,0,0|2,0,0]=4 3743 B15R2.21243 CN1C(=O)C(CO)=Cc2ccccc12 Amb18006219 [0,2,0,0,0,0|1,0,0]=3 3744 B15R2.21243 CN1c2ccccc2C=C(C=O)C1=O Amb18526958 [0,2,0,0,0,0|1,0,1]=4 3745 B15R2.21243 CNC=1Oc2ccccc2C(=O)C1O Amb25743393 [0,2,0,0,0,0|1,0,0]=3 3746 B15R2.21243 COC1=Cc2ccccc2C(=O)C1=O Amb24744460 [0,2,0,0,0,0|1,0,0]=3 3747 B15R2.21243 COc1cc2ccccc2c(Br)c1O Amb21926717 [0,2,0,0,0,0|1,0,1]=4 3748 B15R2.21243 COc1cc2ccccc2c(O)c1O Amb18650354 [0,2,0,0,0,0|1,0,1]=4 3749 B15R2.21243 COc1nc2ccccc2n(c1=O)C Amb10553835 [0,2,0,0,0,0|2,0,0]=4 3750 B15R2.21243 C[n]1c(=O)c(CBr)cc2ccccc12 Amb24085330 [0,2,0,0,0,0|2,0,0]=4 3751 B15R2.21243 Cc1c(O)c(cc2ccccc12)OC Amb25767803 [0,2,0,0,0,0|1,0,1]=4 3752 B15R2.21243 ClCc1cc2ccccc2n(c1=O)C Amb1102201 [0,2,0,0,0,0|2,0,0]=4 3753 B15R2.21243 OCc1cc2ccccc2n(c1=O)C Amb1398198 [0,2,0,0,0,0|1,0,0]=3 3754 B15R2.21243 Oc1c(Br)c2ccccc2cc1C=O Amb18667009 [0,2,0,0,0,0|1,0,0]=3 3755 B15R2.21243 Oc1c(Br)c2ccccc2cc1CO Amb24685104 [0,2,0,0,0,0|1,0,1]=4 3756 B15R2.1007 CC1=C(O)c2cc(Cl)ccc2OC1=O Amb19261951 [0,2,0,0,0,0|1,0,0]=3 3757 B15R2.1007 CC1=C(O)c2cc(F)ccc2NC1=O Amb24592612 [0,2,0,0,0,0|2,0,0]=4 3758 B15R2.1007 CC1=C(O)c2cc(F)ccc2OC1=O Amb25848616 [0,2,0,0,0,0|1,0,0]=3 3759 B15R2.1007 CC=1C(=O)Oc2ccc(O)cc2C1C Amb18650355 [0,2,0,0,0,0|1,0,0]=3 3760 B15R2.1007 CC=1C(=O)c2cc(O)ccc2OC1C Amb25834336 [0,2,0,0,0,0|2,0,0]=4 3761 B15R2.1007 CC=1Nc2ccc(Cl)cc2C(=O)C1O Amb25758993 [0,2,0,0,0,0|2,0,0]=4 3762 B15R2.1007 CN1C(=O)Oc2ccc(F)cc2C1=O Amb24643911 [0,2,0,0,0,0|2,0,0]=4 3763 B15R2.1007 Cc1cc2C(O)=C(Br)C(=O)Nc2cc1 Amb23533634 [0,2,0,0,0,0|2,0,0]=4 3764 B15R2.1007 Cc1cc2C(O)=C(C)C(=O)Oc2cc1 Amb20247476 [0,2,0,0,0,0|1,0,0]=3 3765 B15R2.1007 Cc1cc2C(O)=C(Cl)C(=O)Nc2cc1 Amb25324130 [0,2,0,0,0,0|2,0,0]=4 3766 B15R2.1007 Cc1cc2C(O)=C(I)C(=O)Nc2cc1 Amb20662505 [0,2,0,0,0,0|2,0,0]=4 3767 B15R2.1007 Cc1cc2C(O)=C(N)C(=O)Nc2cc1 Amb25114660 [0,2,0,0,0,0|2,0,0]=4 3768 B15R2.1007 Cc1cc2C(O)=C(N)C(=O)Oc2cc1 Amb25164456 [0,2,0,0,0,0|1,0,0]=3 3769 B15R2.1007 Cc1cc2c(cc(Cl)c(O)c2O)cc1 Amb24354610 [0,2,0,0,0,0|2,0,0]=4 3770 B15R2.1007 Cc1cc2c(cc(O)c(C)c2O)cc1 Amb25263101 [0,2,0,0,0,0|2,0,0]=4 3771 B15R2.1007 Cc1cc2c(cc1)OC(=O)C(Cl)C2=O Amb24574053 [0,2,0,0,0,0|1,0,1]=4 3772 B15R2.1007 Cc1cc2ccc(N)cc2[n](C)c1=O Amb24091979 [0,2,0,0,0,0|2,0,0]=4 3773 B15R2.1007 OC1=C(Br)C(=O)Nc2ccc(Cl)cc21 Amb25304038 [0,2,0,0,0,0|2,0,0]=4 3774 B15R2.1007 OC=1C(=O)Oc2ccc(Cl)cc2C1O Amb25071163 [0,2,0,0,0,0|0,0,0]=2 3775 B15R2.1007 ON1C(=O)Cc2ccc(I)cc2C1=O Amb24456998 [0,2,0,0,0,0|2,0,0]=4 3776 B15R2.1007 Oc1c2cc(I)ccc2cc(Cl)c1O Amb22171919 [0,2,0,0,0,0|2,0,0]=4 3777 B15R2.1007 Oc1ccc2CC(=O)N(O)C(=O)c2c1 Amb25142615 [0,2,0,0,0,0|2,0,0]=4 3778 B15R2.6237 CC=1C(=O)Nc2ccccc2C1CC Amb25309508 [0,2,0,0,0,0|2,0,0]=4 3779 B15R2.6237 CC=1C(=O)Nc2ccccc2C1OC Amb25806049 [0,2,0,0,0,0|2,0,0]=4 3780 B15R2.6237 CC=1C(=O)Oc2ccccc2C1OC Amb22753598 [0,2,0,0,0,0|1,0,0]=3 3781 B15R2.6237 CCC1=C(N)C(=O)Oc2ccccc21 Amb24451077 [0,2,0,0,0,0|1,0,0]=3 3782 B15R2.6237 CCN1C(=O)C(N)=Cc2ccccc12 Amb22372129 [0,2,0,0,0,0|2,0,0]=4 3783 B15R2.6237 CCN1C(=O)C(O)=Nc2ccccc12 Amb19651675 [0,2,0,0,0,0|2,0,0]=4 3784 B15R2.6237 CC[n]1c(=O)c(Cl)cc2ccccc12 Amb24085900 [0,2,0,0,0,0|2,0,0]=4 3785 B15R2.6237 CNC1=C(N)C(=O)Oc2ccccc21 Amb19517939 [0,2,0,0,0,0|1,0,0]=3 3786 B15R2.6237 COC=1c2ccccc2OC(=O)C1O Amb22753605 [0,2,0,0,0,0|0,0,0]=2 3787 B15R2.6237 Cc1[n]c2ccccc2c(CN)c1O Amb25857541 [0,2,0,0,0,0|2,0,0]=4 3788 B15R2.6237 Cc1cc2ccccc2c(OC)c1O Amb25723181 [0,2,0,0,0,0|2,0,0]=4 3789 B15R2.6237 OCC1=C(Cl)C(=O)Nc2ccccc21 Amb25278268 [0,2,0,0,0,0|2,0,0]=4 3790 B15R2.6237 Oc1cc2ccccc2c(C=O)c1O Amb18649730 [0,2,0,0,0,0|1,0,1]=4 3791 B15R2.9032 CC1=C(N)c2ccccc2C(=O)C1=O Amb25114160 [0,2,0,0,0,0|2,0,0]=4 3792 B15R2.9032 CC1=C(O)C(=O)c2c(C1=O)cccc2 Amb1967769 [0,2,0,0,0,0|2,0,0]=4 3793 B15R2.9032 CC1=C(O)C(=O)c2ccccc2N1C Amb20242314 [0,2,0,0,0,0|2,0,0]=4 3794 B15R2.9032 CC1=C(O)c2ccccc2C(=O)C1=O Amb24694636 [0,2,0,0,0,0|2,0,0]=4 3795 B15R2.9032 CC1c2ccccc2C(=O)N(O)C1=O Amb25783634 [0,2,0,0,0,0|2,0,0]=4 3796 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1Cl Amb19894905 [0,2,0,0,0,0|2,0,0]=4 3797 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1N Amb18649967 [0,2,0,0,0,0|2,0,0]=4 3798 B15R2.9032 CC=1C(=O)N(C)c2ccccc2C1O Amb19668039 [0,2,0,0,0,0|2,0,0]=4 3799 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1Br Amb23448570 [0,2,0,0,0,0|2,0,0]=4 3800 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1N Amb23448332 [0,2,0,0,0,0|2,0,0]=4 3801 B15R2.9032 CC=1c2ccccc2N(C)C(=O)C1O Amb22751148 [0,2,0,0,0,0|1,0,0]=3 3802 B15R2.9032 CN1C(=O)C(Br)=C(O)c2ccccc12 Amb20660833 [0,2,0,0,0,0|2,0,0]=4 3803 B15R2.9032 CN1C(=O)C(Cl)=C(Cl)c2ccccc12 Amb22447977 [0,2,0,0,0,0|2,0,0]=4 3804 B15R2.9032 CN1C(=O)C(Cl)=C(O)c2ccccc12 Amb19520628 [0,2,0,0,0,0|2,0,0]=4 3805 B15R2.9032 CN1C(=O)C(I)=C(Cl)c2ccccc12 Amb23509158 [0,2,0,0,0,0|2,0,0]=4 3806 B15R2.9032 CN1C(=O)C(I)=C(O)c2ccccc12 Amb19667473 [0,2,0,0,0,0|2,0,0]=4 3807 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc12 Amb18650459 [0,2,0,0,0,0|2,0,0]=4 3808 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc12 Amb21927455 [0,2,0,0,0,0|2,0,0]=4 3809 B15R2.9032 CN1C(=O)C(O)=C(O)c2ccccc12 Amb21912831 [0,2,0,0,0,0|1,0,0]=3 3810 B15R2.9032 CN1c2ccccc2C(=O)C(=O)C1=O Amb22750771 [0,2,0,0,0,0|1,0,1]=4 3811 B15R2.9032 C[n]1c(=O)c(N)c(N)c2ccccc12 Amb24085450 [0,2,0,0,0,0|2,0,0]=4 3812 B15R2.9032 Cc1c2ccccc2c(C)c(O)c1O Amb25044329 [0,2,0,0,0,0|1,0,1]=4 3813 B15R2.9032 NC1=C(Cl)C(=O)C(=O)c2ccccc21 Amb24435366 [0,2,0,0,0,0|2,0,0]=4 3814 B15R2.9032 NC1=C(O)C(=O)c2ccccc2C1=O Amb24183009 [0,2,0,0,0,0|2,0,0]=4 3815 B15R2.9032 Nc1c(O)c(O)c(c2c1cccc2)N Amb17594950 [0,2,0,0,0,0|1,0,1]=4 3816 B15R2.9032 Nc1c(O)c(O)c2ccccc2c1O Amb25109182 [0,2,0,0,0,0|2,0,0]=4 3817 B15R2.9032 O=C1c2ccccc2C(=O)C(=O)C1=O Amb18048565 [0,2,0,0,0,0|1,0,1]=4 3818 B15R2.9032 O=C1c2ccccc2C(=O)C(=O)C1=O Amb19984875 [0,2,0,0,0,0|1,0,1]=4 3819 B15R2.9032 OC1=C(Cl)C(=O)c2c(C1=O)cccc2 Amb1349051 [0,2,0,0,0,0|2,0,0]=4 3820 B15R2.9032 OC1=C(I)C(=O)c2ccccc2C1=O Amb24521292 [0,2,0,0,0,0|2,0,0]=4 3821 B15R2.9032 Oc1c(N)c(O)c(c2c1cccc2)N Amb17594946 [0,2,0,0,0,0|2,0,0]=4 3822 B15R2.9032 Oc1c(O)c(N)c(c2c1cccc2)N Amb17594945 [0,2,0,0,0,0|2,0,0]=4 3823 B15R2.9032 Oc1c(O)c(O)c(c2c1cccc2)O Amb17595014 [0,2,0,0,0,0|1,0,1]=4 3824 B15R2.13612 CC1=C(O)C(=O)Nc2c(Cl)cccc21 Amb25681411 [0,2,0,0,0,0|1,0,0]=3 3825 B15R2.13612 CC1=C(O)c2cccc(Br)c2NC1=O Amb25060386 [0,2,0,0,0,0|2,0,0]=4 3826 B15R2.13612 CC1=C(O)c2cccc(F)c2OC1=O Amb24456925 [0,2,0,0,0,0|1,0,0]=3 3827 B15R2.13612 CC=1C(=O)c2cccc(N)c2OC1C Amb24711295 [0,2,0,0,0,0|2,0,0]=4 3828 B15R2.13612 CC=1Oc2c(cccc2O)C(=O)C1O Amb18650987 [0,2,0,0,0,0|1,0,0]=3 3829 B15R2.13612 CN1C(=O)c2cccc(F)c2OC1=O Amb25801946 [0,2,0,0,0,0|2,0,0]=4 3830 B15R2.13612 Cc1cc2c(N)cccc2[n](C)c1=O Amb24070990 [0,2,0,0,0,0|2,0,0]=4 3831 B15R2.13612 Cc1cccc2C(F)=C(O)C(=O)Nc21 Amb25779409 [0,2,0,0,0,0|1,0,0]=3 3832 B15R2.13612 Cc1cccc2C(O)=C(Cl)C(=O)Nc21 Amb25081387 [0,2,0,0,0,0|2,0,0]=4 3833 B15R2.13612 Cc1cccc2C(O)=C(N)C(=O)Sc21 Amb24640426 [0,2,0,0,0,0|1,1,0]=4 3834 B15R2.13612 Cc1cccc2c1cc(O)c(C)c2C Amb24576018 [0,2,0,0,0,0|2,0,0]=4 3835 B15R2.13612 NC1=C(O)c2cccc(Cl)c2OC1=O Amb25835730 [0,2,0,0,0,0|1,0,0]=3 3836 B15R2.13612 OC=1C(=O)Nc2c(Cl)cc[n]c2C1F Amb25731837 [0,2,0,0,0,0|2,0,0]=4 3837 B15R2.13612 OC=1C(=O)Nc2c(c[n]cc2F)C1F Amb25764365 [0,2,0,0,0,0|2,0,0]=4 3838 B15R2.13612 Oc1cccc2c1OC(=O)C(O)=C2O Amb19886340 [0,2,0,0,0,0|0,0,0]=2 3839 B15R2.61372 CC1=Cc2cccc(C)c2C(=O)C1=O Amb25181133 [0,2,0,0,0,0|2,0,0]=4 3840 B15R2.61372 CC=1C(=O)c2c(N)cccc2OC1C Amb18650107 [0,2,0,0,0,0|2,0,0]=4 3841 B15R2.61372 CN1C(=O)C(F)=Cc2cccc(F)c12 Amb22547155 [0,2,0,0,0,0|2,0,0]=4 3842 B15R2.61372 CN1C(=O)Oc2cccc(O)c2C1=O Amb24614769 [0,2,0,0,0,0|2,0,0]=4 3843 B15R2.61372 ON1C(=O)Nc2cccc(Cl)c2C1=O Amb25121201 [0,2,0,0,0,0|2,0,0]=4 3844 B15R2.61372 Oc1cccc2OC(=O)C(O)=C(O)c12 Amb25116641 [0,2,0,0,0,0|0,0,0]=2 3845 B15R2.63893 CC1=C(Br)C(=O)Oc2cc(O)ccc21 Amb19935634 [0,2,0,0,0,0|1,0,0]=3 3846 B15R2.63893 CC1=C(Cl)C(=O)Oc2cc(O)ccc21 Amb20171421 [0,2,0,0,0,0|1,0,0]=3 3847 B15R2.63893 CC1=C(F)C(=O)Nc2cc(N)ccc21 Amb25690920 [0,2,0,0,0,0|2,0,0]=4 3848 B15R2.63893 CC1=C(F)C(=O)Oc2cc(N)ccc21 Amb24381528 [0,2,0,0,0,0|1,0,0]=3 3849 B15R2.63893 CC1=C(F)C(=O)Oc2cc(O)ccc21 Amb18384134 [0,2,0,0,0,0|1,0,0]=3 3850 B15R2.63893 CC1=C(O)C(=O)Nc2cc(Br)ccc21 Amb24500715 [0,2,0,0,0,0|1,0,0]=3 3851 B15R2.63893 CC1=C(O)c2ccc(N)cc2OC1=O Amb24433309 [0,2,0,0,0,0|1,0,0]=3 3852 B15R2.63893 CC1=Cc2cc(N)ccc2N(C)C1=O Amb22901108 [0,2,0,0,0,0|2,0,0]=4 3853 B15R2.63893 CC=1C(=O)Oc2cc(N)ccc2C1C Amb25164479 [0,2,0,0,0,0|1,0,0]=3 3854 B15R2.63893 CC=1C(=O)Oc2cc(O)ccc2C1C Amb19650861 [0,2,0,0,0,0|1,0,0]=3 3855 B15R2.63893 CC=1C(=O)c2ccc(N)cc2OC1C Amb25138571 [0,2,0,0,0,0|2,0,0]=4 3856 B15R2.63893 CC=1Oc2cc(F)ccc2C(=O)C1N Amb24674234 [0,2,0,0,0,0|2,0,0]=4 3857 B15R2.63893 CC=1Oc2cc(O)ccc2C(=O)C1F Amb25060630 [0,2,0,0,0,0|2,0,0]=4 3858 B15R2.63893 CC=1Oc2cc(O)ccc2C(=O)C1N Amb24079247 [0,2,0,0,0,0|2,0,0]=4 3859 B15R2.63893 CC=1Oc2cc(O)ccc2C(=O)C1O Amb24506150 [0,2,0,0,0,0|1,0,0]=3 3860 B15R2.63893 CN1C(=O)C(O)=Nc2cc(N)ccc12 Amb19882074 [0,2,0,0,0,0|2,0,0]=4 3861 B15R2.63893 CN1C(=O)C(O)=Nc2cc(N)ccc12 Amb21894572 [0,2,0,0,0,0|2,0,0]=4 3862 B15R2.63893 Cc1c(O)c(N)cc2cc(Br)ccc21 Amb25136239 [0,2,0,0,0,0|2,0,0]=4 3863 B15R2.63893 Cc1cc2SC(=O)C(N)=C(O)c2cc1 Amb24359920 [0,2,0,0,0,0|1,1,0]=4 3864 B15R2.63893 Cc1cc2cc(F)ccc2[n](C)c1=O Amb24091670 [0,2,0,0,0,0|2,0,0]=4 3865 B15R2.63893 NC1=C(O)c2ccc(Br)cc2OC1=O Amb24705760 [0,2,0,0,0,0|1,0,0]=3 3866 B15R2.63893 NC1=C(O)c2ccc(Cl)cc2OC1=O Amb25103673 [0,2,0,0,0,0|1,0,0]=3 3867 B15R2.63893 Oc1c(Br)c2ccc(Br)cc2cc1Br Amb24521811 [0,2,0,0,0,0|2,0,0]=4 3868 B15R2.63893 Oc1cc2OC(=O)C(F)C(=O)c2cc1 Amb25200136 [0,2,0,0,0,0|1,0,1]=4 3869 B15R2.63893 Oc1ccc2c(c1)oc(=O)c(c2C)Cl Amb1157535 [0,2,0,0,0,0|1,0,0]=3 3870 B15R2.13981 CC1=Cc2ccc(O)c(O)c2OC1=O Amb24357207 [0,2,0,0,0,0|1,0,0]=3 3871 B15R2.13981 Cc1[n]c2c(cc1O)ccc(F)c2F Amb25114922 [0,2,0,0,0,0|2,0,0]=4 3872 B15R2.13981 Cc1c(Cl)ccc2C=C(O)C(=O)Nc21 Amb25665240 [0,2,0,0,0,0|1,0,0]=3 3873 B15R2.13981 Cc1c(Cl)ccc2NC(=O)C(O)=Cc21 Amb25375657 [0,2,0,0,0,0|1,0,0]=3 3874 B15R2.13981 Cc1c(F)ccc2NC(=O)C(O)=Cc21 Amb24392192 [0,2,0,0,0,0|1,0,0]=3 3875 B15R2.13981 Cc1c2OC(=O)C(O)=Cc2ccc1O Amb24466964 [0,2,0,0,0,0|0,0,0]=2 3876 B15R2.13981 Cc1ccc2OC(=O)C(=O)Nc2c1C Amb25731826 [0,2,0,0,0,0|1,0,1]=4 3877 B15R2.13981 O=C1Nc2c(C=C1Br)ccc(Cl)c2Cl Amb23509995 [0,2,0,0,0,0|2,0,0]=4 3878 B15R2.13981 OC1=Cc2c(Cl)c(F)c[n]c2NC1=O Amb24074696 [0,2,0,0,0,0|2,0,0]=4 3879 B15R2.13981 OC1=Cc2c(ccc(F)c2F)NC1=O Amb25194676 [0,2,0,0,0,0|1,0,0]=3 3880 B15R2.21336 CC1=Cc2cc(CCl)ccc2NC1=O Amb18529720 [0,2,0,0,0,0|2,0,0]=4 3881 B15R2.21336 CC1=Cc2cc(CN)ccc2NC1=O Amb18023596 [0,2,0,0,0,0|2,0,0]=4 3882 B15R2.21336 CC1=Cc2cc(CN)ccc2NC1=O Amb18364025 [0,2,0,0,0,0|2,0,0]=4 3883 B15R2.21336 CC1=Cc2cc(ccc2NC1=O)OC Amb18368687 [0,2,0,0,0,0|2,0,0]=4 3884 B15R2.21336 CC1=Cc2cc(ccc2OC1=O)C=O Amb18649740 [0,2,0,0,0,0|1,0,0]=3 3885 B15R2.21336 CC1=Cc2ccc(CCl)cc2NC1=O Amb18529718 [0,2,0,0,0,0|2,0,0]=4 3886 B15R2.21336 CC1=Cc2ccc(cc2NC1=O)OC Amb18049043 [0,2,0,0,0,0|2,0,0]=4 3887 B15R2.21336 CC1=Nc2ccc(cc2OC1=O)NC Amb25234462 [0,2,0,0,0,0|2,0,0]=4 3888 B15R2.21336 CC1=Nc2ccc(cc2OC1=O)OC Amb24084258 [0,2,0,0,0,0|2,0,0]=4 3889 B15R2.21336 CC=1Oc2cc(ccc2NC1O)OC Amb24558619 [0,2,0,0,0,0|2,0,0]=4 3890 B15R2.21336 COc1cc2C=C(Br)C(=O)Oc2cc1 Amb23580466 [0,2,0,0,0,0|1,0,0]=3 3891 B15R2.21336 COc1cc2C=C(F)C(=O)Nc2cc1 Amb22641637 [0,2,0,0,0,0|2,0,0]=4 3892 B15R2.21336 COc1cc2C=C(N)C(=O)Oc2cc1 Amb18650741 [0,2,0,0,0,0|1,0,0]=3 3893 B15R2.21336 COc1cc2NC(=O)C(Br)=Cc2cc1 Amb25342187 [0,2,0,0,0,0|2,0,0]=4 3894 B15R2.21336 COc1cc2NC(=O)C(F)=Cc2cc1 Amb25205948 [0,2,0,0,0,0|2,0,0]=4 3895 B15R2.21336 COc1cc2cc(O)c(Br)[n]c2cc1 Amb24360524 [0,2,0,0,0,0|2,0,0]=4 3896 B15R2.21336 COc1cc2cc(O)c(Cl)[n]c2cc1 Amb23590874 [0,2,0,0,0,0|2,0,0]=4 3897 B15R2.21336 COc1ccc2C=C(Br)C(=O)Oc2c1 Amb23580467 [0,2,0,0,0,0|1,0,0]=3 3898 B15R2.21336 COc1ccc2C=C(N)C(=O)Oc2c1 Amb18650742 [0,2,0,0,0,0|1,0,0]=3 3899 B15R2.21336 CSc1cc2cc(O)c(O)cc2cc1 Amb24707022 [0,2,0,0,0,0|1,0,1]=4 3900 B15R2.21336 N#Cc1cc2OC(=O)C(=O)Nc2cc1 Amb18129736 [0,2,0,0,0,0|1,0,1]=4 3901 B15R2.21336 N#Cc1cc2cc(F)c(O)cc2cc1 Amb24714604 [0,2,0,0,0,0|2,0,0]=4 3902 B15R2.21336 NCc1cc2cc(O)c(O)cc2cc1 Amb25799682 [0,2,0,0,0,0|1,0,1]=4 3903 B15R2.21336 Nc1[n]c2cc(ccc2cc1O)C#N Amb25338293 [0,2,0,0,0,0|2,0,0]=4 3904 B15R2.21336 O=Cc1cc2NC(=O)C(=O)Oc2cc1 Amb25837321 [0,2,0,0,0,0|1,0,1]=4 3905 B15R2.21336 Oc1cc2ccc(C=O)cc2cc1O Amb25368922 [0,2,0,0,0,0|1,0,1]=4 3906 B15R2.59733 Brc1cc2cc(O)c(nc2c(c1)Br)C Amb2420079 [0,2,0,0,0,0|2,0,0]=4 3907 B15R2.59733 CC1=Cc2cc(N)cc(C)c2NC1=O Amb24345851 [0,2,0,0,0,0|2,0,0]=4 3908 B15R2.59733 Cc1cc(C)cc2NC(=O)C(F)=Cc12 Amb22547380 [0,2,0,0,0,0|2,0,0]=4 3909 B15R2.59733 Cc1cc(Cl)c2C=C(O)C(=O)Nc2c1 Amb24526199 [0,2,0,0,0,0|1,0,0]=3 3910 B15R2.59733 Cc1cc(Cl)cc2C=C(O)C(=O)Nc21 Amb25779408 [0,2,0,0,0,0|1,0,0]=3 3911 B15R2.59733 Cc1cc2C=C(N)C(=O)Oc2c(Br)c1 Amb24672761 [0,2,0,0,0,0|1,0,0]=3 3912 B15R2.59733 Cc1cc2C=C(O)C(=O)Nc2c(C)c1 Amb25723945 [0,2,0,0,0,0|1,0,0]=3 3913 B15R2.59733 Cc1cc2C=C(O)C(=O)Nc2c(Cl)c1 Amb25325941 [0,2,0,0,0,0|1,0,0]=3 3914 B15R2.59733 Cc1cc2OC(=O)C(=O)Nc2c(C)c1 Amb25315141 [0,2,0,0,0,0|1,0,1]=4 3915 B15R2.59733 NC1=Cc2cc(Cl)cc(Cl)c2OC1=O Amb24349057 [0,2,0,0,0,0|1,0,0]=3 3916 B15R2.59733 O=C1Nc2c(C=C1Cl)cc(Cl)cc2Cl Amb23509998 [0,2,0,0,0,0|2,0,0]=4 3917 B15R2.59733 O=C1Nc2c(cc(Cl)cc2Cl)C=C1Br Amb23509996 [0,2,0,0,0,0|2,0,0]=4 3918 B15R2.59733 OC1=Cc2c(Cl)cc(F)cc2NC1=O Amb25254731 [0,2,0,0,0,0|1,0,0]=3 3919 B15R2.59733 OC1=Cc2c(cc(Cl)cc2Cl)NC1=O Amb22263308 [0,2,0,0,0,0|1,0,0]=3 3920 B15R2.59733 OC1=Cc2c(cc(F)cc2F)NC1=O Amb22263310 [0,2,0,0,0,0|1,0,0]=3 3921 B15R2.59733 OC1=Cc2cc(Cl)cc(F)c2NC1=O Amb24526200 [0,2,0,0,0,0|1,0,0]=3 3922 B15R2.59733 OC1=Cc2cc(F)cc(F)c2NC1=O Amb24443769 [0,2,0,0,0,0|1,0,0]=3 3923 B15R2.59733 OC1=Nc2cc(Cl)cc(Cl)c2NC1=O Amb19815277 [0,2,0,0,0,0|2,0,0]=4 3924 B15R2.62227 CC1=Cc2cc(C)c(C)cc2NC1=O Amb18548646 [0,2,0,0,0,0|2,0,0]=4 3925 B15R2.62227 CC1=Cc2cc(Cl)c(Cl)cc2NC1=O Amb22448741 [0,2,0,0,0,0|2,0,0]=4 3926 B15R2.62227 CC1=Cc2cc(O)c(O)cc2OC1=O Amb24309328 [0,2,0,0,0,0|1,0,0]=3 3927 B15R2.62227 Cc1cc2NC(=O)C(=O)Oc2cc1C Amb25276460 [0,2,0,0,0,0|1,0,1]=4 3928 B15R2.62227 Cc1cc2cc(C)c(O)cc2cc1O Amb18649852 [0,2,0,0,0,0|2,0,0]=4 3929 B15R2.62227 Cc1cc2cc(O)c(O)cc2cc1C Amb25142720 [0,2,0,0,0,0|1,0,1]=4 3930 B15R2.62227 O=C1Nc2cc(Cl)c(Cl)cc2C=C1Br Amb25070507 [0,2,0,0,0,0|2,0,0]=4 3931 B15R2.62227 OC1=Cc2cc(Cl)c(Cl)cc2NC1=O Amb25075165 [0,2,0,0,0,0|1,0,0]=3 3932 B15R2.63633 CC1=Cc2c(NC1=O)c(C)ccc2C Amb18049041 [0,2,0,0,0,0|2,0,0]=4 3933 B15R2.63633 CC1=Cc2c(O)ccc(C)c2NC1=O Amb25165787 [0,2,0,0,0,0|2,0,0]=4 3934 B15R2.63633 Cc1cc2c(cc1O)c(O)ccc2O Amb25066424 [0,2,0,0,0,0|2,0,0]=4 3935 B15R2.63633 Cc1ccc(C)c2cc(O)c(C)cc12 Amb25735157 [0,2,0,0,0,0|2,0,0]=4 3936 B15R2.63633 O=C1C=CC(=O)c2c1cc(O)c(c2)O Amb17594932 [0,2,0,0,0,0|1,0,1]=4 3937 B15R2.63633 O=C1Nc2c(C=C1Br)c(Cl)ccc2Cl Amb23449366 [0,2,0,0,0,0|2,0,0]=4 3938 B15R2.63633 O=C1Oc2c(CC1=O)c(F)ccc2F Amb25693169 [0,2,0,0,0,0|0,0,2]=4 3939 B15R2.63633 OC1=Cc2c(F)ccc(Cl)c2NC1=O Amb25738034 [0,2,0,0,0,0|1,0,0]=3 3940 B15R2.63633 OC1=Cc2c(NC1=O)c(F)ccc2F Amb24443770 [0,2,0,0,0,0|1,0,0]=3 3941 B15R2.86973 CC1=Cc2c(cccc2OC)OC1=O Amb25253091 [0,2,0,0,0,0|1,0,0]=3 3942 B15R2.86973 CC1=Cc2cccc(C=O)c2OC1=O Amb18649739 [0,2,0,0,0,0|1,0,0]=3 3943 B15R2.86973 CC1=Cc2cccc(OC)c2NC1=O Amb24404044 [0,2,0,0,0,0|2,0,0]=4 3944 B15R2.86973 CCc1cccc2C=C(F)C(=O)Nc21 Amb22547232 [0,2,0,0,0,0|2,0,0]=4 3945 B15R2.86973 CCc1cccc2NC(=O)C(O)=Cc21 Amb25671982 [0,2,0,0,0,0|1,0,0]=3 3946 B15R2.86973 COc1cccc2C=C(Br)C(=O)Oc12 Amb23580469 [0,2,0,0,0,0|1,0,0]=3 3947 B15R2.86973 COc1cccc2C=C(N)C(=O)Oc12 Amb18650743 [0,2,0,0,0,0|1,0,0]=3 3948 B15R2.86973 COc1cccc2C=C(O)C(=O)Oc12 Amb25789016 [0,2,0,0,0,0|0,0,0]=2 3949 B15R2.86973 COc1cccc2NC(=O)C(F)=Cc12 Amb25165908 [0,2,0,0,0,0|2,0,0]=4 3950 B15R2.86973 COc1cccc2[n]c(Cl)c(O)cc12 Amb25828664 [0,2,0,0,0,0|2,0,0]=4 3951 B15R2.86973 COc1cccc2cc(O)c(Cl)[n]c21 Amb25835767 [0,2,0,0,0,0|2,0,0]=4 3952 B15R2.86973 N#Cc1cccc2C=C(O)C(=O)Nc21 Amb24459788 [0,2,0,0,0,0|1,0,0]=3 3953 B15R2.86973 N#Cc1cccc2NC(=O)C(O)=Cc21 Amb25844574 [0,2,0,0,0,0|1,0,0]=3 3954 B15R2.86973 Nc1[n]c2c(cccc2cc1O)C#N Amb25063204 [0,2,0,0,0,0|2,0,0]=4 3955 B13R2.27 O=C/1C=C\C1=C/c2ccccc2 Amb24544610 [0,0,1,1,0,0|2,0,0]=4 3956 B13R2.27 O=C/1C=C\C1=C\c2ccccc2 Amb25142591 [0,0,1,1,0,0|2,0,0]=4 3957 B13R2.27 O=C/1CC\C1=C/c2ccccc2 Amb25366584 [0,0,1,1,0,0|2,0,0]=4 3958 B13R2.27 O=C/1CS\C1=C/c2ccccc2 Amb24450518 [0,0,1,1,0,0|1,1,0]=4 3959 B13R2.27 O=C/1CS\C1=C\c2ccccc2 Amb17594489 [0,0,1,1,0,0|1,1,0]=4 3960 B13R2.27 O=C/1NC\C1=C/c2ccccc2 Amb24547036 [0,0,1,1,0,0|2,0,0]=4 3961 B13R2.373 NC=1C(=O)OC1c2ccccc2 Amb25360814 [0,0,1,1,0,0|1,0,0]=3 3962 B13R2.373 O=C1C=C(c2ccccc2)C1=O Amb22172059 [0,0,1,1,0,0|1,0,1]=4 3963 B13R2.373 O=C1CC(=C1Cl)c2ccccc2 Amb25706972 [0,0,1,1,0,0|2,0,0]=4 3964 B13R2.373 OC=1C(=O)CC1c2ccccc2 Amb25092955 [0,0,1,1,0,0|1,0,0]=3 3965 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [0,0,1,1,0,0|0,0,2]=4 3966 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [0,0,1,1,0,0|0,0,2]=4 3967 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [0,0,1,1,0,0|0,0,2]=4 3968 B13R2.435 CC(=C)c1[n]c2ccccc2o1 Amb24084443 [0,0,1,1,0,0|2,0,0]=4 3969 B13R2.435 CC(=C)c1cc2ccccc2o1 Amb24084444 [0,0,1,1,0,0|2,0,0]=4 3970 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,0,1,1,0,0|2,0,0]=4 3971 B13R2.435 CC(=O)c1[n]c2ccccc2o1 Amb19957805 [0,0,1,1,0,0|2,0,0]=4 3972 B13R2.435 CC(=O)c1cc2c([nH]1)cccc2 Amb10576614 [0,0,1,1,0,0|2,0,0]=4 3973 B13R2.435 CC(=O)c1cc2c(o1)cccc2 Amb1212626 [0,0,1,1,0,0|1,0,0]=3 3974 B13R2.435 CC(=O)c1cc2c[n]ccc2o1 Amb18830138 [0,0,1,1,0,0|2,0,0]=4 3975 B13R2.435 CC(=O)c1cc2cc[n]cc2o1 Amb18830115 [0,0,1,1,0,0|2,0,0]=4 3976 B13R2.435 C[C@@H](c1cc2c(o1)cccc2)O Amb13952987 [0,0,1,1,0,0|1,0,1]=4 3977 B13R2.435 C[C@H](c1cc2c(o1)cccc2)O Amb13952988 [0,0,1,1,0,0|1,0,1]=4 3978 B13R2.435 ClC(=O)C1=Cc2c(C1)cccc2 Amb10553797 [0,0,1,1,0,0|2,0,0]=4 3979 B13R2.435 NC(=N)c1cc2ccccc2o1 Amb19374967 [0,0,1,1,0,0|2,0,0]=4 3980 B13R2.435 NC(=O)C=1Cc2ccccc2C1 Amb22227964 [0,0,1,1,0,0|2,0,0]=4 3981 B13R2.435 NC(=O)c1[n]c2ccccc2o1 Amb22500295 [0,0,1,1,0,0|2,0,0]=4 3982 B13R2.435 O=C(Cl)c1[n]c2ccccc2o1 Amb24061135 [0,0,1,1,0,0|2,0,0]=4 3983 B13R2.435 O=C(Cl)c1cc2cc[n]cc2o1 Amb24081786 [0,0,1,1,0,0|2,0,0]=4 3984 B13R2.435 O=C(F)c1cc2ccccc2[nH]1 Amb24089088 [0,0,1,1,0,0|2,0,0]=4 3985 B13R2.435 OB(c1cc2c(o1)cccc2)O Amb2447248 [0,0,1,1,0,0|1,0,1]=4 3986 B13R2.435 OC(=O)C1=Cc2c(C1)cccc2 Amb10553818 [0,0,1,1,0,0|1,0,0]=3 3987 B13R2.435 OC(=O)C1Cc2c(O1)cccc2 Amb1154832 [0,0,1,1,0,0|0,0,2]=4 3988 B13R2.435 OC(=O)C=1Cc2ccccc2N1 Amb24078944 [0,0,1,1,0,0|1,0,1]=4 3989 B13R2.435 OC(=O)[C@H]1Cc2ccccc2O1 Amb25210803 [0,0,1,1,0,0|0,0,2]=4 3990 B13R2.435 OC(=O)c1[nH]c2ccccc2[n]1 Amb22499360 [0,0,1,1,0,0|2,0,0]=4 3991 B13R2.435 OC(=O)c1[n]c2[n]cccc2o1 Amb18829106 [0,0,1,1,0,0|2,0,0]=4 3992 B13R2.435 OC(=O)c1[n]c2ccc[n]c2o1 Amb25053322 [0,0,1,1,0,0|2,0,0]=4 3993 B13R2.435 OC(=O)c1c[n]2ccccc2[n]1 Amb19514889 [0,0,1,1,0,0|2,0,0]=4 3994 B13R2.435 OC(=O)c1c[n]2ccccc2[n]1 Amb22587715 [0,0,1,1,0,0|2,0,0]=4 3995 B13R2.435 OC(=O)c1cc2[nH]cccc2[n]1 Amb25816404 [0,0,1,1,0,0|2,0,0]=4 3996 B13R2.435 OC(=O)c1cc2[n]cc[n]c2o1 Amb18829111 [0,0,1,1,0,0|2,0,0]=4 3997 B13R2.435 OC(=O)c1cc2c([nH]1)cccc2 Amb1211920 [0,0,1,1,0,0|1,0,0]=3 3998 B13R2.435 OC(=O)c1cc2c([nH]1)cncc2 Amb16233678 [0,0,1,1,0,0|2,0,0]=4 3999 B13R2.435 OC(=O)c1cc2c([nH]1)nccc2 Amb1141884 [0,0,1,1,0,0|2,0,0]=4 4000 B13R2.435 OC(=O)c1cc2c(o1)cccc2 Amb1203290 [0,0,1,1,0,0|0,0,0]=2 4001 B13R2.435 OC(=O)c1cc2c[n]c[n]c2o1 Amb18142231 [0,0,1,1,0,0|2,0,0]=4 4002 B13R2.435 OC(=O)c1cc2c[n]ccc2[s]1 Amb18648240 [0,0,1,1,0,0|1,1,0]=4 4003 B13R2.435 OC(=O)c1cc2c[n]ccc2o1 Amb18645761 [0,0,1,1,0,0|1,0,0]=3 4004 B13R2.435 OC(=O)c1cc2cc[n]cc2[nH]1 Amb24179200 [0,0,1,1,0,0|2,0,0]=4 4005 B13R2.435 OC(=O)c1cc2cc[n]cc2[s]1 Amb18824745 [0,0,1,1,0,0|1,1,0]=4 4006 B13R2.435 OC(=O)c1cc2cc[n]cc2o1 Amb18645760 [0,0,1,1,0,0|1,0,0]=3 4007 B13R2.435 OC(=O)c1cc2ccc[n]c2[nH]1 Amb21857766 [0,0,1,1,0,0|2,0,0]=4 4008 B13R2.435 OC(=O)c1cc2n(n1)cccc2 Amb2235996 [0,0,1,1,0,0|2,0,0]=4 4009 B13R2.435 OC(=O)c1cc2ncccc2o1 Amb17774703 [0,0,1,1,0,0|1,0,0]=3 4010 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb17622300 [0,0,1,1,0,0|2,0,0]=4 4011 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb1797073 [0,0,1,1,0,0|2,0,0]=4 4012 B13R2.435 OC(=O)c1nc2c(o1)cccc2 Amb10066905 [0,0,1,1,0,0|1,0,0]=3 4013 B13R2.435 OC(=O)c1nc2c(s1)cccc2 Amb17622301 [0,0,1,1,0,0|1,1,0]=4 4014 B13R2.435 OC(=O)c1nc2n(c1)cccc2 Amb1106602 [0,0,1,1,0,0|2,0,0]=4 4015 B13R2.435 OC(=O)c1nc2n(c1)cccc2 Amb15694770 [0,0,1,1,0,0|2,0,0]=4 4016 B13R2.435 OC(=O)c:1:c:c-2:c:c:c:[nH]:c2:[n]1 Amb18944027 [0,0,1,1,0,0|2,0,0]=4 4017 B13R2.435 OC(=S)c1cc2ccccc2o1 Amb25253336 [0,0,1,1,0,0|0,1,0]=3 4018 B13R2.435 OC(O)c1cc2ccccc2o1 Amb25079076 [0,0,1,1,0,0|0,0,2]=4 4019 B13R2.435 O[13C](=O)c1cc2c([nH]1)cccc2 Amb17616073 [0,0,1,1,0,0|1,0,0]=3 4020 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb19651173 [0,0,1,1,0,0|1,0,1]=4 4021 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb19944614 [0,0,1,1,0,0|1,0,1]=4 4022 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb21961465 [0,0,1,1,0,0|1,0,1]=4 4023 B13R2.435 [O-][N+](=O)c1cc2ccccc2o1 Amb19958202 [0,0,1,1,0,0|1,0,1]=4 4024 B13R2.163 O=C1CN=Cc2ccccc2O1 Amb24060690 [0,0,1,1,0,0|2,0,0]=4 4025 B13R2.163 O=C1Oc2ccccc2N=CO1 Amb24376626 [0,0,1,1,0,0|1,0,0]=3 4026 B13R2.292 C=CCc1cccc2occc21 Amb25221947 [0,0,1,1,0,0|2,0,0]=4 4027 B13R2.292 O=CCc1cccc2[s]ccc21 Amb24091110 [0,0,1,1,0,0|1,1,0]=4 4028 B13R2.292 O=CNc1cccc2[nH]ccc12 Amb24440798 [0,0,1,1,0,0|2,0,0]=4 4029 B13R2.292 O=COc1cccc2OCOc21 Amb24436001 [0,0,1,1,0,0|1,0,1]=4 4030 B13R2.1613 O=CC1OC=Cc2ccccc21 Amb24078411 [0,0,1,1,0,0|1,0,0]=3 4031 B13R2.1613 O=CN1CC=Cc2ccccc12 Amb24060063 [0,0,1,1,0,0|2,0,0]=4 4032 B13R2.54 Cc1[n]ccc2oc(C=O)cc21 Amb18830129 [0,0,1,1,0,0|2,0,0]=4 4033 B13R2.54 Cc1cccc2[nH]c(C=O)cc21 Amb25707893 [0,0,1,1,0,0|2,0,0]=4 4034 B13R2.54 Cc1cccc2[s]c(C=O)cc21 Amb18675011 [0,0,1,1,0,0|1,1,0]=4 4035 B13R2.54 Cc1cccc2oc(C=O)cc21 Amb18830290 [0,0,1,1,0,0|1,0,0]=3 4036 B13R2.54 N#Cc1cc2c(O)cccc2o1 Amb24364131 [0,0,1,1,0,0|1,0,1]=4 4037 B13R2.54 Nc1cccc2[nH]c(C=O)cc21 Amb18830226 [0,0,1,1,0,0|2,0,0]=4 4038 B13R2.54 Nc1cccc2oc(C=O)[n]c21 Amb25686567 [0,0,1,1,0,0|2,0,0]=4 4039 B13R2.54 Nc1cccc2oc(C=O)cc21 Amb18830105 [0,0,1,1,0,0|1,0,0]=3 4040 B13R2.54 O=Cc1[n]c2c(Br)cccc2o1 Amb22756790 [0,0,1,1,0,0|2,0,0]=4 4041 B13R2.54 O=Cc1[n]c2c(Cl)cccc2o1 Amb25057912 [0,0,1,1,0,0|2,0,0]=4 4042 B13R2.54 O=Cc1[n]c2c(F)cccc2o1 Amb18828624 [0,0,1,1,0,0|2,0,0]=4 4043 B13R2.54 O=Cc1cc2c(Br)[n]ccc2o1 Amb18160775 [0,0,1,1,0,0|2,0,0]=4 4044 B13R2.54 O=Cc1cc2c(Br)cccc2[nH]1 Amb18755043 [0,0,1,1,0,0|2,0,0]=4 4045 B13R2.54 O=Cc1cc2c(Br)cccc2[s]1 Amb18156449 [0,0,1,1,0,0|1,1,0]=4 4046 B13R2.54 O=Cc1cc2c(Br)cccc2o1 Amb18754939 [0,0,1,1,0,0|1,0,0]=3 4047 B13R2.54 O=Cc1cc2c(Cl)[n]ccc2o1 Amb18648558 [0,0,1,1,0,0|2,0,0]=4 4048 B13R2.54 O=Cc1cc2c(F)cccc2[nH]1 Amb18829493 [0,0,1,1,0,0|2,0,0]=4 4049 B13R2.54 O=Cc1cc2c(F)cccc2[s]1 Amb18141133 [0,0,1,1,0,0|1,1,0]=4 4050 B13R2.54 O=Cc1cc2c([nH]1)cccc2Cl Amb17594598 [0,0,1,1,0,0|2,0,0]=4 4051 B13R2.54 O=Cc1sc2c(c1)c(Cl)ccc2 Amb10975246 [0,0,1,1,0,0|1,1,0]=4 4052 B13R2.54 Oc1[n]ccc2oc(C=O)cc21 Amb18829556 [0,0,1,1,0,0|1,0,0]=3 4053 B13R2.54 Oc1cccc2[nH]c(C=O)cc21 Amb18830119 [0,0,1,1,0,0|1,0,0]=3 4054 B13R2.54 Oc1cccc2[n]c(C=O)[nH]c21 Amb25129509 [0,0,1,1,0,0|2,0,0]=4 4055 B13R2.54 Oc1cccc2[n]c(C=O)[s]c21 Amb25724431 [0,0,1,1,0,0|2,0,0]=4 4056 B13R2.54 Oc1cccc2[s]c(C=O)[n]c21 Amb18824743 [0,0,1,1,0,0|1,1,0]=4 4057 B13R2.15272 C\C(\C=O)=C/1\Cc2ccccc21 Amb25039273 [0,0,1,1,0,0|2,0,0]=4 4058 B13R3.25 C1Oc2[nH]c3ccccc3c21 Amb25378939 [0,0,0,1,1,0|2,0,0]=4 4059 B15R3.4266 c1c2OSNc2cc3ccccc31 Amb24619226 [0,1,0,1,0,0|1,1,0]=4 4060 B15R3.4266 c1c2ccccc2oc3cccc31 Amb25113367 [0,1,0,1,0,0|2,0,0]=4 4061 B15R3.4266 c1o[n]c2cc3ccccc3cc21 Amb25212657 [0,1,0,1,0,0|2,0,0]=4 4062 B15R3.15145 O=C1Cc2cc3ccccc3cc21 Amb25841318 [0,1,0,1,0,0|2,0,0]=4 4063 B11R1.35 CC(=O)\C(\O)=C\c1ccco1 Amb25804329 [0,0,1,0,1,0|2,0,0]=4 4064 B11R1.35 C\C(=C\c1ccc[s]1)\C(O)=O Amb25273294 [0,0,1,0,1,0|2,0,0]=4 4065 B11R1.35 C\C(=C\c1ccoc1)\C(O)=O Amb25829028 [0,0,1,0,1,0|2,0,0]=4 4066 B11R1.35 N\C(=C\c1cc[s]c1)\C(O)=O Amb24729838 [0,0,1,0,1,0|2,0,0]=4 4067 B11R1.35 N\C(=C\c1ccc[nH]1)\C(O)=O Amb24438740 [0,0,1,0,1,0|2,0,0]=4 4068 B11R1.35 N\C(=C\c1ccoc1)\C(O)=O Amb24549139 [0,0,1,0,1,0|2,0,0]=4 4069 B11R1.35 OC(=O)\C(\Br)=C\c1ccco1 Amb25827160 [0,0,1,0,1,0|2,0,0]=4 4070 B11R1.35 OC(=O)\C(\Cl)=C\c1ccc[s]1 Amb24511927 [0,0,1,0,1,0|2,0,0]=4 4071 B11R1.35 OC(=O)\C(\F)=C\c1cc[nH]c1 Amb25859294 [0,0,1,0,1,0|2,0,0]=4 4072 B11R1.35 OC(=O)\C(\F)=C\c1cc[s]c1 Amb24725504 [0,0,1,0,1,0|2,0,0]=4 4073 B11R1.35 OC(=O)\C(\F)=C\c1ccc[nH]1 Amb25735919 [0,0,1,0,1,0|2,0,0]=4 4074 B11R1.35 OC(=O)\C(\S)=C\c1cc[s]c1 Amb25172800 [0,0,1,0,1,0|1,1,0]=4 4075 B11R1.35 OC(=O)\C(\S)=C\c1ccc[nH]1 Amb25238397 [0,0,1,0,1,0|1,1,0]=4 4076 B11R1.35 OC(=O)\C(\S)=C\c1ccc[s]1 Amb18649398 [0,0,1,0,1,0|1,1,0]=4 4077 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,0,1,0,1,0|1,0,0]=3 4078 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,0,1,0,1,0|2,0,0]=4 4079 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [0,0,1,0,1,0|2,0,0]=4 4080 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [0,0,1,0,1,0|2,0,0]=4 4081 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [0,0,1,0,1,0|2,0,0]=4 4082 B11R1.36 C=C(F)C(=O)c1ccccc1 Amb25347602 [0,0,1,0,1,0|1,0,0]=3 4083 B11R1.36 C=[N+]([O-])C(=O)c1ccccc1 Amb24069126 [0,0,1,0,1,0|1,0,1]=4 4084 B11R1.36 CC(=C)C(=O)c1cc[n]cc1 Amb24413658 [0,0,1,0,1,0|2,0,0]=4 4085 B11R1.36 CC(=C)C(=O)c1ccc[n]c1 Amb25139926 [0,0,1,0,1,0|2,0,0]=4 4086 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [0,0,1,0,1,0|1,0,1]=4 4087 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,0,1,0,1,0|2,0,0]=4 4088 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,0,1,0,1,0|1,0,1]=4 4089 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,0,1,0,1,0|0,0,2]=4 4090 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,0,1,0,1,0|1,0,1]=4 4091 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [0,0,1,0,1,0|0,0,2]=4 4092 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [0,0,1,0,1,0|2,0,0]=4 4093 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,0,1,0,1,0|1,0,0]=3 4094 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,0,1,0,1,0|2,0,0]=4 4095 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,1,0,1,0|1,0,1]=4 4096 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,0,1,0,1,0|2,0,0]=4 4097 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,1,0,1,0|1,0,1]=4 4098 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,1,0,1,0|1,0,1]=4 4099 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,0,1,0,1,0|1,0,1]=4 4100 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,0,1,0,1,0|1,0,1]=4 4101 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,0,1,0,1,0|1,0,1]=4 4102 B11R1.36 O=C(C(=S)Cl)c1ccccc1 Amb24096825 [0,0,1,0,1,0|1,1,0]=4 4103 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [0,0,1,0,1,0|1,0,0]=3 4104 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,0,1,0,1,0|1,0,1]=4 4105 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,0,1,0,1,0|0,0,2]=4 4106 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,0,1,0,1,0|1,0,1]=4 4107 B11R1.36 OB(O)C(=O)c1ccccc1 Amb25260688 [0,0,1,0,1,0|2,0,0]=4 4108 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [0,0,1,0,1,0|1,0,1]=4 4109 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [0,0,1,0,1,0|1,0,1]=4 4110 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [0,0,1,0,1,0|1,0,1]=4 4111 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [0,0,1,0,1,0|1,0,1]=4 4112 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,0,1,0,1,0|1,0,1]=4 4113 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,0,1,0,1,0|1,0,1]=4 4114 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,0,1,0,1,0|1,0,1]=4 4115 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,0,1,0,1,0|1,0,1]=4 4116 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,0,1,0,1,0|0,0,1]=3 4117 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,0,1,0,1,0|0,0,1]=3 4118 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,0,1,0,1,0|1,0,1]=4 4119 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,0,1,0,1,0|1,0,1]=4 4120 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,0,1,0,1,0|1,0,1]=4 4121 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,0,1,0,1,0|1,0,1]=4 4122 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,0,1,0,1,0|1,0,1]=4 4123 B11R1.36 OC(Br)C(=O)c1ccccc1 Amb24104060 [0,0,1,0,1,0|1,0,1]=4 4124 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,0,1,0,1,0|1,0,1]=4 4125 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,0,1,0,1,0|0,1,1]=4 4126 B11R1.36 OC(Cl)C(=O)c1ccccc1 Amb24528115 [0,0,1,0,1,0|1,0,1]=4 4127 B11R1.36 OC(c1ccccc1)=C(Cl)Cl Amb24101433 [0,0,1,0,1,0|2,0,0]=4 4128 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,0,1,0,1,0|1,0,1]=4 4129 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,0,1,0,1,0|1,0,1]=4 4130 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,0,1,0,1,0|1,0,1]=4 4131 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,0,1,0,1,0|1,0,1]=4 4132 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,0,1,0,1,0|1,0,1]=4 4133 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,0,1,0,1,0|0,0,2]=4 4134 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,0,1,0,1,0|0,0,2]=4 4135 B11R1.222 C=C(C=C)c1ccccc1O Amb25144658 [0,0,1,0,1,0|2,0,0]=4 4136 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,0,1,0,1,0|2,0,0]=4 4137 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,0,1,0,1,0|1,0,1]=4 4138 B11R1.222 C=CC(O)c1ccccc1O Amb18644420 [0,0,1,0,1,0|1,0,1]=4 4139 B11R1.222 CC(C=O)c1ccccc1O Amb18125106 [0,0,1,0,1,0|1,0,1]=4 4140 B11R1.222 CN(C=O)c1ccccc1O Amb24072010 [0,0,1,0,1,0|2,0,0]=4 4141 B11R1.222 C\C(=C/Br)\c1ccccc1O Amb25188598 [0,0,1,0,1,0|2,0,0]=4 4142 B11R1.222 C\C(=C/C)\c1ccccc1O Amb18124922 [0,0,1,0,1,0|2,0,0]=4 4143 B11R1.222 C\C(=C/Cl)\c1ccccc1O Amb24711474 [0,0,1,0,1,0|2,0,0]=4 4144 B11R1.222 C\C(=C\Br)\c1ccccc1O Amb24582490 [0,0,1,0,1,0|2,0,0]=4 4145 B11R1.222 C\C(=C\C)\c1ccccc1O Amb25707041 [0,0,1,0,1,0|2,0,0]=4 4146 B11R1.222 C\C(=C\Cl)\c1ccccc1O Amb24635743 [0,0,1,0,1,0|2,0,0]=4 4147 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,0,1,0,1,0|0,0,2]=4 4148 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [0,0,1,0,1,0|0,0,2]=4 4149 B11R1.222 Cc1ccccc1[C@@H](O)C=O Amb24722747 [0,0,1,0,1,0|1,0,1]=4 4150 B11R1.222 O/N=C(/O)c1ccccc1O Amb17777872 [0,0,1,0,1,0|1,0,1]=4 4151 B11R1.222 O=C(C=O)c1ccccc1Br Amb18131520 [0,0,1,0,1,0|1,0,1]=4 4152 B11R1.222 O=C(C=O)c1ccccc1Cl Amb18126568 [0,0,1,0,1,0|1,0,1]=4 4153 B11R1.222 O=C(C=O)c1ccccc1F Amb22011841 [0,0,1,0,1,0|1,0,1]=4 4154 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,0,1,0,1,0|1,0,1]=4 4155 B11R1.222 OC(C=O)c1ccccc1F Amb24625145 [0,0,1,0,1,0|1,0,1]=4 4156 B11R1.222 OCC(=O)c1ccccc1Br Amb24639690 [0,0,1,0,1,0|1,0,1]=4 4157 B11R1.222 OCC(=O)c1ccccc1Cl Amb18185665 [0,0,1,0,1,0|1,0,1]=4 4158 B11R1.222 OCC(=O)c1ccccc1F Amb18182895 [0,0,1,0,1,0|1,0,1]=4 4159 B11R1.222 ONC(=O)c1ccccc1O Amb2504335 [0,0,1,0,1,0|2,0,0]=4 4160 B11R1.222 ONC(=O)c1ccccc1S Amb25855420 [0,0,1,0,1,0|2,0,0]=4 4161 B11R1.222 Oc1ccccc1C(=O)C=O Amb25269559 [0,0,1,0,1,0|0,0,1]=3 4162 B11R1.222 Oc1ccccc1C(=O)CO Amb18125347 [0,0,1,0,1,0|1,0,1]=4 4163 B11R1.222 Oc1ccccc1C(F)C=O Amb25062510 [0,0,1,0,1,0|1,0,1]=4 4164 B11R1.222 Oc1ccccc1\C(\O)=N\O Amb21811585 [0,0,1,0,1,0|1,0,1]=4 4165 B11R2.1 BrC1C=Cc2ccccc21 Amb25101590 [1,0,0,0,1,0|1,0,1]=4 4166 B11R2.1 Brc1[n]oc2ccccc21 Amb18187786 [1,0,0,0,1,0|2,0,0]=4 4167 B11R2.1 Brc1c[nH]c2c1cccc2 Amb2447679 [1,0,0,0,1,0|2,0,0]=4 4168 B11R2.1 Brc1ccc2cccc[n]21 Amb18061677 [1,0,0,0,1,0|2,0,0]=4 4169 B11R2.1 Brc1coc2[n]cccc21 Amb18811362 [1,0,0,0,1,0|2,0,0]=4 4170 B11R2.1 Brc1coc2cc[n]cc21 Amb18187801 [1,0,0,0,1,0|2,0,0]=4 4171 B11R2.1 Brc1coc2ccc[n]c21 Amb18187782 [1,0,0,0,1,0|2,0,0]=4 4172 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [1,0,0,0,1,0|1,0,1]=4 4173 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [1,0,0,0,1,0|1,0,1]=4 4174 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [1,0,0,0,1,0|2,0,0]=4 4175 B11R2.1 Cc1cc[n]2ccccc21 Amb24709297 [1,0,0,0,1,0|2,0,0]=4 4176 B11R2.1 Cc1coc2[n]cccc21 Amb21963399 [1,0,0,0,1,0|2,0,0]=4 4177 B11R2.1 Cc1coc2c[n]ccc21 Amb22494706 [1,0,0,0,1,0|2,0,0]=4 4178 B11R2.1 Cc1coc2cc[n]cc21 Amb22494707 [1,0,0,0,1,0|2,0,0]=4 4179 B11R2.1 Cc1coc2ccc[n]c21 Amb22494708 [1,0,0,0,1,0|2,0,0]=4 4180 B11R2.1 Cl[C@@H]1C=Cc2ccccc21 Amb24518031 [1,0,0,0,1,0|1,0,1]=4 4181 B11R2.1 Cl[C@H]1C=Cc2ccccc21 Amb25783948 [1,0,0,0,1,0|1,0,1]=4 4182 B11R2.1 Clc1c[nH]c2ccccc12 Amb17672708 [1,0,0,0,1,0|2,0,0]=4 4183 B11R2.1 Clc1coc2c[n]ccc21 Amb24406651 [1,0,0,0,1,0|2,0,0]=4 4184 B11R2.1 Clc1coc2ccc[n]c21 Amb24509512 [1,0,0,0,1,0|2,0,0]=4 4185 B11R2.1 Clc1coc2ccccc21 Amb21963868 [1,0,0,0,1,0|1,0,0]=3 4186 B11R2.1 Fc1c[nH]c2c1cccc2 Amb10841217 [1,0,0,0,1,0|2,0,0]=4 4187 B11R2.1 Fc1coc2ccccc21 Amb24409168 [1,0,0,0,1,0|1,0,0]=3 4188 B11R2.1 Ic1[n]oc2ccccc21 Amb25320384 [1,0,0,0,1,0|2,0,0]=4 4189 B11R2.1 Ic1c[nH]c2c1cccc2 Amb17134442 [1,0,0,0,1,0|2,0,0]=4 4190 B11R2.1 Ic1c[s]c2ccccc21 Amb22002561 [1,0,0,0,1,0|1,1,0]=4 4191 B11R2.1 Ic1coc2c[n]ccc21 Amb24644003 [1,0,0,0,1,0|2,0,0]=4 4192 B11R2.1 Ic1coc2ccccc21 Amb24622374 [1,0,0,0,1,0|1,0,0]=3 4193 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [1,0,0,0,1,0|1,0,1]=4 4194 B11R2.1 Nc1[nH]cc2ccccc21 Amb24479060 [1,0,0,0,1,0|2,0,0]=4 4195 B11R2.1 Nc1c[s]c2ccccc21 Amb19957699 [1,0,0,0,1,0|1,1,0]=4 4196 B11R2.1 Nc1ccc2cccc[n]21 Amb18061678 [1,0,0,0,1,0|2,0,0]=4 4197 B11R2.1 Nc1coc2[n]cccc21 Amb18522246 [1,0,0,0,1,0|2,0,0]=4 4198 B11R2.1 Nc1coc2ccc[n]c21 Amb24742644 [1,0,0,0,1,0|2,0,0]=4 4199 B11R2.1 Nc1coc2ccccc21 Amb24371464 [1,0,0,0,1,0|1,0,0]=3 4200 B11R2.1 Nc1csc2c1cccc2 Amb13890519 [1,0,0,0,1,0|1,1,0]=4 4201 B11R2.1 Nc1noc2c1cccc2 Amb1323334 [1,0,0,0,1,0|2,0,0]=4 4202 B11R2.1 Nc1occ2ccccc21 Amb24463840 [1,0,0,0,1,0|2,0,0]=4 4203 B11R2.1 Nn1ccc2c1cccc2 Amb16233739 [1,0,0,0,1,0|2,0,0]=4 4204 B11R2.1 O=C1C=CN2C=CC=CC21 Amb25839279 [1,0,0,0,1,0|1,0,1]=4 4205 B11R2.1 O=C1C=Cc2c1cccc2 Amb10603436 [1,0,0,0,1,0|0,0,0]=2 4206 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [1,0,0,0,1,0|1,0,1]=4 4207 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [1,0,0,0,1,0|1,0,1]=4 4208 B11R2.1 O=C1COc2c1cccc2 Amb2383539 [1,0,0,0,1,0|0,0,2]=4 4209 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [1,0,0,0,1,0|1,0,0]=3 4210 B11R2.1 O=C1N=Nc2ccccc21 Amb21928183 [1,0,0,0,1,0|2,0,0]=4 4211 B11R2.1 O=C1NC=C2C=CC=CC21 Amb25217951 [1,0,0,0,1,0|1,0,1]=4 4212 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [1,0,0,0,1,0|2,0,0]=4 4213 B11R2.1 O=C1NS[13c]2[13cH][13cH][13cH][13cH]c21 Amb19130670 [1,0,0,0,1,0|2,0,0]=4 4214 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [1,0,0,0,1,0|2,0,0]=4 4215 B11R2.1 O=C1O[Hg]c2ccccc21 Amb22369198 [1,0,0,0,1,0|2,0,0]=4 4216 B11R2.1 O=C1SCc2c1cccc2 Amb2421358 [1,0,0,0,1,0|1,0,1]=4 4217 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [1,0,0,0,1,0|2,0,0]=4 4218 B11R2.1 O=C1SSc2ccccc21 Amb20660516 [1,0,0,0,1,0|2,0,0]=4 4219 B11R2.1 O=S1C=Nc2ccccc12 Amb24479722 [1,0,0,0,1,0|2,0,0]=4 4220 B11R2.1 O=[s]1ccc2ccccc12 Amb24078341 [1,0,0,0,1,0|1,0,0]=3 4221 B11R2.1 O=c1s[nH]c2c1cccc2 Amb1071736 [1,0,0,0,1,0|2,0,0]=4 4222 B11R2.1 OB1COc2ccccc21 Amb25132941 [1,0,0,0,1,0|1,0,1]=4 4223 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [1,0,0,0,1,0|0,0,2]=4 4224 B11R2.1 OC1COc2ccccc21 Amb24104532 [1,0,0,0,1,0|0,0,2]=4 4225 B11R2.1 O[C@H]1C=Cc2ccccc21 Amb24748284 [1,0,0,0,1,0|0,0,2]=4 4226 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [1,0,0,0,1,0|2,0,0]=4 4227 B11R2.1 Oc1[n][s]c2ccccc21 Amb22166851 [1,0,0,0,1,0|1,1,0]=4 4228 B11R2.1 Oc1[s][n]c2ccccc21 Amb22059084 [1,0,0,0,1,0|2,0,0]=4 4229 B11R2.1 Oc1c[nH]c2[n]cccc21 Amb24387306 [1,0,0,0,1,0|2,0,0]=4 4230 B11R2.1 Oc1c[n][n]2ccccc21 Amb25359066 [1,0,0,0,1,0|2,0,0]=4 4231 B11R2.1 Oc1c[n]c2cccc[n]21 Amb22008558 [1,0,0,0,1,0|2,0,0]=4 4232 B11R2.1 Oc1c[n]c2cccc[n]21 Amb24074110 [1,0,0,0,1,0|2,0,0]=4 4233 B11R2.1 Oc1c[s]c2ccc[n]c21 Amb24066972 [1,0,0,0,1,0|1,1,0]=4 4234 B11R2.1 Oc1coc2ccc[n]c21 Amb21963453 [1,0,0,0,1,0|1,0,0]=3 4235 B11R2.1 Oc1coc2ccccc21 Amb24097480 [1,0,0,0,1,0|0,0,0]=2 4236 B11R2.1 Oc1noc2c1ccnc2 Amb10975477 [1,0,0,0,1,0|2,0,0]=4 4237 B11R2.1 S=c1[nH]oc2ccccc21 Amb24060603 [1,0,0,0,1,0|1,1,0]=4 4238 B11R2.1 Sc1c[s]c2ccccc21 Amb24396652 [1,0,0,0,1,0|0,2,0]=4 4239 B11R2.1 Sc1coc2ccccc21 Amb24061893 [1,0,0,0,1,0|0,1,0]=3 4240 B11R2.1 [Ti+3]C1C=Cc2ccccc21 Amb22053615 [1,0,0,0,1,0|1,0,1]=4 4241 B11R2.10 Brc1[n]c2ccccc2o1 Amb19054929 [1,0,0,0,1,0|2,0,0]=4 4242 B11R2.10 Brc1cc2[n]cccc2o1 Amb25133797 [1,0,0,0,1,0|2,0,0]=4 4243 B11R2.10 Brc1cc2c[n]ccc2o1 Amb18187766 [1,0,0,0,1,0|2,0,0]=4 4244 B11R2.10 Brc1cc2cc[n]cc2o1 Amb25377338 [1,0,0,0,1,0|2,0,0]=4 4245 B11R2.10 Brc1cc2ccccc2[nH]1 Amb24089429 [1,0,0,0,1,0|2,0,0]=4 4246 B11R2.10 C=C1Oc2ccccc2O1 Amb24665414 [1,0,0,0,1,0|2,0,0]=4 4247 B11R2.10 CC1=Cc2c(C1)cccc2 Amb15692403 [1,0,0,0,1,0|1,0,1]=4 4248 B11R2.10 Cc1cc2c(s1)cccc2 Amb2237023 [1,0,0,0,1,0|1,1,0]=4 4249 B11R2.10 Cc1cc2c[n]ccc2o1 Amb23590993 [1,0,0,0,1,0|2,0,0]=4 4250 B11R2.10 Cc1cc2cc[n]cc2o1 Amb24648841 [1,0,0,0,1,0|2,0,0]=4 4251 B11R2.10 Cc1cc2ccc[n]c2o1 Amb25299352 [1,0,0,0,1,0|2,0,0]=4 4252 B11R2.10 Cc1cc2cccc[n]2c1 Amb22264777 [1,0,0,0,1,0|2,0,0]=4 4253 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926528 [1,0,0,0,1,0|2,0,0]=4 4254 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926529 [1,0,0,0,1,0|2,0,0]=4 4255 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [1,0,0,0,1,0|1,0,0]=3 4256 B11R2.10 ClC=1Cc2ccccc2C1 Amb22752069 [1,0,0,0,1,0|1,0,1]=4 4257 B11R2.10 Clc1cc2[n]cccc2o1 Amb24538055 [1,0,0,0,1,0|2,0,0]=4 4258 B11R2.10 Clc1cc2ccccc2[nH]1 Amb17673956 [1,0,0,0,1,0|2,0,0]=4 4259 B11R2.10 Clc1cc2ccccc2[nH]1 Amb22757517 [1,0,0,0,1,0|2,0,0]=4 4260 B11R2.10 Clc1cc2ccccc2[s]1 Amb24086422 [1,0,0,0,1,0|1,1,0]=4 4261 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [1,0,0,0,1,0|1,0,0]=3 4262 B11R2.10 Clc1nc2c(o1)cccc2 Amb1106378 [1,0,0,0,1,0|2,0,0]=4 4263 B11R2.10 Fc1[n]c2ccccc2o1 Amb24565875 [1,0,0,0,1,0|2,0,0]=4 4264 B11R2.10 Fc1cc2ccccc2[nH]1 Amb24738487 [1,0,0,0,1,0|2,0,0]=4 4265 B11R2.10 Fc1cc2ccccc2[s]1 Amb24086004 [1,0,0,0,1,0|1,1,0]=4 4266 B11R2.10 Fc1cc2ccccc2o1 Amb24648804 [1,0,0,0,1,0|1,0,0]=3 4267 B11R2.10 Ic1[n]c2ccccc2o1 Amb25111418 [1,0,0,0,1,0|2,0,0]=4 4268 B11R2.10 Ic1cc2ccccc2[nH]1 Amb22001898 [1,0,0,0,1,0|2,0,0]=4 4269 B11R2.10 Ic1cc2ccccc2[s]1 Amb22896395 [1,0,0,0,1,0|1,1,0]=4 4270 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [1,0,0,0,1,0|1,0,0]=3 4271 B11R2.10 Nc1cc2c([nH]1)cccc2 Amb17593390 [1,0,0,0,1,0|2,0,0]=4 4272 B11R2.10 Nc1cc2c(s1)cccc2 Amb17593717 [1,0,0,0,1,0|1,1,0]=4 4273 B11R2.10 Nc1cc2c[n]ccc2o1 Amb18203158 [1,0,0,0,1,0|2,0,0]=4 4274 B11R2.10 Nc1cc2ccccc2[s]1 Amb22496276 [1,0,0,0,1,0|1,1,0]=4 4275 B11R2.10 Nc1cc2ccccc2o1 Amb22011828 [1,0,0,0,1,0|1,0,0]=3 4276 B11R2.10 Nc1nc2c(o1)cccc2 Amb1153977 [1,0,0,0,1,0|2,0,0]=4 4277 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,0,0,0,1,0|1,0,0]=3 4278 B11R2.10 O=C1C=C2C=CC=CN2N1 Amb21858515 [1,0,0,0,1,0|2,0,0]=4 4279 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [1,0,0,0,1,0|1,0,0]=3 4280 B11R2.10 O=C1C=C2NC=CC=C2N1 Amb23437349 [1,0,0,0,1,0|2,0,0]=4 4281 B11R2.10 O=C1C=C2NC=CC=C2O1 Amb24718430 [1,0,0,0,1,0|1,0,0]=3 4282 B11R2.10 O=C1Cc2[n]cccc2O1 Amb24093371 [1,0,0,0,1,0|1,0,1]=4 4283 B11R2.10 O=C1Cc2c(C1)cccc2 Amb1227714 [1,0,0,0,1,0|1,0,1]=4 4284 B11R2.10 O=C1Cc2c(N1)cccc2 Amb1351379 [1,0,0,0,1,0|1,0,1]=4 4285 B11R2.10 O=C1Cc2ccccc2S1 Amb24066372 [1,0,0,0,1,0|0,1,1]=4 4286 B11R2.10 O=C1N=C2C=CC=CC2=N1 Amb20247445 [1,0,0,0,1,0|2,0,0]=4 4287 B11R2.10 O=C1Nc2[n]cccc2O1 Amb17933371 [1,0,0,0,1,0|2,0,0]=4 4288 B11R2.10 O=C1Nc2cc[n]cc2O1 Amb22233917 [1,0,0,0,1,0|2,0,0]=4 4289 B11R2.10 O=C1Nc2ccc[n]c2O1 Amb18560583 [1,0,0,0,1,0|2,0,0]=4 4290 B11R2.10 O=C1Nc2ccccc2N1 Amb18375774 [1,0,0,0,1,0|2,0,0]=4 4291 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [1,0,0,0,1,0|1,0,0]=3 4292 B11R2.10 O=C1Nc2ccccc2S1 Amb17933260 [1,0,0,0,1,0|1,1,0]=4 4293 B11R2.10 O=C1O[n+]2ccccc2S1 Amb20662459 [1,0,0,0,1,0|2,0,0]=4 4294 B11R2.10 O=C1Oc2cccc[n+]2S1 Amb24472982 [1,0,0,0,1,0|2,0,0]=4 4295 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [1,0,0,0,1,0|1,0,0]=3 4296 B11R2.10 O=C1Sc2ccccc2S1 Amb25108529 [1,0,0,0,1,0|1,1,0]=4 4297 B11R2.10 O=[Ti]1Oc2ccccc2O1 Amb22733198 [1,0,0,0,1,0|2,0,0]=4 4298 B11R2.10 O=c1oc2c([nH]1)cccc2 Amb1149900 [1,0,0,0,1,0|1,0,0]=3 4299 B11R2.10 O=c1oc2c(s1)nccc2 Amb10552542 [1,0,0,0,1,0|2,0,0]=4 4300 B11R2.10 O=c1sc2c([nH]1)cccc2 Amb16205823 [1,0,0,0,1,0|1,1,0]=4 4301 B11R2.10 OB1Oc2c(O1)cccc2 Amb16228209 [1,0,0,0,1,0|2,0,0]=4 4302 B11R2.10 OB1Oc2c(O1)cccc2 Amb16228210 [1,0,0,0,1,0|2,0,0]=4 4303 B11R2.10 O[Sb]1Oc2ccccc2O1 Amb22453160 [1,0,0,0,1,0|2,0,0]=4 4304 B11R2.10 O[b]1oc2ccccc2o1 Amb24674117 [1,0,0,0,1,0|2,0,0]=4 4305 B11R2.10 O[n]1cc2ccccc2[n]1 Amb24085998 [1,0,0,0,1,0|2,0,0]=4 4306 B11R2.10 Oc1c[n]2ccccc2[n]1 Amb19515773 [1,0,0,0,1,0|2,0,0]=4 4307 B11R2.10 Oc1cc2[n]cccc2[nH]1 Amb23437350 [1,0,0,0,1,0|2,0,0]=4 4308 B11R2.10 Oc1cc2c([nH]1)cccc2 Amb10561372 [1,0,0,0,1,0|1,0,0]=3 4309 B11R2.10 Oc1cc2c[n]ccc2[s]1 Amb24694388 [1,0,0,0,1,0|1,1,0]=4 4310 B11R2.10 Oc1cc2cc[n]cc2[nH]1 Amb23437347 [1,0,0,0,1,0|2,0,0]=4 4311 B11R2.10 Oc1cc2ccc[n]c2[nH]1 Amb21963071 [1,0,0,0,1,0|2,0,0]=4 4312 B11R2.10 Oc1cc2ccccc2[s]1 Amb24518934 [1,0,0,0,1,0|0,1,0]=3 4313 B11R2.10 Oc1cc2ccccc2o1 Amb24065682 [1,0,0,0,1,0|0,0,0]=2 4314 B11R2.10 Oc1nc2c(o1)cccc2 Amb17593429 [1,0,0,0,1,0|1,0,0]=3 4315 B11R2.10 Oc1nc2c(s1)cccc2 Amb1814195 [1,0,0,0,1,0|1,1,0]=4 4316 B11R2.10 Oc1nc2ncccc2o1 Amb17949727 [1,0,0,0,1,0|2,0,0]=4 4317 B11R2.10 S=C1C=C2C=CC=CC2=N1 Amb25251819 [1,0,0,0,1,0|1,1,0]=4 4318 B11R2.10 S=C1Cc2ccccc2O1 Amb24089820 [1,0,0,0,1,0|0,1,1]=4 4319 B11R2.10 S=C1Nc2ccccc2O1 Amb18799383 [1,0,0,0,1,0|1,1,0]=4 4320 B11R2.10 S=C1Oc2ccccc2O1 Amb22363540 [1,0,0,0,1,0|1,1,0]=4 4321 B11R2.10 S=c1oc2c([nH]1)cccc2 Amb1157763 [1,0,0,0,1,0|1,1,0]=4 4322 B11R2.10 Sc1cc2ccccc2[s]1 Amb24105482 [1,0,0,0,1,0|0,2,0]=4 4323 B11R2.10 Sc1cc2ccccc2o1 Amb24061116 [1,0,0,0,1,0|0,1,0]=3 4324 B11R2.10 Sc1nc2c(o1)cccc2 Amb17570013 [1,0,0,0,1,0|1,1,0]=4 4325 B11R2.10 [SH3]c1[n]c2ccccc2o1 Amb18046725 [1,0,0,0,1,0|1,1,0]=4 4326 B11R2.36 Cc1cc2cccc2[nH]c1 Amb25240550 [1,0,0,0,1,0|2,0,0]=4 4327 B11R2.36 O=C1C=Cc2[nH]ccc2N1 Amb22727937 [1,0,0,0,1,0|2,0,0]=4 4328 B11R2.36 O=C1C=Cc2[nH]ccc2O1 Amb25259806 [1,0,0,0,1,0|1,0,0]=3 4329 B11R2.36 O=C1C=Cc2cc[s]c2N1 Amb24417184 [1,0,0,0,1,0|2,0,0]=4 4330 B11R2.36 O=C1Cc2ccc[n]2C=C1 Amb24066251 [1,0,0,0,1,0|2,0,0]=4 4331 B11R2.36 O=C1Cc2ccoc2C=C1 Amb24757003 [1,0,0,0,1,0|2,0,0]=4 4332 B11R2.36 O=c1ccc2ccoc2[nH]1 Amb24081771 [1,0,0,0,1,0|2,0,0]=4 4333 B11R2.36 Oc1c[nH]c2cc[n]c2c1 Amb25782210 [1,0,0,0,1,0|2,0,0]=4 4334 B11R2.36 Oc1c[n]c2cc[s]c2c1 Amb19959222 [1,0,0,0,1,0|2,0,0]=4 4335 B11R2.36 Oc1cc2C=CCc2cc1 Amb18124353 [1,0,0,0,1,0|1,0,1]=4 4336 B11R2.36 Oc1cc2[s]ccc2cc1 Amb18644429 [1,0,0,0,1,0|2,0,0]=4 4337 B11R2.36 Oc1cc2cc[s]c2[n]c1 Amb18644463 [1,0,0,0,1,0|2,0,0]=4 4338 B11R2.36 Oc1cc2cc[s]c2cc1 Amb18644430 [1,0,0,0,1,0|2,0,0]=4 4339 B11R2.36 Oc1cc2cc[s]c2cc1 Amb24094703 [1,0,0,0,1,0|2,0,0]=4 4340 B11R2.36 Oc1cc2ccc[n]2cc1 Amb24066320 [1,0,0,0,1,0|2,0,0]=4 4341 B11R2.36 Oc1cc2ccoc2[n]c1 Amb24081770 [1,0,0,0,1,0|2,0,0]=4 4342 B11R2.36 Oc1cc2occc2cc1 Amb18124404 [1,0,0,0,1,0|2,0,0]=4 4343 B11R2.36 Oc1ccc2C=CCc2c1 Amb25229098 [1,0,0,0,1,0|1,0,1]=4 4344 B11R2.36 Oc1ccc2c(c1)[nH]cc2 Amb2455716 [1,0,0,0,1,0|2,0,0]=4 4345 B11R2.36 Oc1ccc2c(c1)cco2 Amb16185813 [1,0,0,0,1,0|2,0,0]=4 4346 B11R2.36 Oc1cnc2c(c1)occ2 Amb13890162 [1,0,0,0,1,0|2,0,0]=4 4347 B11R2.8 CC1=Cc2ccc[n]2C1=O Amb24062050 [0,0,0,0,2,0|2,0,0]=4 4348 B11R2.8 O=C1C(Br)=Cc2ccc[n]21 Amb25313196 [0,0,0,0,2,0|2,0,0]=4 4349 B11R2.54 O=C1C(Cl)c2ccccc21 Amb21948336 [0,0,0,0,2,0|1,0,1]=4 4350 B11R2.54 O=C1c2cc[n]cc2C1=O Amb24606585 [0,0,0,0,2,0|1,0,1]=4 4351 B11R2.54 O=C1c2ccccc2C1=O Amb18048412 [0,0,0,0,2,0|0,0,1]=3 4352 B13R1.348 CC(=C)CC(=O)Nc1ccccc1 Amb24759109 [0,0,1,0,0,1|2,0,0]=4 4353 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,0,1,0,0,1|2,0,0]=4 4354 B13R1.348 CC(=N)NC(=O)Oc1ccccc1 Amb25288293 [0,0,1,0,0,1|1,0,1]=4 4355 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [0,0,1,0,0,1|2,0,0]=4 4356 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,0,1,0,0,1|0,0,2]=4 4357 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [0,0,1,0,0,1|1,0,1]=4 4358 B13R1.348 C\C(=C/C(O)=O)\Sc1ccccc1 Amb18130094 [0,0,1,0,0,1|2,0,0]=4 4359 B13R1.348 C\C(=C/c1ccccc1)\CC(=O)O Amb17594482 [0,0,1,0,0,1|1,0,0]=3 4360 B13R1.348 C\C(\CC(N)=O)=C/c1ccccc1 Amb22734412 [0,0,1,0,0,1|2,0,0]=4 4361 B13R1.348 C\C(\CC(N)=O)=C\c1ccccc1 Amb24603442 [0,0,1,0,0,1|2,0,0]=4 4362 B13R1.348 C\C(\CC(O)=O)=C\c1ccccc1 Amb25229524 [0,0,1,0,0,1|1,0,0]=3 4363 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,0,1,0,0,1|1,0,1]=4 4364 B13R1.348 NC(=O)NC(=O)Oc1ccccc1 Amb24635786 [0,0,1,0,0,1|1,0,1]=4 4365 B13R1.348 NC(=S)NC(=O)Oc1ccccc1 Amb24634040 [0,0,1,0,0,1|1,1,0]=4 4366 B13R1.348 N\C(=C\C(O)=O)\Oc1ccccc1 Amb24655097 [0,0,1,0,0,1|2,0,0]=4 4367 B13R1.348 O=C(Nc1ccccc1)CC(=O)O Amb2436726 [0,0,1,0,0,1|1,0,1]=4 4368 B13R1.348 O=C(Oc1ccccc1)CC(=O)O Amb2417322 [0,0,1,0,0,1|1,0,0]=3 4369 B13R1.348 O=C(Oc1ccccc1)CC(=S)N Amb1981073 [0,0,1,0,0,1|1,1,0]=4 4370 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [0,0,1,0,0,1|0,0,2]=4 4371 B13R1.348 OC(=O)CC(=S)Nc1ccccc1 Amb24470037 [0,0,1,0,0,1|1,1,0]=4 4372 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [0,0,1,0,0,1|0,0,2]=4 4373 B13R1.351 C=C(CSc1ccccc1)C(O)=O Amb18130089 [0,0,1,0,0,1|1,0,1]=4 4374 B13R1.351 C=C(Cl)C(=O)NNc1ccccc1 Amb22461851 [0,0,1,0,0,1|2,0,0]=4 4375 B13R1.351 C=C(F)C(=O)\C=C\c1ccccc1 Amb24577794 [0,0,1,0,0,1|2,0,0]=4 4376 B13R1.351 C=C(OCc1ccccc1)C(O)=O Amb24626599 [0,0,1,0,0,1|1,0,1]=4 4377 B13R1.351 CC(=C)C(=O)\C=C\c1ccccc1 Amb24357139 [0,0,1,0,0,1|2,0,0]=4 4378 B13R1.351 CC(=C=Cc1ccccc1)C(O)=O Amb25337779 [0,0,1,0,0,1|1,0,0]=3 4379 B13R1.351 CC(=O)C(/C)=C\Nc1ccccc1 Amb17778142 [0,0,1,0,0,1|2,0,0]=4 4380 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,0,1,0,0,1|0,0,2]=4 4381 B13R1.351 CC(=O)C(=O)\C=C\c1ccccc1 Amb24697906 [0,0,1,0,0,1|1,0,1]=4 4382 B13R1.351 CC(=O)\C(\O)=C\Nc1ccccc1 Amb24488935 [0,0,1,0,0,1|1,0,0]=3 4383 B13R1.351 CC(O)C(=O)O[Hg]c1ccccc1 Amb22345872 [0,0,1,0,0,1|0,0,2]=4 4384 B13R1.351 CC(\C=C\c1ccccc1)C(O)=O Amb18127714 [0,0,1,0,0,1|1,0,1]=4 4385 B13R1.351 C[C@@H](O)C(=O)OCc1ccccc1 Amb22801052 [0,0,1,0,0,1|0,0,2]=4 4386 B13R1.351 C[C@H](\N=C\c1ccccc1)C(O)=O Amb25124071 [0,0,1,0,0,1|1,0,1]=4 4387 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [0,0,1,0,0,1|2,0,0]=4 4388 B13R1.351 C\C(=C/Cc1ccccc1)\C(O)=O Amb24462262 [0,0,1,0,0,1|1,0,0]=3 4389 B13R1.351 C\C(=C/Sc1ccccc1)\C(O)=O Amb25072536 [0,0,1,0,0,1|1,0,0]=3 4390 B13R1.351 C\C(=C\Oc1ccccc1)\C(O)=O Amb25798942 [0,0,1,0,0,1|1,0,0]=3 4391 B13R1.351 C\C(=C\Sc1ccccc1)\C(O)=O Amb18130088 [0,0,1,0,0,1|1,0,0]=3 4392 B13R1.351 C\C(=N/Nc1ccccc1)\C(=O)O Amb16205342 [0,0,1,0,0,1|2,0,0]=4 4393 B13R1.351 N=C(NCc1ccccc1)C(O)=O Amb18128144 [0,0,1,0,0,1|1,0,1]=4 4394 B13R1.351 NC(=O)C(=O)\C=C\c1ccccc1 Amb25798864 [0,0,1,0,0,1|1,0,1]=4 4395 B13R1.351 NC(=O)C(O)\C=C\c1ccccc1 Amb24552951 [0,0,1,0,0,1|1,0,1]=4 4396 B13R1.351 NC(=S)C(=O)OCc1ccccc1 Amb25836805 [0,0,1,0,0,1|1,1,0]=4 4397 B13R1.351 N[C@H](\C=C\c1ccccc1)C(O)=O Amb25187708 [0,0,1,0,0,1|1,0,1]=4 4398 B13R1.351 N\C(=N/Nc1ccccc1)\C(O)=O Amb24658773 [0,0,1,0,0,1|2,0,0]=4 4399 B13R1.351 O=C(C(=C)C)OCc1ccccc1 Amb10807491 [0,0,1,0,0,1|1,0,0]=3 4400 B13R1.351 O=C(C(=O)O)\C=C\c1ccccc1 Amb16192457 [0,0,1,0,0,1|0,0,1]=3 4401 B13R1.351 O=C(C(=O)O)\C=C\c1ccncc1 Amb17470560 [0,0,1,0,0,1|1,0,1]=4 4402 B13R1.351 O=C(OCc1ccccc1)C(=O)Cl Amb24687217 [0,0,1,0,0,1|1,0,1]=4 4403 B13R1.351 OC(=O)C(=O)C#Cc1ccccc1 Amb25298732 [0,0,1,0,0,1|0,0,2]=4 4404 B13R1.351 OC(=O)C(=O)NNc1ccccc1 Amb18128574 [0,0,1,0,0,1|1,0,1]=4 4405 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [0,0,1,0,0,1|1,0,0]=3 4406 B13R1.351 OC(=O)C(=O)\C=C\c1ccccn1 Amb17470558 [0,0,1,0,0,1|1,0,1]=4 4407 B13R1.351 OC(=O)C(=O)\C=C\c1cccnc1 Amb17470559 [0,0,1,0,0,1|1,0,1]=4 4408 B13R1.351 OC(=O)C(O)C#Cc1ccccc1 Amb25111134 [0,0,1,0,0,1|0,0,2]=4 4409 B13R1.351 OC(=O)C(O)\C=C\c1c[n]ccc1 Amb25108233 [0,0,1,0,0,1|1,0,1]=4 4410 B13R1.351 OC(=O)\C(\Cl)=C\Sc1ccccc1 Amb24587115 [0,0,1,0,0,1|1,0,0]=3 4411 B13R1.351 OC(=O)\C(\F)=C\Cc1ccccc1 Amb25265375 [0,0,1,0,0,1|1,0,0]=3 4412 B13R1.351 OC(=O)\C(\F)=C\Sc1ccccc1 Amb25288171 [0,0,1,0,0,1|1,0,0]=3 4413 B13R1.351 OC(=O)\C(\S)=N\Nc1ccccc1 Amb18130277 [0,0,1,0,0,1|1,1,0]=4 4414 B13R1.351 OC(C(=O)O)\C=C\c1ccccc1 Amb17594531 [0,0,1,0,0,1|0,0,1]=3 4415 B13R1.351 O[C@H](C(=O)O)CCc1ccccc1 Amb10603260 [0,0,1,0,0,1|0,0,2]=4 4416 B13R1.351 O\C(=C/Nc1ccccc1)\C(O)=O Amb24677773 [0,0,1,0,0,1|0,0,0]=2 4417 B13R1.351 [O-]C(=O)C(=O)C=Cc1ccccc1 Amb22484596 [0,0,1,0,0,1|0,0,2]=4 4418 B13R1.528 Cc1ccccc1NC=C(Cl)C=O Amb22469352 [0,0,1,0,0,1|2,0,0]=4 4419 B13R1.528 Cc1ccccc1N\C=C(\O)/C=O Amb24512234 [0,0,1,0,0,1|1,0,0]=3 4420 B13R1.528 Cc1ccccc1OCC(=O)CO Amb18065910 [0,0,1,0,0,1|0,0,2]=4 4421 B13R1.528 Cc1ccccc1OCC(=O)NO Amb25093365 [0,0,1,0,0,1|1,0,1]=4 4422 B13R1.528 Cc1ccccc1\C=C\C(=O)C=O Amb24357178 [0,0,1,0,0,1|1,0,1]=4 4423 B13R1.528 O=CC(Cl)=CNc1ccccc1Br Amb22461983 [0,0,1,0,0,1|2,0,0]=4 4424 B13R1.528 OCC(=O)COc1ccccc1Br Amb18072010 [0,0,1,0,0,1|1,0,1]=4 4425 B13R1.528 OCC(=O)COc1ccccc1Cl Amb18566284 [0,0,1,0,0,1|1,0,1]=4 4426 B13R1.528 OCC(=O)COc1ccccc1F Amb18564273 [0,0,1,0,0,1|1,0,1]=4 4427 B13R1.528 ONC(=O)COc1ccccc1Br Amb25854806 [0,0,1,0,0,1|2,0,0]=4 4428 B13R1.528 ONC(=O)COc1ccccc1Cl Amb22465743 [0,0,1,0,0,1|2,0,0]=4 4429 B13R1.528 ONC(=O)COc1ccccc1O Amb1332070 [0,0,1,0,0,1|2,0,0]=4 4430 B13R1.528 O\C(\C=O)=C/Nc1ccccc1Cl Amb25195841 [0,0,1,0,0,1|1,0,0]=3 4431 B13R1.528 O\C(\C=O)=C\Nc1ccccc1Cl Amb25288462 [0,0,1,0,0,1|1,0,0]=3 4432 B13R1.528 Oc1ccccc1N\C=C(/O)\C=O Amb25155510 [0,0,1,0,0,1|0,0,0]=2 4433 B13R2.33 FC=1COc2ccccc2CC1 Amb24379592 [1,0,0,0,0,1|1,0,1]=4 4434 B13R2.33 O=C1C=Cc2[n]cccc2CN1 Amb24545909 [1,0,0,0,0,1|2,0,0]=4 4435 B13R2.33 O=C1C=Cc2c(CC1)cccc2 Amb17593958 [1,0,0,0,0,1|1,0,0]=3 4436 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [1,0,0,0,0,1|1,0,0]=3 4437 B13R2.33 O=C1C=Nc2ccccc2C=N1 Amb22489908 [1,0,0,0,0,1|1,0,1]=4 4438 B13R2.33 O=C1CCc2cc[n]cc2C=C1 Amb24424904 [1,0,0,0,0,1|2,0,0]=4 4439 B13R2.33 O=C1CCc2ccccc2CO1 Amb24525708 [1,0,0,0,0,1|0,0,2]=4 4440 B13R2.33 O=C1COc2c(CN1)cccc2 Amb2137257 [1,0,0,0,0,1|1,0,1]=4 4441 B13R2.33 O=C1NCc2ccccc2CO1 Amb24100846 [1,0,0,0,0,1|1,0,1]=4 4442 B13R2.33 OC1C=Cc2ccccc2C=C1 Amb25155952 [1,0,0,0,0,1|1,0,1]=4 4443 B13R2.3681 Nc:1:c:c:2Cc(:c:c1):c:c:c:c2 Amb24373094 [1,0,0,0,0,1|2,0,0]=4 4444 B13R2.3729 Oc1cc2C=CC=CCc2cc1 Amb24588874 [1,0,0,0,0,1|1,0,0]=3 4445 B13R2.3729 Oc1ccc2C=CC=CCc2c1 Amb24497364 [1,0,0,0,0,1|1,0,0]=3 4446 B15R2.356 S=C1NCC(=O)Oc2c(N1)cccc2 Amb1064697 [0,0,0,0,0,2|1,1,0]=4 4447 B15R2.1157 O=C1CC(=O)Nc2ccccc2CO1 Amb25824720 [0,0,0,0,0,2|1,0,1]=4