0 B13R2.369 Brc1cc2ccccc2cc1Br Amb4027856 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.369 Brc1cc2ccccc2cc1I Amb13883628 [0,0,0,0,0,0|4,0,0]=4 2 B13R2.369 Brc1cc2ccccc2nc1Br Amb2609656 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.369 Brc1cc2ccccc2nc1I Amb24483630 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.369 Brc1cc2cccnc2nc1Br Amb2795319 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.369 Brc1cc2ncccc2nc1Br Amb17912720 [0,0,0,0,0,0|2,0,1]=3 6 B13R2.369 Brc1cc2nccnc2cc1Br Amb23560533 [0,0,0,0,0,0|4,0,0]=4 7 B13R2.369 Brc1nc2ccccc2cc1I Amb27665904 [0,0,0,0,0,0|3,0,1]=4 8 B13R2.369 C=C1C=C2C=CC=CC2=CC1=O Amb27175861 [0,0,0,0,0,0|3,0,0]=3 9 B13R2.369 C=C1Nc2ccccc2OC1=O Amb25996357 [0,0,0,0,0,0|3,0,1]=4 10 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,0,0,0,0,0|3,0,0]=3 12 B13R2.369 CC1=Cc2cccnc2NC1=O Amb22497900 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.369 CC1=Cc2cnccc2NC1=O Amb27876494 [0,0,0,0,0,0|3,0,0]=3 14 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,0,0,0,0,0|3,0,0]=3 15 B13R2.369 CC1=Nc2ccccc2NC1=S Amb18043495 [0,0,0,0,0,0|3,1,0]=4 16 B13R2.369 CC1=Nc2ccccc2OC1=O Amb27482974 [0,0,0,0,0,0|4,0,0]=4 17 B13R2.369 CC1=Nc2cccnc2NC1=O Amb19373141 [0,0,0,0,0,0|2,0,2]=4 18 B13R2.369 CC1=Nc2cccnc2NC1=S Amb25149949 [0,0,0,0,0,0|2,1,1]=4 19 B13R2.369 CC1=Nc2ccncc2NC1=O Amb23597005 [0,0,0,0,0,0|4,0,0]=4 20 B13R2.369 CC1=Nc2ncccc2NC1=O Amb26342261 [0,0,0,0,0,0|2,0,0]=2 21 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,0,0,0,0,0|2,0,2]=4 22 B13R2.369 CC1Cc2ccccc2NC1=O Amb10604462 [0,0,0,0,0,0|2,0,2]=4 23 B13R2.369 CC1Cc2ncccc2NC1=O Amb28122873 [0,0,0,0,0,0|1,0,2]=3 24 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,0,0,0,0,0|3,0,1]=4 25 B13R2.369 CC1Nc2cccnc2NC1=O Amb24589618 [0,0,0,0,0,0|2,0,2]=4 26 B13R2.369 CC1Nc2ncccc2NC1=O Amb19334168 [0,0,0,0,0,0|2,0,1]=3 27 B13R2.369 CC1Nc2nnccc2NC1=O Amb18828946 [0,0,0,0,0,0|3,0,1]=4 28 B13R2.369 CC1Oc2ccccc2NC1=O Amb2568450 [0,0,0,0,0,0|3,0,1]=4 29 B13R2.369 CC1Oc2ncccc2NC1=O Amb9810637 [0,0,0,0,0,0|2,0,1]=3 30 B13R2.369 CC1Sc2ccccc2NC1=O Amb2714505 [0,0,0,0,0,0|3,0,1]=4 31 B13R2.369 CN1Cc2ccccc2NC1=O Amb6198737 [0,0,0,0,0,0|3,0,1]=4 32 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,0,0,0,0,0|3,0,1]=4 33 B13R2.369 Cc1cc2ccccc2cc1Br Amb22228668 [0,0,0,0,0,0|4,0,0]=4 34 B13R2.369 Cc1cc2ccccc2cc1C Amb4012683 [0,0,0,0,0,0|4,0,0]=4 35 B13R2.369 Cc1cc2ccccc2cc1Cl Amb24408885 [0,0,0,0,0,0|4,0,0]=4 36 B13R2.369 Cc1cc2ccccc2cc1F Amb24484265 [0,0,0,0,0,0|4,0,0]=4 37 B13R2.369 Cc1cc2ccccc2cc1I Amb26457588 [0,0,0,0,0,0|4,0,0]=4 38 B13R2.369 Cc1cc2ccccc2cc1N Amb22751118 [0,0,0,0,0,0|4,0,0]=4 39 B13R2.369 Cc1cc2ccccc2cc1O Amb22262990 [0,0,0,0,0,0|3,0,0]=3 40 B13R2.369 Cc1cc2ccccc2nc1Br Amb4057225 [0,0,0,0,0,0|3,0,1]=4 41 B13R2.369 Cc1cc2ccccc2nc1C Amb2411347 [0,0,0,0,0,0|3,0,1]=4 42 B13R2.369 Cc1cc2ccccc2nc1Cl Amb2447526 [0,0,0,0,0,0|3,0,1]=4 43 B13R2.369 Cc1cc2ccccc2nc1F Amb34164902 [0,0,0,0,0,0|3,0,1]=4 44 B13R2.369 Cc1cc2ccccc2nc1I Amb27840817 [0,0,0,0,0,0|3,0,1]=4 45 B13R2.369 Cc1cc2ccccc2nc1N Amb9134109 [0,0,0,0,0,0|3,0,1]=4 46 B13R2.369 Cc1cc2ccccc2nc1S Amb2786384 [0,0,0,0,0,0|2,1,1]=4 47 B13R2.369 Cc1cc2cccnc2cc1Br Amb26041897 [0,0,0,0,0,0|3,0,0]=3 48 B13R2.369 Cc1cc2cccnc2cc1C Amb24309324 [0,0,0,0,0,0|3,0,0]=3 49 B13R2.369 Cc1cc2cccnc2cc1O Amb18645153 [0,0,0,0,0,0|2,0,0]=2 50 B13R2.369 Cc1cc2cccnc2nc1Cl Amb22497901 [0,0,0,0,0,0|4,0,0]=4 51 B13R2.369 Cc1cc2ccncc2cc1O Amb27262920 [0,0,0,0,0,0|4,0,0]=4 52 B13R2.369 Cc1cc2cnccc2cc1O Amb21963927 [0,0,0,0,0,0|4,0,0]=4 53 B13R2.369 Cc1cc2ncccc2cc1Br Amb21858684 [0,0,0,0,0,0|3,0,0]=3 54 B13R2.369 Cc1cc2ncccc2cc1F Amb23504855 [0,0,0,0,0,0|3,0,0]=3 55 B13R2.369 Cc1cc2ncccc2cc1N Amb594754 [0,0,0,0,0,0|3,0,0]=3 56 B13R2.369 Cc1cc2ncccc2cc1O Amb18645152 [0,0,0,0,0,0|2,0,1]=3 57 B13R2.369 Cc1cc2ncccc2cc1O Amb35747831 [0,0,0,0,0,0|2,0,1]=3 58 B13R2.369 Cc1cc2ncccc2nc1Br Amb10879381 [0,0,0,0,0,0|2,0,1]=3 59 B13R2.369 Cc1cc2ncccc2nc1Cl Amb7101485 [0,0,0,0,0,0|2,0,1]=3 60 B13R2.369 Cc1cc2ncccc2nc1N Amb7101466 [0,0,0,0,0,0|2,0,1]=3 61 B13R2.369 Cc1cc2ncccc2nc1O Amb7101465 [0,0,0,0,0,0|1,0,2]=3 62 B13R2.369 Cc1cc2nccnc2cc1Br Amb24182153 [0,0,0,0,0,0|4,0,0]=4 63 B13R2.369 Cc1cc2nccnc2cc1Cl Amb20171144 [0,0,0,0,0,0|4,0,0]=4 64 B13R2.369 Cc1cc2nccnc2cc1I Amb24497444 [0,0,0,0,0,0|4,0,0]=4 65 B13R2.369 Cc1nc2ccccc2cc1Br Amb2720703 [0,0,0,0,0,0|3,0,1]=4 66 B13R2.369 Cc1nc2ccccc2cc1I Amb27628637 [0,0,0,0,0,0|3,0,1]=4 67 B13R2.369 Cc1nc2ccccc2cc1N Amb18062093 [0,0,0,0,0,0|3,0,1]=4 68 B13R2.369 Cc1nc2ccccc2cc1N Amb20239532 [0,0,0,0,0,0|3,0,1]=4 69 B13R2.369 Cc1nc2ccccc2cc1O Amb660984 [0,0,0,0,0,0|2,0,1]=3 70 B13R2.369 Cc1nc2ccccc2nc1O Amb631810 [0,0,0,0,0,0|3,0,1]=4 71 B13R2.369 Cc1nc2cccnc2nc1Cl Amb26373737 [0,0,0,0,0,0|3,0,1]=4 72 B13R2.369 Cc1nc2cccnc2nc1N Amb19148480 [0,0,0,0,0,0|3,0,1]=4 73 B13R2.369 Cc1nc2ccncc2cc1O Amb24692629 [0,0,0,0,0,0|3,0,1]=4 74 B13R2.369 Cc1nc2ncccc2cc1Br Amb2610813 [0,0,0,0,0,0|4,0,0]=4 75 B13R2.369 Cc1nc2ncccc2cc1O Amb25359913 [0,0,0,0,0,0|3,0,1]=4 76 B13R2.369 Cc1nc2nccnc2cc1Br Amb22886773 [0,0,0,0,0,0|3,0,1]=4 77 B13R2.369 Cc1nc2nccnc2cc1N Amb32423755 [0,0,0,0,0,0|3,0,1]=4 78 B13R2.369 Clc1cc2ccccc2cc1Br Amb26539587 [0,0,0,0,0,0|4,0,0]=4 79 B13R2.369 Clc1cc2ccccc2cc1Cl Amb22730503 [0,0,0,0,0,0|4,0,0]=4 80 B13R2.369 Clc1cc2ccccc2nc1Cl Amb19958556 [0,0,0,0,0,0|3,0,1]=4 81 B13R2.369 Clc1cc2ccccc2nc1I Amb27603446 [0,0,0,0,0,0|3,0,1]=4 82 B13R2.369 Clc1cc2cccnc2cc1Cl Amb21964466 [0,0,0,0,0,0|3,0,0]=3 83 B13R2.369 Clc1cc2cccnc2nc1Br Amb22751899 [0,0,0,0,0,0|4,0,0]=4 84 B13R2.369 Clc1cc2nccnc2cc1Br Amb22752569 [0,0,0,0,0,0|4,0,0]=4 85 B13R2.369 Clc1cc2nccnc2cc1Cl Amb10068710 [0,0,0,0,0,0|4,0,0]=4 86 B13R2.369 Clc1nc2ccccc2cc1Br Amb10606855 [0,0,0,0,0,0|3,0,1]=4 87 B13R2.369 Clc1nc2cccnc2nc1Cl Amb8390037 [0,0,0,0,0,0|3,0,1]=4 88 B13R2.369 Clc1nc2ncccc2cc1Br Amb33512710 [0,0,0,0,0,0|4,0,0]=4 89 B13R2.369 Clc1nc2nccnc2cc1Br Amb23400068 [0,0,0,0,0,0|3,0,1]=4 90 B13R2.369 Fc1cc2ccccc2cc1Br Amb25351655 [0,0,0,0,0,0|4,0,0]=4 91 B13R2.369 Fc1cc2ccccc2cc1Cl Amb24606517 [0,0,0,0,0,0|4,0,0]=4 92 B13R2.369 Fc1cc2ccccc2cc1F Amb25100177 [0,0,0,0,0,0|4,0,0]=4 93 B13R2.369 Fc1cc2ccccc2cc1I Amb28436689 [0,0,0,0,0,0|4,0,0]=4 94 B13R2.369 Fc1cc2ccccc2nc1Br Amb22547372 [0,0,0,0,0,0|3,0,1]=4 95 B13R2.369 Fc1cc2ccccc2nc1Cl Amb26328980 [0,0,0,0,0,0|3,0,1]=4 96 B13R2.369 Fc1cc2ccccc2nc1I Amb25797787 [0,0,0,0,0,0|3,0,1]=4 97 B13R2.369 Fc1cc2cccnc2cc1F Amb620169 [0,0,0,0,0,0|3,0,0]=3 98 B13R2.369 Fc1cc2ncccc2cc1Br Amb18548688 [0,0,0,0,0,0|3,0,0]=3 99 B13R2.369 Fc1cc2nccnc2cc1Br Amb26867496 [0,0,0,0,0,0|4,0,0]=4 100 B13R2.369 Fc1cc2nccnc2cc1Cl Amb28723713 [0,0,0,0,0,0|4,0,0]=4 101 B13R2.369 Fc1nc2ccccc2cc1Br Amb25897111 [0,0,0,0,0,0|3,0,1]=4 102 B13R2.369 Ic1cc2ccccc2cc1I Amb21954221 [0,0,0,0,0,0|4,0,0]=4 103 B13R2.369 N=C1Nc2ccccc2NC1=O Amb19804517 [0,0,0,0,0,0|3,0,0]=3 104 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,0,0,0,0,0|3,0,1]=4 105 B13R2.369 NC1=Cc2ccccc2NC1=S Amb24373878 [0,0,0,0,0,0|2,1,0]=3 106 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,0,0,0,0,0|3,0,0]=3 107 B13R2.369 NC1=Cc2cnccc2NC1=O Amb32418303 [0,0,0,0,0,0|3,0,0]=3 108 B13R2.369 NC1=Nc2cccnc2NC1=O Amb25106877 [0,0,0,0,0,0|2,0,2]=4 109 B13R2.369 NC1=Nc2cnccc2NC1=O Amb26371895 [0,0,0,0,0,0|4,0,0]=4 110 B13R2.369 NC1Cc2ccccc2NC1=O Amb10975380 [0,0,0,0,0,0|2,0,2]=4 111 B13R2.369 NC1Cc2ccccc2NC1=O Amb2196732 [0,0,0,0,0,0|2,0,2]=4 112 B13R2.369 NC1Cc2ccccc2NC1=O Amb6353803 [0,0,0,0,0,0|2,0,2]=4 113 B13R2.369 NC1Cc2ncccc2NC1=O Amb20241349 [0,0,0,0,0,0|1,0,2]=3 114 B13R2.369 NN1Cc2ccccc2NC1=O Amb28076843 [0,0,0,0,0,0|3,0,1]=4 115 B13R2.369 Nc1cc2ccccc2cc1Br Amb2610350 [0,0,0,0,0,0|4,0,0]=4 116 B13R2.369 Nc1cc2ccccc2cc1Cl Amb18648080 [0,0,0,0,0,0|4,0,0]=4 117 B13R2.369 Nc1cc2ccccc2cc1F Amb26978863 [0,0,0,0,0,0|4,0,0]=4 118 B13R2.369 Nc1cc2ccccc2cc1I Amb21955955 [0,0,0,0,0,0|4,0,0]=4 119 B13R2.369 Nc1cc2ccccc2cc1N Amb2710387 [0,0,0,0,0,0|4,0,0]=4 120 B13R2.369 Nc1cc2ccccc2cc1O Amb2781576 [0,0,0,0,0,0|3,0,0]=3 121 B13R2.369 Nc1cc2ccccc2nc1Br Amb22499505 [0,0,0,0,0,0|3,0,1]=4 122 B13R2.369 Nc1cc2ccccc2nc1Cl Amb22263229 [0,0,0,0,0,0|3,0,1]=4 123 B13R2.369 Nc1cc2ccccc2nc1O Amb18645300 [0,0,0,0,0,0|2,0,2]=4 124 B13R2.369 Nc1cc2cccnc2cc1Cl Amb24601767 [0,0,0,0,0,0|3,0,0]=3 125 B13R2.369 Nc1cc2cccnc2cc1F Amb31291475 [0,0,0,0,0,0|3,0,0]=3 126 B13R2.369 Nc1cc2cccnc2cc1O Amb26586376 [0,0,0,0,0,0|2,0,0]=2 127 B13R2.369 Nc1cc2cccnc2nc1Br Amb13881196 [0,0,0,0,0,0|4,0,0]=4 128 B13R2.369 Nc1cc2cccnc2nc1Cl Amb27175619 [0,0,0,0,0,0|4,0,0]=4 129 B13R2.369 Nc1cc2cccnc2nc1N Amb21811362 [0,0,0,0,0,0|4,0,0]=4 130 B13R2.369 Nc1cc2cccnc2nc1O Amb13881382 [0,0,0,0,0,0|3,0,0]=3 131 B13R2.369 Nc1cc2ccncc2cc1O Amb18830217 [0,0,0,0,0,0|4,0,0]=4 132 B13R2.369 Nc1cc2ncccc2cc1O Amb25966047 [0,0,0,0,0,0|2,0,1]=3 133 B13R2.369 Nc1cc2ncccc2nc1Br Amb13881197 [0,0,0,0,0,0|2,0,1]=3 134 B13R2.369 Nc1cc2ncccc2nc1N Amb18645346 [0,0,0,0,0,0|2,0,1]=3 135 B13R2.369 Nc1nc2ccccc2cc1Br Amb21962044 [0,0,0,0,0,0|3,0,1]=4 136 B13R2.369 Nc1nc2ccccc2cc1F Amb25800913 [0,0,0,0,0,0|3,0,1]=4 137 B13R2.369 Nc1nc2ccccc2cc1O Amb27471786 [0,0,0,0,0,0|2,0,1]=3 138 B13R2.369 Nc1nc2cccnc2cc1Br Amb28400870 [0,0,0,0,0,0|2,0,1]=3 139 B13R2.369 Nc1nc2cccnc2cc1F Amb28052946 [0,0,0,0,0,0|2,0,1]=3 140 B13R2.369 Nc1nc2ncccc2cc1Br Amb2795054 [0,0,0,0,0,0|4,0,0]=4 141 B13R2.369 O=C1Cc2ccccc2CN1O Amb27607094 [0,0,0,0,0,0|3,0,1]=4 142 B13R2.369 O=C1Cc2ccccc2OC1=O Amb22755081 [0,0,0,0,0,0|2,0,2]=4 143 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,0,0,0,0,0|2,0,2]=4 144 B13R2.369 O=C1Nc2ccccc2C=C1Br Amb20247010 [0,0,0,0,0,0|2,0,0]=2 145 B13R2.369 O=C1Nc2ccccc2C=C1Cl Amb21857147 [0,0,0,0,0,0|2,0,0]=2 146 B13R2.369 O=C1Nc2ccccc2C=C1F Amb22547229 [0,0,0,0,0,0|2,0,0]=2 147 B13R2.369 O=C1Nc2ccccc2C=C1O Amb20619410 [0,0,0,0,0,0|1,0,0]=1 148 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,0,0,0,0,0|2,0,2]=4 149 B13R2.369 O=C1Nc2ccccc2CC1O Amb22899290 [0,0,0,0,0,0|1,0,2]=3 150 B13R2.369 O=C1Nc2ccccc2NC1=O Amb18545062 [0,0,0,0,0,0|2,0,1]=3 151 B13R2.369 O=C1Nc2ccccc2NC1=S Amb19654259 [0,0,0,0,0,0|2,1,0]=3 152 B13R2.369 O=C1Nc2ccccc2OC1=O Amb19650977 [0,0,0,0,0,0|2,0,1]=3 153 B13R2.369 O=C1Nc2ccccc2OC1Br Amb33328763 [0,0,0,0,0,0|3,0,1]=4 154 B13R2.369 O=C1Nc2ccccc2OC1O Amb9824611 [0,0,0,0,0,0|2,0,1]=3 155 B13R2.369 O=C1Nc2ccccc2SC1=O Amb27949655 [0,0,0,0,0,0|2,0,1]=3 156 B13R2.369 O=C1Nc2ccccc2SC1O Amb28243913 [0,0,0,0,0,0|2,0,1]=3 157 B13R2.369 O=C1Nc2cccnc2C=C1Br Amb20671324 [0,0,0,0,0,0|1,0,0]=1 158 B13R2.369 O=C1Nc2cccnc2NC1=O Amb19813203 [0,0,0,0,0,0|1,0,1]=2 159 B13R2.369 O=C1Nc2ccncc2C=C1Br Amb26647449 [0,0,0,0,0,0|3,0,0]=3 160 B13R2.369 O=C1Nc2ccncc2C=C1Cl Amb27587506 [0,0,0,0,0,0|3,0,0]=3 161 B13R2.369 O=C1Nc2ccncc2C=C1O Amb25034645 [0,0,0,0,0,0|2,0,0]=2 162 B13R2.369 O=C1Nc2ccncc2NC1=O Amb18043122 [0,0,0,0,0,0|3,0,1]=4 163 B13R2.369 O=C1Nc2cncnc2NC1=O Amb24309295 [0,0,0,0,0,0|2,0,1]=3 164 B13R2.369 O=C1Nc2ncccc2OC1O Amb25352472 [0,0,0,0,0,0|3,0,1]=4 165 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,0,0,0,0,0|3,0,0]=3 166 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,0,0,0,0,0|3,0,0]=3 167 B13R2.369 O=C1Oc2ccccc2C=C1O Amb18511465 [0,0,0,0,0,0|2,0,0]=2 168 B13R2.369 O=C1Oc2ccccc2C=C1S Amb27173626 [0,0,0,0,0,0|2,1,0]=3 169 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,0,0,0,0,0|4,0,0]=4 170 B13R2.369 O=C1Oc2ccccc2N=C1O Amb22494623 [0,0,0,0,0,0|3,0,0]=3 171 B13R2.369 O=C1Oc2ccccc2NC1=S Amb27947432 [0,0,0,0,0,0|2,1,1]=4 172 B13R2.369 O=C1Oc2ccccc2NC1O Amb27767886 [0,0,0,0,0,0|3,0,1]=4 173 B13R2.369 O=C1Sc2ccccc2C=C1Br Amb19886583 [0,0,0,0,0,0|3,0,0]=3 174 B13R2.369 O=C1Sc2ccccc2C=C1Cl Amb22347336 [0,0,0,0,0,0|3,0,0]=3 175 B13R2.369 O=C1Sc2ccccc2C=C1F Amb22641706 [0,0,0,0,0,0|3,0,0]=3 176 B13R2.369 O=c1nc2cccnc2nc1=O Amb1040622 [0,0,0,0,0,0|1,0,2]=3 177 B13R2.369 Oc1cc2ccccc2cc1Br Amb17596080 [0,0,0,0,0,0|3,0,0]=3 178 B13R2.369 Oc1cc2ccccc2cc1Cl Amb4010282 [0,0,0,0,0,0|3,0,0]=3 179 B13R2.369 Oc1cc2ccccc2cc1F Amb26494442 [0,0,0,0,0,0|3,0,0]=3 180 B13R2.369 Oc1cc2ccccc2cc1I Amb25148790 [0,0,0,0,0,0|3,0,0]=3 181 B13R2.369 Oc1cc2ccccc2cc1O Amb6296607 [0,0,0,0,0,0|2,0,1]=3 182 B13R2.369 Oc1cc2ccccc2nc1Br Amb18134374 [0,0,0,0,0,0|2,0,1]=3 183 B13R2.369 Oc1cc2ccccc2nc1Cl Amb21963885 [0,0,0,0,0,0|2,0,1]=3 184 B13R2.369 Oc1cc2ccccc2nc1F Amb27244594 [0,0,0,0,0,0|2,0,1]=3 185 B13R2.369 Oc1cc2ccccc2nc1I Amb28187128 [0,0,0,0,0,0|2,0,1]=3 186 B13R2.369 Oc1cc2cccnc2cc1Br Amb18658931 [0,0,0,0,0,0|2,0,1]=3 187 B13R2.369 Oc1cc2cccnc2cc1Br Amb33734275 [0,0,0,0,0,0|2,0,1]=3 188 B13R2.369 Oc1cc2cccnc2cc1Cl Amb23403182 [0,0,0,0,0,0|2,0,1]=3 189 B13R2.369 Oc1cc2cccnc2cc1F Amb23437334 [0,0,0,0,0,0|2,0,1]=3 190 B13R2.369 Oc1cc2cccnc2cc1I Amb23437335 [0,0,0,0,0,0|2,0,1]=3 191 B13R2.369 Oc1cc2cccnc2cc1O Amb17594015 [0,0,0,0,0,0|1,0,1]=2 192 B13R2.369 Oc1cc2cccnc2nc1Br Amb21811364 [0,0,0,0,0,0|3,0,1]=4 193 B13R2.369 Oc1cc2ccncc2cc1Br Amb28244392 [0,0,0,0,0,0|4,0,0]=4 194 B13R2.369 Oc1cc2cnccc2cc1Br Amb24453966 [0,0,0,0,0,0|4,0,0]=4 195 B13R2.369 Oc1cc2ncccc2cc1Br Amb27154500 [0,0,0,0,0,0|2,0,0]=2 196 B13R2.369 Oc1cc2ncccc2cc1Cl Amb27175729 [0,0,0,0,0,0|2,0,0]=2 197 B13R2.369 Oc1cc2ncccc2cc1I Amb25771696 [0,0,0,0,0,0|2,0,0]=2 198 B13R2.369 Oc1nc2ccccc2cc1Br Amb10608236 [0,0,0,0,0,0|2,0,2]=4 199 B13R2.369 Oc1nc2ccccc2nc1Cl Amb22497412 [0,0,0,0,0,0|3,0,1]=4 200 B13R2.369 Oc1nc2ccccc2nc1O Amb6334823 [0,0,0,0,0,0|2,0,2]=4 201 B13R2.369 Oc1nc2ccccc2nc1S Amb4138352 [0,0,0,0,0,0|2,1,1]=4 202 B13R2.369 Oc1nc2ncccc2cc1Br Amb13881381 [0,0,0,0,0,0|3,0,0]=3 203 B13R2.369 S=C1Nc2ccccc2C=C1Br Amb27631744 [0,0,0,0,0,0|2,1,0]=3 204 B13R2.369 S=C1Nc2ccccc2N=C1Cl Amb27230317 [0,0,0,0,0,0|3,1,0]=4 205 B13R2.369 S=C1Nc2ccccc2NC1=S Amb22527759 [0,0,0,0,0,0|2,2,0]=4 206 B13R2.369 Sc1cc2ccccc2nc1Cl Amb26056479 [0,0,0,0,0,0|2,1,1]=4 207 B12R2.24 Brc1cc2cccnc2cn1 Amb35745025 [1,0,0,0,0,0|3,0,0]=4 208 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [1,0,0,0,0,0|3,0,0]=4 209 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [1,0,0,0,0,0|2,0,1]=4 210 B12R2.24 Brc1ccc2cccnc2c1 Amb8397712 [1,0,0,0,0,0|2,0,0]=3 211 B12R2.24 Brc1ccc2cccnc2n1 Amb2795056 [1,0,0,0,0,0|3,0,0]=4 212 B12R2.24 Brc1ccc2ccnnc2c1 Amb22276042 [1,0,0,0,0,0|3,0,0]=4 213 B12R2.24 Brc1ccc2cncnc2c1 Amb10975967 [1,0,0,0,0,0|3,0,0]=4 214 B12R2.24 Brc1ccc2ncccc2c1 Amb1033034 [1,0,0,0,0,0|2,0,0]=3 215 B12R2.24 Brc1ccc2ncccc2c1 Amb19516224 [1,0,0,0,0,0|2,0,0]=3 216 B12R2.24 Brc1ccc2ncccc2n1 Amb8438939 [1,0,0,0,0,0|1,0,1]=3 217 B12R2.24 Brc1ccc2nccnc2c1 Amb2723164 [1,0,0,0,0,0|3,0,0]=4 218 B12R2.24 Brc1ccc2nccnc2n1 Amb19895077 [1,0,0,0,0,0|2,0,1]=4 219 B12R2.24 Brc1ccc2ncncc2c1 Amb10975973 [1,0,0,0,0,0|3,0,0]=4 220 B12R2.24 Brc1ccc2nnccc2c1 Amb20241324 [1,0,0,0,0,0|3,0,0]=4 221 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [1,0,0,0,0,0|2,0,1]=4 222 B12R2.24 Brc1cnc2cccnc2c1 Amb19958317 [1,0,0,0,0,0|1,0,1]=3 223 B12R2.24 Brc1cnc2ncccc2c1 Amb2541644 [1,0,0,0,0,0|3,0,0]=4 224 B12R2.24 Brc1cnc2nccnc2c1 Amb9806400 [1,0,0,0,0,0|2,0,1]=4 225 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [1,0,0,0,0,0|2,0,1]=4 226 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [1,0,0,0,0,0|2,0,1]=4 227 B12R2.24 CC1C=Cc2ncccc2O1 Amb25700391 [1,0,0,0,0,0|2,0,1]=4 228 B12R2.24 C[n+]1ccc2ncccc2c1 Amb2610099 [1,0,0,0,0,0|3,0,0]=4 229 B12R2.24 C[n+]1ccc2ncccc2c1 Amb32454864 [1,0,0,0,0,0|3,0,0]=4 230 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [1,0,0,0,0,0|3,0,0]=4 231 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [1,0,0,0,0,0|2,0,1]=4 232 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [1,0,0,0,0,0|2,0,1]=4 233 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [1,0,0,0,0,0|2,0,0]=3 234 B12R2.24 Cc1ccc2cccnc2n1 Amb2793429 [1,0,0,0,0,0|3,0,0]=4 235 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [1,0,0,0,0,0|2,0,0]=3 236 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [1,0,0,0,0,0|2,0,0]=3 237 B12R2.24 Cc1ccc2ncccc2n1 Amb15692772 [1,0,0,0,0,0|1,0,1]=3 238 B12R2.24 Cc1ccc2nccnc2c1 Amb2689687 [1,0,0,0,0,0|3,0,0]=4 239 B12R2.24 Cc1ccc2nccnc2n1 Amb22000902 [1,0,0,0,0,0|2,0,1]=4 240 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [1,0,0,0,0,0|2,0,1]=4 241 B12R2.24 Cc1cnc2cccnc2c1 Amb26979817 [1,0,0,0,0,0|1,0,1]=3 242 B12R2.24 Cc1cnc2ncccc2c1 Amb26074359 [1,0,0,0,0,0|3,0,0]=4 243 B12R2.24 Clc1cc2cccnc2cn1 Amb25284449 [1,0,0,0,0,0|3,0,0]=4 244 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [1,0,0,0,0,0|3,0,0]=4 245 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [1,0,0,0,0,0|2,0,1]=4 246 B12R2.24 Clc1ccc2cccnc2c1 Amb10069239 [1,0,0,0,0,0|2,0,0]=3 247 B12R2.24 Clc1ccc2cccnc2n1 Amb9806399 [1,0,0,0,0,0|3,0,0]=4 248 B12R2.24 Clc1ccc2ccnnc2c1 Amb22752658 [1,0,0,0,0,0|3,0,0]=4 249 B12R2.24 Clc1ccc2cncnc2c1 Amb4011495 [1,0,0,0,0,0|3,0,0]=4 250 B12R2.24 Clc1ccc2ncccc2c1 Amb749944 [1,0,0,0,0,0|2,0,0]=3 251 B12R2.24 Clc1ccc2ncccc2n1 Amb21856967 [1,0,0,0,0,0|1,0,1]=3 252 B12R2.24 Clc1ccc2nccnc2c1 Amb10068707 [1,0,0,0,0,0|3,0,0]=4 253 B12R2.24 Clc1ccc2nccnc2n1 Amb19415587 [1,0,0,0,0,0|2,0,1]=4 254 B12R2.24 Clc1ccc2ncncc2c1 Amb17943286 [1,0,0,0,0,0|3,0,0]=4 255 B12R2.24 Clc1ccc2ncncc2n1 Amb27168673 [1,0,0,0,0,0|2,0,1]=4 256 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [1,0,0,0,0,0|2,0,1]=4 257 B12R2.24 Clc1cnc2ncccc2c1 Amb21864631 [1,0,0,0,0,0|3,0,0]=4 258 B12R2.24 Clc1ncc2ncccc2n1 Amb25821843 [1,0,0,0,0,0|2,0,1]=4 259 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [1,0,0,0,0,0|3,0,0]=4 260 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [1,0,0,0,0,0|2,0,1]=4 261 B12R2.24 Fc1ccc2cccnc2c1 Amb2622129 [1,0,0,0,0,0|2,0,0]=3 262 B12R2.24 Fc1ccc2cccnc2n1 Amb24511773 [1,0,0,0,0,0|3,0,0]=4 263 B12R2.24 Fc1ccc2cncnc2c1 Amb4007611 [1,0,0,0,0,0|3,0,0]=4 264 B12R2.24 Fc1ccc2ncccc2c1 Amb22831215 [1,0,0,0,0,0|2,0,0]=3 265 B12R2.24 Fc1ccc2ncccc2c1 Amb6892892 [1,0,0,0,0,0|2,0,0]=3 266 B12R2.24 Fc1ccc2nccnc2c1 Amb10840038 [1,0,0,0,0,0|3,0,0]=4 267 B12R2.24 Fc1ccc2nccnc2n1 Amb34163601 [1,0,0,0,0,0|2,0,1]=4 268 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [1,0,0,0,0,0|2,0,1]=4 269 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [1,0,0,0,0,0|3,0,0]=4 270 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [1,0,0,0,0,0|2,0,1]=4 271 B12R2.24 Ic1ccc2cccnc2c1 Amb21858708 [1,0,0,0,0,0|2,0,0]=3 272 B12R2.24 Ic1ccc2cncnc2c1 Amb23402211 [1,0,0,0,0,0|3,0,0]=4 273 B12R2.24 Ic1ccc2ncccc2c1 Amb10066910 [1,0,0,0,0,0|2,0,0]=3 274 B12R2.24 Ic1ccc2nccnc2c1 Amb5751221 [1,0,0,0,0,0|3,0,0]=4 275 B12R2.24 Ic1ccc2nccnc2n1 Amb25703357 [1,0,0,0,0,0|2,0,1]=4 276 B12R2.24 Ic1ccc2ncncc2c1 Amb19957516 [1,0,0,0,0,0|3,0,0]=4 277 B12R2.24 Ic1ccc2nnccc2c1 Amb22751176 [1,0,0,0,0,0|3,0,0]=4 278 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [1,0,0,0,0,0|2,0,1]=4 279 B12R2.24 Ic1cnc2cccnc2c1 Amb13890060 [1,0,0,0,0,0|1,0,1]=3 280 B12R2.24 Ic1cnc2nccnc2c1 Amb10067844 [1,0,0,0,0,0|2,0,1]=4 281 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [1,0,0,0,0,0|2,0,1]=4 282 B12R2.24 Nc1cc2cccnc2cn1 Amb22495695 [1,0,0,0,0,0|3,0,0]=4 283 B12R2.24 Nc1cc2cccnc2cn1 Amb32668902 [1,0,0,0,0,0|3,0,0]=4 284 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [1,0,0,0,0,0|3,0,0]=4 285 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [1,0,0,0,0,0|3,0,0]=4 286 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [1,0,0,0,0,0|2,0,1]=4 287 B12R2.24 Nc1ccc2cccnc2c1 Amb24183307 [1,0,0,0,0,0|2,0,0]=3 288 B12R2.24 Nc1ccc2cccnc2c1 Amb31217512 [1,0,0,0,0,0|2,0,0]=3 289 B12R2.24 Nc1ccc2cccnc2c1 Amb5717605 [1,0,0,0,0,0|2,0,0]=3 290 B12R2.24 Nc1ccc2cccnc2n1 Amb2795032 [1,0,0,0,0,0|3,0,0]=4 291 B12R2.24 Nc1ccc2cncnc2c1 Amb22001709 [1,0,0,0,0,0|3,0,0]=4 292 B12R2.24 Nc1ccc2ncccc2c1 Amb2721017 [1,0,0,0,0,0|2,0,0]=3 293 B12R2.24 Nc1ccc2ncccc2c1 Amb33536629 [1,0,0,0,0,0|2,0,0]=3 294 B12R2.24 Nc1ccc2ncccc2n1 Amb2696937 [1,0,0,0,0,0|1,0,1]=3 295 B12R2.24 Nc1ccc2nccnc2c1 Amb6315763 [1,0,0,0,0,0|3,0,0]=4 296 B12R2.24 Nc1ccc2nccnc2n1 Amb2610665 [1,0,0,0,0,0|2,0,1]=4 297 B12R2.24 Nc1ccc2ncncc2c1 Amb17935799 [1,0,0,0,0,0|3,0,0]=4 298 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [1,0,0,0,0,0|2,0,1]=4 299 B12R2.24 Nc1cnc2cccnc2c1 Amb13881251 [1,0,0,0,0,0|1,0,1]=3 300 B12R2.24 Nc1cnc2ncccc2c1 Amb8827554 [1,0,0,0,0,0|3,0,0]=4 301 B12R2.24 Nc1cnc2nccnc2c1 Amb10067337 [1,0,0,0,0,0|2,0,1]=4 302 B12R2.24 Nc1ncc2ncccc2n1 Amb27467697 [1,0,0,0,0,0|2,0,1]=4 303 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [1,0,0,0,0,0|3,0,0]=4 304 B12R2.24 O=C1C=C2C=CC=NC2=CN1 Amb27239109 [1,0,0,0,0,0|2,0,0]=3 305 B12R2.24 O=C1C=C2N=CC=CC2=CN1 Amb27642614 [1,0,0,0,0,0|2,0,1]=4 306 B12R2.24 O=C1C=CN2N=CC=CC2=N1 Amb22497885 [1,0,0,0,0,0|1,0,1]=3 307 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [1,0,0,0,0,0|1,0,0]=2 308 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [1,0,0,0,0,0|2,0,0]=3 309 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [1,0,0,0,0,0|1,0,1]=3 310 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [1,0,0,0,0,0|1,0,1]=3 311 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [1,0,0,0,0,0|2,0,0]=3 312 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [1,0,0,0,0,0|2,0,0]=3 313 B12R2.24 O=C1C=Cc2ccncc2O1 Amb24395883 [1,0,0,0,0,0|3,0,0]=4 314 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [1,0,0,0,0,0|2,0,0]=3 315 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [1,0,0,0,0,0|0,0,0]=1 316 B12R2.24 O=C1C=Cc2nccnc2N1 Amb19957771 [1,0,0,0,0,0|1,0,0]=2 317 B12R2.24 O=C1C=Cc2ncncc2N1 Amb21811941 [1,0,0,0,0,0|1,0,0]=2 318 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [1,0,0,0,0,0|2,0,0]=3 319 B12R2.24 O=C1C=Nc2cccnc2N1 Amb20461570 [1,0,0,0,0,0|1,0,2]=4 320 B12R2.24 O=C1C=Nc2ccncc2N1 Amb18016830 [1,0,0,0,0,0|3,0,0]=4 321 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [1,0,0,0,0,0|1,0,2]=4 322 B12R2.24 O=C1CCc2ncccc2C1 Amb7969886 [1,0,0,0,0,0|1,0,2]=4 323 B12R2.24 O=C1CCc2ncccc2N1 Amb25095800 [1,0,0,0,0,0|0,0,2]=3 324 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [1,0,0,0,0,0|2,0,1]=4 325 B12R2.24 O=C1CNc2ncccc2N1 Amb17948510 [1,0,0,0,0,0|1,0,1]=3 326 B12R2.24 O=C1CNc2ncncc2N1 Amb24091942 [1,0,0,0,0,0|2,0,1]=4 327 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [1,0,0,0,0,0|2,0,1]=4 328 B12R2.24 O=C1COc2ncccc2N1 Amb9824130 [1,0,0,0,0,0|1,0,1]=3 329 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [1,0,0,0,0,0|2,0,1]=4 330 B12R2.24 O=C1CSc2ncccc2N1 Amb29083254 [1,0,0,0,0,0|1,0,1]=3 331 B12R2.24 O=C1CSc2ncccc2N1 Amb7172747 [1,0,0,0,0,0|1,0,1]=3 332 B12R2.24 O=C1CSc2nccnc2N1 Amb26917466 [1,0,0,0,0,0|2,0,1]=4 333 B12R2.24 O=C1Cc2cccnc2CN1 Amb24513882 [1,0,0,0,0,0|2,0,1]=4 334 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [1,0,0,0,0,0|2,0,0]=3 335 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [1,0,0,0,0,0|3,0,0]=4 336 B12R2.24 O=C1NCc2nccnc2N1 Amb24486067 [1,0,0,0,0,0|2,0,1]=4 337 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [1,0,0,0,0,0|2,0,1]=4 338 B12R2.24 O=C1Nc2cccnc2CO1 Amb32692993 [1,0,0,0,0,0|1,0,1]=3 339 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [1,0,0,0,0,0|3,0,0]=4 340 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [1,0,0,0,0,0|3,0,0]=4 341 B12R2.24 OC1=COc2ncccc2N1 Amb19516358 [1,0,0,0,0,0|1,0,1]=3 342 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [1,0,0,0,0,0|3,0,0]=4 343 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [1,0,0,0,0,0|3,0,0]=4 344 B12R2.24 Oc1ccc2c(c1)OCC=C2 Amb27804492 [1,0,0,0,0,0|2,0,1]=4 345 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [1,0,0,0,0,0|2,0,0]=3 346 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [1,0,0,0,0,0|1,0,0]=2 347 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [1,0,0,0,0,0|1,0,0]=2 348 B12R2.24 Oc1ccc2cccnc2n1 Amb9806398 [1,0,0,0,0,0|2,0,0]=3 349 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [1,0,0,0,0,0|3,0,0]=4 350 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [1,0,0,0,0,0|3,0,0]=4 351 B12R2.24 Oc1ccc2ccnnc2c1 Amb25319976 [1,0,0,0,0,0|2,0,0]=3 352 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [1,0,0,0,0,0|3,0,0]=4 353 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [1,0,0,0,0,0|3,0,0]=4 354 B12R2.24 Oc1ccc2cncnc2c1 Amb24066333 [1,0,0,0,0,0|2,0,0]=3 355 B12R2.24 Oc1ccc2cncnc2n1 Amb27958671 [1,0,0,0,0,0|3,0,0]=4 356 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [1,0,0,0,0,0|1,0,1]=3 357 B12R2.24 Oc1ccc2nccnc2c1 Amb2548376 [1,0,0,0,0,0|2,0,0]=3 358 B12R2.24 Oc1ccc2ncncc2c1 Amb8484685 [1,0,0,0,0,0|2,0,1]=4 359 B12R2.24 Oc1ccc2nnccc2c1 Amb26871668 [1,0,0,0,0,0|2,0,1]=4 360 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [1,0,0,0,0,0|1,0,1]=3 361 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [1,0,0,0,0,0|2,0,1]=4 362 B12R2.24 Oc1cnc2cccnc2c1 Amb13890072 [1,0,0,0,0,0|0,0,1]=2 363 B12R2.24 Oc1cnc2ccncc2c1 Amb27265400 [1,0,0,0,0,0|2,0,1]=4 364 B12R2.24 Oc1cnc2ncccc2c1 Amb26616876 [1,0,0,0,0,0|2,0,1]=4 365 B12R2.24 Oc1cnc2ncccc2c1 Amb32653317 [1,0,0,0,0,0|2,0,1]=4 366 B12R2.24 Oc1cnc2nccnc2c1 Amb23401943 [1,0,0,0,0,0|1,0,1]=3 367 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [1,0,0,0,0,0|1,1,0]=3 368 B12R2.24 S=C1C=Cc2cccnc2N1 Amb27233738 [1,0,0,0,0,0|2,1,0]=4 369 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [1,0,0,0,0,0|2,1,0]=4 370 B12R2.24 S=C1CSc2ncccc2N1 Amb27257946 [1,0,0,0,0,0|1,1,1]=4 371 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [1,0,0,0,0,0|2,1,0]=4 372 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [1,0,0,0,0,0|2,1,0]=4 373 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [1,0,0,0,0,0|1,1,1]=4 374 B12R2.24 Sc1ccc2cccnc2c1 Amb25885524 [1,0,0,0,0,0|1,1,0]=3 375 B12R2.24 Sc1ccc2ncccc2c1 Amb25076144 [1,0,0,0,0,0|1,1,0]=3 376 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [1,0,0,0,0,0|1,1,1]=4 377 B12R2.24 Sc1cnc2nccnc2c1 Amb25877777 [1,0,0,0,0,0|1,1,1]=4 378 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [1,0,0,0,0,0|3,0,0]=4 379 B14R2.639 CC1(C)Nc2ncccc2NC1=O Amb18196094 [0,1,0,0,0,0|2,0,1]=4 380 B14R2.639 CC1(C)Oc2ncccc2NC1=O Amb33623610 [0,1,0,0,0,0|2,0,1]=4 381 B14R2.639 CC1(C)Sc2ncccc2NC1=O Amb27772408 [0,1,0,0,0,0|2,0,1]=4 382 B14R2.639 CC1(O)Oc2ccccc2NC1=O Amb28205899 [0,1,0,0,0,0|2,0,1]=4 383 B14R2.1128 C#CC1=Cc2ccccc2OC1=O Amb27186021 [0,1,0,0,0,0|3,0,0]=4 384 B14R2.1128 C#CC1=Nc2ccccc2NC1=O Amb29853352 [0,1,0,0,0,0|3,0,0]=4 385 B14R2.1128 C=CC1=Nc2ccccc2NC1=O Amb28252437 [0,1,0,0,0,0|3,0,0]=4 386 B14R2.1128 C=Cc1cc2ccccc2cc1O Amb28383138 [0,1,0,0,0,0|3,0,0]=4 387 B14R2.1128 CCC1=Cc2ccccc2NC1=O Amb22723317 [0,1,0,0,0,0|2,0,0]=3 388 B14R2.1128 CCC1=Nc2ccccc2NC1=O Amb19891159 [0,1,0,0,0,0|3,0,0]=4 389 B14R2.1128 CCC1Nc2ncccc2NC1=O Amb19515415 [0,1,0,0,0,0|2,0,1]=4 390 B14R2.1128 CCc1cc2ccccc2cc1O Amb25059607 [0,1,0,0,0,0|3,0,0]=4 391 B14R2.1128 CCc1nc2ccccc2cc1O Amb24749839 [0,1,0,0,0,0|2,0,1]=4 392 B14R2.1128 COC1=Cc2ccccc2OC1=O Amb23512578 [0,1,0,0,0,0|2,0,0]=3 393 B14R2.1128 COC1=Cc2ccncc2NC1=O Amb28364749 [0,1,0,0,0,0|2,0,0]=3 394 B14R2.1128 COC1=Cc2ncccc2NC1=O Amb27168932 [0,1,0,0,0,0|0,0,0]=1 395 B14R2.1128 COC1=Nc2cccnc2NC1=O Amb24674244 [0,1,0,0,0,0|3,0,0]=4 396 B14R2.1128 COC1Nc2ncncc2NC1=O Amb26593172 [0,1,0,0,0,0|2,0,1]=4 397 B14R2.1128 COc1cc2ccccc2cc1Br Amb22445934 [0,1,0,0,0,0|3,0,0]=4 398 B14R2.1128 COc1cc2ccccc2cc1C Amb24415328 [0,1,0,0,0,0|3,0,0]=4 399 B14R2.1128 COc1cc2ccccc2cc1Cl Amb24735700 [0,1,0,0,0,0|3,0,0]=4 400 B14R2.1128 COc1cc2ccccc2cc1I Amb26595184 [0,1,0,0,0,0|3,0,0]=4 401 B14R2.1128 COc1cc2ccccc2cc1N Amb18127045 [0,1,0,0,0,0|3,0,0]=4 402 B14R2.1128 COc1cc2ccccc2cc1O Amb6358072 [0,1,0,0,0,0|2,0,1]=4 403 B14R2.1128 COc1cc2ccccc2nc1Br Amb25739600 [0,1,0,0,0,0|2,0,1]=4 404 B14R2.1128 COc1cc2ccccc2nc1Cl Amb24534649 [0,1,0,0,0,0|2,0,1]=4 405 B14R2.1128 COc1cc2ccccc2nc1O Amb2612889 [0,1,0,0,0,0|1,0,2]=4 406 B14R2.1128 COc1cc2cccnc2cc1Br Amb23437339 [0,1,0,0,0,0|2,0,1]=4 407 B14R2.1128 COc1cc2cccnc2cc1C Amb22886999 [0,1,0,0,0,0|2,0,1]=4 408 B14R2.1128 COc1cc2cccnc2cc1Cl Amb23401102 [0,1,0,0,0,0|2,0,1]=4 409 B14R2.1128 COc1cc2cccnc2cc1F Amb19957347 [0,1,0,0,0,0|2,0,1]=4 410 B14R2.1128 COc1cc2cccnc2cc1I Amb23400929 [0,1,0,0,0,0|2,0,1]=4 411 B14R2.1128 COc1cc2cccnc2cc1N Amb24565737 [0,1,0,0,0,0|2,0,1]=4 412 B14R2.1128 COc1cc2ncccc2cc1Br Amb30594112 [0,1,0,0,0,0|2,0,0]=3 413 B14R2.1128 COc1cc2ncccc2cc1C Amb25869889 [0,1,0,0,0,0|2,0,0]=3 414 B14R2.1128 COc1cc2ncccc2cc1F Amb27593053 [0,1,0,0,0,0|2,0,0]=3 415 B14R2.1128 COc1cc2ncccc2cc1N Amb24427333 [0,1,0,0,0,0|2,0,0]=3 416 B14R2.1128 COc1cc2nccnc2cc1Cl Amb28290890 [0,1,0,0,0,0|3,0,0]=4 417 B14R2.1128 COc1cc2nccnc2cc1F Amb28122912 [0,1,0,0,0,0|3,0,0]=4 418 B14R2.1128 COc1nc2ccccc2cc1O Amb27476171 [0,1,0,0,0,0|1,0,2]=4 419 B14R2.1128 COc1nc2cccnc2cc1Br Amb34931281 [0,1,0,0,0,0|1,0,2]=4 420 B14R2.1128 COc1nc2ncccc2cc1N Amb32424340 [0,1,0,0,0,0|3,0,0]=4 421 B14R2.1128 CSC1=Cc2ccccc2OC1=O Amb27623644 [0,1,0,0,0,0|2,1,0]=4 422 B14R2.1128 Cc1cc2ccccc2cc1CO Amb25943382 [0,1,0,0,0,0|3,0,0]=4 423 B14R2.1128 Cc1cc2ccccc2nc1C=O Amb22372301 [0,1,0,0,0,0|2,0,1]=4 424 B14R2.1128 Cc1cc2ncccc2cc1C=O Amb25956006 [0,1,0,0,0,0|2,0,0]=3 425 B14R2.1128 Cc1nc2ccccc2cc1CO Amb27804004 [0,1,0,0,0,0|2,0,1]=4 426 B14R2.1128 Cc1nc2nccnc2cc1CO Amb32423747 [0,1,0,0,0,0|2,0,1]=4 427 B14R2.1128 Clc1cc2ncccc2cc1CBr Amb26078158 [0,1,0,0,0,0|3,0,0]=4 428 B14R2.1128 N#CC1=Cc2ccccc2NC1=O Amb18003107 [0,1,0,0,0,0|2,0,0]=3 429 B14R2.1128 N#CC1=Cc2ccccc2OC1=O Amb18531768 [0,1,0,0,0,0|3,0,0]=4 430 B14R2.1128 N#CC1=Cc2cccnc2NC1=O Amb19895271 [0,1,0,0,0,0|3,0,0]=4 431 B14R2.1128 N#CC1=Cc2cnccc2NC1=O Amb25815326 [0,1,0,0,0,0|3,0,0]=4 432 B14R2.1128 N#CC1=Nc2ccccc2NC1=O Amb18126753 [0,1,0,0,0,0|3,0,0]=4 433 B14R2.1128 N#Cc1cc2ccccc2cc1O Amb27591627 [0,1,0,0,0,0|3,0,0]=4 434 B14R2.1128 N#Cc1cc2cccnc2cc1F Amb22757135 [0,1,0,0,0,0|3,0,0]=4 435 B14R2.1128 N#Cc1cc2cccnc2cc1O Amb25097189 [0,1,0,0,0,0|2,0,0]=3 436 B14R2.1128 N#Cc1cc2ncccc2cc1O Amb25219998 [0,1,0,0,0,0|2,0,1]=4 437 B14R2.1128 N#Cc1cc2ncccc2nc1O Amb18647472 [0,1,0,0,0,0|1,0,2]=4 438 B14R2.1128 N#Cc1nc2ccccc2cc1O Amb24655868 [0,1,0,0,0,0|2,0,1]=4 439 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb17991271 [0,1,0,0,0,0|2,0,0]=3 440 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb18908960 [0,1,0,0,0,0|2,0,0]=3 441 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [0,1,0,0,0,0|3,0,0]=4 442 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb32686597 [0,1,0,0,0,0|3,0,0]=4 443 B14R2.1128 NCC1=Cc2cccnc2NC1=O Amb18252246 [0,1,0,0,0,0|3,0,0]=4 444 B14R2.1128 NCC1=Cc2ccncc2NC1=O Amb32668058 [0,1,0,0,0,0|3,0,0]=4 445 B14R2.1128 NCC1=Cc2cnccc2NC1=O Amb32668056 [0,1,0,0,0,0|3,0,0]=4 446 B14R2.1128 NCc1cc2ccccc2cc1O Amb26044834 [0,1,0,0,0,0|3,0,0]=4 447 B14R2.1128 NCc1cc2cccnc2cc1Br Amb20668430 [0,1,0,0,0,0|3,0,0]=4 448 B14R2.1128 NCc1cc2cccnc2cc1Br Amb27164263 [0,1,0,0,0,0|3,0,0]=4 449 B14R2.1128 NCc1cc2cccnc2cc1Cl Amb28063296 [0,1,0,0,0,0|3,0,0]=4 450 B14R2.1128 NNC1=Nc2ccccc2NC1=O Amb18127652 [0,1,0,0,0,0|3,0,0]=4 451 B14R2.1128 NNc1cc2ccccc2cc1O Amb27830653 [0,1,0,0,0,0|3,0,0]=4 452 B14R2.1128 Nc1cc2ccccc2cc1C=O Amb25782655 [0,1,0,0,0,0|3,0,0]=4 453 B14R2.1128 Nc1cc2ccccc2cc1CO Amb19959319 [0,1,0,0,0,0|3,0,0]=4 454 B14R2.1128 Nc1cc2ccccc2nc1C=O Amb23401878 [0,1,0,0,0,0|2,0,1]=4 455 B14R2.1128 Nc1nc2ccccc2cc1CO Amb18946793 [0,1,0,0,0,0|2,0,1]=4 456 B14R2.1128 Nc1nc2ncccc2cc1C=O Amb25109110 [0,1,0,0,0,0|3,0,0]=4 457 B14R2.1128 O=C1Nc2ccccc2C=C1CCl Amb18015274 [0,1,0,0,0,0|2,0,0]=3 458 B14R2.1128 O=C1Nc2ccccc2C=C1CO Amb18528795 [0,1,0,0,0,0|1,0,0]=2 459 B14R2.1128 O=C1Nc2ccccc2C=C1NO Amb27827448 [0,1,0,0,0,0|1,0,0]=2 460 B14R2.1128 O=C1Nc2ccccc2N=C1CBr Amb18026153 [0,1,0,0,0,0|3,0,0]=4 461 B14R2.1128 O=C1Nc2ccccc2N=C1CCl Amb24723234 [0,1,0,0,0,0|3,0,0]=4 462 B14R2.1128 O=C1Nc2ccccc2N=C1NO Amb20641462 [0,1,0,0,0,0|2,0,0]=3 463 B14R2.1128 O=C1Nc2ccccc2NC1CO Amb9777133 [0,1,0,0,0,0|2,0,1]=4 464 B14R2.1128 O=C1Nc2ccccc2N[C@@H]1CO Amb24567701 [0,1,0,0,0,0|2,0,1]=4 465 B14R2.1128 O=C1Nc2ccccc2O[C@H]1CO Amb27618136 [0,1,0,0,0,0|2,0,1]=4 466 B14R2.1128 O=C1Nc2ncccc2C=C1CBr Amb25338287 [0,1,0,0,0,0|3,0,0]=4 467 B14R2.1128 O=C1Oc2ccccc2C=C1CBr Amb27239513 [0,1,0,0,0,0|3,0,0]=4 468 B14R2.1128 O=C1Oc2ccccc2C=C1CCl Amb21937093 [0,1,0,0,0,0|3,0,0]=4 469 B14R2.1128 O=C1Oc2ccccc2C\C1=N\O Amb27441913 [0,1,0,0,0,0|2,0,1]=4 470 B14R2.1128 O=C1Oc2ccccc2N=C1NO Amb20641490 [0,1,0,0,0,0|3,0,0]=4 471 B14R2.1128 O=C1Sc2ccccc2N=C1NO Amb20641550 [0,1,0,0,0,0|3,0,0]=4 472 B14R2.1128 O=CC1=C(O)Nc2ccccc2N1 Amb27265827 [0,1,0,0,0,0|2,0,0]=3 473 B14R2.1128 O=CC1=Cc2ccccc2NC1=O Amb18014582 [0,1,0,0,0,0|1,0,1]=3 474 B14R2.1128 O=CC1=Cc2ccccc2OC1=O Amb18647793 [0,1,0,0,0,0|2,0,1]=4 475 B14R2.1128 O=Cc1cc2ccccc2cc1Cl Amb18650675 [0,1,0,0,0,0|3,0,0]=4 476 B14R2.1128 O=Cc1cc2ccccc2cc1F Amb18647802 [0,1,0,0,0,0|3,0,0]=4 477 B14R2.1128 O=Cc1cc2ccccc2cc1I Amb27223051 [0,1,0,0,0,0|3,0,0]=4 478 B14R2.1128 O=Cc1cc2ccccc2cc1O Amb5494028 [0,1,0,0,0,0|2,0,0]=3 479 B14R2.1128 O=Cc1cc2ccccc2nc1O Amb1794818 [0,1,0,0,0,0|3,0,0]=4 480 B14R2.1128 O=Cc1cc2cccnc2cc1Br Amb27180877 [0,1,0,0,0,0|2,0,0]=3 481 B14R2.1128 O=Cc1cc2cccnc2cc1F Amb20076039 [0,1,0,0,0,0|2,0,0]=3 482 B14R2.1128 O=Cc1cc2cccnc2cc1O Amb24432684 [0,1,0,0,0,0|1,0,0]=2 483 B14R2.1128 O=Cc1nc2ccccc2cc1Br Amb19516501 [0,1,0,0,0,0|2,0,1]=4 484 B14R2.1128 O=Cc1nc2ccccc2cc1Cl Amb25859966 [0,1,0,0,0,0|2,0,1]=4 485 B14R2.1128 O=Cc1nc2ccccc2cc1F Amb22547353 [0,1,0,0,0,0|2,0,1]=4 486 B14R2.1128 O=Cc1nc2ccccc2cc1I Amb27487355 [0,1,0,0,0,0|2,0,1]=4 487 B14R2.1128 O=Cc1nc2ccccc2nc1O Amb17594377 [0,1,0,0,0,0|2,0,1]=4 488 B14R2.1128 O=c1nc2ccccc2n\c1=N\O Amb2786676 [0,1,0,0,0,0|2,0,1]=4 489 B14R2.1128 OCc1cc2ccccc2cc1Br Amb27814189 [0,1,0,0,0,0|3,0,0]=4 490 B14R2.1128 OCc1cc2ccccc2cc1Cl Amb26512048 [0,1,0,0,0,0|3,0,0]=4 491 B14R2.1128 OCc1cc2ccccc2cc1F Amb25927086 [0,1,0,0,0,0|3,0,0]=4 492 B14R2.1128 OCc1cc2ccccc2cc1I Amb27949521 [0,1,0,0,0,0|3,0,0]=4 493 B14R2.1128 OCc1cc2ccccc2cc1O Amb18127196 [0,1,0,0,0,0|2,0,1]=4 494 B14R2.1128 OCc1cc2ccccc2nc1Cl Amb696676 [0,1,0,0,0,0|2,0,1]=4 495 B14R2.1128 OCc1cc2ccccc2nc1I Amb24309344 [0,1,0,0,0,0|2,0,1]=4 496 B14R2.1128 Oc1cc2ccccc2cc1CBr Amb26316705 [0,1,0,0,0,0|3,0,0]=4 497 B14R2.1128 Oc1cc2ccccc2cc1CCl Amb26053532 [0,1,0,0,0,0|3,0,0]=4 498 B14R2.8188 C=C1c2ccccc2NC(=O)N1C Amb25309633 [0,1,0,0,0,0|3,0,0]=4 499 B14R2.8188 CC1=C(Br)C(=O)Nc2ccccc21 Amb19650649 [0,1,0,0,0,0|2,0,0]=3 500 B14R2.8188 CC1=C(C)C(=O)c2ccccc2N1 Amb18180399 [0,1,0,0,0,0|3,0,0]=4 501 B14R2.8188 CC1=C(C)C(=S)c2ccccc2N1 Amb19553674 [0,1,0,0,0,0|3,0,0]=4 502 B14R2.8188 CC1=C(C)c2ccccc2OC1=O Amb20247473 [0,1,0,0,0,0|3,0,0]=4 503 B14R2.8188 CC1=C(Cl)c2ccccc2NC1=O Amb28457180 [0,1,0,0,0,0|2,0,0]=3 504 B14R2.8188 CC1=C(I)C(=O)c2ccccc2N1 Amb23533648 [0,1,0,0,0,0|3,0,0]=4 505 B14R2.8188 CC1=C(N)C(=O)Oc2ccccc21 Amb18127405 [0,1,0,0,0,0|3,0,0]=4 506 B14R2.8188 CC1=C(N)C(=O)c2ccccc2N1 Amb18647838 [0,1,0,0,0,0|3,0,0]=4 507 B14R2.8188 CC1=C(N)c2ccccc2NC1=O Amb25097050 [0,1,0,0,0,0|2,0,0]=3 508 B14R2.8188 CC1=C(O)C(=O)Nc2ccccc21 Amb22752590 [0,1,0,0,0,0|1,0,0]=2 509 B14R2.8188 CC1=C(O)C(=O)c2ccccc2N1 Amb20171457 [0,1,0,0,0,0|2,0,0]=3 510 B14R2.8188 CC1=C(O)C(=O)c2ccccc2O1 Amb24633658 [0,1,0,0,0,0|3,0,0]=4 511 B14R2.8188 CC1=C(O)c2ccccc2NC1=O Amb22752589 [0,1,0,0,0,0|2,0,0]=3 512 B14R2.8188 CC1=Cc2ccccc2N(C)C1=O Amb22904186 [0,1,0,0,0,0|2,0,0]=3 513 B14R2.8188 CC1=Nc2ccccc2N(C)C1=O Amb19652902 [0,1,0,0,0,0|3,0,0]=4 514 B14R2.8188 CC1=Nc2ccccc2N(N)C1=O Amb28319544 [0,1,0,0,0,0|3,0,0]=4 515 B14R2.8188 CC1=Nc2ccccc2N(O)C1=O Amb27205386 [0,1,0,0,0,0|3,0,0]=4 516 B14R2.8188 CC1C(=O)Nc2ccccc2C1=O Amb35735225 [0,1,0,0,0,0|2,0,1]=4 517 B14R2.8188 CN1C(=O)C(=O)Nc2ccccc21 Amb19516760 [0,1,0,0,0,0|2,0,1]=4 518 B14R2.8188 CN1C(=O)C(=O)Nc2cccnc21 Amb21940098 [0,1,0,0,0,0|1,0,1]=3 519 B14R2.8188 CN1C(=O)C(=O)Nc2cncnc21 Amb27793471 [0,1,0,0,0,0|2,0,1]=4 520 B14R2.8188 CN1C(=O)C(=O)Nc2ncncc21 Amb24726973 [0,1,0,0,0,0|2,0,1]=4 521 B14R2.8188 CN1C(=O)C(Br)=Cc2ccccc21 Amb20246919 [0,1,0,0,0,0|2,0,0]=3 522 B14R2.8188 CN1C(=O)C(Cl)=Nc2ncccc21 Amb23557989 [0,1,0,0,0,0|2,0,0]=3 523 B14R2.8188 CN1C(=O)C(F)=Cc2ccccc21 Amb22547226 [0,1,0,0,0,0|2,0,0]=3 524 B14R2.8188 CN1C(=O)C(N)=Cc2ccccc21 Amb18065259 [0,1,0,0,0,0|2,0,0]=3 525 B14R2.8188 CN1C(=O)C(O)=Nc2ncccc21 Amb23557988 [0,1,0,0,0,0|1,0,0]=2 526 B14R2.8188 CN1C(=O)Nc2ccccc2C1=O Amb19372548 [0,1,0,0,0,0|3,0,0]=4 527 B14R2.8188 CN1C(=O)Nc2cccnc2C1=O Amb27982881 [0,1,0,0,0,0|2,0,0]=3 528 B14R2.8188 CN1C(=O)Nc2nccnc2C1=O Amb21994673 [0,1,0,0,0,0|3,0,0]=4 529 B14R2.8188 Cc1c(Br)c(=O)oc2ccccc12 Amb2797846 [0,1,0,0,0,0|3,0,0]=4 530 B14R2.8188 Cc1c(Br)c(Cl)nc2cccnc12 Amb23597932 [0,1,0,0,0,0|2,0,1]=4 531 B14R2.8188 Cc1c(Br)c(N)nc2cccnc12 Amb23597938 [0,1,0,0,0,0|2,0,1]=4 532 B14R2.8188 Cc1c(Cl)c(Br)cc2cccnc12 Amb20171097 [0,1,0,0,0,0|3,0,0]=4 533 B14R2.8188 Cc1c(Cl)c(O)cc2cccnc12 Amb27641337 [0,1,0,0,0,0|2,0,1]=4 534 B14R2.8188 Cc1c(Cl)cc2cccnc2c1Cl Amb27180646 [0,1,0,0,0,0|3,0,0]=4 535 B14R2.8188 Cc1c(Cl)cc2ncccc2c1Cl Amb25755798 [0,1,0,0,0,0|3,0,0]=4 536 B14R2.8188 Cc1c(F)cc2cccnc2c1Br Amb23448780 [0,1,0,0,0,0|3,0,0]=4 537 B14R2.8188 Cc1c(F)cc2cccnc2c1N Amb23448777 [0,1,0,0,0,0|3,0,0]=4 538 B14R2.8188 Cc1c(F)cc2cccnc2c1O Amb23448788 [0,1,0,0,0,0|3,0,0]=4 539 B14R2.8188 Cc1c(O)cc2ccccc2c1C Amb24309351 [0,1,0,0,0,0|3,0,0]=4 540 B14R2.8188 Cc1c(O)cc2ccccc2c1O Amb27589809 [0,1,0,0,0,0|3,0,0]=4 541 B14R2.8188 Cc1c(O)nc2ncccc2c1O Amb10766625 [0,1,0,0,0,0|3,0,0]=4 542 B14R2.8188 Cc1cc2ccccc2c(Br)c1O Amb27604330 [0,1,0,0,0,0|3,0,0]=4 543 B14R2.8188 Cc1cc2cccnc2c(C)c1O Amb27476093 [0,1,0,0,0,0|2,0,0]=3 544 B14R2.8188 Cc1cc2cccnc2c(N)c1C Amb28193459 [0,1,0,0,0,0|3,0,0]=4 545 B14R2.8188 Cc1cc2ncccc2c(C)c1O Amb28344072 [0,1,0,0,0,0|2,0,1]=4 546 B14R2.8188 Cc1cc2ncccc2c(N)c1C Amb18126934 [0,1,0,0,0,0|3,0,0]=4 547 B14R2.8188 Cc1cc2ncccc2c(N)c1N Amb27848574 [0,1,0,0,0,0|3,0,0]=4 548 B14R2.8188 Cc1nc2ccccc2c(Br)c1O Amb15695061 [0,1,0,0,0,0|2,0,1]=4 549 B14R2.8188 Cc1nc2cccnc2c(C)c1C Amb23596109 [0,1,0,0,0,0|2,0,1]=4 550 B14R2.8188 Cc1nc2cccnc2c(C)c1Cl Amb33610499 [0,1,0,0,0,0|2,0,1]=4 551 B14R2.8188 Cn1c(=O)c(N)nc2ccccc21 Amb8439682 [0,1,0,0,0,0|3,0,0]=4 552 B14R2.8188 Fc1c(Cl)c(Br)cc2cccnc12 Amb26498703 [0,1,0,0,0,0|3,0,0]=4 553 B14R2.8188 Fc1cc2cccnc2c(F)c1F Amb19106614 [0,1,0,0,0,0|3,0,0]=4 554 B14R2.8188 Fc1cc2ncccc2c(F)c1Br Amb15693036 [0,1,0,0,0,0|3,0,0]=4 555 B14R2.8188 Fc1cc2ncccc2c(F)c1F Amb27659184 [0,1,0,0,0,0|3,0,0]=4 556 B14R2.8188 NC1=C(N)c2ccccc2OC1=O Amb18647951 [0,1,0,0,0,0|3,0,0]=4 557 B14R2.8188 NC1=C(O)C(=O)Oc2ccccc21 Amb28255541 [0,1,0,0,0,0|2,0,0]=3 558 B14R2.8188 NC1=C(O)C(=O)c2ccccc2O1 Amb28054811 [0,1,0,0,0,0|3,0,0]=4 559 B14R2.8188 NC1=C(O)Nc2ccccc2N1O Amb27445463 [0,1,0,0,0,0|3,0,0]=4 560 B14R2.8188 NC1=Cc2ccccc2N(O)C1=O Amb27244820 [0,1,0,0,0,0|2,0,0]=3 561 B14R2.8188 NN1C(=O)C(=O)Nc2ccccc21 Amb25828466 [0,1,0,0,0,0|2,0,1]=4 562 B14R2.8188 NN1C(=O)Nc2ccccc2C1=O Amb18186048 [0,1,0,0,0,0|3,0,0]=4 563 B14R2.8188 NN1C(=O)c2ncccc2NC1=S Amb28251185 [0,1,0,0,0,0|2,1,0]=4 564 B14R2.8188 Nc1c(O)c(O)cc2ccccc12 Amb17594436 [0,1,0,0,0,0|2,0,1]=4 565 B14R2.8188 Nc1c(O)cc2ccccc2c1N Amb17594400 [0,1,0,0,0,0|3,0,0]=4 566 B14R2.8188 Nc1cc2ccccc2c(N)c1O Amb17594395 [0,1,0,0,0,0|3,0,0]=4 567 B14R2.8188 Nc1cc2ccccc2c(O)c1O Amb17594426 [0,1,0,0,0,0|3,0,0]=4 568 B14R2.8188 Nc1nc2ccccc2c(O)c1O Amb27453637 [0,1,0,0,0,0|2,0,1]=4 569 B14R2.8188 O=C1C(=O)c2ccccc2C=C1Cl Amb27404598 [0,1,0,0,0,0|3,0,0]=4 570 B14R2.8188 O=C1C(=O)c2ccccc2C=C1O Amb17594373 [0,1,0,0,0,0|2,0,0]=3 571 B14R2.8188 O=C1C(O)Oc2ccccc2N1O Amb9824609 [0,1,0,0,0,0|2,0,1]=4 572 B14R2.8188 O=C1Cc2ccccc2C(=O)N1O Amb10553629 [0,1,0,0,0,0|3,0,0]=4 573 B14R2.8188 O=C1Nc2ccccc2C(=O)C1=O Amb26519857 [0,1,0,0,0,0|1,0,1]=3 574 B14R2.8188 O=C1Nc2ccccc2C(Cl)=C1Br Amb23533718 [0,1,0,0,0,0|2,0,0]=3 575 B14R2.8188 O=C1Nc2ccccc2C(O)=C1F Amb19667464 [0,1,0,0,0,0|2,0,0]=3 576 B14R2.8188 O=C1Nc2ccccc2C(O)=C1O Amb21912810 [0,1,0,0,0,0|1,0,0]=2 577 B14R2.8188 O=C1Nc2ccccc2C(O)C1O Amb28120097 [0,1,0,0,0,0|1,0,2]=4 578 B14R2.8188 O=C1Oc2ccccc2C(O)=C1Br Amb19517267 [0,1,0,0,0,0|3,0,0]=4 579 B14R2.8188 O=C1Oc2ccccc2C(O)=C1O Amb28243097 [0,1,0,0,0,0|2,0,0]=3 580 B14R2.8188 Oc1c(Cl)cc2ccccc2c1Cl Amb17595764 [0,1,0,0,0,0|3,0,0]=4 581 B14R2.8188 Oc1c(Cl)cc2ccccc2c1O Amb27949113 [0,1,0,0,0,0|3,0,0]=4 582 B14R2.8188 Oc1cc2ccccc2c(Br)c1O Amb28435398 [0,1,0,0,0,0|2,0,1]=4 583 B14R2.8188 Oc1cc2ccccc2c(Cl)c1Cl Amb17595770 [0,1,0,0,0,0|3,0,0]=4 584 B14R2.8188 Oc1cc2ccccc2c(O)c1O Amb17594459 [0,1,0,0,0,0|2,0,1]=4 585 B14R2.8239 C=C1Nc2cc(C)ccc2NC1=O Amb25222560 [0,1,0,0,0,0|3,0,0]=4 586 B14R2.8239 C=C1Nc2ccc(C)cc2NC1=O Amb25996380 [0,1,0,0,0,0|3,0,0]=4 587 B14R2.8239 CC1=Cc2cc(Br)cnc2NC1=O Amb22497903 [0,1,0,0,0,0|3,0,0]=4 588 B14R2.8239 CC1=Cc2cc(C)ccc2NC1=O Amb24703263 [0,1,0,0,0,0|2,0,0]=3 589 B14R2.8239 CC1=Cc2cc(N)ccc2NC1=O Amb18529717 [0,1,0,0,0,0|2,0,0]=3 590 B14R2.8239 CC1=Cc2cc(O)ccc2NC1=O Amb18538502 [0,1,0,0,0,0|2,0,0]=3 591 B14R2.8239 CC1=Cc2ccc(C)cc2NC1=O Amb24670978 [0,1,0,0,0,0|2,0,0]=3 592 B14R2.8239 CC1=Cc2ccc(Cl)cc2NC1=O Amb27751346 [0,1,0,0,0,0|2,0,0]=3 593 B14R2.8239 CC1=Cc2ccc(F)cc2OC1=O Amb33719440 [0,1,0,0,0,0|3,0,0]=4 594 B14R2.8239 CC1=Cc2ccc(N)cc2NC1=O Amb18537355 [0,1,0,0,0,0|2,0,0]=3 595 B14R2.8239 CC1=Cc2ccc(O)cc2NC1=O Amb22752603 [0,1,0,0,0,0|2,0,0]=3 596 B14R2.8239 CC1=Cc2ccc(O)cc2OC1=O Amb18127560 [0,1,0,0,0,0|3,0,0]=4 597 B14R2.8239 CC1=Nc2cc(Br)ccc2NC1=O Amb20412635 [0,1,0,0,0,0|3,0,0]=4 598 B14R2.8239 CC1=Nc2ccc(Br)cc2NC1=O Amb19657942 [0,1,0,0,0,0|3,0,0]=4 599 B14R2.8239 CC1=Nc2ccc(C)cc2NC1=O Amb20412682 [0,1,0,0,0,0|3,0,0]=4 600 B14R2.8239 CC1=Nc2ccc(Cl)cc2NC1=O Amb20412679 [0,1,0,0,0,0|3,0,0]=4 601 B14R2.8239 CC1Nc2ncc(Cl)cc2NC1=O Amb27485312 [0,1,0,0,0,0|2,0,1]=4 602 B14R2.8239 CC1Oc2nc(Br)ccc2NC1=O Amb25839338 [0,1,0,0,0,0|2,0,1]=4 603 B14R2.8239 CC1Oc2ncc(Br)cc2NC1=O Amb9810643 [0,1,0,0,0,0|2,0,1]=4 604 B14R2.8239 CC1Oc2ncc(N)cc2NC1=O Amb24554819 [0,1,0,0,0,0|2,0,1]=4 605 B14R2.8239 CC1Sc2ncc(Cl)cc2NC1=O Amb27621563 [0,1,0,0,0,0|2,0,1]=4 606 B14R2.8239 C[C@@H]1Nc2nc(Cl)ccc2NC1=O Amb27179091 [0,1,0,0,0,0|2,0,1]=4 607 B14R2.8239 Cc1cc2c(cc1O)OC(=O)C=C2 Amb18127564 [0,1,0,0,0,0|3,0,0]=4 608 B14R2.8239 Cc1cc2cc(N)cnc2cc1C Amb26877507 [0,1,0,0,0,0|3,0,0]=4 609 B14R2.8239 Cc1cc2cc(N)cnc2cc1Cl Amb32673601 [0,1,0,0,0,0|3,0,0]=4 610 B14R2.8239 Cc1cc2cc(N)cnc2cc1F Amb32673576 [0,1,0,0,0,0|3,0,0]=4 611 B14R2.8239 Cc1cc2cc(O)cnc2cc1Cl Amb28317045 [0,1,0,0,0,0|3,0,0]=4 612 B14R2.8239 Cc1cc2cc(O)cnc2cc1F Amb28205310 [0,1,0,0,0,0|3,0,0]=4 613 B14R2.8239 Cc1cc2ccc(Br)nc2cc1C Amb23589167 [0,1,0,0,0,0|3,0,0]=4 614 B14R2.8239 Cc1cc2ccc(Br)nc2cc1F Amb27945887 [0,1,0,0,0,0|3,0,0]=4 615 B14R2.8239 Cc1cc2nc(Br)ccc2nc1N Amb7101467 [0,1,0,0,0,0|2,0,1]=4 616 B14R2.8239 Cc1cc2nc(Br)ccc2nc1O Amb7101487 [0,1,0,0,0,0|1,0,2]=4 617 B14R2.8239 Cc1cc2ncc(Br)cc2nc1Cl Amb33611643 [0,1,0,0,0,0|2,0,1]=4 618 B14R2.8239 Cc1cc2ncc(Br)cc2nc1O Amb33610715 [0,1,0,0,0,0|1,0,2]=4 619 B14R2.8239 Cc1ccc2c(c1)C=C(Br)C(=O)O2 Amb23580464 [0,1,0,0,0,0|3,0,0]=4 620 B14R2.8239 Cc1ccc2c(c1)C=C(N)C(=O)O2 Amb26054633 [0,1,0,0,0,0|3,0,0]=4 621 B14R2.8239 Cc1ccc2c(c1)C=C(O)C(=O)N2 Amb22752606 [0,1,0,0,0,0|1,0,0]=2 622 B14R2.8239 Cc1ccc2c(c1)C[C@H](O)C(=O)N2 Amb28205939 [0,1,0,0,0,0|1,0,2]=4 623 B14R2.8239 Cc1ccc2c(c1)N=C(Cl)C(=O)N2 Amb27427018 [0,1,0,0,0,0|3,0,0]=4 624 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(=O)N2 Amb18043058 [0,1,0,0,0,0|2,0,1]=4 625 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(F)=C2 Amb27184526 [0,1,0,0,0,0|2,0,0]=3 626 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(O)=C2 Amb22752604 [0,1,0,0,0,0|1,0,0]=2 627 B14R2.8239 Cc1ccc2c(n1)NC(=O)C(=O)N2 Amb21937165 [0,1,0,0,0,0|1,0,1]=3 628 B14R2.8239 Cc1ccc2c(n1)NC(=O)C(Br)=C2 Amb23455854 [0,1,0,0,0,0|3,0,0]=4 629 B14R2.8239 Cc1ccc2cc(Br)c(C)cc2n1 Amb23402673 [0,1,0,0,0,0|3,0,0]=4 630 B14R2.8239 Cc1ccc2cc(Br)c(I)cc2n1 Amb27411916 [0,1,0,0,0,0|3,0,0]=4 631 B14R2.8239 Cc1ccc2cc(C)c(C)cc2n1 Amb1994280 [0,1,0,0,0,0|3,0,0]=4 632 B14R2.8239 Cc1ccc2cc(Cl)c(C)cc2n1 Amb23402674 [0,1,0,0,0,0|3,0,0]=4 633 B14R2.8239 Cc1ccc2cc(Cl)c(Cl)cc2n1 Amb1994718 [0,1,0,0,0,0|3,0,0]=4 634 B14R2.8239 Cc1ccc2cc(Cl)c(F)cc2n1 Amb34913523 [0,1,0,0,0,0|3,0,0]=4 635 B14R2.8239 Cc1ccc2cc(F)c(C)cc2n1 Amb23412365 [0,1,0,0,0,0|3,0,0]=4 636 B14R2.8239 Cc1ccc2cc(F)c(Cl)cc2n1 Amb17578653 [0,1,0,0,0,0|3,0,0]=4 637 B14R2.8239 Cc1ccc2cc(F)c(F)cc2n1 Amb17578305 [0,1,0,0,0,0|3,0,0]=4 638 B14R2.8239 Cc1ccc2cc(I)c(C)cc2n1 Amb23401098 [0,1,0,0,0,0|3,0,0]=4 639 B14R2.8239 Cc1ccc2cc(N)c(C)cc2n1 Amb27860310 [0,1,0,0,0,0|3,0,0]=4 640 B14R2.8239 Cc1ccc2cc(O)c(C)cc2n1 Amb28122444 [0,1,0,0,0,0|2,0,1]=4 641 B14R2.8239 Cc1ccc2nc(C)c(O)cc2c1 Amb33133959 [0,1,0,0,0,0|2,0,1]=4 642 B14R2.8239 Cc1cnc2c(c1)NC(=O)C(=O)N2 Amb25125014 [0,1,0,0,0,0|1,0,1]=3 643 B14R2.8239 Cc1cnc2c(c1)NC(=O)C(C)N2 Amb27403726 [0,1,0,0,0,0|2,0,1]=4 644 B14R2.8239 Cc1cnc2cc(C)c(C)cc2c1 Amb17334862 [0,1,0,0,0,0|3,0,0]=4 645 B14R2.8239 Cc1nc2cc(Br)ccc2cc1O Amb33134036 [0,1,0,0,0,0|2,0,1]=4 646 B14R2.8239 Cc1nc2cc(Cl)ccc2cc1O Amb33134124 [0,1,0,0,0,0|2,0,1]=4 647 B14R2.8239 Cc1nc2cc(F)ccc2cc1O Amb33133993 [0,1,0,0,0,0|2,0,1]=4 648 B14R2.8239 Cc1nc2ccc(Br)cc2cc1O Amb22496218 [0,1,0,0,0,0|2,0,1]=4 649 B14R2.8239 Cc1nc2ccc(Cl)cc2cc1O Amb32416795 [0,1,0,0,0,0|2,0,1]=4 650 B14R2.8239 Cc1nc2ccc(F)cc2cc1O Amb32416801 [0,1,0,0,0,0|2,0,1]=4 651 B14R2.8239 Cc1nc2ccc(N)cc2cc1O Amb33133854 [0,1,0,0,0,0|2,0,1]=4 652 B14R2.8239 Clc1cc2cc(Br)cnc2cc1Cl Amb23449320 [0,1,0,0,0,0|3,0,0]=4 653 B14R2.8239 Fc1cc2cc(Br)cnc2cc1F Amb24183761 [0,1,0,0,0,0|3,0,0]=4 654 B14R2.8239 Fc1cc2ccc(Cl)nc2cc1F Amb27207882 [0,1,0,0,0,0|3,0,0]=4 655 B14R2.8239 Fc1cc2nc(Br)ccc2cc1Br Amb28369744 [0,1,0,0,0,0|3,0,0]=4 656 B14R2.8239 Fc1cc2nc(Cl)ccc2cc1Br Amb19375334 [0,1,0,0,0,0|3,0,0]=4 657 B14R2.8239 Fc1cc2ncc(Br)cc2cc1Br Amb27423959 [0,1,0,0,0,0|3,0,0]=4 658 B14R2.8239 NC1=Cc2cc(Br)ccc2OC1=O Amb25116013 [0,1,0,0,0,0|3,0,0]=4 659 B14R2.8239 NC1=Cc2cc(F)ccc2OC1=O Amb27631411 [0,1,0,0,0,0|3,0,0]=4 660 B14R2.8239 NC1=Cc2cc(N)ccc2OC1=O Amb26033314 [0,1,0,0,0,0|3,0,0]=4 661 B14R2.8239 NC1=Cc2cc(O)ccc2OC1=O Amb25189956 [0,1,0,0,0,0|3,0,0]=4 662 B14R2.8239 NC1=Nc2cc(Cl)ccc2NC1=O Amb27238644 [0,1,0,0,0,0|3,0,0]=4 663 B14R2.8239 NC1=Nc2ccc(Br)cc2NC1=O Amb27771981 [0,1,0,0,0,0|3,0,0]=4 664 B14R2.8239 NC1=Nc2ncc(Br)cc2NC1=O Amb18135233 [0,1,0,0,0,0|2,0,0]=3 665 B14R2.8239 Nc1cc2cc(Br)ccc2cc1O Amb28123732 [0,1,0,0,0,0|3,0,0]=4 666 B14R2.8239 Nc1cc2ccc(O)cc2cc1O Amb27393167 [0,1,0,0,0,0|3,0,0]=4 667 B14R2.8239 Nc1ccc2c(c1)C=C(Br)C(=O)O2 Amb28185190 [0,1,0,0,0,0|3,0,0]=4 668 B14R2.8239 Nc1ccc2c(c1)NC(=O)C(=O)N2 Amb18038531 [0,1,0,0,0,0|2,0,1]=4 669 B14R2.8239 Nc1ccc2c(c1)NC(=O)C(=O)N2 Amb21955545 [0,1,0,0,0,0|2,0,1]=4 670 B14R2.8239 Nc1ccc2c(c1)NC(=O)C(O)=C2 Amb26622269 [0,1,0,0,0,0|1,0,0]=2 671 B14R2.8239 Nc1ccc2c(n1)NC(=O)C(I)=C2 Amb23510058 [0,1,0,0,0,0|3,0,0]=4 672 B14R2.8239 Nc1ccc2cc(Br)c(F)cc2n1 Amb27449882 [0,1,0,0,0,0|3,0,0]=4 673 B14R2.8239 Nc1ccc2cc(F)c(F)cc2n1 Amb24709825 [0,1,0,0,0,0|3,0,0]=4 674 B14R2.8239 Nc1ccc2nc(O)c(O)nc2n1 Amb24379586 [0,1,0,0,0,0|1,0,2]=4 675 B14R2.8239 Nc1cnc2cc(Br)c(F)cc2c1 Amb27800883 [0,1,0,0,0,0|3,0,0]=4 676 B14R2.8239 Nc1cnc2cc(F)c(Br)cc2c1 Amb32673581 [0,1,0,0,0,0|3,0,0]=4 677 B14R2.8239 Nc1cnc2cc(F)c(Cl)cc2c1 Amb32673578 [0,1,0,0,0,0|3,0,0]=4 678 B14R2.8239 Nc1cnc2cc(F)c(F)cc2c1 Amb24183766 [0,1,0,0,0,0|3,0,0]=4 679 B14R2.8239 Nc1ncc2c(n1)NC(=O)C(=O)N2 Amb26880802 [0,1,0,0,0,0|2,0,1]=4 680 B14R2.8239 O=C1C=Cc2cc(O)c(O)cc2O1 Amb18511463 [0,1,0,0,0,0|2,0,1]=4 681 B14R2.8239 O=C1N=C2C=C(Br)C=NC2=NC1=O Amb27455452 [0,1,0,0,0,0|1,0,2]=4 682 B14R2.8239 O=C1Nc2cc(Br)ccc2C=C1O Amb25041039 [0,1,0,0,0,0|1,0,0]=2 683 B14R2.8239 O=C1Nc2cc(Br)ccc2N=C1Cl Amb27963102 [0,1,0,0,0,0|3,0,0]=4 684 B14R2.8239 O=C1Nc2cc(Br)cnc2NC1=O Amb18043125 [0,1,0,0,0,0|1,0,1]=3 685 B14R2.8239 O=C1Nc2cc(Cl)ccc2C=C1F Amb27868400 [0,1,0,0,0,0|2,0,0]=3 686 B14R2.8239 O=C1Nc2cc(Cl)ccc2C=C1O Amb28186631 [0,1,0,0,0,0|1,0,0]=2 687 B14R2.8239 O=C1Nc2cc(Cl)ccc2N=C1Cl Amb27815873 [0,1,0,0,0,0|3,0,0]=4 688 B14R2.8239 O=C1Nc2cc(Cl)ccc2OC1O Amb26449481 [0,1,0,0,0,0|2,0,1]=4 689 B14R2.8239 O=C1Nc2cc(Cl)cnc2C=C1O Amb27792917 [0,1,0,0,0,0|0,0,0]=1 690 B14R2.8239 O=C1Nc2cc(Cl)cnc2NC1=O Amb25366002 [0,1,0,0,0,0|1,0,1]=3 691 B14R2.8239 O=C1Nc2cc(F)ccc2C=C1F Amb22547386 [0,1,0,0,0,0|2,0,0]=3 692 B14R2.8239 O=C1Nc2cc(F)cnc2C=C1O Amb27793269 [0,1,0,0,0,0|0,0,0]=1 693 B14R2.8239 O=C1Nc2ccc(Br)cc2C=C1Br Amb26331489 [0,1,0,0,0,0|2,0,0]=3 694 B14R2.8239 O=C1Nc2ccc(Br)cc2C=C1I Amb26327962 [0,1,0,0,0,0|2,0,0]=3 695 B14R2.8239 O=C1Nc2ccc(Br)cc2C=C1O Amb25866612 [0,1,0,0,0,0|1,0,0]=2 696 B14R2.8239 O=C1Nc2ccc(Br)cc2CC1O Amb22899291 [0,1,0,0,0,0|1,0,2]=4 697 B14R2.8239 O=C1Nc2ccc(Br)cc2NC1=O Amb18541037 [0,1,0,0,0,0|2,0,1]=4 698 B14R2.8239 O=C1Nc2ccc(Cl)cc2C=C1Br Amb23450241 [0,1,0,0,0,0|2,0,0]=3 699 B14R2.8239 O=C1Nc2ccc(Cl)cc2C=C1F Amb22547371 [0,1,0,0,0,0|2,0,0]=3 700 B14R2.8239 O=C1Nc2ccc(Cl)cc2C=C1O Amb24658218 [0,1,0,0,0,0|1,0,0]=2 701 B14R2.8239 O=C1Nc2ccc(Cl)cc2NC1=O Amb18043060 [0,1,0,0,0,0|2,0,1]=4 702 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1Br Amb23451834 [0,1,0,0,0,0|2,0,0]=3 703 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1Cl Amb23451835 [0,1,0,0,0,0|2,0,0]=3 704 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1F Amb22641642 [0,1,0,0,0,0|2,0,0]=3 705 B14R2.8239 O=C1Nc2ccc(F)cc2C=C1O Amb25124313 [0,1,0,0,0,0|1,0,0]=2 706 B14R2.8239 O=C1Nc2ccc(F)cc2N=C1Cl Amb27618344 [0,1,0,0,0,0|3,0,0]=4 707 B14R2.8239 O=C1Nc2ccc(F)cc2NC1=O Amb18043059 [0,1,0,0,0,0|2,0,1]=4 708 B14R2.8239 O=C1Nc2ccc(F)cc2OC1O Amb27243174 [0,1,0,0,0,0|2,0,1]=4 709 B14R2.8239 O=C1Nc2ccc(I)cc2NC1=O Amb24488714 [0,1,0,0,0,0|2,0,1]=4 710 B14R2.8239 O=C1Nc2ccc(O)cc2C=C1Cl Amb18035970 [0,1,0,0,0,0|2,0,0]=3 711 B14R2.8239 O=C1Nc2ccc(O)cc2NC1=O Amb18128049 [0,1,0,0,0,0|2,0,1]=4 712 B14R2.8239 O=C1Nc2ccc(O)cc2OC1O Amb22168797 [0,1,0,0,0,0|2,0,1]=4 713 B14R2.8239 O=C1Nc2ncc(Cl)cc2C=C1O Amb27170935 [0,1,0,0,0,0|2,0,0]=3 714 B14R2.8239 O=C1Oc2cc(Br)ccc2C=C1Br Amb28051742 [0,1,0,0,0,0|3,0,0]=4 715 B14R2.8239 O=C1Oc2cc(O)ccc2C=C1Br Amb24556387 [0,1,0,0,0,0|3,0,0]=4 716 B14R2.8239 O=C1Oc2cc(O)ccc2C=C1O Amb26377380 [0,1,0,0,0,0|2,0,0]=3 717 B14R2.8239 O=C1Oc2ccc(Br)cc2C=C1Br Amb26974401 [0,1,0,0,0,0|3,0,0]=4 718 B14R2.8239 O=C1Oc2ccc(Cl)cc2C=C1Br Amb23580471 [0,1,0,0,0,0|3,0,0]=4 719 B14R2.8239 O=C1Oc2ccc(F)cc2C=C1Br Amb23580472 [0,1,0,0,0,0|3,0,0]=4 720 B14R2.8239 O=C1Oc2ccc(O)cc2C=C1O Amb28367070 [0,1,0,0,0,0|2,0,0]=3 721 B14R2.8239 O=c1nc2ccc(O)nc2nc1=O Amb4479359 [0,1,0,0,0,0|1,0,2]=4 722 B14R2.8239 Oc1cc2cc(Br)cnc2cc1Cl Amb22396338 [0,1,0,0,0,0|2,0,1]=4 723 B14R2.8239 Oc1cc2cc(Cl)ccc2nc1Br Amb25320239 [0,1,0,0,0,0|2,0,1]=4 724 B14R2.8239 Oc1cc2cc(Cl)ccc2nc1Cl Amb27231513 [0,1,0,0,0,0|2,0,1]=4 725 B14R2.8239 Oc1cc2cc(F)ccc2nc1Cl Amb28282561 [0,1,0,0,0,0|2,0,1]=4 726 B14R2.8239 Oc1cc2ccc(Cl)cc2cc1Cl Amb17595771 [0,1,0,0,0,0|3,0,0]=4 727 B14R2.8239 Oc1cc2ccc(Cl)cc2nc1Cl Amb27203959 [0,1,0,0,0,0|2,0,1]=4 728 B14R2.8239 Oc1cc2ccc(S)cc2cc1O Amb28351592 [0,1,0,0,0,0|2,0,1]=4 729 B14R2.8239 Oc1ccc2cc(Br)c(O)cc2c1 Amb28130965 [0,1,0,0,0,0|3,0,0]=4 730 B14R2.8239 Oc1cnc2cc(F)c(Br)cc2c1 Amb25035411 [0,1,0,0,0,0|3,0,0]=4 731 B14R2.8239 Oc1cnc2cc(F)c(Cl)cc2c1 Amb27462990 [0,1,0,0,0,0|3,0,0]=4 732 B14R2.8239 Oc1cnc2cc(F)c(F)cc2c1 Amb24183768 [0,1,0,0,0,0|3,0,0]=4 733 B14R2.28472 CC1=CC=NC2=NC(=O)C(=O)N=C12 Amb28198297 [0,1,0,0,0,0|1,0,2]=4 734 B14R2.28472 CC1=Cc2c(O)cccc2NC1=O Amb22752597 [0,1,0,0,0,0|2,0,0]=3 735 B14R2.28472 CC1=Cc2cccc(Br)c2NC1=O Amb33714882 [0,1,0,0,0,0|2,0,0]=3 736 B14R2.28472 CC1=Cc2cccc(C)c2NC1=O Amb24425415 [0,1,0,0,0,0|2,0,0]=3 737 B14R2.28472 CC1=Cc2cccc(N)c2OC1=O Amb27259329 [0,1,0,0,0,0|3,0,0]=4 738 B14R2.28472 CC1=Cc2cccc(O)c2NC1=O Amb22752602 [0,1,0,0,0,0|2,0,0]=3 739 B14R2.28472 CC1=Cc2ccnc(Cl)c2NC1=O Amb33714877 [0,1,0,0,0,0|3,0,0]=4 740 B14R2.28472 CC1=Nc2c(Br)cccc2NC1=O Amb27445801 [0,1,0,0,0,0|3,0,0]=4 741 B14R2.28472 CC1=Nc2c(Cl)cccc2NC1=O Amb27635802 [0,1,0,0,0,0|3,0,0]=4 742 B14R2.28472 CC1=Nc2cccc(Br)c2NC1=O Amb27421476 [0,1,0,0,0,0|3,0,0]=4 743 B14R2.28472 Cc1cc2c(Br)ccnc2cc1Br Amb10240953 [0,1,0,0,0,0|3,0,0]=4 744 B14R2.28472 Cc1cc2c(Br)ccnc2cc1Cl Amb24117931 [0,1,0,0,0,0|3,0,0]=4 745 B14R2.28472 Cc1cc2c(Br)ccnc2cc1F Amb27175171 [0,1,0,0,0,0|3,0,0]=4 746 B14R2.28472 Cc1cc2c(Cl)ccnc2cc1Br Amb10240952 [0,1,0,0,0,0|3,0,0]=4 747 B14R2.28472 Cc1cc2c(Cl)ccnc2cc1I Amb28429729 [0,1,0,0,0,0|3,0,0]=4 748 B14R2.28472 Cc1cc2c(N)ccnc2cc1Br Amb10240955 [0,1,0,0,0,0|3,0,0]=4 749 B14R2.28472 Cc1cc2c(N)ccnc2cc1F Amb27837194 [0,1,0,0,0,0|3,0,0]=4 750 B14R2.28472 Cc1cc2nccc(Br)c2cc1Br Amb10240948 [0,1,0,0,0,0|3,0,0]=4 751 B14R2.28472 Cc1cc2nccc(Br)c2cc1C Amb9134351 [0,1,0,0,0,0|3,0,0]=4 752 B14R2.28472 Cc1cc2nccc(C)c2cc1C Amb10554260 [0,1,0,0,0,0|3,0,0]=4 753 B14R2.28472 Cc1cc2nccc(C)c2cc1F Amb23448772 [0,1,0,0,0,0|3,0,0]=4 754 B14R2.28472 Cc1cc2nccc(Cl)c2cc1Br Amb10240947 [0,1,0,0,0,0|3,0,0]=4 755 B14R2.28472 Cc1cc2nccc(Cl)c2cc1C Amb1994628 [0,1,0,0,0,0|3,0,0]=4 756 B14R2.28472 Cc1cc2nccc(N)c2cc1Br Amb10240950 [0,1,0,0,0,0|3,0,0]=4 757 B14R2.28472 Cc1cc2nccc(N)c2cc1C Amb1994587 [0,1,0,0,0,0|3,0,0]=4 758 B14R2.28472 Cc1cc2nccc(O)c2cc1C Amb1994728 [0,1,0,0,0,0|3,0,0]=4 759 B14R2.28472 Cc1cccc2c1C=C(F)C(=O)N2 Amb27771425 [0,1,0,0,0,0|2,0,0]=3 760 B14R2.28472 Cc1cccc2c1C=C(O)C(=O)N2 Amb22752608 [0,1,0,0,0,0|1,0,0]=2 761 B14R2.28472 Cc1cccc2c1NC(=O)C(F)=C2 Amb22547233 [0,1,0,0,0,0|2,0,0]=3 762 B14R2.28472 Cc1cccc2c1NC(=O)C(O)=C2 Amb22752607 [0,1,0,0,0,0|1,0,0]=2 763 B14R2.28472 Cc1cccc2c1NC(=O)C(O)C2 Amb28243418 [0,1,0,0,0,0|1,0,2]=4 764 B14R2.28472 Cc1cccc2c1OC(=O)C(N)=C2 Amb27165226 [0,1,0,0,0,0|3,0,0]=4 765 B14R2.28472 Cc1ccnc2c1C=C(Br)C(=O)N2 Amb32419009 [0,1,0,0,0,0|3,0,0]=4 766 B14R2.28472 Cc1ccnc2c1NC(=O)C(=O)N2 Amb28047800 [0,1,0,0,0,0|1,0,1]=3 767 B14R2.28472 Cc1ccnc2c1NC(=O)C(C)N2 Amb27656265 [0,1,0,0,0,0|2,0,1]=4 768 B14R2.28472 Cc1ccnc2cc(Cl)c(Cl)cc12 Amb16200313 [0,1,0,0,0,0|3,0,0]=4 769 B14R2.28472 Cc1nc2c(Br)cccc2cc1O Amb32455754 [0,1,0,0,0,0|2,0,1]=4 770 B14R2.28472 Cc1nc2c(C)cccc2cc1O Amb33133924 [0,1,0,0,0,0|2,0,1]=4 771 B14R2.28472 Cc1nc2c(Cl)cccc2cc1O Amb33134080 [0,1,0,0,0,0|2,0,1]=4 772 B14R2.28472 Cc1nc2c(F)cccc2cc1O Amb27210982 [0,1,0,0,0,0|2,0,1]=4 773 B14R2.28472 Cc1nc2cccc(Br)c2cc1O Amb33134016 [0,1,0,0,0,0|2,0,1]=4 774 B14R2.28472 Cc1nc2cccc(Cl)c2cc1O Amb33134140 [0,1,0,0,0,0|2,0,1]=4 775 B14R2.28472 Cc1nccc2c1C=C(Br)C(=O)N2 Amb21926812 [0,1,0,0,0,0|3,0,0]=4 776 B14R2.28472 Cc1nccc2c1C=C(I)C(=O)N2 Amb21927566 [0,1,0,0,0,0|3,0,0]=4 777 B14R2.28472 Cc1nccc2c1C=C(O)C(=O)N2 Amb27825947 [0,1,0,0,0,0|2,0,0]=3 778 B14R2.28472 Clc1cc2nccc(Br)c2cc1Cl Amb9134356 [0,1,0,0,0,0|3,0,0]=4 779 B14R2.28472 Clc1cc2nccc(Cl)c2cc1Br Amb25309384 [0,1,0,0,0,0|3,0,0]=4 780 B14R2.28472 Clc1cc2nccc(Cl)c2cc1Cl Amb1994561 [0,1,0,0,0,0|3,0,0]=4 781 B14R2.28472 Clc1cc2nccc(Cl)c2cc1I Amb27268314 [0,1,0,0,0,0|3,0,0]=4 782 B14R2.28472 Fc1cc2c(Br)ccnc2cc1Cl Amb35788524 [0,1,0,0,0,0|3,0,0]=4 783 B14R2.28472 Fc1cc2c(Cl)ccnc2cc1Br Amb26445294 [0,1,0,0,0,0|3,0,0]=4 784 B14R2.28472 Fc1cc2c(Cl)ccnc2cc1Cl Amb27638703 [0,1,0,0,0,0|3,0,0]=4 785 B14R2.28472 Fc1cc2nccc(Br)c2cc1Cl Amb25822625 [0,1,0,0,0,0|3,0,0]=4 786 B14R2.28472 Fc1cc2nccc(Br)c2cc1F Amb27181156 [0,1,0,0,0,0|3,0,0]=4 787 B14R2.28472 Fc1cc2nccc(Cl)c2cc1Br Amb24534654 [0,1,0,0,0,0|3,0,0]=4 788 B14R2.28472 Fc1cc2nccc(Cl)c2cc1Cl Amb23571873 [0,1,0,0,0,0|3,0,0]=4 789 B14R2.28472 Fc1cc2nccc(Cl)c2cc1F Amb33531657 [0,1,0,0,0,0|3,0,0]=4 790 B14R2.28472 Fc1cc2nccc(Cl)c2cc1I Amb28139905 [0,1,0,0,0,0|3,0,0]=4 791 B14R2.28472 NC1=Cc2c(F)cccc2OC1=O Amb27242642 [0,1,0,0,0,0|3,0,0]=4 792 B14R2.28472 NC1=Cc2cccc(O)c2OC1=O Amb18127813 [0,1,0,0,0,0|3,0,0]=4 793 B14R2.28472 NC1=Nc2c(O)cccc2NC1=O Amb22001484 [0,1,0,0,0,0|3,0,0]=4 794 B14R2.28472 Nc1cccc2c1C=C(O)C(=O)N2 Amb25123362 [0,1,0,0,0,0|1,0,0]=2 795 B14R2.28472 Nc1cccc2c1NC(=O)C(=O)N2 Amb19813318 [0,1,0,0,0,0|2,0,1]=4 796 B14R2.28472 Nc1ccnc2cc(Cl)c(Cl)cc12 Amb1994586 [0,1,0,0,0,0|3,0,0]=4 797 B14R2.28472 O=C1NC=CC2=C1C=C(O)C(=O)O2 Amb28291020 [0,1,0,0,0,0|3,0,0]=4 798 B14R2.28472 O=C1NC=Nc2cc(O)c(O)cc21 Amb24057460 [0,1,0,0,0,0|2,0,1]=4 799 B14R2.28472 O=C1Nc2c(Br)cccc2C=C1F Amb22547234 [0,1,0,0,0,0|2,0,0]=3 800 B14R2.28472 O=C1Nc2c(Br)cccc2C=C1O Amb25800197 [0,1,0,0,0,0|1,0,0]=2 801 B14R2.28472 O=C1Nc2c(Cl)cccc2C=C1F Amb22547231 [0,1,0,0,0,0|2,0,0]=3 802 B14R2.28472 O=C1Nc2c(Cl)cncc2C=C1O Amb27442983 [0,1,0,0,0,0|2,0,0]=3 803 B14R2.28472 O=C1Nc2c(F)cccc2C=C1F Amb22547161 [0,1,0,0,0,0|2,0,0]=3 804 B14R2.28472 O=C1Nc2c(F)cccc2C=C1O Amb24697603 [0,1,0,0,0,0|1,0,0]=2 805 B14R2.28472 O=C1Nc2ccc[n+]([O-])c2NC1=O Amb27650448 [0,1,0,0,0,0|1,0,2]=4 806 B14R2.28472 O=C1Nc2cccc(Br)c2C=C1O Amb26445096 [0,1,0,0,0,0|1,0,0]=2 807 B14R2.28472 O=C1Nc2cccc(Cl)c2C=C1F Amb27599995 [0,1,0,0,0,0|2,0,0]=3 808 B14R2.28472 O=C1Nc2cccc(F)c2C=C1F Amb27832552 [0,1,0,0,0,0|2,0,0]=3 809 B14R2.28472 O=C1Nc2cccc(F)c2C=C1O Amb28342551 [0,1,0,0,0,0|1,0,0]=2 810 B14R2.28472 O=C1Nc2cccc(F)c2CC1O Amb27415161 [0,1,0,0,0,0|1,0,2]=4 811 B14R2.28472 O=C1Nc2cccc(O)c2C=C1Br Amb21926742 [0,1,0,0,0,0|2,0,0]=3 812 B14R2.28472 O=C1Nc2cccc(O)c2NC1=O Amb22234954 [0,1,0,0,0,0|2,0,1]=4 813 B14R2.28472 O=C1Nc2nccc(Br)c2C=C1O Amb27647706 [0,1,0,0,0,0|2,0,0]=3 814 B14R2.28472 O=C1Nc2nccc(Cl)c2NC1=O Amb27625211 [0,1,0,0,0,0|1,0,1]=3 815 B14R2.28472 O=C1Nc2nccc(O)c2NC1=O Amb24751568 [0,1,0,0,0,0|1,0,1]=3 816 B14R2.28472 O=C1Oc2c(O)cccc2C=C1O Amb26476553 [0,1,0,0,0,0|2,0,0]=3 817 B14R2.28472 Oc1cc2c(F)cccc2nc1Cl Amb27817699 [0,1,0,0,0,0|2,0,1]=4 818 B14R2.28472 Oc1cc2cccc(O)c2cc1O Amb17594466 [0,1,0,0,0,0|2,0,1]=4 819 B14R2.28472 Oc1cc2ncnc(Cl)c2cc1O Amb24057474 [0,1,0,0,0,0|2,0,1]=4 820 B14R2.28472 Oc1ccnc2cc(Br)c(F)cc12 Amb27463556 [0,1,0,0,0,0|3,0,0]=4 821 B14R2.28472 Oc1ccnc2cc(Cl)c(Br)cc12 Amb22410672 [0,1,0,0,0,0|3,0,0]=4 822 B14R2.28472 Oc1ccnc2cc(Cl)c(Cl)cc12 Amb1994723 [0,1,0,0,0,0|3,0,0]=4 823 B14R2.28472 Oc1ccnc2cc(F)c(F)cc12 Amb19375571 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.43 C=C(C)C(=O)Nc1ccccc1 Amb6384289 [0,0,1,0,0,0|2,0,0]=3 825 B12R1.43 C=C(C)C(=O)Nc1ccncc1 Amb2613139 [0,0,1,0,0,0|3,0,0]=4 826 B12R1.43 C=C(C)C(=O)Oc1ccccc1 Amb8394675 [0,0,1,0,0,0|3,0,0]=4 827 B12R1.43 C=C(C)C(=S)Nc1ccccc1 Amb28243811 [0,0,1,0,0,0|2,1,0]=4 828 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [0,0,1,0,0,0|3,0,0]=4 829 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 Amb27751263 [0,0,1,0,0,0|2,0,0]=3 830 B12R1.43 C=C(Cl)C(=O)Nc1cccnc1 Amb28197358 [0,0,1,0,0,0|1,0,0]=2 831 B12R1.43 C=C(Cl)C(=O)Nc1cnccn1 Amb27959685 [0,0,1,0,0,0|2,0,0]=3 832 B12R1.43 C=C(Cl)C(=O)Nc1cncnc1 Amb27786095 [0,0,1,0,0,0|2,0,0]=3 833 B12R1.43 CC(=O)C(=O)Cc1ccccn1 Amb26923275 [0,0,1,0,0,0|1,0,2]=4 834 B12R1.43 CC(=O)C(=O)Cc1cccnc1 Amb24556780 [0,0,1,0,0,0|1,0,2]=4 835 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [0,0,1,0,0,0|1,0,2]=4 836 B12R1.43 CC(=O)C(=O)Nc1cccnc1 Amb28319843 [0,0,1,0,0,0|0,0,2]=3 837 B12R1.43 CC(=O)\C(Br)=C\c1ccccc1 Amb17596166 [0,0,1,0,0,0|3,0,0]=4 838 B12R1.43 CC(=O)\C(C)=C\c1ccccc1 Amb17594004 [0,0,1,0,0,0|3,0,0]=4 839 B12R1.43 CC(=O)\C(C)=C\c1cnccn1 Amb35601037 [0,0,1,0,0,0|3,0,0]=4 840 B12R1.43 CC(C)C(=O)Nc1cccnc1 Amb3366279 [0,0,1,0,0,0|1,0,2]=4 841 B12R1.43 CC(Cl)C(=O)Nc1cccnc1 Amb1137108 [0,0,1,0,0,0|1,0,2]=4 842 B12R1.43 CC(Nc1cccnc1)C(=O)O Amb18270393 [0,0,1,0,0,0|2,0,1]=4 843 B12R1.43 CC(O)C(=O)Nc1ccccc1 Amb1230509 [0,0,1,0,0,0|1,0,2]=4 844 B12R1.43 CC(O)C(=O)Nc1cnccn1 Amb28369850 [0,0,1,0,0,0|1,0,2]=4 845 B12R1.43 CC(Sc1ccccn1)C(N)=O Amb13953849 [0,0,1,0,0,0|2,0,1]=4 846 B12R1.43 CN(O)C(=O)Nc1ccccc1 Amb2691797 [0,0,1,0,0,0|2,0,1]=4 847 B12R1.43 C[C@@H](N)C(=O)Nc1cccnc1 Amb18792647 [0,0,1,0,0,0|1,0,2]=4 848 B12R1.43 C[C@@H](O)C(=O)Nc1cccnc1 Amb27599014 [0,0,1,0,0,0|0,0,2]=3 849 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 Amb27244706 [0,0,1,0,0,0|1,0,2]=4 850 B12R1.43 C\C(=C/c1ccccc1)C(=N)N Amb32952072 [0,0,1,0,0,0|3,0,0]=4 851 B12R1.43 C\C(=C/c1ccccc1)C(=O)Cl Amb24061289 [0,0,1,0,0,0|3,0,0]=4 852 B12R1.43 C\C(=C/c1ccccc1)C(=O)O Amb8513246 [0,0,1,0,0,0|3,0,0]=4 853 B12R1.43 C\C(=C/c1ccccc1)C(N)=S Amb33082670 [0,0,1,0,0,0|2,1,0]=4 854 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb30584914 [0,0,1,0,0,0|2,0,0]=3 855 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb33995393 [0,0,1,0,0,0|2,0,0]=3 856 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb30584915 [0,0,1,0,0,0|3,0,0]=4 857 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb5743927 [0,0,1,0,0,0|3,0,0]=4 858 B12R1.43 C\C(=C\c1ccccc1)C(=O)O Amb24603461 [0,0,1,0,0,0|3,0,0]=4 859 B12R1.43 C\C(=C\c1ccccc1)C(N)=S Amb27466528 [0,0,1,0,0,0|2,1,0]=4 860 B12R1.43 C\C(=C\c1cccnc1)C(=O)O Amb27837141 [0,0,1,0,0,0|3,0,0]=4 861 B12R1.43 C\C(=C\c1cnccn1)C(=O)O Amb27622051 [0,0,1,0,0,0|3,0,0]=4 862 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [0,0,1,0,0,0|3,0,0]=4 863 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [0,0,1,0,0,0|1,0,2]=4 864 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,0,1,0,0,0|2,0,1]=4 865 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [0,0,1,0,0,0|2,0,1]=4 866 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [0,0,1,0,0,0|2,1,0]=4 867 B12R1.43 NC(=O)C(=S)Nc1ccccn1 Amb6870743 [0,0,1,0,0,0|1,1,0]=3 868 B12R1.43 NC(=O)C(N)Cc1ccccn1 Amb25873185 [0,0,1,0,0,0|1,0,2]=4 869 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,0,1,0,0,0|1,0,2]=4 870 B12R1.43 NC(=O)N(O)Cc1ccccc1 Amb27966850 [0,0,1,0,0,0|2,0,1]=4 871 B12R1.43 NC(=O)N(O)Cc1ccccn1 Amb27657600 [0,0,1,0,0,0|1,0,1]=3 872 B12R1.43 NC(=O)[C@@H](N)Cc1ccccn1 Amb30527600 [0,0,1,0,0,0|1,0,2]=4 873 B12R1.43 NC(=O)[C@@H](O)Cc1ccccc1 Amb26371653 [0,0,1,0,0,0|1,0,2]=4 874 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,0,1,0,0,0|1,0,2]=4 875 B12R1.43 NC(=O)\C(Cl)=C\c1ccccc1 Amb3724521 [0,0,1,0,0,0|2,0,0]=3 876 B12R1.43 N\C(=C/c1ccccc1)C(=O)O Amb24081025 [0,0,1,0,0,0|3,0,0]=4 877 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [0,0,1,0,0,0|3,0,0]=4 878 B12R1.43 N\C(=C\c1ccccc1)C(=O)O Amb27148014 [0,0,1,0,0,0|3,0,0]=4 879 B12R1.43 N\C(=C\c1ccccn1)C(=O)O Amb27770994 [0,0,1,0,0,0|2,0,0]=3 880 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [0,0,1,0,0,0|3,0,0]=4 881 B12R1.43 O=C(Cl)\C(F)=C/c1ccccc1 Amb27416385 [0,0,1,0,0,0|3,0,0]=4 882 B12R1.43 O=C(O)C(=O)Cc1ccccc1 Amb2718694 [0,0,1,0,0,0|3,0,0]=4 883 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb17477815 [0,0,1,0,0,0|1,0,2]=4 884 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb32952891 [0,0,1,0,0,0|1,0,2]=4 885 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [0,0,1,0,0,0|2,0,0]=3 886 B12R1.43 O=C(O)C(=O)Cc1cnccn1 Amb33360026 [0,0,1,0,0,0|3,0,0]=4 887 B12R1.43 O=C(O)C(=O)Cc1cncnc1 Amb26564641 [0,0,1,0,0,0|3,0,0]=4 888 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [0,0,1,0,0,0|2,0,0]=3 889 B12R1.43 O=C(O)C(=O)Nc1ccccn1 Amb9303802 [0,0,1,0,0,0|2,0,1]=4 890 B12R1.43 O=C(O)C(=O)Nc1cccnc1 Amb9303807 [0,0,1,0,0,0|1,0,0]=2 891 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [0,0,1,0,0,0|3,0,0]=4 892 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [0,0,1,0,0,0|2,1,0]=4 893 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb17138619 [0,0,1,0,0,0|1,0,2]=4 894 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb35750904 [0,0,1,0,0,0|1,0,2]=4 895 B12R1.43 O=C(O)[C@H](O)Cc1ccccn1 Amb27165660 [0,0,1,0,0,0|1,0,2]=4 896 B12R1.43 O=C(O)\C(Br)=C\c1ccccc1 Amb2794045 [0,0,1,0,0,0|3,0,0]=4 897 B12R1.43 O=C(O)\C(Cl)=C/c1ccccc1 Amb18648695 [0,0,1,0,0,0|3,0,0]=4 898 B12R1.43 O=C(O)\C(Cl)=C\c1ccccc1 Amb19651416 [0,0,1,0,0,0|3,0,0]=4 899 B12R1.43 O=C(O)\C(Cl)=C\c1cccnc1 Amb26448364 [0,0,1,0,0,0|3,0,0]=4 900 B12R1.43 O=C(O)\C(F)=C\c1ccccc1 Amb24093652 [0,0,1,0,0,0|3,0,0]=4 901 B12R1.43 O=C(O)\C(F)=C\c1ccccn1 Amb27977069 [0,0,1,0,0,0|2,0,0]=3 902 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb17614474 [0,0,1,0,0,0|3,0,0]=4 903 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb31339126 [0,0,1,0,0,0|3,0,0]=4 904 B12R1.43 O=C(O)\C(F)=C\c1cnccn1 Amb35600945 [0,0,1,0,0,0|3,0,0]=4 905 B12R1.43 O=C(O)\C(S)=C/c1ccccc1 Amb2550972 [0,0,1,0,0,0|2,1,0]=4 906 B12R1.43 O=C(O)\C(S)=C\c1ccccc1 Amb1250109 [0,0,1,0,0,0|2,1,0]=4 907 B12R1.43 O=C(O)\C(S)=C\c1ccccn1 Amb1761004 [0,0,1,0,0,0|1,1,0]=3 908 B12R1.169 C=CCc1ccccc1NC=O Amb27412358 [0,0,1,0,0,0|2,0,1]=4 909 B12R1.169 N=CNc1nccnc1\C=N\O Amb27790781 [0,0,1,0,0,0|3,0,0]=4 910 B12R1.169 O=CNc1ccccc1CCO Amb28239664 [0,0,1,0,0,0|1,0,2]=4 911 B12R1.169 O=CNc1ccccc1\C=N\O Amb27865601 [0,0,1,0,0,0|2,0,0]=3 912 B12R1.169 O=CNc1ncccc1\C=N\O Amb28398080 [0,0,1,0,0,0|3,0,0]=4 913 B12R1.371 C#CC(=O)Nc1cccnc1F Amb35714286 [0,0,1,0,0,0|2,0,1]=4 914 B12R1.371 C=CC(=O)Cc1cccnc1N Amb27592747 [0,0,1,0,0,0|3,0,0]=4 915 B12R1.371 C=CC(=O)Nc1ccccc1C Amb6843670 [0,0,1,0,0,0|2,0,1]=4 916 B12R1.371 C=CC(=O)Nc1ccccc1Cl Amb6843675 [0,0,1,0,0,0|3,0,0]=4 917 B12R1.371 C=CC(=O)Nc1ccccc1F Amb6843680 [0,0,1,0,0,0|3,0,0]=4 918 B12R1.371 C=CC(=O)Nc1ccccc1I Amb9261228 [0,0,1,0,0,0|3,0,0]=4 919 B12R1.371 C=CC(=O)Nc1cccnc1F Amb30018346 [0,0,1,0,0,0|2,0,0]=3 920 B12R1.371 C=CC(=O)Nc1nccnc1Cl Amb27401466 [0,0,1,0,0,0|3,0,0]=4 921 B12R1.371 CCC(=O)Nc1cccnc1F Amb30018367 [0,0,1,0,0,0|2,0,1]=4 922 B12R1.371 CCC(=O)Nc1cccnc1O Amb27770131 [0,0,1,0,0,0|2,0,1]=4 923 B12R1.371 CNC(=O)Nc1cccnc1C Amb27485791 [0,0,1,0,0,0|2,0,1]=4 924 B12R1.371 COC(=O)Nc1cccnc1C Amb27840459 [0,0,1,0,0,0|2,0,1]=4 925 B12R1.371 C\C(C=O)=C/c1ccccc1C Amb17334495 [0,0,1,0,0,0|3,0,0]=4 926 B12R1.371 C\C(C=O)=C/c1ccccc1Cl Amb17335454 [0,0,1,0,0,0|3,0,0]=4 927 B12R1.371 C\C(C=O)=C/c1ccccc1F Amb17334598 [0,0,1,0,0,0|3,0,0]=4 928 B12R1.371 C\C(C=O)=C/c1nccnc1C Amb35600875 [0,0,1,0,0,0|3,0,0]=4 929 B12R1.371 C\C(C=O)=C\c1ccccc1O Amb28457572 [0,0,1,0,0,0|3,0,0]=4 930 B12R1.371 Cc1ccccc1NC(=O)CO Amb1110662 [0,0,1,0,0,0|1,0,2]=4 931 B12R1.371 Cc1ccccc1NC(=O)NO Amb27614514 [0,0,1,0,0,0|2,0,1]=4 932 B12R1.371 Cc1ccccc1\C=C(/F)C=O Amb27851468 [0,0,1,0,0,0|3,0,0]=4 933 B12R1.371 Cc1ncccc1NC(=O)CN Amb27761075 [0,0,1,0,0,0|1,0,2]=4 934 B12R1.371 Cc1ncccc1NC(=O)CS Amb27835191 [0,0,1,0,0,0|0,1,2]=4 935 B12R1.371 NCC(=O)Nc1cccnc1F Amb35714160 [0,0,1,0,0,0|2,0,1]=4 936 B12R1.371 O=C(CBr)Nc1cccnc1F Amb30018348 [0,0,1,0,0,0|2,0,1]=4 937 B12R1.371 O=C(CCl)Nc1cccnc1Cl Amb6335195 [0,0,1,0,0,0|2,0,1]=4 938 B12R1.371 O=C(CCl)Nc1cccnc1F Amb30018347 [0,0,1,0,0,0|2,0,1]=4 939 B12R1.371 O=C(CO)Nc1ccccc1Br Amb1109988 [0,0,1,0,0,0|2,0,1]=4 940 B12R1.371 O=C(CO)Nc1ccccc1Cl Amb1111147 [0,0,1,0,0,0|2,0,1]=4 941 B12R1.371 O=C(CO)Nc1ccccc1F Amb1109775 [0,0,1,0,0,0|2,0,1]=4 942 B12R1.371 O=C(CO)Nc1ccccc1O Amb5798034 [0,0,1,0,0,0|2,0,1]=4 943 B12R1.371 O=C(CO)Nc1cccnc1Cl Amb1110552 [0,0,1,0,0,0|1,0,1]=3 944 B12R1.371 O=C(CO)Oc1cccnc1Cl Amb27809295 [0,0,1,0,0,0|2,0,1]=4 945 B12R1.371 O=C(NO)Nc1ccccc1Cl Amb4013619 [0,0,1,0,0,0|3,0,0]=4 946 B12R1.371 O=C(NO)Nc1ccccc1F Amb28040914 [0,0,1,0,0,0|3,0,0]=4 947 B12R1.385 O=C\C=C\c1ccc(O)c(Br)c1 Amb33388591 [0,0,1,0,0,0|3,0,0]=4 948 B12R1.385 O=C\C=C\c1ccc(O)c(Cl)c1 Amb33390541 [0,0,1,0,0,0|3,0,0]=4 949 B12R1.385 O=C\C=C\c1ccc(O)c(F)c1 Amb33450047 [0,0,1,0,0,0|3,0,0]=4 950 B12R1.385 O=C\C=C\c1ccc(O)c(O)c1 Amb33136429 [0,0,1,0,0,0|2,0,1]=4 951 B14R3.5352 O=C1C(=O)C2=C1c3ccccc32 Amb27948619 [0,0,0,1,0,0|2,0,1]=4 952 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,0,0,0,1,0|2,0,0]=3 953 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,0,0,0,1,0|2,0,1]=4 954 B12R2.18 CC1C(=O)Nc2ccccc21 Amb2612193 [0,0,0,0,1,0|2,0,1]=4 955 B12R2.18 CN1C(=O)Cc2cccnc21 Amb24334650 [0,0,0,0,1,0|3,0,0]=4 956 B12R2.18 CN1C(=O)Nc2ccccc21 Amb18537193 [0,0,0,0,1,0|3,0,0]=4 957 B12R2.18 CN1C(=O)Nc2cccnc21 Amb21963725 [0,0,0,0,1,0|2,0,0]=3 958 B12R2.18 CN1C(=O)Nc2nccnc21 Amb27614337 [0,0,0,0,1,0|3,0,0]=4 959 B12R2.18 CN1C(=S)Nc2cccnc21 Amb21876618 [0,0,0,0,1,0|2,1,0]=4 960 B12R2.18 Cc1c(O)oc2ccccc12 Amb33310521 [0,0,0,0,1,0|3,0,0]=4 961 B12R2.18 Cc1nc2cccnc2n1O Amb27839848 [0,0,0,0,1,0|2,0,1]=4 962 B12R2.18 Cn1c(Br)cc2ncccc21 Amb18175870 [0,0,0,0,1,0|3,0,0]=4 963 B12R2.18 Cn1c(O)cc2ccccc21 Amb3427957 [0,0,0,0,1,0|3,0,0]=4 964 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,0,0,0,1,0|2,0,0]=3 965 B12R2.18 NC1C(=O)Nc2ccccc21 Amb1154822 [0,0,0,0,1,0|2,0,1]=4 966 B12R2.18 NC1C(=O)Nc2ccccc21 Amb9745696 [0,0,0,0,1,0|2,0,1]=4 967 B12R2.18 NN1C(=S)Nc2cccnc21 Amb26498986 [0,0,0,0,1,0|2,1,0]=4 968 B12R2.18 Nc1sc2ncccc2c1Br Amb27826393 [0,0,0,0,1,0|3,0,0]=4 969 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,0,0,0,1,0|1,1,1]=4 970 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,0,0,0,1,0|2,0,0]=3 971 B12R2.18 O=C1C(Cl)=Nc2ccccc21 Amb17594117 [0,0,0,0,1,0|3,0,0]=4 972 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [0,0,0,0,1,0|1,0,2]=4 973 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [0,0,0,0,1,0|3,0,0]=4 974 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,0,0,0,1,0|1,0,1]=3 975 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,0,0,0,1,0|1,1,0]=3 976 B12R2.18 O=C1Nc2ccccc2C1Br Amb2228105 [0,0,0,0,1,0|2,0,1]=4 977 B12R2.18 O=C1Nc2ccccc2C1Cl Amb27753977 [0,0,0,0,1,0|2,0,1]=4 978 B12R2.18 O=C1Nc2ccccc2C1F Amb32456094 [0,0,0,0,1,0|2,0,1]=4 979 B12R2.18 O=C1Nc2ccccc2C1O Amb9748239 [0,0,0,0,1,0|1,0,1]=3 980 B12R2.18 O=C1Nc2ccccc2C1S Amb32788888 [0,0,0,0,1,0|1,1,1]=4 981 B12R2.18 O=C1Nc2ccccc2N1O Amb26332921 [0,0,0,0,1,0|2,0,0]=3 982 B12R2.18 O=C1Nc2cccnc2C1F Amb32456099 [0,0,0,0,1,0|1,0,1]=3 983 B12R2.18 O=C1Nc2ncccc2C1=O Amb10976067 [0,0,0,0,1,0|1,0,1]=3 984 B12R2.18 O=C1Oc2ccccc2C1=O Amb9783305 [0,0,0,0,1,0|2,0,1]=4 985 B12R2.18 O=C1Sc2ccccc2C1=O Amb2608884 [0,0,0,0,1,0|2,0,1]=4 986 B12R2.18 O=C1Sc2ccccc2C1O Amb27636570 [0,0,0,0,1,0|2,0,1]=4 987 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,0,0,0,1,0|1,0,2]=4 988 B12R2.18 O=C1c2cccnc2CN1Cl Amb27172064 [0,0,0,0,1,0|2,0,1]=4 989 B12R2.18 Oc1sc2ccccc2c1O Amb27966224 [0,0,0,0,1,0|2,0,1]=4 990 B12R2.100 CC1=Nc2cscc2NC1=O Amb28369344 [0,0,0,0,1,0|3,0,0]=4 991 B12R2.100 O=C1Nc2ccsc2NC1=O Amb24184104 [0,0,0,0,1,0|2,0,1]=4 992 B12R2.100 O=C1Nc2cnoc2C=C1O Amb27427257 [0,0,0,0,1,0|2,0,0]=3 993 B12R2.100 O=C1Nc2cocc2NC1=O Amb20664974 [0,0,0,0,1,0|2,0,1]=4 994 B12R2.100 O=C1Nc2cscc2NC1=O Amb27614352 [0,0,0,0,1,0|2,0,1]=4 995 B12R2.100 Oc1cc2ccoc2cc1O Amb26981330 [0,0,0,0,1,0|2,0,1]=4 996 B12R2.100 Oc1cc2nccn2cc1Br Amb27816747 [0,0,0,0,1,0|3,0,0]=4 997 B12R2.100 Oc1cc2occc2cc1Br Amb23568419 [0,0,0,0,1,0|3,0,0]=4 998 B12R2.100 Oc1cc2occc2cc1Cl Amb23568417 [0,0,0,0,1,0|3,0,0]=4 999 B14R2.738 CC1=CC(=O)Nc2ccccc2N1 Amb17912774 [0,0,0,0,0,1|3,0,0]=4 1000 B14R2.738 CC1=CC(=O)Nc2cccnc2N1 Amb28401418 [0,0,0,0,0,1|2,0,0]=3 1001 B14R2.738 CC1=CC(=O)Nc2cncnc2N1 Amb28428620 [0,0,0,0,0,1|3,0,0]=4 1002 B14R2.738 CC1=Cc2ccccc2CC(=O)N1 Amb28146816 [0,0,0,0,0,1|3,0,0]=4 1003 B14R2.738 CC1=Nc2ccccc2NC(=O)C1 Amb1396300 [0,0,0,0,0,1|3,0,0]=4 1004 B14R2.738 CC1CC(=O)Nc2cccnc2N1 Amb28042866 [0,0,0,0,0,1|2,0,1]=4 1005 B14R2.738 O=C1C=C(O)Nc2ccccc2O1 Amb27427124 [0,0,0,0,0,1|3,0,0]=4 1006 B14R2.738 O=C1CC(=O)Nc2ccccc2N1 Amb1678046 [0,0,0,0,0,1|2,0,1]=4 1007 B14R2.741 CC1=Cc2ccccc2C=CC1=O Amb21948167 [0,0,0,0,0,1|3,0,0]=4 1008 B14R2.741 CC1=Nc2ccccc2CNC1=O Amb27628340 [0,0,0,0,0,1|3,0,0]=4 1009 B14R2.741 CC1CNc2ncccc2NC1=O Amb25670227 [0,0,0,0,0,1|1,0,2]=4 1010 B14R2.741 CC1N=Cc2ccccc2NC1=O Amb27882750 [0,0,0,0,0,1|2,0,1]=4 1011 B14R2.741 CN1N=Cc2ccccc2NC1=O Amb28325892 [0,0,0,0,0,1|3,0,0]=4 1012 B14R2.741 NC1=CCc2ccccc2NC1=O Amb27411952 [0,0,0,0,0,1|2,0,0]=3 1013 B14R2.741 O=C1C=C2C=CC=CC2=CC=C1O Amb26365142 [0,0,0,0,0,1|2,0,0]=3 1014 B14R2.741 O=C1C=Cc2cccnc2C=C1O Amb27267189 [0,0,0,0,0,1|1,0,0]=2 1015 B14R2.741 O=C1N=C2C=CC=CC2=CC=C1I Amb20240863 [0,0,0,0,0,1|2,0,1]=4 1016 B14R2.741 O=C1Nc2ccccc2CCC1O Amb25226835 [0,0,0,0,0,1|1,0,2]=4 1017 B14R2.741 O=C1Nc2ccccc2CC[C@H]1O Amb28340942 [0,0,0,0,0,1|1,0,2]=4 1018 B14R2.7726 O=C1C=C2C=CC=CC=C2C=C1O Amb28253719 [0,0,0,0,0,1|2,0,0]=3 1019 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [1,0,1,0,0,0|2,0,0]=4 1020 B11R1.40 C=CC(=O)Cc1cccnc1 Amb28365485 [1,0,1,0,0,0|1,0,0]=3 1021 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [1,0,1,0,0,0|1,0,0]=3 1022 B11R1.40 C=CC(=O)Nc1ccccn1 Amb33532236 [1,0,1,0,0,0|2,0,0]=4 1023 B11R1.40 C=CC(=O)Nc1cccnc1 Amb33532237 [1,0,1,0,0,0|0,0,0]=2 1024 B11R1.40 C=CC(=O)Nc1ccncc1 Amb9480418 [1,0,1,0,0,0|2,0,0]=4 1025 B11R1.40 C=CC(=O)Nc1nccnn1 Amb28060603 [1,0,1,0,0,0|2,0,0]=4 1026 B11R1.40 C=C\C(C)=C\c1ccccn1 Amb24101881 [1,0,1,0,0,0|2,0,0]=4 1027 B11R1.40 C=C\C(C)=C\c1cccnc1 Amb24085616 [1,0,1,0,0,0|2,0,0]=4 1028 B11R1.40 CCC(=O)Nc1cccnc1 Amb5797495 [1,0,1,0,0,0|0,0,2]=4 1029 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [1,0,1,0,0,0|1,0,1]=4 1030 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [1,0,1,0,0,0|2,0,0]=4 1031 B11R1.40 C\C(C=O)=C/c1ccccn1 Amb1014105 [1,0,1,0,0,0|1,0,0]=3 1032 B11R1.40 NCC(=O)Nc1cccnc1 Amb21987914 [1,0,1,0,0,0|1,0,1]=4 1033 B11R1.40 NCC(=O)Nc1cccnc1 Amb6261654 [1,0,1,0,0,0|1,0,1]=4 1034 B11R1.40 NNC(=O)Nc1cccnc1 Amb24433263 [1,0,1,0,0,0|2,0,0]=4 1035 B11R1.40 O=C(CBr)Nc1cccnc1 Amb4311216 [1,0,1,0,0,0|1,0,1]=4 1036 B11R1.40 O=C(CCl)Nc1cccnc1 Amb1126278 [1,0,1,0,0,0|1,0,1]=4 1037 B11R1.40 O=C(CCl)Nc1cccnc1 Amb33551638 [1,0,1,0,0,0|1,0,1]=4 1038 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [1,0,1,0,0,0|1,0,1]=4 1039 B11R1.40 O=C(CO)Nc1cccnc1 Amb5798134 [1,0,1,0,0,0|0,0,1]=3 1040 B11R1.40 O=C(CO)Nc1cncnc1 Amb27664711 [1,0,1,0,0,0|1,0,1]=4 1041 B11R1.40 O=C(CO)Oc1cccnc1 Amb28189046 [1,0,1,0,0,0|1,0,1]=4 1042 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [1,0,1,0,0,0|2,0,0]=4 1043 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [1,0,1,0,0,0|1,0,1]=4 1044 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [1,0,1,0,0,0|0,0,2]=4 1045 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [1,0,1,0,0,0|2,0,0]=4 1046 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [1,0,1,0,0,0|2,0,0]=4 1047 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [1,0,1,0,0,0|2,0,0]=4 1048 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [1,0,1,0,0,0|2,0,0]=4 1049 B11R1.40 O=C\C(Cl)=C\c1ccccn1 Amb18126489 [1,0,1,0,0,0|1,0,0]=3 1050 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [1,0,1,0,0,0|1,0,0]=3 1051 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,1,0,0,0|2,0,0]=4 1052 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,0,1,0,0,0|2,0,0]=4 1053 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,0,1,0,0,0|1,0,0]=3 1054 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [1,0,1,0,0,0|1,0,0]=3 1055 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [1,0,1,0,0,0|2,0,0]=4 1056 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [1,0,1,0,0,0|2,0,0]=4 1057 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [1,0,1,0,0,0|2,0,0]=4 1058 B11R1.91 CC(N)\C=C\c1ccccn1 Amb33172666 [1,0,1,0,0,0|1,0,1]=4 1059 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [1,0,1,0,0,0|2,0,0]=4 1060 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,1,0,0,0|0,0,2]=4 1061 B11R1.91 NC(=O)CNc1ccccn1 Amb6658788 [1,0,1,0,0,0|1,0,1]=4 1062 B11R1.91 NC(=O)COc1ccccn1 Amb27878790 [1,0,1,0,0,0|1,0,1]=4 1063 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [1,0,1,0,0,0|1,0,1]=4 1064 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [1,0,1,0,0,0|1,0,1]=4 1065 B11R1.91 NC(=O)NNc1ccccn1 Amb28119875 [1,0,1,0,0,0|2,0,0]=4 1066 B11R1.91 NC(=O)SCc1ccccn1 Amb28145815 [1,0,1,0,0,0|1,0,1]=4 1067 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [1,0,1,0,0,0|1,0,0]=3 1068 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [1,0,1,0,0,0|2,0,0]=4 1069 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [1,0,1,0,0,0|1,0,0]=3 1070 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [1,0,1,0,0,0|1,0,0]=3 1071 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [1,0,1,0,0,0|0,0,0]=2 1072 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [1,0,1,0,0,0|2,0,0]=4 1073 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [1,0,1,0,0,0|2,0,0]=4 1074 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [1,0,1,0,0,0|2,0,0]=4 1075 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [1,0,1,0,0,0|1,1,0]=4 1076 B11R1.91 NC(=S)\C=C\c1ccccn1 Amb27233532 [1,0,1,0,0,0|0,1,0]=3 1077 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [1,0,1,0,0,0|2,0,0]=4 1078 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [1,0,1,0,0,0|1,0,1]=4 1079 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [1,0,1,0,0,0|1,0,1]=4 1080 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [1,0,1,0,0,0|2,0,0]=4 1081 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [1,0,1,0,0,0|1,0,0]=3 1082 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [1,0,1,0,0,0|2,0,0]=4 1083 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [1,0,1,0,0,0|2,0,0]=4 1084 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [1,0,1,0,0,0|2,0,0]=4 1085 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [1,0,1,0,0,0|1,0,0]=3 1086 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [1,0,1,0,0,0|2,0,0]=4 1087 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [1,0,1,0,0,0|2,0,0]=4 1088 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [1,0,1,0,0,0|2,0,0]=4 1089 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [1,0,1,0,0,0|2,0,0]=4 1090 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [1,0,1,0,0,0|2,0,0]=4 1091 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [1,0,1,0,0,0|2,0,0]=4 1092 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [1,0,1,0,0,0|2,0,0]=4 1093 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [1,0,1,0,0,0|2,0,0]=4 1094 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb19373998 [1,0,1,0,0,0|2,0,0]=4 1095 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb24106744 [1,0,1,0,0,0|2,0,0]=4 1096 B11R1.101 O=C1C=CC=CC=CC=CC1 Amb26062133 [1,0,1,0,0,0|2,0,0]=4 1097 B11R1.41 C=Cc1ccccc1NC=O Amb27856053 [1,0,1,0,0,0|1,0,0]=3 1098 B11R1.41 O=CNc1cccnc1C=O Amb27823154 [1,0,1,0,0,0|0,0,1]=3 1099 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [1,0,1,0,0,0|2,0,0]=4 1100 B11R1.17 Cc1cccnc1\C=C\C=O Amb33428727 [1,0,1,0,0,0|1,0,0]=3 1101 B11R1.17 Cc1nccnc1\C=C\C=O Amb35600874 [1,0,1,0,0,0|2,0,0]=4 1102 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [1,0,1,0,0,0|1,0,0]=3 1103 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [1,0,1,0,0,0|2,0,0]=4 1104 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [1,0,1,0,0,0|2,0,0]=4 1105 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [1,0,1,0,0,0|2,0,0]=4 1106 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [1,0,1,0,0,0|2,0,0]=4 1107 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [1,0,1,0,0,0|2,0,0]=4 1108 B11R1.17 O=C\C=C\c1ncccc1Br Amb33388586 [1,0,1,0,0,0|1,0,0]=3 1109 B11R1.17 O=C\C=C\c1ncccc1F Amb33418874 [1,0,1,0,0,0|1,0,0]=3 1110 B11R1.86 CC(=O)Nc1cccnc1Br Amb2611773 [1,0,1,0,0,0|1,0,1]=4 1111 B11R1.86 CC(=O)Nc1cccnc1C Amb22750736 [1,0,1,0,0,0|0,0,2]=4 1112 B11R1.86 CC(=O)Nc1cccnc1Cl Amb6512902 [1,0,1,0,0,0|1,0,1]=4 1113 B11R1.86 CC(=O)Nc1cccnc1F Amb30018366 [1,0,1,0,0,0|1,0,1]=4 1114 B11R1.86 CC(=O)Nc1cccnc1N Amb28291490 [1,0,1,0,0,0|1,0,1]=4 1115 B11R1.86 CC(=O)Nc1cccnc1N Amb32718785 [1,0,1,0,0,0|1,0,1]=4 1116 B11R1.86 CC(=O)Nc1ncccc1N Amb18125264 [1,0,1,0,0,0|2,0,0]=4 1117 B11R1.86 Cc1cccnc1CC(=O)O Amb20247885 [1,0,1,0,0,0|1,0,1]=4 1118 B11R1.86 Cc1cccnc1CC(=O)O Amb22587588 [1,0,1,0,0,0|1,0,1]=4 1119 B11R1.86 Cc1ncccc1CC(=O)O Amb18215698 [1,0,1,0,0,0|1,0,1]=4 1120 B11R1.86 Cc1ncccc1CC(=O)O Amb28652864 [1,0,1,0,0,0|1,0,1]=4 1121 B11R1.86 Cc1ncccc1NC(=O)Cl Amb35625661 [1,0,1,0,0,0|1,0,1]=4 1122 B11R1.86 Cc1ncccc1NC(N)=O Amb28047100 [1,0,1,0,0,0|1,0,1]=4 1123 B11R1.86 NC(=O)Nc1cccnc1Br Amb27598194 [1,0,1,0,0,0|2,0,0]=4 1124 B11R1.86 NC(=O)Nc1cccnc1Cl Amb23584701 [1,0,1,0,0,0|2,0,0]=4 1125 B11R1.86 NC(=O)Nc1cccnc1O Amb25363195 [1,0,1,0,0,0|2,0,0]=4 1126 B11R1.86 Nc1ccccc1CC(=O)O Amb5519014 [1,0,1,0,0,0|1,0,1]=4 1127 B11R1.86 Nc1ncccc1CC(=O)O Amb21962140 [1,0,1,0,0,0|2,0,0]=4 1128 B11R1.86 Nc1ncccc1CC(=O)O Amb28652875 [1,0,1,0,0,0|2,0,0]=4 1129 B11R1.86 O=C(O)Cc1cccnc1Br Amb25834640 [1,0,1,0,0,0|2,0,0]=4 1130 B11R1.86 O=C(O)Cc1cccnc1Cl Amb8630440 [1,0,1,0,0,0|2,0,0]=4 1131 B11R1.86 O=C(O)Cc1cccnc1F Amb20247892 [1,0,1,0,0,0|2,0,0]=4 1132 B11R1.86 O=C(O)Cc1ncccc1Br Amb20247878 [1,0,1,0,0,0|1,0,1]=4 1133 B11R1.86 O=C(O)Cc1ncccc1Br Amb20247879 [1,0,1,0,0,0|1,0,1]=4 1134 B11R1.86 O=C(O)Cc1ncccc1Cl Amb19516058 [1,0,1,0,0,0|1,0,1]=4 1135 B11R1.86 O=C(O)Cc1ncccc1F Amb20247871 [1,0,1,0,0,0|1,0,1]=4 1136 B11R1.86 O=C(O)Cc1ncccc1F Amb33204428 [1,0,1,0,0,0|1,0,1]=4 1137 B11R1.86 O=C(O)Cc1ncccc1O Amb18125512 [1,0,1,0,0,0|1,0,1]=4 1138 B11R1.86 O=C(O)Cc1ncccc1O Amb20247882 [1,0,1,0,0,0|1,0,1]=4 1139 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [1,0,1,0,0,0|2,0,0]=4 1140 B11R2.20 C1=CCc2ncccc2C1 Amb28146039 [2,0,0,0,0,0|1,0,1]=4 1141 B11R2.20 C1=CNc2ncncc2N1 Amb27614413 [2,0,0,0,0,0|2,0,0]=4 1142 B11R2.20 C1=COC2=CN=CNC2=C1 Amb24564703 [2,0,0,0,0,0|2,0,0]=4 1143 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [2,0,0,0,0,0|2,0,0]=4 1144 B11R2.20 C1=COc2cccnc2C1 Amb27860347 [2,0,0,0,0,0|1,0,1]=4 1145 B11R2.20 C1=COc2cccnc2N1 Amb27403264 [2,0,0,0,0,0|2,0,0]=4 1146 B11R2.20 C1=CSC2=CN=CNC2=C1 Amb27245769 [2,0,0,0,0,0|2,0,0]=4 1147 B11R2.20 C1=CSc2ncccc2N1 Amb27954664 [2,0,0,0,0,0|1,0,0]=3 1148 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [2,0,0,0,0,0|1,0,1]=4 1149 B11R2.20 C1=NNc2cccnc2O1 Amb28291339 [2,0,0,0,0,0|2,0,0]=4 1150 B11R2.20 c1cc[n+]2cccnc2c1 Amb2603162 [2,0,0,0,0,0|2,0,0]=4 1151 B11R2.20 c1ccc2[nH+]cccc2c1 Amb10839799 [2,0,0,0,0,0|1,0,1]=4 1152 B11R2.20 c1ccc2ccccc2c1 Amb6608803 [2,0,0,0,0,0|2,0,0]=4 1153 B11R2.20 c1ccc2ncccc2c1 Amb22002632 [2,0,0,0,0,0|1,0,0]=3 1154 B11R2.20 c1ccc2ncccc2c1 Amb2610545 [2,0,0,0,0,0|1,0,0]=3 1155 B11R2.20 c1ccc2nccnc2c1 Amb2099438 [2,0,0,0,0,0|2,0,0]=4 1156 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [2,0,0,0,0,0|2,0,0]=4 1157 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [2,0,0,0,0,0|2,0,0]=4 1158 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [2,0,0,0,0,0|2,0,0]=4 1159 B11R2.20 c1cnc2cccnc2c1 Amb1106274 [2,0,0,0,0,0|0,0,1]=3 1160 B11R2.20 c1cnc2ccncc2c1 Amb6565155 [2,0,0,0,0,0|2,0,0]=4 1161 B11R2.20 c1cnc2ccnnc2c1 Amb27470418 [2,0,0,0,0,0|1,0,1]=4 1162 B11R2.20 c1cnc2cnccc2c1 Amb4560929 [2,0,0,0,0,0|2,0,0]=4 1163 B11R2.20 c1cnc2ncccc2c1 Amb15692873 [2,0,0,0,0,0|2,0,0]=4 1164 B11R2.20 c1cnc2nccnc2c1 Amb33544339 [2,0,0,0,0,0|1,0,1]=4 1165 B13R1.133 C=C(C)C(=O)Nc1ccc(Br)cc1 Amb22001452 [0,1,1,0,0,0|2,0,0]=4 1166 B13R1.133 C=C(C)C(=O)Nc1ccc(C)cc1 Amb2410051 [0,1,1,0,0,0|2,0,0]=4 1167 B13R1.133 C=C(C)C(=O)Nc1ccc(Cl)cc1 Amb2406800 [0,1,1,0,0,0|2,0,0]=4 1168 B13R1.133 C=C(C)C(=O)Nc1ccc(Cl)nc1 Amb27248327 [0,1,1,0,0,0|1,0,0]=3 1169 B13R1.133 C=C(C)C(=O)Nc1ccc(F)cc1 Amb28255752 [0,1,1,0,0,0|2,0,0]=4 1170 B13R1.133 C=C(Cl)C(=O)NC1=CNC(=O)C=C1 Amb28197361 [0,1,1,0,0,0|1,0,1]=4 1171 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Br)cc1 Amb22460391 [0,1,1,0,0,0|2,0,0]=4 1172 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Br)nc1 Amb27783608 [0,1,1,0,0,0|1,0,0]=3 1173 B13R1.133 C=C(Cl)C(=O)Nc1ccc(C)cc1 Amb22460375 [0,1,1,0,0,0|2,0,0]=4 1174 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Cl)cc1 Amb2444521 [0,1,1,0,0,0|2,0,0]=4 1175 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Cl)nn1 Amb27235111 [0,1,1,0,0,0|2,0,0]=4 1176 B13R1.133 C=C(Cl)C(=O)Nc1ccc(F)cc1 Amb27959929 [0,1,1,0,0,0|2,0,0]=4 1177 B13R1.133 C=C(Cl)C(=O)Nc1ccc(F)nc1 Amb27969594 [0,1,1,0,0,0|1,0,0]=3 1178 B13R1.133 C=C(Cl)C(=O)Nc1ccc(I)cc1 Amb22460397 [0,1,1,0,0,0|2,0,0]=4 1179 B13R1.133 C=C(Cl)C(=O)Nc1cnc(Br)cn1 Amb28142528 [0,1,1,0,0,0|2,0,0]=4 1180 B13R1.133 CC(=O)\C(C)=C\c1ccc(Br)cn1 Amb27411612 [0,1,1,0,0,0|2,0,0]=4 1181 B13R1.133 CC(O)C(=O)Nc1ccc(Cl)nc1 Amb27586413 [0,1,1,0,0,0|0,0,2]=4 1182 B13R1.133 C\C(=C\c1ccc(Br)cn1)C(=O)O Amb27815482 [0,1,1,0,0,0|2,0,0]=4 1183 B13R1.133 C\C(=C\c1ccc(C)cn1)C(=O)O Amb27254577 [0,1,1,0,0,0|2,0,0]=4 1184 B13R1.133 Cc1ccc(CC(=O)C(=O)O)cn1 Amb33344531 [0,1,1,0,0,0|2,0,0]=4 1185 B13R1.133 Cc1ccc(NC(=O)C(=O)O)cc1 Amb838974 [0,1,1,0,0,0|2,0,0]=4 1186 B13R1.133 Cc1ccc(NC(=O)C(=O)O)cn1 Amb28121575 [0,1,1,0,0,0|1,0,0]=3 1187 B13R1.133 NC(=O)C(=O)Nc1ccc(Br)cn1 Amb27755221 [0,1,1,0,0,0|1,0,1]=4 1188 B13R1.133 NC(=O)C(=O)Nc1ccc(F)nc1 Amb28457996 [0,1,1,0,0,0|1,0,1]=4 1189 B13R1.133 N\C(=C\c1ccc(Br)cn1)C(=O)O Amb35644575 [0,1,1,0,0,0|2,0,0]=4 1190 B13R1.133 Nc1ccc(NC(=O)C(=O)O)cc1 Amb1348301 [0,1,1,0,0,0|2,0,0]=4 1191 B13R1.133 O=C(O)C(=O)Cc1ccc(Br)nc1 Amb33387727 [0,1,1,0,0,0|2,0,0]=4 1192 B13R1.133 O=C(O)C(=O)Cc1ccc(Cl)nc1 Amb33261566 [0,1,1,0,0,0|2,0,0]=4 1193 B13R1.133 O=C(O)C(=O)Cc1ccc(F)nc1 Amb33426564 [0,1,1,0,0,0|2,0,0]=4 1194 B13R1.133 O=C(O)C(=O)Nc1ccc(Br)cc1 Amb838965 [0,1,1,0,0,0|2,0,0]=4 1195 B13R1.133 O=C(O)C(=O)Nc1ccc(Cl)cc1 Amb2371148 [0,1,1,0,0,0|2,0,0]=4 1196 B13R1.133 O=C(O)C(=O)Nc1ccc(F)cc1 Amb9303980 [0,1,1,0,0,0|2,0,0]=4 1197 B13R1.133 O=C(O)C(=O)Nc1ccc(I)cc1 Amb9303921 [0,1,1,0,0,0|2,0,0]=4 1198 B13R1.133 O=C(O)\C(O)=C\c1ccc(F)cc1 Amb22549399 [0,1,1,0,0,0|2,0,0]=4 1199 B13R1.135 C=C(CN)C(=O)Nc1ccccc1 Amb27403619 [0,1,1,0,0,0|2,0,0]=4 1200 B13R1.135 C=C(CO)C(=O)Nc1ccccc1 Amb27653164 [0,1,1,0,0,0|1,0,0]=3 1201 B13R1.135 C=C(CO)C(=O)Nc1cccnc1 Amb27979930 [0,1,1,0,0,0|0,0,0]=2 1202 B13R1.135 C=C(SC)C(=O)Nc1ccccc1 Amb27797309 [0,1,1,0,0,0|1,1,0]=4 1203 B13R1.135 CNC(=O)C(=O)Nc1ccccn1 Amb5485137 [0,1,1,0,0,0|1,0,1]=4 1204 B13R1.135 CNC(=O)\C(C)=C\c1ccccc1 Amb3447584 [0,1,1,0,0,0|2,0,0]=4 1205 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,1,0,0,0|2,0,0]=4 1206 B13R1.135 COC(=O)C(=O)Nc1cccnn1 Amb27963380 [0,1,1,0,0,0|2,0,0]=4 1207 B13R1.135 C\C(=C/c1ccccc1)C(=O)CN Amb33476121 [0,1,1,0,0,0|2,0,0]=4 1208 B13R1.135 C\C=C(\C)C(=O)Nc1ccccc1 Amb27604243 [0,1,1,0,0,0|2,0,0]=4 1209 B13R1.135 C\C=C(\C)C(=O)Oc1cccnc1 Amb27806023 [0,1,1,0,0,0|2,0,0]=4 1210 B13R1.135 NNC(=O)C(=O)Nc1ccccn1 Amb10562782 [0,1,1,0,0,0|1,0,1]=4 1211 B13R1.135 NNC(=O)\C(F)=C\c1ccccc1 Amb27833930 [0,1,1,0,0,0|2,0,0]=4 1212 B13R1.135 O=C(NO)C(=O)Nc1ccccc1 Amb27439064 [0,1,1,0,0,0|2,0,0]=4 1213 B13R1.135 O=C(Nc1ccccc1)\C(Cl)=C/O Amb27755040 [0,1,1,0,0,0|2,0,0]=4 1214 B13R1.135 O=C(Nc1ccccc1)\C(Cl)=N/O Amb27473306 [0,1,1,0,0,0|2,0,0]=4 1215 B13R1.135 O=C(Nc1ccccc1)\C(Cl)=N\O Amb5720077 [0,1,1,0,0,0|2,0,0]=4 1216 B13R1.148 C=C(C)C(=O)Nc1cccc(N)c1 Amb28137733 [0,1,1,0,0,0|2,0,0]=4 1217 B13R1.148 C=C(Cl)C(=O)Nc1cccc(Br)c1 Amb27868861 [0,1,1,0,0,0|2,0,0]=4 1218 B13R1.148 C=C(Cl)C(=O)Nc1cccc(I)c1 Amb27845250 [0,1,1,0,0,0|2,0,0]=4 1219 B13R1.148 C=C(Cl)C(=O)Nc1cccc(O)c1 Amb27880021 [0,1,1,0,0,0|2,0,0]=4 1220 B13R1.148 C=C(Cl)C(=O)Nc1cncc(Cl)c1 Amb35717662 [0,1,1,0,0,0|1,0,0]=3 1221 B13R1.148 C=C(Cl)C(=O)Nc1cncc(F)c1 Amb27620892 [0,1,1,0,0,0|1,0,0]=3 1222 B13R1.148 CC(O)C(=O)Nc1cncc(F)c1 Amb28400557 [0,1,1,0,0,0|0,0,2]=4 1223 B13R1.148 C\C(=C/c1cc(C)ccn1)C(=O)O Amb28137941 [0,1,1,0,0,0|2,0,0]=4 1224 B13R1.148 Cc1cccc(NC(=O)C(=O)O)c1 Amb838988 [0,1,1,0,0,0|2,0,0]=4 1225 B13R1.148 Cc1cccc(NC(=S)C(N)=O)n1 Amb27402640 [0,1,1,0,0,0|1,1,0]=4 1226 B13R1.148 Cc1cncc(CC(=O)C(=O)O)c1 Amb33318377 [0,1,1,0,0,0|2,0,0]=4 1227 B13R1.148 Cc1cncc(NC(=O)[C@@H](C)O)c1 Amb27771287 [0,1,1,0,0,0|0,0,2]=4 1228 B13R1.148 NC(=O)C(=O)Nc1cncc(Br)c1 Amb27598101 [0,1,1,0,0,0|1,0,1]=4 1229 B13R1.148 O=C(O)C(=O)Cc1cncc(Br)c1 Amb25979407 [0,1,1,0,0,0|2,0,0]=4 1230 B13R1.148 O=C(O)C(=O)Cc1cncc(F)c1 Amb33196974 [0,1,1,0,0,0|2,0,0]=4 1231 B13R1.148 O=C(O)C(=O)Nc1cccc(Br)c1 Amb838964 [0,1,1,0,0,0|2,0,0]=4 1232 B13R1.148 O=C(O)C(=O)Nc1cccc(Cl)c1 Amb838963 [0,1,1,0,0,0|2,0,0]=4 1233 B13R1.148 O=C(O)C(=O)Nc1cccc(F)c1 Amb9303976 [0,1,1,0,0,0|2,0,0]=4 1234 B13R1.148 O=C(O)C(=O)Nc1cncc(Cl)c1 Amb29864905 [0,1,1,0,0,0|1,0,0]=3 1235 B13R1.152 C=C(C(N)=O)C(O)c1ccccn1 Amb27955302 [0,1,1,0,0,0|1,0,1]=4 1236 B13R1.152 C=C(C)C(=O)N(N)c1ccccc1 Amb33191329 [0,1,1,0,0,0|2,0,0]=4 1237 B13R1.152 C=C(Cl)C(=O)N(C)c1ccccc1 Amb27436283 [0,1,1,0,0,0|2,0,0]=4 1238 B13R1.152 CN(C(=O)C(=O)O)c1ccccc1 Amb9303801 [0,1,1,0,0,0|2,0,0]=4 1239 B13R1.152 C[C@H](O)C(=O)N(C)c1cccnc1 Amb27802430 [0,1,1,0,0,0|0,0,2]=4 1240 B13R1.152 O=C(O)C(=O)C(=O)c1ccccn1 Amb31096954 [0,1,1,0,0,0|1,0,1]=4 1241 B13R1.152 O=C(O)C(=O)C(=O)c1cccnc1 Amb31096955 [0,1,1,0,0,0|2,0,0]=4 1242 B13R1.202 C=C(C)C(=O)Cc1cccnc1N Amb28132598 [0,1,1,0,0,0|2,0,0]=4 1243 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl Amb28046252 [0,1,1,0,0,0|2,0,0]=4 1244 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1C Amb27620885 [0,1,1,0,0,0|2,0,0]=4 1245 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1Cl Amb22460395 [0,1,1,0,0,0|2,0,0]=4 1246 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1Br Amb27815702 [0,1,1,0,0,0|1,0,0]=3 1247 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1C Amb27786098 [0,1,1,0,0,0|1,0,0]=3 1248 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1F Amb30018361 [0,1,1,0,0,0|1,0,0]=3 1249 B13R1.202 C=C(Cl)C(=O)Nc1cnccc1C Amb27960751 [0,1,1,0,0,0|1,0,0]=3 1250 B13R1.202 CC(=O)C(=O)Nc1cnccc1C Amb27589372 [0,1,1,0,0,0|0,0,2]=4 1251 B13R1.202 CC(O)C(=O)Nc1cnccc1O Amb22491812 [0,1,1,0,0,0|0,0,2]=4 1252 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1O Amb27591215 [0,1,1,0,0,0|0,0,2]=4 1253 B13R1.202 C[C@@H](O)C(=O)Nc1cnccc1Cl Amb28291954 [0,1,1,0,0,0|0,0,2]=4 1254 B13R1.202 Cc1ccccc1NC(=O)C(=O)O Amb838973 [0,1,1,0,0,0|2,0,0]=4 1255 B13R1.202 Cc1cccnc1NC(=N)C(N)=O Amb28243470 [0,1,1,0,0,0|2,0,0]=4 1256 B13R1.202 Cc1ccncc1CC(=O)C(=O)O Amb33377101 [0,1,1,0,0,0|2,0,0]=4 1257 B13R1.202 Cc1ncccc1CC(=O)C(=O)O Amb32880135 [0,1,1,0,0,0|2,0,0]=4 1258 B13R1.202 NC(=O)C(=O)Nc1cccnc1Br Amb28047940 [0,1,1,0,0,0|1,0,1]=4 1259 B13R1.202 NC(=O)C(=O)Nc1cccnc1Cl Amb27977383 [0,1,1,0,0,0|1,0,1]=4 1260 B13R1.202 O=C(O)C(=O)Cc1cccnc1Br Amb33387453 [0,1,1,0,0,0|2,0,0]=4 1261 B13R1.202 O=C(O)C(=O)Cc1cccnc1Cl Amb33256969 [0,1,1,0,0,0|2,0,0]=4 1262 B13R1.202 O=C(O)C(=O)Cc1cccnc1F Amb33378326 [0,1,1,0,0,0|2,0,0]=4 1263 B13R1.202 O=C(O)C(=O)Nc1ccccc1Br Amb9238892 [0,1,1,0,0,0|2,0,0]=4 1264 B13R1.202 O=C(O)C(=O)Nc1ccccc1Cl Amb9303981 [0,1,1,0,0,0|2,0,0]=4 1265 B13R1.202 O=C(O)C(=O)Nc1ccccc1F Amb9303984 [0,1,1,0,0,0|2,0,0]=4 1266 B13R1.202 O=C(O)C(=O)Nc1ccccc1O Amb18128783 [0,1,1,0,0,0|2,0,0]=4 1267 B13R1.353 CC(C)(O)C(=O)Nc1cccnc1 Amb27272803 [0,1,1,0,0,0|0,0,2]=4 1268 B13R1.418 CC\C(=C/c1ccccn1)C(=O)O Amb5743950 [0,1,1,0,0,0|2,0,0]=4 1269 B13R1.418 CC\C(=C/c1ccccn1)C(C)=O Amb28199981 [0,1,1,0,0,0|2,0,0]=4 1270 B13R1.418 CC\C(=C\c1ccccn1)C(C)=O Amb28054425 [0,1,1,0,0,0|2,0,0]=4 1271 B13R1.418 CO\C(=C/c1ccccc1)C(=O)O Amb1945718 [0,1,1,0,0,0|2,0,0]=4 1272 B13R1.418 CO\C(=C\c1ccccc1)C(=O)O Amb28242324 [0,1,1,0,0,0|2,0,0]=4 1273 B13R1.418 CS\C(=C/c1ccccn1)C(=O)O Amb1761007 [0,1,1,0,0,0|1,1,0]=4 1274 B13R1.418 N#C\C(=C/c1ccccc1)C(N)=O Amb2222555 [0,1,1,0,0,0|2,0,0]=4 1275 B13R1.418 N#C\C(=C/c1ccccn1)C(=O)O Amb6245649 [0,1,1,0,0,0|2,0,0]=4 1276 B13R1.418 N#C\C(=C/c1ccccn1)C(N)=S Amb28120032 [0,1,1,0,0,0|1,1,0]=4 1277 B13R1.418 N#C\C(=C\c1ccccc1)C(N)=O Amb4074010 [0,1,1,0,0,0|2,0,0]=4 1278 B13R1.418 NC(=O)\C(=C\O)Sc1ccccc1 Amb27630458 [0,1,1,0,0,0|2,0,0]=4 1279 B13R1.418 O=C(O)\C(=C/c1ccccc1)CO Amb20671516 [0,1,1,0,0,0|2,0,0]=4 1280 B13R1.418 O=C(O)\C(Cc1ccccn1)=N/O Amb23603651 [0,1,1,0,0,0|1,0,1]=4 1281 B13R1.380 CC(=O)Nc1ccccc1\C=C\Br Amb33135173 [0,1,1,0,0,0|2,0,0]=4 1282 B13R1.380 CC(=O)Nc1ccccc1\C=C\Cl Amb27878645 [0,1,1,0,0,0|2,0,0]=4 1283 B13R1.380 CC(=O)Nc1ccccc1\C=N\O Amb27782390 [0,1,1,0,0,0|2,0,0]=4 1284 B13R1.380 NC(=O)Nc1ccccc1\C=N\O Amb27471956 [0,1,1,0,0,0|2,0,0]=4 1285 B13R1.382 C\C=C(\C)c1ccccc1NC=O Amb28077107 [0,1,1,0,0,0|2,0,0]=4 1286 B13R1.91 C=CC(=O)Nc1ccccc1C=C Amb27596942 [0,1,1,0,0,0|2,0,0]=4 1287 B13R1.91 C=CC(=O)Nc1cccnc1CN Amb32679090 [0,1,1,0,0,0|1,0,1]=4 1288 B13R1.470 C=CCC(=O)Nc1cccnc1Br Amb28318560 [0,1,1,0,0,0|2,0,0]=4 1289 B13R1.470 C=CCC(=O)Nc1cccnc1Cl Amb28422299 [0,1,1,0,0,0|2,0,0]=4 1290 B13R1.470 C=CCC(=O)Nc1cccnc1F Amb35714289 [0,1,1,0,0,0|2,0,0]=4 1291 B13R1.470 COCC(=O)Nc1cccnc1Br Amb27875661 [0,1,1,0,0,0|1,0,1]=4 1292 B13R1.470 COCC(=O)Nc1cccnc1F Amb30018372 [0,1,1,0,0,0|1,0,1]=4 1293 B13R1.470 COCC(=O)Nc1cccnc1I Amb27982749 [0,1,1,0,0,0|1,0,1]=4 1294 B13R1.470 COCC(=O)Nc1cccnc1O Amb27261105 [0,1,1,0,0,0|1,0,1]=4 1295 B13R1.470 CONC(=O)Nc1cccnc1C Amb27977617 [0,1,1,0,0,0|1,0,1]=4 1296 B13R1.470 C\C=C\C(=O)Nc1cccnc1F Amb30018349 [0,1,1,0,0,0|2,0,0]=4 1297 B13R1.470 C\C=C\C(=O)Nc1cccnc1O Amb28064902 [0,1,1,0,0,0|2,0,0]=4 1298 B13R1.470 Cc1ccccc1NC(=O)\C=N\O Amb6360526 [0,1,1,0,0,0|1,0,1]=4 1299 B13R1.470 Cc1ncccc1NC(=O)\C=N\O Amb28123153 [0,1,1,0,0,0|0,0,1]=3 1300 B13R1.470 O=C(\C=N\O)Nc1ccccc1Br Amb1223214 [0,1,1,0,0,0|2,0,0]=4 1301 B13R1.470 O=C(\C=N\O)Nc1ccccc1Cl Amb6547919 [0,1,1,0,0,0|2,0,0]=4 1302 B13R1.470 O=C(\C=N\O)Nc1ccccc1F Amb6548732 [0,1,1,0,0,0|2,0,0]=4 1303 B13R1.470 O=C(\C=N\O)Nc1ccccc1I Amb4032179 [0,1,1,0,0,0|2,0,0]=4 1304 B13R1.2679 Cc1ccc(NC(=O)CO)c(C)n1 Amb28454972 [0,1,1,0,0,0|0,0,2]=4 1305 B13R1.2679 O=C(CO)Nc1ccc(Br)nc1O Amb27972164 [0,1,1,0,0,0|1,0,1]=4 1306 B13R1.2872 C=CC(=O)Nc1cc(Br)cnc1Cl Amb28146695 [0,1,1,0,0,0|2,0,0]=4 1307 B13R1.2872 C=CC(=O)Nc1cc(C)cnc1Br Amb28242736 [0,1,1,0,0,0|2,0,0]=4 1308 B13R1.2872 C=CC(=O)Nc1cc(C)cnc1C Amb30019656 [0,1,1,0,0,0|1,0,1]=4 1309 B13R1.4928 C=CC(=O)Nc1c(C)ccnc1Cl Amb27983425 [0,1,1,0,0,0|2,0,0]=4 1310 B13R2.32 Brc1ccc2ncccc2c1Br Amb25117400 [1,1,0,0,0,0|2,0,0]=4 1311 B13R2.32 Brc1cnc2cccnc2c1Br Amb2609623 [1,1,0,0,0,0|1,0,1]=4 1312 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [1,1,0,0,0,0|2,0,0]=4 1313 B13R2.32 C=C1C=Cc2ccccc2N1C Amb25918137 [1,1,0,0,0,0|2,0,0]=4 1314 B13R2.32 CC1=CNc2ccccc2C1=O Amb21811680 [1,1,0,0,0,0|2,0,0]=4 1315 B13R2.32 CN1C(=O)C=Cc2ccccc21 Amb19116112 [1,1,0,0,0,0|1,0,0]=3 1316 B13R2.32 CN1C(=O)C=Cc2cccnc21 Amb28365713 [1,1,0,0,0,0|2,0,0]=4 1317 B13R2.32 CN1C(=O)C=Cc2cnccc21 Amb22491898 [1,1,0,0,0,0|2,0,0]=4 1318 B13R2.32 CN1C(=O)C=Cc2ncccc21 Amb28254581 [1,1,0,0,0,0|0,0,0]=2 1319 B13R2.32 CN1C(=O)CNc2ncccc21 Amb27265837 [1,1,0,0,0,0|1,0,1]=4 1320 B13R2.32 CN1C(=O)NCc2ncccc21 Amb27600581 [1,1,0,0,0,0|1,0,1]=4 1321 B13R2.32 CN1C(=S)C=Cc2ccccc21 Amb19651670 [1,1,0,0,0,0|1,1,0]=4 1322 B13R2.32 Cc1c(Br)ccc2cccnc12 Amb19895195 [1,1,0,0,0,0|2,0,0]=4 1323 B13R2.32 Cc1c(Br)ccc2ncccc12 Amb27230462 [1,1,0,0,0,0|2,0,0]=4 1324 B13R2.32 Cc1c(Br)cnc2cccnc12 Amb23597934 [1,1,0,0,0,0|1,0,1]=4 1325 B13R2.32 Cc1c(Cl)ccc2cccnc12 Amb10607058 [1,1,0,0,0,0|2,0,0]=4 1326 B13R2.32 Cc1c(F)ccc2cccnc12 Amb24454469 [1,1,0,0,0,0|2,0,0]=4 1327 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [1,1,0,0,0,0|2,0,0]=4 1328 B13R2.32 Cc1c(O)ccc2ncccc12 Amb18645164 [1,1,0,0,0,0|1,0,1]=4 1329 B13R2.32 Cc1c(O)ccc2ncccc12 Amb35748094 [1,1,0,0,0,0|1,0,1]=4 1330 B13R2.32 Cc1c(O)cnc2ccccc12 Amb18645166 [1,1,0,0,0,0|1,0,1]=4 1331 B13R2.32 Cc1ccc2cccnc2c1Br Amb22584155 [1,1,0,0,0,0|2,0,0]=4 1332 B13R2.32 Cc1ccc2cccnc2c1C Amb19101295 [1,1,0,0,0,0|2,0,0]=4 1333 B13R2.32 Cc1ccc2cccnc2c1C Amb34202228 [1,1,0,0,0,0|2,0,0]=4 1334 B13R2.32 Cc1ccc2cccnc2c1Cl Amb1678477 [1,1,0,0,0,0|2,0,0]=4 1335 B13R2.32 Cc1ccc2cccnc2c1F Amb23448791 [1,1,0,0,0,0|2,0,0]=4 1336 B13R2.32 Cc1ccc2cccnc2c1N Amb2226936 [1,1,0,0,0,0|2,0,0]=4 1337 B13R2.32 Cc1ccc2cccnc2c1O Amb9790954 [1,1,0,0,0,0|2,0,0]=4 1338 B13R2.32 Cc1ccc2ncccc2c1Br Amb22261628 [1,1,0,0,0,0|2,0,0]=4 1339 B13R2.32 Cc1ccc2ncccc2c1C Amb2612996 [1,1,0,0,0,0|2,0,0]=4 1340 B13R2.32 Cc1ccc2ncccc2c1N Amb2429223 [1,1,0,0,0,0|2,0,0]=4 1341 B13R2.32 Cc1ccc2ncccc2c1O Amb22750813 [1,1,0,0,0,0|2,0,0]=4 1342 B13R2.32 Clc1c(Br)ccc2cccnc12 Amb27603498 [1,1,0,0,0,0|2,0,0]=4 1343 B13R2.32 Clc1c(Br)ccc2ncccc12 Amb27445937 [1,1,0,0,0,0|2,0,0]=4 1344 B13R2.32 Clc1ccc2cccnc2c1Br Amb22757405 [1,1,0,0,0,0|2,0,0]=4 1345 B13R2.32 Clc1ccc2cccnc2c1Cl Amb18350646 [1,1,0,0,0,0|2,0,0]=4 1346 B13R2.32 Clc1ccc2ncccc2c1Br Amb27462085 [1,1,0,0,0,0|2,0,0]=4 1347 B13R2.32 Clc1ccc2ncccc2c1Cl Amb26641983 [1,1,0,0,0,0|2,0,0]=4 1348 B13R2.32 Clc1ccc2ncccc2c1I Amb27642672 [1,1,0,0,0,0|2,0,0]=4 1349 B13R2.32 Cn1c(=N)ccc2ccccc21 Amb8439002 [1,1,0,0,0,0|2,0,0]=4 1350 B13R2.32 Cn1c(=O)cnc2ccccc21 Amb2612192 [1,1,0,0,0,0|2,0,0]=4 1351 B13R2.32 Fc1c(Br)ccc2cccnc12 Amb25969123 [1,1,0,0,0,0|2,0,0]=4 1352 B13R2.32 Fc1c(Br)ccc2ncccc12 Amb19516207 [1,1,0,0,0,0|2,0,0]=4 1353 B13R2.32 Fc1c(Br)ccc2ncccc12 Amb27263312 [1,1,0,0,0,0|2,0,0]=4 1354 B13R2.32 Fc1c(Cl)ccc2cccnc12 Amb10607059 [1,1,0,0,0,0|2,0,0]=4 1355 B13R2.32 Fc1ccc2cccnc2c1Br Amb22752068 [1,1,0,0,0,0|2,0,0]=4 1356 B13R2.32 Fc1ccc2cccnc2c1Br Amb33446988 [1,1,0,0,0,0|2,0,0]=4 1357 B13R2.32 Fc1ccc2cccnc2c1Cl Amb25210311 [1,1,0,0,0,0|2,0,0]=4 1358 B13R2.32 Fc1ccc2cccnc2c1F Amb24763740 [1,1,0,0,0,0|2,0,0]=4 1359 B13R2.32 Fc1ccc2cccnc2c1I Amb23448739 [1,1,0,0,0,0|2,0,0]=4 1360 B13R2.32 Fc1ccc2cccnc2c1S Amb27246700 [1,1,0,0,0,0|2,0,0]=4 1361 B13R2.32 Fc1ccc2ncccc2c1Br Amb23448729 [1,1,0,0,0,0|2,0,0]=4 1362 B13R2.32 Fc1ccc2ncccc2c1I Amb23448731 [1,1,0,0,0,0|2,0,0]=4 1363 B13R2.32 Fc1ccc2ncccc2c1S Amb27259870 [1,1,0,0,0,0|2,0,0]=4 1364 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [1,1,0,0,0,0|2,0,0]=4 1365 B13R2.32 Nc1c(Br)ccc2cccnc12 Amb18658785 [1,1,0,0,0,0|2,0,0]=4 1366 B13R2.32 Nc1c(Br)ccc2ncccc12 Amb22235427 [1,1,0,0,0,0|2,0,0]=4 1367 B13R2.32 Nc1c(Br)cnc2cccnc12 Amb18658932 [1,1,0,0,0,0|1,0,1]=4 1368 B13R2.32 Nc1c(Cl)ccc2cccnc12 Amb21857167 [1,1,0,0,0,0|2,0,0]=4 1369 B13R2.32 Nc1c(Cl)ccc2ncccc12 Amb18648195 [1,1,0,0,0,0|2,0,0]=4 1370 B13R2.32 Nc1c(F)ccc2cccnc12 Amb22497658 [1,1,0,0,0,0|2,0,0]=4 1371 B13R2.32 Nc1c(F)ccc2ncccc12 Amb22499165 [1,1,0,0,0,0|2,0,0]=4 1372 B13R2.32 Nc1c(I)ccc2ncccc12 Amb27827306 [1,1,0,0,0,0|2,0,0]=4 1373 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [1,1,0,0,0,0|2,0,0]=4 1374 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [1,1,0,0,0,0|2,0,0]=4 1375 B13R2.32 Nc1c(O)ccc2cccnc12 Amb23440835 [1,1,0,0,0,0|1,0,0]=3 1376 B13R2.32 Nc1c(O)ccc2cccnc12 Amb35748746 [1,1,0,0,0,0|1,0,0]=3 1377 B13R2.32 Nc1c(O)ccc2ncccc12 Amb9676621 [1,1,0,0,0,0|1,0,1]=4 1378 B13R2.32 Nc1ccc2cccnc2c1Br Amb27416667 [1,1,0,0,0,0|2,0,0]=4 1379 B13R2.32 Nc1ccc2cccnc2c1Cl Amb22755358 [1,1,0,0,0,0|2,0,0]=4 1380 B13R2.32 Nc1ccc2cccnc2c1O Amb18645295 [1,1,0,0,0,0|2,0,0]=4 1381 B13R2.32 Nc1ccc2ncccc2c1Br Amb19737281 [1,1,0,0,0,0|2,0,0]=4 1382 B13R2.32 Nc1ccc2ncccc2c1F Amb31291477 [1,1,0,0,0,0|2,0,0]=4 1383 B13R2.32 Nc1ccc2ncccc2c1N Amb31217535 [1,1,0,0,0,0|2,0,0]=4 1384 B13R2.32 Nc1ccc2ncccc2c1N Amb534275 [1,1,0,0,0,0|2,0,0]=4 1385 B13R2.32 Nc1ccc2ncccc2c1O Amb24071892 [1,1,0,0,0,0|2,0,0]=4 1386 B13R2.32 Nc1cnc2cccnc2c1I Amb21959434 [1,1,0,0,0,0|1,0,1]=4 1387 B13R2.32 O=C1C(O)=CSc2ccccc21 Amb20252018 [1,1,0,0,0,0|2,0,0]=4 1388 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [1,1,0,0,0,0|2,0,0]=4 1389 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [1,1,0,0,0,0|2,0,0]=4 1390 B13R2.32 O=C1C=Cc2ccccc2N1O Amb22723451 [1,1,0,0,0,0|1,0,0]=3 1391 B13R2.32 O=C1CNc2ncccc2N1O Amb27175787 [1,1,0,0,0,0|1,0,1]=4 1392 B13R2.32 O=C1N=Cc2ccccc2N1O Amb28248668 [1,1,0,0,0,0|2,0,0]=4 1393 B13R2.32 Oc1c(Br)ccc2cccnc12 Amb9807957 [1,1,0,0,0,0|2,0,0]=4 1394 B13R2.32 Oc1c(Br)ccc2ncccc12 Amb27642416 [1,1,0,0,0,0|2,0,0]=4 1395 B13R2.32 Oc1c(Cl)ccc2cccnc12 Amb18648300 [1,1,0,0,0,0|2,0,0]=4 1396 B13R2.32 Oc1c(Cl)ccc2cccnc12 Amb35747482 [1,1,0,0,0,0|2,0,0]=4 1397 B13R2.32 Oc1c(Cl)ccc2ncccc12 Amb26844215 [1,1,0,0,0,0|2,0,0]=4 1398 B13R2.32 Oc1c(F)ccc2cccnc12 Amb15693133 [1,1,0,0,0,0|2,0,0]=4 1399 B13R2.32 Oc1c(I)ccc2cccnc12 Amb22752325 [1,1,0,0,0,0|2,0,0]=4 1400 B13R2.32 Oc1c(I)ccc2ncccc12 Amb25941783 [1,1,0,0,0,0|2,0,0]=4 1401 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [1,1,0,0,0,0|2,0,0]=4 1402 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [1,1,0,0,0,0|2,0,0]=4 1403 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [1,1,0,0,0,0|2,0,0]=4 1404 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [1,1,0,0,0,0|2,0,0]=4 1405 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [1,1,0,0,0,0|2,0,0]=4 1406 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [1,1,0,0,0,0|2,0,0]=4 1407 B13R2.32 Oc1ccc2cccnc2c1Br Amb21864974 [1,1,0,0,0,0|1,0,0]=3 1408 B13R2.32 Oc1ccc2cccnc2c1Br Amb28719639 [1,1,0,0,0,0|1,0,0]=3 1409 B13R2.32 Oc1ccc2cccnc2c1Cl Amb23437336 [1,1,0,0,0,0|1,0,0]=3 1410 B13R2.32 Oc1ccc2cccnc2c1F Amb23437338 [1,1,0,0,0,0|1,0,0]=3 1411 B13R2.32 Oc1ccc2cccnc2c1I Amb23437337 [1,1,0,0,0,0|1,0,0]=3 1412 B13R2.32 Oc1ccc2ncccc2c1Br Amb18658841 [1,1,0,0,0,0|1,0,1]=4 1413 B13R2.32 Oc1ccc2ncccc2c1Br Amb33803387 [1,1,0,0,0,0|1,0,1]=4 1414 B13R2.32 Oc1ccc2ncccc2c1Cl Amb22757138 [1,1,0,0,0,0|1,0,1]=4 1415 B13R2.32 Oc1ccc2ncccc2c1F Amb22728877 [1,1,0,0,0,0|1,0,1]=4 1416 B13R2.32 Oc1ccc2ncccc2c1I Amb23437325 [1,1,0,0,0,0|1,0,1]=4 1417 B13R2.32 Oc1ccc2ncccc2c1O Amb27442475 [1,1,0,0,0,0|1,0,1]=4 1418 B13R2.32 Oc1ccc2ncccc2c1O Amb33802648 [1,1,0,0,0,0|1,0,1]=4 1419 B13R2.32 Oc1cnc2ccccc2c1Br Amb8438944 [1,1,0,0,0,0|1,0,1]=4 1420 B13R2.32 Oc1cnc2ccccc2c1Cl Amb18648301 [1,1,0,0,0,0|1,0,1]=4 1421 B13R2.32 Oc1cnc2ccccc2c1Cl Amb32653571 [1,1,0,0,0,0|1,0,1]=4 1422 B13R2.32 Oc1cnc2ccccc2c1F Amb27592408 [1,1,0,0,0,0|1,0,1]=4 1423 B13R2.32 Oc1cnc2ccccc2c1I Amb22752326 [1,1,0,0,0,0|1,0,1]=4 1424 B13R2.32 Oc1cnc2ccccc2c1O Amb5718045 [1,1,0,0,0,0|1,0,1]=4 1425 B13R2.32 Oc1cnc2ccccc2c1S Amb18127892 [1,1,0,0,0,0|1,0,1]=4 1426 B13R2.32 Oc1cnc2cccnc2c1I Amb13890076 [1,1,0,0,0,0|0,0,1]=3 1427 B13R2.32 S=C1C(S)=CNc2ccccc21 Amb27209576 [1,1,0,0,0,0|1,1,0]=4 1428 B13R2.32 Sc1c(Br)ccc2cccnc12 Amb24518936 [1,1,0,0,0,0|2,0,0]=4 1429 B13R2.32 Sc1c(Cl)ccc2cccnc12 Amb26575075 [1,1,0,0,0,0|2,0,0]=4 1430 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [1,1,0,0,0,0|2,0,0]=4 1431 B13R2.32 [NH3+]c1ccc2cccnc2c1O Amb32510249 [1,1,0,0,0,0|2,0,0]=4 1432 B13R2.57 BrCC1=CNN2C=CC=NC2=C1 Amb27450420 [1,1,0,0,0,0|2,0,0]=4 1433 B13R2.57 BrCc1ccc2cccnc2c1 Amb21927780 [1,1,0,0,0,0|2,0,0]=4 1434 B13R2.57 BrCc1ccc2cccnc2c1 Amb25202125 [1,1,0,0,0,0|2,0,0]=4 1435 B13R2.57 BrCc1ccc2ncccc2c1 Amb22641432 [1,1,0,0,0,0|2,0,0]=4 1436 B13R2.57 BrCc1ccc2ncccc2n1 Amb27616800 [1,1,0,0,0,0|1,0,1]=4 1437 B13R2.57 C#Cc1ccc2cccnc2c1 Amb21857606 [1,1,0,0,0,0|2,0,0]=4 1438 B13R2.57 C#Cc1ccc2ncccc2c1 Amb18787471 [1,1,0,0,0,0|2,0,0]=4 1439 B13R2.57 C#Cc1ccc2ncccc2n1 Amb25141017 [1,1,0,0,0,0|1,0,1]=4 1440 B13R2.57 C#Cc1cnc2cccnc2c1 Amb26606929 [1,1,0,0,0,0|1,0,1]=4 1441 B13R2.57 C=Cc1ccc2cccnc2c1 Amb32681920 [1,1,0,0,0,0|2,0,0]=4 1442 B13R2.57 C=Cc1ccc2ncccc2c1 Amb26841127 [1,1,0,0,0,0|2,0,0]=4 1443 B13R2.57 C=Cc1ccc2ncccc2n1 Amb25682614 [1,1,0,0,0,0|1,0,1]=4 1444 B13R2.57 C=Cc1cnc2cccnc2c1 Amb25842365 [1,1,0,0,0,0|1,0,1]=4 1445 B13R2.57 C=Nc1ccc2ncccc2c1 Amb27667186 [1,1,0,0,0,0|2,0,0]=4 1446 B13R2.57 CCc1ccc2cccnc2c1 Amb24436476 [1,1,0,0,0,0|2,0,0]=4 1447 B13R2.57 CCc1ccc2ncccc2c1 Amb18355325 [1,1,0,0,0,0|2,0,0]=4 1448 B13R2.57 CNc1ccc2cccnc2c1 Amb5717611 [1,1,0,0,0,0|2,0,0]=4 1449 B13R2.57 CNc1ccc2ncccc2c1 Amb18949283 [1,1,0,0,0,0|2,0,0]=4 1450 B13R2.57 CNc1ccc2ncccc2n1 Amb22751196 [1,1,0,0,0,0|1,0,1]=4 1451 B13R2.57 COc1cc2ncccc2cn1 Amb27847145 [1,1,0,0,0,0|2,0,0]=4 1452 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [1,1,0,0,0,0|2,0,0]=4 1453 B13R2.57 COc1ccc2cccnc2c1 Amb17617089 [1,1,0,0,0,0|1,0,0]=3 1454 B13R2.57 COc1ccc2cccnc2c1 Amb24183299 [1,1,0,0,0,0|1,0,0]=3 1455 B13R2.57 COc1ccc2cccnc2n1 Amb27624881 [1,1,0,0,0,0|2,0,0]=4 1456 B13R2.57 COc1ccc2cncnc2c1 Amb22745180 [1,1,0,0,0,0|2,0,0]=4 1457 B13R2.57 COc1ccc2ncccc2c1 Amb1156981 [1,1,0,0,0,0|1,0,1]=4 1458 B13R2.57 COc1ccc2ncccc2n1 Amb27453648 [1,1,0,0,0,0|0,0,2]=4 1459 B13R2.57 COc1ccc2nccnc2c1 Amb10068725 [1,1,0,0,0,0|2,0,0]=4 1460 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [1,1,0,0,0,0|1,0,1]=4 1461 B13R2.57 COc1cnc2cccnc2c1 Amb21959422 [1,1,0,0,0,0|0,0,1]=3 1462 B13R2.57 COc1cnc2nccnc2c1 Amb23401942 [1,1,0,0,0,0|1,0,1]=4 1463 B13R2.57 ClCc1ccc2cccnc2c1 Amb25259693 [1,1,0,0,0,0|2,0,0]=4 1464 B13R2.57 ClCc1ccc2cccnc2c1 Amb32757719 [1,1,0,0,0,0|2,0,0]=4 1465 B13R2.57 ClCc1ccc2ncccc2c1 Amb32685297 [1,1,0,0,0,0|2,0,0]=4 1466 B13R2.57 ClCc1ccc2ncccc2c1 Amb9132860 [1,1,0,0,0,0|2,0,0]=4 1467 B13R2.57 N#Cc1ccc2cccnc2c1 Amb9901753 [1,1,0,0,0,0|2,0,0]=4 1468 B13R2.57 N#Cc1ccc2ncccc2c1 Amb18787501 [1,1,0,0,0,0|2,0,0]=4 1469 B13R2.57 N#Cc1ccc2ncccc2n1 Amb21964779 [1,1,0,0,0,0|1,0,1]=4 1470 B13R2.57 N#Cc1cnc2cccnc2c1 Amb21959457 [1,1,0,0,0,0|1,0,1]=4 1471 B13R2.57 N#[N+]c1ccc2ncccc2c1 Amb27850516 [1,1,0,0,0,0|2,0,0]=4 1472 B13R2.57 NCc1ccc2cccnc2c1 Amb16185723 [1,1,0,0,0,0|2,0,0]=4 1473 B13R2.57 NCc1ccc2cccnc2c1 Amb21928073 [1,1,0,0,0,0|2,0,0]=4 1474 B13R2.57 NCc1ccc2ncccc2c1 Amb10608799 [1,1,0,0,0,0|2,0,0]=4 1475 B13R2.57 NCc1ccc2ncccc2c1 Amb10825274 [1,1,0,0,0,0|2,0,0]=4 1476 B13R2.57 NCc1ccc2ncccc2c1 Amb1946047 [1,1,0,0,0,0|2,0,0]=4 1477 B13R2.57 NCc1cnc2cccnc2c1 Amb32685158 [1,1,0,0,0,0|1,0,1]=4 1478 B13R2.57 NNc1ccc2cccnc2c1 Amb18645204 [1,1,0,0,0,0|2,0,0]=4 1479 B13R2.57 NNc1ccc2cccnc2c1 Amb22235093 [1,1,0,0,0,0|2,0,0]=4 1480 B13R2.57 NNc1ccc2ncccc2c1 Amb18182419 [1,1,0,0,0,0|2,0,0]=4 1481 B13R2.57 NNc1ccc2ncccc2c1 Amb21964376 [1,1,0,0,0,0|2,0,0]=4 1482 B13R2.57 NOc1ccc2ncccc2c1 Amb24397483 [1,1,0,0,0,0|1,0,1]=4 1483 B13R2.57 O=Cc1cc2cccnc2cn1 Amb31379099 [1,1,0,0,0,0|2,0,0]=4 1484 B13R2.57 O=Cc1ccc2ccccc2c1 Amb3939951 [1,1,0,0,0,0|2,0,0]=4 1485 B13R2.57 O=Cc1ccc2ccccc2n1 Amb533663 [1,1,0,0,0,0|1,0,1]=4 1486 B13R2.57 O=Cc1ccc2cccnc2c1 Amb2548373 [1,1,0,0,0,0|1,0,1]=4 1487 B13R2.57 O=Cc1ccc2ncccc2c1 Amb1266161 [1,1,0,0,0,0|1,0,0]=3 1488 B13R2.57 O=Cc1ccc2ncccc2n1 Amb25292132 [1,1,0,0,0,0|0,0,1]=3 1489 B13R2.57 O=Cc1ccc2nccnc2c1 Amb1158037 [1,1,0,0,0,0|2,0,0]=4 1490 B13R2.57 O=Cc1cnc2cccnc2c1 Amb13890074 [1,1,0,0,0,0|0,0,2]=4 1491 B13R2.57 O=Cc1cnc2ncccc2c1 Amb8010589 [1,1,0,0,0,0|2,0,0]=4 1492 B13R2.57 O=Nc1ccc2ccccc2c1 Amb27170669 [1,1,0,0,0,0|2,0,0]=4 1493 B13R2.57 OCC1=CNc2ccccc2N1 Amb24309070 [1,1,0,0,0,0|2,0,0]=4 1494 B13R2.57 OCc1ccc2ccccc2c1 Amb2389960 [1,1,0,0,0,0|2,0,0]=4 1495 B13R2.57 OCc1ccc2cccnc2c1 Amb19105058 [1,1,0,0,0,0|1,0,0]=3 1496 B13R2.57 OCc1ccc2cccnc2n1 Amb28076129 [1,1,0,0,0,0|2,0,0]=4 1497 B13R2.57 OCc1ccc2ncccc2c1 Amb1995120 [1,1,0,0,0,0|1,0,1]=4 1498 B13R2.57 OCc1ccc2ncccc2n1 Amb27166704 [1,1,0,0,0,0|0,0,2]=4 1499 B13R2.57 OCc1ccc2nccnc2c1 Amb13890528 [1,1,0,0,0,0|2,0,0]=4 1500 B13R2.57 OCc1cnc2ccccc2c1 Amb1995109 [1,1,0,0,0,0|1,0,1]=4 1501 B13R2.57 OCc1cnc2ccccc2c1 Amb20668047 [1,1,0,0,0,0|1,0,1]=4 1502 B13R2.57 OCc1cnc2cccnc2c1 Amb21959456 [1,1,0,0,0,0|0,0,1]=3 1503 B13R2.57 SCc1ccc2cccnc2c1 Amb32878081 [1,1,0,0,0,0|1,1,0]=4 1504 B13R2.57 SCc1ccc2ncccc2c1 Amb26634583 [1,1,0,0,0,0|1,1,0]=4 1505 B13R2.57 [C-]#[N+]c1ccc2cccnc2c1 Amb32880579 [1,1,0,0,0,0|2,0,0]=4 1506 B13R2.57 [C-]#[N+]c1ccc2ncccc2c1 Amb26440687 [1,1,0,0,0,0|2,0,0]=4 1507 B13R2.155 Brc1ccc2ccc(Br)nc2c1 Amb22000956 [1,1,0,0,0,0|2,0,0]=4 1508 B13R2.155 Brc1ccc2ccc(I)nc2c1 Amb25217538 [1,1,0,0,0,0|2,0,0]=4 1509 B13R2.155 Brc1ccc2ncc(Br)cc2c1 Amb21964475 [1,1,0,0,0,0|2,0,0]=4 1510 B13R2.155 Brc1ccc2ncc(I)cc2c1 Amb24179183 [1,1,0,0,0,0|2,0,0]=4 1511 B13R2.155 Brc1cnc2ccc(I)cc2c1 Amb15693012 [1,1,0,0,0,0|2,0,0]=4 1512 B13R2.155 Cc1cc2c(cn1)C=CC(=O)N2 Amb27790702 [1,1,0,0,0,0|2,0,0]=4 1513 B13R2.155 Cc1ccc2c(c1)NC(=O)C=C2 Amb21857833 [1,1,0,0,0,0|1,0,0]=3 1514 B13R2.155 Cc1ccc2c(c1)NC(=O)N=C2 Amb24468183 [1,1,0,0,0,0|2,0,0]=4 1515 B13R2.155 Cc1ccc2c(c1)OC(=O)C=C2 Amb18511476 [1,1,0,0,0,0|2,0,0]=4 1516 B13R2.155 Cc1ccc2ccc(Br)cc2n1 Amb1994793 [1,1,0,0,0,0|2,0,0]=4 1517 B13R2.155 Cc1ccc2ccc(C)nc2c1 Amb22002033 [1,1,0,0,0,0|2,0,0]=4 1518 B13R2.155 Cc1ccc2ccc(Cl)cc2n1 Amb2371819 [1,1,0,0,0,0|2,0,0]=4 1519 B13R2.155 Cc1ccc2ccc(Cl)nc2c1 Amb22007944 [1,1,0,0,0,0|2,0,0]=4 1520 B13R2.155 Cc1ccc2ccc(F)cc2n1 Amb2688237 [1,1,0,0,0,0|2,0,0]=4 1521 B13R2.155 Cc1ccc2ccc(I)cc2n1 Amb26576362 [1,1,0,0,0,0|2,0,0]=4 1522 B13R2.155 Cc1ccc2ccc(N)nc2c1 Amb25982717 [1,1,0,0,0,0|2,0,0]=4 1523 B13R2.155 Cc1ccc2ccc(O)cc2c1 Amb18645051 [1,1,0,0,0,0|2,0,0]=4 1524 B13R2.155 Cc1ccc2ccc(O)cc2n1 Amb18353419 [1,1,0,0,0,0|1,0,0]=3 1525 B13R2.155 Cc1ccc2ccc(O)nc2n1 Amb19889040 [1,1,0,0,0,0|2,0,0]=4 1526 B13R2.155 Cc1ccc2ccc(S)nc2c1 Amb23536151 [1,1,0,0,0,0|2,0,0]=4 1527 B13R2.155 Cc1ccc2ncc(Br)cc2c1 Amb24054480 [1,1,0,0,0,0|2,0,0]=4 1528 B13R2.155 Cc1ccc2ncc(C)cc2c1 Amb17334418 [1,1,0,0,0,0|2,0,0]=4 1529 B13R2.155 Cc1ccc2ncc(F)cc2c1 Amb28244382 [1,1,0,0,0,0|2,0,0]=4 1530 B13R2.155 Cc1ccc2ncc(N)cc2c1 Amb17157131 [1,1,0,0,0,0|2,0,0]=4 1531 B13R2.155 Cc1ccc2ncc(O)cc2c1 Amb8506040 [1,1,0,0,0,0|1,0,1]=4 1532 B13R2.155 Cc1cnc2c(c1)NC(=O)C=C2 Amb24556512 [1,1,0,0,0,0|0,0,0]=2 1533 B13R2.155 Cc1cnc2c(c1)NC(=O)CN2 Amb20667978 [1,1,0,0,0,0|1,0,1]=4 1534 B13R2.155 Cc1cnc2c(c1)NC(=O)CO2 Amb13890281 [1,1,0,0,0,0|1,0,1]=4 1535 B13R2.155 Cc1cnc2c(n1)NC(=O)N=C2 Amb27873221 [1,1,0,0,0,0|2,0,0]=4 1536 B13R2.155 Cc1cnc2ccc(Br)cc2c1 Amb1994327 [1,1,0,0,0,0|2,0,0]=4 1537 B13R2.155 Cc1cnc2ccc(N)cc2c1 Amb26609461 [1,1,0,0,0,0|2,0,0]=4 1538 B13R2.155 Cc1cnc2ccc(O)cc2c1 Amb25204459 [1,1,0,0,0,0|1,0,1]=4 1539 B13R2.155 Clc1ccc2ccc(Br)cc2n1 Amb1994309 [1,1,0,0,0,0|2,0,0]=4 1540 B13R2.155 Clc1ccc2ccc(Cl)nc2c1 Amb20239455 [1,1,0,0,0,0|2,0,0]=4 1541 B13R2.155 Clc1ccc2ncc(Br)cc2c1 Amb22899265 [1,1,0,0,0,0|2,0,0]=4 1542 B13R2.155 Clc1ccc2ncc(Br)cc2n1 Amb26611244 [1,1,0,0,0,0|1,0,1]=4 1543 B13R2.155 Clc1ccc2ncc(I)cc2c1 Amb28135713 [1,1,0,0,0,0|2,0,0]=4 1544 B13R2.155 Clc1ccc2ncc(I)cc2n1 Amb27219161 [1,1,0,0,0,0|1,0,1]=4 1545 B13R2.155 Clc1cnc2ccc(Br)cc2c1 Amb22751168 [1,1,0,0,0,0|2,0,0]=4 1546 B13R2.155 Clc1cnc2ccc(Cl)nc2c1 Amb27624626 [1,1,0,0,0,0|1,0,1]=4 1547 B13R2.155 Fc1ccc2ccc(Br)nc2c1 Amb23401192 [1,1,0,0,0,0|2,0,0]=4 1548 B13R2.155 Fc1ccc2ccc(Cl)cc2n1 Amb27965778 [1,1,0,0,0,0|2,0,0]=4 1549 B13R2.155 Fc1ccc2ccc(Cl)nc2c1 Amb19148834 [1,1,0,0,0,0|2,0,0]=4 1550 B13R2.155 Fc1ccc2ccc(S)nc2c1 Amb26491962 [1,1,0,0,0,0|2,0,0]=4 1551 B13R2.155 Fc1ccc2ncc(Br)cc2c1 Amb22899327 [1,1,0,0,0,0|2,0,0]=4 1552 B13R2.155 Fc1ccc2ncc(Cl)cc2c1 Amb27218236 [1,1,0,0,0,0|2,0,0]=4 1553 B13R2.155 Fc1ccc2ncc(F)cc2c1 Amb25793547 [1,1,0,0,0,0|2,0,0]=4 1554 B13R2.155 Fc1ccc2ncc(I)cc2c1 Amb25739549 [1,1,0,0,0,0|2,0,0]=4 1555 B13R2.155 Fc1cnc2ccc(Br)cc2c1 Amb22899328 [1,1,0,0,0,0|2,0,0]=4 1556 B13R2.155 Fc1cnc2ccc(Cl)cc2c1 Amb24553217 [1,1,0,0,0,0|2,0,0]=4 1557 B13R2.155 Fc1cnc2ccc(Cl)nc2c1 Amb24485722 [1,1,0,0,0,0|1,0,1]=4 1558 B13R2.155 Fc1cnc2ccc(I)cc2c1 Amb26374202 [1,1,0,0,0,0|2,0,0]=4 1559 B13R2.155 Nc1cc2c(cn1)C=CC(=O)N2 Amb24400239 [1,1,0,0,0,0|2,0,0]=4 1560 B13R2.155 Nc1ccc2c(c1)NC(=O)C=C2 Amb18545106 [1,1,0,0,0,0|1,0,0]=3 1561 B13R2.155 Nc1ccc2c(c1)NC(=O)C=N2 Amb19789097 [1,1,0,0,0,0|2,0,0]=4 1562 B13R2.155 Nc1ccc2c(c1)OC(=O)C=C2 Amb19130409 [1,1,0,0,0,0|2,0,0]=4 1563 B13R2.155 Nc1ccc2c(n1)NC(=O)C=C2 Amb19516712 [1,1,0,0,0,0|2,0,0]=4 1564 B13R2.155 Nc1ccc2ccc(Br)cc2n1 Amb16234051 [1,1,0,0,0,0|2,0,0]=4 1565 B13R2.155 Nc1ccc2ccc(Cl)cc2n1 Amb18648193 [1,1,0,0,0,0|2,0,0]=4 1566 B13R2.155 Nc1ccc2ccc(F)cc2n1 Amb25121338 [1,1,0,0,0,0|2,0,0]=4 1567 B13R2.155 Nc1ccc2ccc(N)nc2c1 Amb18645199 [1,1,0,0,0,0|2,0,0]=4 1568 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb21955697 [1,1,0,0,0,0|2,0,0]=4 1569 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb9173657 [1,1,0,0,0,0|2,0,0]=4 1570 B13R2.155 Nc1ccc2ccc(O)cc2n1 Amb27471897 [1,1,0,0,0,0|1,0,0]=3 1571 B13R2.155 Nc1ccc2ccc(O)nc2n1 Amb1102214 [1,1,0,0,0,0|2,0,0]=4 1572 B13R2.155 Nc1ccc2ncc(Br)cc2c1 Amb1101979 [1,1,0,0,0,0|2,0,0]=4 1573 B13R2.155 Nc1ccc2ncc(Br)cc2n1 Amb24458620 [1,1,0,0,0,0|1,0,1]=4 1574 B13R2.155 Nc1ccc2ncc(Cl)cc2c1 Amb22586586 [1,1,0,0,0,0|2,0,0]=4 1575 B13R2.155 Nc1ccc2ncc(Cl)cc2n1 Amb27625242 [1,1,0,0,0,0|1,0,1]=4 1576 B13R2.155 Nc1ccc2ncc(F)cc2c1 Amb22899391 [1,1,0,0,0,0|2,0,0]=4 1577 B13R2.155 Nc1ccc2ncc(I)cc2c1 Amb24359099 [1,1,0,0,0,0|2,0,0]=4 1578 B13R2.155 Nc1ccc2ncc(O)cc2c1 Amb24183776 [1,1,0,0,0,0|1,0,1]=4 1579 B13R2.155 Nc1cnc2c(c1)NC(=O)CO2 Amb26074227 [1,1,0,0,0,0|1,0,1]=4 1580 B13R2.155 Nc1cnc2ccc(Br)cc2c1 Amb1994332 [1,1,0,0,0,0|2,0,0]=4 1581 B13R2.155 Nc1cnc2ccc(Br)cc2c1 Amb9134115 [1,1,0,0,0,0|2,0,0]=4 1582 B13R2.155 Nc1cnc2ccc(Cl)cc2c1 Amb17157138 [1,1,0,0,0,0|2,0,0]=4 1583 B13R2.155 Nc1cnc2ccc(F)cc2c1 Amb17157137 [1,1,0,0,0,0|2,0,0]=4 1584 B13R2.155 Nc1cnc2ccc(F)cc2c1 Amb17621721 [1,1,0,0,0,0|2,0,0]=4 1585 B13R2.155 Nc1cnc2ccc(I)cc2c1 Amb32673379 [1,1,0,0,0,0|2,0,0]=4 1586 B13R2.155 Nc1cnc2ccc(N)nc2c1 Amb22751197 [1,1,0,0,0,0|1,0,1]=4 1587 B13R2.155 Nc1cnc2ccc(O)cc2c1 Amb23580321 [1,1,0,0,0,0|1,0,1]=4 1588 B13R2.155 O=C1C=Cc2ccc(Br)cc2N1 Amb20248087 [1,1,0,0,0,0|1,0,0]=3 1589 B13R2.155 O=C1C=Cc2ccc(Br)cc2O1 Amb26841310 [1,1,0,0,0,0|2,0,0]=4 1590 B13R2.155 O=C1C=Cc2ccc(Cl)cc2N1 Amb19894727 [1,1,0,0,0,0|1,0,0]=3 1591 B13R2.155 O=C1C=Cc2ccc(F)cc2N1 Amb23412015 [1,1,0,0,0,0|1,0,0]=3 1592 B13R2.155 O=C1C=Cc2ccc(F)cc2O1 Amb24736406 [1,1,0,0,0,0|2,0,0]=4 1593 B13R2.155 O=C1C=Cc2ccc(F)nc2N1 Amb22386916 [1,1,0,0,0,0|2,0,0]=4 1594 B13R2.155 O=C1C=Cc2ccc(I)cc2O1 Amb26420862 [1,1,0,0,0,0|2,0,0]=4 1595 B13R2.155 O=C1C=Cc2ccc(O)cc2N1 Amb18645438 [1,1,0,0,0,0|1,0,0]=3 1596 B13R2.155 O=C1C=Cc2ccc(O)cc2O1 Amb18511480 [1,1,0,0,0,0|2,0,0]=4 1597 B13R2.155 O=C1C=Cc2ccc(S)cc2O1 Amb27963071 [1,1,0,0,0,0|2,0,0]=4 1598 B13R2.155 O=C1C=Cc2cnc(Cl)cc2N1 Amb28121939 [1,1,0,0,0,0|2,0,0]=4 1599 B13R2.155 O=C1C=Cc2cnc(F)cc2N1 Amb22494138 [1,1,0,0,0,0|2,0,0]=4 1600 B13R2.155 O=C1C=Cc2ncc(Br)cc2N1 Amb22739841 [1,1,0,0,0,0|0,0,0]=2 1601 B13R2.155 O=C1C=Cc2ncc(Cl)cc2N1 Amb22235070 [1,1,0,0,0,0|0,0,0]=2 1602 B13R2.155 O=C1C=Cc2ncc(F)cc2N1 Amb22234515 [1,1,0,0,0,0|0,0,0]=2 1603 B13R2.155 O=C1C=Nc2ccc(Br)cc2N1 Amb19789102 [1,1,0,0,0,0|2,0,0]=4 1604 B13R2.155 O=C1C=Nc2ccc(Cl)cc2N1 Amb19889641 [1,1,0,0,0,0|2,0,0]=4 1605 B13R2.155 O=C1C=Nc2ccc(I)cc2N1 Amb25178643 [1,1,0,0,0,0|2,0,0]=4 1606 B13R2.155 O=C1CCc2ncc(Br)cc2N1 Amb27770085 [1,1,0,0,0,0|0,0,2]=4 1607 B13R2.155 O=C1CCc2ncc(F)cc2N1 Amb27668880 [1,1,0,0,0,0|0,0,2]=4 1608 B13R2.155 O=C1CNc2ncc(Br)cc2N1 Amb18063265 [1,1,0,0,0,0|1,0,1]=4 1609 B13R2.155 O=C1CNc2ncc(Cl)cc2N1 Amb25104811 [1,1,0,0,0,0|1,0,1]=4 1610 B13R2.155 O=C1CNc2ncc(F)cc2N1 Amb27626029 [1,1,0,0,0,0|1,0,1]=4 1611 B13R2.155 O=C1CNc2ncc(I)cc2N1 Amb15692000 [1,1,0,0,0,0|1,0,1]=4 1612 B13R2.155 O=C1COc2ncc(Br)cc2N1 Amb9810642 [1,1,0,0,0,0|1,0,1]=4 1613 B13R2.155 O=C1COc2ncc(Cl)cc2N1 Amb9810641 [1,1,0,0,0,0|1,0,1]=4 1614 B13R2.155 O=C1COc2ncc(I)cc2N1 Amb13890271 [1,1,0,0,0,0|1,0,1]=4 1615 B13R2.155 O=C1CSc2ncc(Br)cc2N1 Amb26374096 [1,1,0,0,0,0|1,0,1]=4 1616 B13R2.155 O=C1CSc2ncc(Cl)cc2N1 Amb24440986 [1,1,0,0,0,0|1,0,1]=4 1617 B13R2.155 O=C1N=Cc2ccc(Br)cc2N1 Amb21963258 [1,1,0,0,0,0|2,0,0]=4 1618 B13R2.155 O=c1ccc2ccc(Cl)cc2o1 Amb5717858 [1,1,0,0,0,0|2,0,0]=4 1619 B13R2.155 Oc1ccc2ccc(Br)cc2c1 Amb17596083 [1,1,0,0,0,0|2,0,0]=4 1620 B13R2.155 Oc1ccc2ccc(Br)cc2n1 Amb22284792 [1,1,0,0,0,0|2,0,0]=4 1621 B13R2.155 Oc1ccc2ccc(Br)nc2n1 Amb25055789 [1,1,0,0,0,0|2,0,0]=4 1622 B13R2.155 Oc1ccc2ccc(Cl)cc2c1 Amb17594576 [1,1,0,0,0,0|2,0,0]=4 1623 B13R2.155 Oc1ccc2ccc(Cl)cc2n1 Amb10603917 [1,1,0,0,0,0|2,0,0]=4 1624 B13R2.155 Oc1ccc2ccc(Cl)nc2c1 Amb613542 [1,1,0,0,0,0|1,0,0]=3 1625 B13R2.155 Oc1ccc2ccc(Cl)nc2n1 Amb22002316 [1,1,0,0,0,0|2,0,0]=4 1626 B13R2.155 Oc1ccc2ccc(F)cc2c1 Amb24589653 [1,1,0,0,0,0|2,0,0]=4 1627 B13R2.155 Oc1ccc2ccc(F)nc2c1 Amb24485536 [1,1,0,0,0,0|1,0,0]=3 1628 B13R2.155 Oc1ccc2ccc(I)cc2c1 Amb24429632 [1,1,0,0,0,0|2,0,0]=4 1629 B13R2.155 Oc1ccc2ccc(I)cc2n1 Amb24605587 [1,1,0,0,0,0|2,0,0]=4 1630 B13R2.155 Oc1ccc2ccc(I)nc2c1 Amb27667715 [1,1,0,0,0,0|1,0,0]=3 1631 B13R2.155 Oc1ccc2ccc(I)nc2n1 Amb24428263 [1,1,0,0,0,0|2,0,0]=4 1632 B13R2.155 Oc1ccc2ccc(O)cc2c1 Amb6357388 [1,1,0,0,0,0|2,0,0]=4 1633 B13R2.155 Oc1ccc2ccc(O)nc2c1 Amb10602568 [1,1,0,0,0,0|1,0,0]=3 1634 B13R2.155 Oc1ccc2ccc(O)nc2n1 Amb17613076 [1,1,0,0,0,0|2,0,0]=4 1635 B13R2.155 Oc1ccc2cnc(Br)nc2c1 Amb27451076 [1,1,0,0,0,0|2,0,0]=4 1636 B13R2.155 Oc1ccc2cnc(Cl)nc2c1 Amb28249029 [1,1,0,0,0,0|2,0,0]=4 1637 B13R2.155 Oc1ccc2ncc(Br)cc2c1 Amb21964255 [1,1,0,0,0,0|1,0,1]=4 1638 B13R2.155 Oc1ccc2ncc(Cl)cc2c1 Amb22497692 [1,1,0,0,0,0|1,0,1]=4 1639 B13R2.155 Oc1ccc2ncc(F)cc2c1 Amb22899330 [1,1,0,0,0,0|1,0,1]=4 1640 B13R2.155 Oc1ccc2ncc(I)cc2c1 Amb22494723 [1,1,0,0,0,0|1,0,1]=4 1641 B13R2.155 Oc1ccc2ncc(O)cc2c1 Amb24485547 [1,1,0,0,0,0|1,0,1]=4 1642 B13R2.155 Oc1cnc2ccc(Br)cc2c1 Amb33548540 [1,1,0,0,0,0|1,0,1]=4 1643 B13R2.155 Oc1cnc2ccc(Cl)cc2c1 Amb33547567 [1,1,0,0,0,0|1,0,1]=4 1644 B13R2.155 Oc1cnc2ccc(F)cc2c1 Amb22494761 [1,1,0,0,0,0|1,0,1]=4 1645 B13R2.155 Oc1cnc2ccc(I)cc2c1 Amb22494758 [1,1,0,0,0,0|1,0,1]=4 1646 B13R2.155 Sc1ccc2ccc(Br)cc2n1 Amb23536159 [1,1,0,0,0,0|2,0,0]=4 1647 B13R2.155 Sc1ccc2ccc(Cl)cc2n1 Amb23536154 [1,1,0,0,0,0|2,0,0]=4 1648 B13R2.155 Sc1cnc2ccc(Cl)cc2c1 Amb28123722 [1,1,0,0,0,0|2,0,0]=4 1649 B13R2.155 [CH2+]c1ccc2ccc(O)cc2n1 Amb28129015 [1,1,0,0,0,0|1,0,0]=3 1650 B13R2.162 Brc1ccc2nccc(Br)c2c1 Amb9134343 [1,1,0,0,0,0|2,0,0]=4 1651 B13R2.162 Brc1ccc2nccc(Br)c2n1 Amb23440144 [1,1,0,0,0,0|1,0,1]=4 1652 B13R2.162 Brc1ccc2nccc(I)c2c1 Amb22000878 [1,1,0,0,0,0|2,0,0]=4 1653 B13R2.162 CC1=CNC2=CC=CC(=N)C2=C1 Amb28245115 [1,1,0,0,0,0|2,0,0]=4 1654 B13R2.162 C[n+]1cccc2ccc(O)cc21 Amb27599338 [1,1,0,0,0,0|1,0,1]=4 1655 B13R2.162 Cc1ccc2nccc(Br)c2c1 Amb9134332 [1,1,0,0,0,0|2,0,0]=4 1656 B13R2.162 Cc1ccc2nccc(Br)c2n1 Amb27406087 [1,1,0,0,0,0|1,0,1]=4 1657 B13R2.162 Cc1ccc2nccc(C)c2n1 Amb25882153 [1,1,0,0,0,0|1,0,1]=4 1658 B13R2.162 Cc1ccc2nccc(Cl)c2c1 Amb1994850 [1,1,0,0,0,0|2,0,0]=4 1659 B13R2.162 Cc1ccc2nccc(N)c2c1 Amb1994598 [1,1,0,0,0,0|2,0,0]=4 1660 B13R2.162 Cc1ccc2nccc(O)c2c1 Amb1994185 [1,1,0,0,0,0|2,0,0]=4 1661 B13R2.162 Cc1cccc2c1NC(=O)C=C2 Amb18546019 [1,1,0,0,0,0|1,0,0]=3 1662 B13R2.162 Cc1cccc2c1OC(=O)C=C2 Amb28429789 [1,1,0,0,0,0|2,0,0]=4 1663 B13R2.162 Cc1cccc2ccc(O)cc12 Amb28347350 [1,1,0,0,0,0|2,0,0]=4 1664 B13R2.162 Cc1cccc2ncc(O)cc12 Amb25696317 [1,1,0,0,0,0|1,0,1]=4 1665 B13R2.162 Cc1ccnc2c1NC(=O)CN2 Amb22059434 [1,1,0,0,0,0|1,0,1]=4 1666 B13R2.162 Cc1ccnc2c1NC(=O)OC2 Amb32692995 [1,1,0,0,0,0|1,0,1]=4 1667 B13R2.162 Cc1ccnc2ccc(Br)cc12 Amb1994329 [1,1,0,0,0,0|2,0,0]=4 1668 B13R2.162 Cc1ccnc2ccc(Cl)cc12 Amb18353014 [1,1,0,0,0,0|2,0,0]=4 1669 B13R2.162 Cc1ccnc2ccc(F)cc12 Amb18355122 [1,1,0,0,0,0|2,0,0]=4 1670 B13R2.162 Cc1ccnc2ccc(I)cc12 Amb19108190 [1,1,0,0,0,0|2,0,0]=4 1671 B13R2.162 Cc1ccnc2ccc(N)cc12 Amb25992715 [1,1,0,0,0,0|2,0,0]=4 1672 B13R2.162 Cc1ccnc2ccc(O)cc12 Amb17593985 [1,1,0,0,0,0|1,0,1]=4 1673 B13R2.162 Cc1ncnc2c1NC(=O)C=N2 Amb27224738 [1,1,0,0,0,0|2,0,0]=4 1674 B13R2.162 Clc1ccc2nccc(Br)c2c1 Amb9134342 [1,1,0,0,0,0|2,0,0]=4 1675 B13R2.162 Clc1ccc2nccc(Br)c2n1 Amb24497536 [1,1,0,0,0,0|1,0,1]=4 1676 B13R2.162 Clc1ccc2nccc(Cl)c2c1 Amb6316160 [1,1,0,0,0,0|2,0,0]=4 1677 B13R2.162 Clc1ccc2nccc(Cl)c2n1 Amb22406161 [1,1,0,0,0,0|1,0,1]=4 1678 B13R2.162 Clc1ccnc2ccc(Br)cc12 Amb33531718 [1,1,0,0,0,0|2,0,0]=4 1679 B13R2.162 Clc1ccnc2ccc(Br)nc12 Amb27163287 [1,1,0,0,0,0|1,0,1]=4 1680 B13R2.162 Clc1ccnc2ccc(I)cc12 Amb9393489 [1,1,0,0,0,0|2,0,0]=4 1681 B13R2.162 Fc1ccc2nccc(Br)c2c1 Amb9134340 [1,1,0,0,0,0|2,0,0]=4 1682 B13R2.162 Fc1ccc2nccc(Br)c2n1 Amb25251780 [1,1,0,0,0,0|1,0,1]=4 1683 B13R2.162 Fc1ccc2nccc(Cl)c2c1 Amb1994634 [1,1,0,0,0,0|2,0,0]=4 1684 B13R2.162 Fc1ccnc2ccc(Br)cc12 Amb22292328 [1,1,0,0,0,0|2,0,0]=4 1685 B13R2.162 Nc1ccc2nccc(Br)c2c1 Amb19895200 [1,1,0,0,0,0|2,0,0]=4 1686 B13R2.162 Nc1ccc2nccc(Cl)c2c1 Amb21864848 [1,1,0,0,0,0|2,0,0]=4 1687 B13R2.162 Nc1ccc2nccc(N)c2c1 Amb24100909 [1,1,0,0,0,0|2,0,0]=4 1688 B13R2.162 Nc1ccc2nccc(O)c2c1 Amb19895194 [1,1,0,0,0,0|2,0,0]=4 1689 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb18645297 [1,1,0,0,0,0|1,0,0]=3 1690 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb22548256 [1,1,0,0,0,0|1,0,0]=3 1691 B13R2.162 Nc1cccc2c1OC(=O)C=C2 Amb18547323 [1,1,0,0,0,0|2,0,0]=4 1692 B13R2.162 Nc1cccc2ccc(O)cc12 Amb17750263 [1,1,0,0,0,0|2,0,0]=4 1693 B13R2.162 Nc1cccc2ncc(O)cc12 Amb22899411 [1,1,0,0,0,0|1,0,1]=4 1694 B13R2.162 Nc1ccnc2c1NC(=O)C=C2 Amb27453645 [1,1,0,0,0,0|0,0,0]=2 1695 B13R2.162 Nc1ccnc2ccc(Br)cc12 Amb1994589 [1,1,0,0,0,0|2,0,0]=4 1696 B13R2.162 Nc1ccnc2ccc(Cl)cc12 Amb1971631 [1,1,0,0,0,0|2,0,0]=4 1697 B13R2.162 Nc1ccnc2ccc(F)cc12 Amb1971633 [1,1,0,0,0,0|2,0,0]=4 1698 B13R2.162 Nc1ccnc2ccc(I)cc12 Amb22753992 [1,1,0,0,0,0|2,0,0]=4 1699 B13R2.162 O=C1C=CC2=CC=CC(=O)C2=C1 Amb27256369 [1,1,0,0,0,0|2,0,0]=4 1700 B13R2.162 O=C1C=Cc2cccc(Br)c2N1 Amb17933211 [1,1,0,0,0,0|1,0,0]=3 1701 B13R2.162 O=C1C=Cc2cccc(Br)c2O1 Amb19957580 [1,1,0,0,0,0|2,0,0]=4 1702 B13R2.162 O=C1C=Cc2cccc(Cl)c2O1 Amb28073885 [1,1,0,0,0,0|2,0,0]=4 1703 B13R2.162 O=C1C=Cc2cccc(F)c2N1 Amb18546026 [1,1,0,0,0,0|1,0,0]=3 1704 B13R2.162 O=C1C=Cc2cccc(F)c2O1 Amb27272596 [1,1,0,0,0,0|2,0,0]=4 1705 B13R2.162 O=C1C=Cc2cccc(I)c2N1 Amb24579898 [1,1,0,0,0,0|1,0,0]=3 1706 B13R2.162 O=C1C=Cc2cccc(I)c2O1 Amb25206611 [1,1,0,0,0,0|2,0,0]=4 1707 B13R2.162 O=C1C=Cc2cccc(O)c2N1 Amb18038432 [1,1,0,0,0,0|1,0,0]=3 1708 B13R2.162 O=C1C=Cc2cccc(O)c2O1 Amb18645571 [1,1,0,0,0,0|2,0,0]=4 1709 B13R2.162 O=C1C=Cc2cncc(Br)c2N1 Amb22043947 [1,1,0,0,0,0|2,0,0]=4 1710 B13R2.162 O=C1C=Cc2cncc(Cl)c2N1 Amb33493991 [1,1,0,0,0,0|2,0,0]=4 1711 B13R2.162 O=C1C=Cc2ncnc(Cl)c2N1 Amb25200772 [1,1,0,0,0,0|1,0,0]=3 1712 B13R2.162 O=C1C=Nc2cccc(Br)c2N1 Amb21963796 [1,1,0,0,0,0|2,0,0]=4 1713 B13R2.162 O=C1COc2nccc(Cl)c2N1 Amb27407851 [1,1,0,0,0,0|1,0,1]=4 1714 B13R2.162 O=C1N=Cc2cccc(Cl)c2N1 Amb27153655 [1,1,0,0,0,0|2,0,0]=4 1715 B13R2.162 O=c1ccc2cccc(Br)c2o1 Amb22230172 [1,1,0,0,0,0|2,0,0]=4 1716 B13R2.162 Oc1ccc2cccc(Br)c2c1 Amb16231039 [1,1,0,0,0,0|2,0,0]=4 1717 B13R2.162 Oc1ccc2cccc(Cl)c2c1 Amb17594577 [1,1,0,0,0,0|2,0,0]=4 1718 B13R2.162 Oc1ccc2cccc(F)c2c1 Amb18645622 [1,1,0,0,0,0|2,0,0]=4 1719 B13R2.162 Oc1ccc2cccc(I)c2c1 Amb25148831 [1,1,0,0,0,0|2,0,0]=4 1720 B13R2.162 Oc1ccc2cccc(O)c2c1 Amb8516929 [1,1,0,0,0,0|2,0,0]=4 1721 B13R2.162 Oc1ccc2nccc(Cl)c2c1 Amb15692139 [1,1,0,0,0,0|1,0,1]=4 1722 B13R2.162 Oc1ccc2nccc(F)c2c1 Amb27474457 [1,1,0,0,0,0|1,0,1]=4 1723 B13R2.162 Oc1ccc2nccc(I)c2c1 Amb26935916 [1,1,0,0,0,0|1,0,1]=4 1724 B13R2.162 Oc1ccnc2ccc(Br)cc12 Amb1994213 [1,1,0,0,0,0|2,0,0]=4 1725 B13R2.162 Oc1ccnc2ccc(Cl)cc12 Amb1971630 [1,1,0,0,0,0|2,0,0]=4 1726 B13R2.162 Oc1ccnc2ccc(F)cc12 Amb1971632 [1,1,0,0,0,0|2,0,0]=4 1727 B13R2.162 Oc1ccnc2ccc(I)cc12 Amb6893065 [1,1,0,0,0,0|2,0,0]=4 1728 B13R2.162 Oc1cnc2cccc(Br)c2c1 Amb22494956 [1,1,0,0,0,0|1,0,1]=4 1729 B13R2.162 Oc1cnc2cccc(Cl)c2c1 Amb24183754 [1,1,0,0,0,0|1,0,1]=4 1730 B13R2.162 Oc1cnc2cccc(F)c2c1 Amb24183767 [1,1,0,0,0,0|1,0,1]=4 1731 B13R2.162 Oc1cnc2cccc(I)c2c1 Amb26868844 [1,1,0,0,0,0|1,0,1]=4 1732 B13R2.162 Oc1cnc2cccc(O)c2c1 Amb26861197 [1,1,0,0,0,0|1,0,1]=4 1733 B13R2.162 Sc1ccnc2ccc(I)cc12 Amb28206758 [1,1,0,0,0,0|2,0,0]=4 1734 B13R2.222 O=S1(=O)C=Cc2ccccc2N1 Amb27468630 [1,1,0,0,0,0|2,0,0]=4 1735 B13R2.328 Brc1cc(Br)c2cccnc2c1 Amb22233979 [1,1,0,0,0,0|2,0,0]=4 1736 B13R2.328 Brc1cc(Br)c2ncccc2c1 Amb25971184 [1,1,0,0,0,0|2,0,0]=4 1737 B13R2.328 Brc1cc(I)c2ncccc2c1 Amb21858677 [1,1,0,0,0,0|2,0,0]=4 1738 B13R2.328 Brc1cc(I)cc2cccnc12 Amb22371561 [1,1,0,0,0,0|2,0,0]=4 1739 B13R2.328 C=C1NC(=O)Nc2ccccc21 Amb25150937 [1,1,0,0,0,0|2,0,0]=4 1740 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [1,1,0,0,0,0|2,0,0]=4 1741 B13R2.328 CC1=CC(=O)C=C2C=CC=NN12 Amb27177993 [1,1,0,0,0,0|2,0,0]=4 1742 B13R2.328 CC1=CC(=O)Cc2ccccc21 Amb28287006 [1,1,0,0,0,0|2,0,0]=4 1743 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [1,1,0,0,0,0|1,0,0]=3 1744 B13R2.328 CC1=CC(=O)Nc2ccncc21 Amb18015580 [1,1,0,0,0,0|2,0,0]=4 1745 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [1,1,0,0,0,0|2,0,0]=4 1746 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [1,1,0,0,0,0|2,0,0]=4 1747 B13R2.328 CC1=CC(=O)c2ncccc2N1 Amb24497195 [1,1,0,0,0,0|1,0,0]=3 1748 B13R2.328 CC1=CC(=S)Nc2ccccc21 Amb18010309 [1,1,0,0,0,0|1,1,0]=4 1749 B13R2.328 CN1CC(=O)Nc2cccnc21 Amb20622648 [1,1,0,0,0,0|1,0,1]=4 1750 B13R2.328 CN1CC(O)=Cc2ccccc21 Amb27827527 [1,1,0,0,0,0|1,0,1]=4 1751 B13R2.328 Cc1cc(Br)c2cccnc2c1 Amb22755388 [1,1,0,0,0,0|2,0,0]=4 1752 B13R2.328 Cc1cc(Br)c2ncccc2c1 Amb16192038 [1,1,0,0,0,0|2,0,0]=4 1753 B13R2.328 Cc1cc(Br)c2ncccc2c1 Amb20171135 [1,1,0,0,0,0|2,0,0]=4 1754 B13R2.328 Cc1cc(Br)cc2cccnc12 Amb10607062 [1,1,0,0,0,0|2,0,0]=4 1755 B13R2.328 Cc1cc(Br)cc2cccnc12 Amb20171134 [1,1,0,0,0,0|2,0,0]=4 1756 B13R2.328 Cc1cc(C)c2cccnc2c1 Amb18353755 [1,1,0,0,0,0|2,0,0]=4 1757 B13R2.328 Cc1cc(C)c2ncccc2c1 Amb18355306 [1,1,0,0,0,0|2,0,0]=4 1758 B13R2.328 Cc1cc(C)c2ncccc2c1 Amb20171154 [1,1,0,0,0,0|2,0,0]=4 1759 B13R2.328 Cc1cc(C)c2ncccc2n1 Amb32423730 [1,1,0,0,0,0|1,0,1]=4 1760 B13R2.328 Cc1cc(Cl)c2cccnc2c1 Amb23580774 [1,1,0,0,0,0|2,0,0]=4 1761 B13R2.328 Cc1cc(Cl)c2ncccc2c1 Amb21858699 [1,1,0,0,0,0|2,0,0]=4 1762 B13R2.328 Cc1cc(Cl)cc2cccnc12 Amb6893054 [1,1,0,0,0,0|2,0,0]=4 1763 B13R2.328 Cc1cc(Cl)nc2cccnc12 Amb23597931 [1,1,0,0,0,0|1,0,1]=4 1764 B13R2.328 Cc1cc(F)c2ncccc2c1 Amb6892905 [1,1,0,0,0,0|2,0,0]=4 1765 B13R2.328 Cc1cc(F)cc2cccnc12 Amb20171184 [1,1,0,0,0,0|2,0,0]=4 1766 B13R2.328 Cc1cc(N)c2ncccc2c1 Amb2721852 [1,1,0,0,0,0|2,0,0]=4 1767 B13R2.328 Cc1cc(N)c2ncccc2c1 Amb33299405 [1,1,0,0,0,0|2,0,0]=4 1768 B13R2.328 Cc1cc(N)cc2cccnc12 Amb1119987 [1,1,0,0,0,0|2,0,0]=4 1769 B13R2.328 Cc1cc(N)nc2cccnc12 Amb23597930 [1,1,0,0,0,0|1,0,1]=4 1770 B13R2.328 Cc1cc(O)c2cccnc2c1 Amb23589101 [1,1,0,0,0,0|2,0,0]=4 1771 B13R2.328 Cc1cc(O)c2ncccc2c1 Amb18645162 [1,1,0,0,0,0|2,0,0]=4 1772 B13R2.328 Cc1cc(O)cc2ccccc12 Amb18645052 [1,1,0,0,0,0|2,0,0]=4 1773 B13R2.328 Cc1cc(O)cc2ncccc12 Amb26845006 [1,1,0,0,0,0|1,0,0]=3 1774 B13R2.328 Cc1cc(O)nc2ncccc12 Amb3632332 [1,1,0,0,0,0|2,0,0]=4 1775 B13R2.328 Clc1cc(Br)c2cccnc2c1 Amb24183749 [1,1,0,0,0,0|2,0,0]=4 1776 B13R2.328 Clc1cc(Br)c2ncccc2c1 Amb18354435 [1,1,0,0,0,0|2,0,0]=4 1777 B13R2.328 Clc1cc(Br)cc2cccnc12 Amb20171123 [1,1,0,0,0,0|2,0,0]=4 1778 B13R2.328 Clc1cc(Cl)c2cccnc2c1 Amb18351416 [1,1,0,0,0,0|2,0,0]=4 1779 B13R2.328 Clc1cc(Cl)c2ncccc2c1 Amb19108434 [1,1,0,0,0,0|2,0,0]=4 1780 B13R2.328 Clc1cc(Cl)c2ncccc2n1 Amb27471895 [1,1,0,0,0,0|1,0,1]=4 1781 B13R2.328 Clc1cc(I)cc2cccnc12 Amb21858679 [1,1,0,0,0,0|2,0,0]=4 1782 B13R2.328 Fc1cc(Br)c2cccnc2c1 Amb25844589 [1,1,0,0,0,0|2,0,0]=4 1783 B13R2.328 Fc1cc(Br)c2ncccc2c1 Amb18354374 [1,1,0,0,0,0|2,0,0]=4 1784 B13R2.328 Fc1cc(Br)cc2cccnc12 Amb18351163 [1,1,0,0,0,0|2,0,0]=4 1785 B13R2.328 Fc1cc(Br)cc2ncccc12 Amb27178515 [1,1,0,0,0,0|2,0,0]=4 1786 B13R2.328 Fc1cc(Cl)c2ncccc2c1 Amb22498025 [1,1,0,0,0,0|2,0,0]=4 1787 B13R2.328 Fc1cc(Cl)cc2cccnc12 Amb21961943 [1,1,0,0,0,0|2,0,0]=4 1788 B13R2.328 Fc1cc(F)c2cccnc2c1 Amb6893096 [1,1,0,0,0,0|2,0,0]=4 1789 B13R2.328 Fc1cc(F)c2ncccc2c1 Amb8334779 [1,1,0,0,0,0|2,0,0]=4 1790 B13R2.328 Fc1cc(I)cc2cccnc12 Amb19108441 [1,1,0,0,0,0|2,0,0]=4 1791 B13R2.328 Ic1cc(I)c2cccnc2c1 Amb20001068 [1,1,0,0,0,0|2,0,0]=4 1792 B13R2.328 NC1=CC(=O)Nc2ccccc21 Amb18645325 [1,1,0,0,0,0|1,0,0]=3 1793 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [1,1,0,0,0,0|2,0,0]=4 1794 B13R2.328 NC1=CC(=O)c2ccccc2N1 Amb21856421 [1,1,0,0,0,0|2,0,0]=4 1795 B13R2.328 NC1=NC(=O)Nc2nccnc21 Amb24308886 [1,1,0,0,0,0|2,0,0]=4 1796 B13R2.328 NC1=NC(=O)c2ncccc2N1 Amb22498061 [1,1,0,0,0,0|2,0,0]=4 1797 B13R2.328 Nc1cc(Br)c2cccnc2c1 Amb26896463 [1,1,0,0,0,0|2,0,0]=4 1798 B13R2.328 Nc1cc(Br)c2ncccc2c1 Amb28429718 [1,1,0,0,0,0|2,0,0]=4 1799 B13R2.328 Nc1cc(Br)cc2cccnc12 Amb1033015 [1,1,0,0,0,0|2,0,0]=4 1800 B13R2.328 Nc1cc(Br)cc2ncccc12 Amb22233798 [1,1,0,0,0,0|2,0,0]=4 1801 B13R2.328 Nc1cc(Cl)c2cccnc2c1 Amb27965929 [1,1,0,0,0,0|2,0,0]=4 1802 B13R2.328 Nc1cc(Cl)c2ncccc2c1 Amb21858724 [1,1,0,0,0,0|2,0,0]=4 1803 B13R2.328 Nc1cc(Cl)cc2cccnc12 Amb1102377 [1,1,0,0,0,0|2,0,0]=4 1804 B13R2.328 Nc1cc(Cl)cc2ncccc12 Amb31291381 [1,1,0,0,0,0|2,0,0]=4 1805 B13R2.328 Nc1cc(F)cc2cccnc12 Amb18645626 [1,1,0,0,0,0|2,0,0]=4 1806 B13R2.328 Nc1cc(F)cc2ncccc12 Amb25047334 [1,1,0,0,0,0|2,0,0]=4 1807 B13R2.328 Nc1cc(N)c2ncccc2c1 Amb20527852 [1,1,0,0,0,0|2,0,0]=4 1808 B13R2.328 Nc1cc(N)c2ncccc2n1 Amb18645344 [1,1,0,0,0,0|1,0,1]=4 1809 B13R2.328 Nc1cc(O)c2cccnc2c1 Amb28282762 [1,1,0,0,0,0|2,0,0]=4 1810 B13R2.328 Nc1cc(O)c2ncccc2c1 Amb33329375 [1,1,0,0,0,0|2,0,0]=4 1811 B13R2.328 Nc1cc(O)c2ncccc2c1 Amb4303927 [1,1,0,0,0,0|2,0,0]=4 1812 B13R2.328 Nc1cc(O)cc2ccccc12 Amb18048469 [1,1,0,0,0,0|2,0,0]=4 1813 B13R2.328 Nc1cc(O)cc2ncccc12 Amb25709274 [1,1,0,0,0,0|1,0,0]=3 1814 B13R2.328 Nc1cc(O)nc2cccnc12 Amb26931451 [1,1,0,0,0,0|0,0,2]=4 1815 B13R2.328 O=C1C=C(Br)c2ccccc2N1 Amb21520307 [1,1,0,0,0,0|1,0,0]=3 1816 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [1,1,0,0,0,0|2,0,0]=4 1817 B13R2.328 O=C1C=C(Br)c2ccncc2N1 Amb25864668 [1,1,0,0,0,0|2,0,0]=4 1818 B13R2.328 O=C1C=C(Cl)Nc2ccccc21 Amb22500808 [1,1,0,0,0,0|2,0,0]=4 1819 B13R2.328 O=C1C=C(Cl)c2ccccc2N1 Amb19516664 [1,1,0,0,0,0|1,0,0]=3 1820 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [1,1,0,0,0,0|2,0,0]=4 1821 B13R2.328 O=C1C=C(Cl)c2cccnc2N1 Amb22753696 [1,1,0,0,0,0|2,0,0]=4 1822 B13R2.328 O=C1C=C(Cl)c2ccncc2N1 Amb33456380 [1,1,0,0,0,0|2,0,0]=4 1823 B13R2.328 O=C1C=C(F)c2ccccc2N1 Amb26375660 [1,1,0,0,0,0|1,0,0]=3 1824 B13R2.328 O=C1C=C(I)c2ccccc2O1 Amb27442019 [1,1,0,0,0,0|2,0,0]=4 1825 B13R2.328 O=C1C=C(O)c2ccccc2N1 Amb18002636 [1,1,0,0,0,0|1,0,0]=3 1826 B13R2.328 O=C1C=C(O)c2ccccc2O1 Amb18372000 [1,1,0,0,0,0|2,0,0]=4 1827 B13R2.328 O=C1C=C(O)c2ccccc2S1 Amb19517275 [1,1,0,0,0,0|2,0,0]=4 1828 B13R2.328 O=C1C=C(O)c2cccnc2N1 Amb20662029 [1,1,0,0,0,0|2,0,0]=4 1829 B13R2.328 O=C1C=C(O)c2ccncc2N1 Amb22494124 [1,1,0,0,0,0|2,0,0]=4 1830 B13R2.328 O=C1C=C(O)c2ncccc2N1 Amb22372203 [1,1,0,0,0,0|0,0,0]=2 1831 B13R2.328 O=C1C=C(O)c2nccnc2N1 Amb27803663 [1,1,0,0,0,0|1,0,0]=3 1832 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [1,1,0,0,0,0|2,0,0]=4 1833 B13R2.328 O=C1C=C([O-])[n+]2ccccc2N1 Amb20415253 [1,1,0,0,0,0|2,0,0]=4 1834 B13R2.328 O=C1C=C([O-])c2ccccc2N1 Amb22731733 [1,1,0,0,0,0|1,0,0]=3 1835 B13R2.328 O=C1CC(=O)c2ccccc2N1 Amb22263121 [1,1,0,0,0,0|1,0,1]=4 1836 B13R2.328 O=C1CS(=O)c2ncccc2N1 Amb28047569 [1,1,0,0,0,0|1,0,1]=4 1837 B13R2.328 O=C1Cc2cccnc2C(=O)O1 Amb33309586 [1,1,0,0,0,0|2,0,0]=4 1838 B13R2.328 O=C1Cc2cccnc2C(=O)O1 Amb33329093 [1,1,0,0,0,0|2,0,0]=4 1839 B13R2.328 O=C1N=C(Cl)c2ccccc2N1 Amb22371858 [1,1,0,0,0,0|2,0,0]=4 1840 B13R2.328 O=C1NC(=O)c2ccccc2N1 Amb18005794 [1,1,0,0,0,0|2,0,0]=4 1841 B13R2.328 O=C1NC(=O)c2ncccc2N1 Amb20242004 [1,1,0,0,0,0|1,0,0]=3 1842 B13R2.328 O=C1NC(=O)c2nccnc2N1 Amb21913206 [1,1,0,0,0,0|2,0,0]=4 1843 B13R2.328 O=C1NC(=S)Nc2cccnc21 Amb24468907 [1,1,0,0,0,0|1,1,0]=4 1844 B13R2.328 O=C1Nc2ccccc2C(=O)O1 Amb18183505 [1,1,0,0,0,0|2,0,0]=4 1845 B13R2.328 O=C1Nc2nccnc2C(=O)O1 Amb27229721 [1,1,0,0,0,0|2,0,0]=4 1846 B13R2.328 Oc1cc(Br)c2ccccc2c1 Amb17596081 [1,1,0,0,0,0|2,0,0]=4 1847 B13R2.328 Oc1cc(Br)c2cccnc2c1 Amb26905219 [1,1,0,0,0,0|1,0,0]=3 1848 B13R2.328 Oc1cc(Br)c2cccnc2n1 Amb24535969 [1,1,0,0,0,0|2,0,0]=4 1849 B13R2.328 Oc1cc(Br)c2ncccc2c1 Amb22752323 [1,1,0,0,0,0|1,0,1]=4 1850 B13R2.328 Oc1cc(Br)cc2cccnc12 Amb23399826 [1,1,0,0,0,0|2,0,0]=4 1851 B13R2.328 Oc1cc(Br)cc2ncccc12 Amb21964828 [1,1,0,0,0,0|2,0,0]=4 1852 B13R2.328 Oc1cc(Cl)c2ncccc2c1 Amb27217259 [1,1,0,0,0,0|1,0,1]=4 1853 B13R2.328 Oc1cc(Cl)c2ncccc2n1 Amb18648438 [1,1,0,0,0,0|0,0,2]=4 1854 B13R2.328 Oc1cc(Cl)cc2cccnc12 Amb22886928 [1,1,0,0,0,0|2,0,0]=4 1855 B13R2.328 Oc1cc(Cl)cc2cccnc12 Amb33553001 [1,1,0,0,0,0|2,0,0]=4 1856 B13R2.328 Oc1cc(F)c2ccccc2c1 Amb26843113 [1,1,0,0,0,0|2,0,0]=4 1857 B13R2.328 Oc1cc(F)c2cccnc2c1 Amb27616737 [1,1,0,0,0,0|1,0,0]=3 1858 B13R2.328 Oc1cc(F)cc2cccnc12 Amb22234249 [1,1,0,0,0,0|2,0,0]=4 1859 B13R2.328 Oc1cc(F)cc2ncccc12 Amb23437357 [1,1,0,0,0,0|2,0,0]=4 1860 B13R2.328 Oc1cc(I)c2ccccc2c1 Amb26850789 [1,1,0,0,0,0|2,0,0]=4 1861 B13R2.328 Oc1cc(I)c2cccnc2c1 Amb25729835 [1,1,0,0,0,0|1,0,0]=3 1862 B13R2.328 Oc1cc(I)c2ncccc2c1 Amb23437340 [1,1,0,0,0,0|1,0,1]=4 1863 B13R2.328 Oc1cc(I)cc2cccnc12 Amb23437359 [1,1,0,0,0,0|2,0,0]=4 1864 B13R2.328 Oc1cc(I)cc2ncccc12 Amb23437361 [1,1,0,0,0,0|2,0,0]=4 1865 B13R2.328 Oc1cc(O)c2ccccc2c1 Amb6357421 [1,1,0,0,0,0|2,0,0]=4 1866 B13R2.328 Oc1cc(O)c2cccnc2c1 Amb24484214 [1,1,0,0,0,0|1,0,0]=3 1867 B13R2.328 Oc1cc(O)c2ncccc2c1 Amb8559059 [1,1,0,0,0,0|1,0,1]=4 1868 B13R2.328 Oc1cc(O)c2nccnc2c1 Amb24484212 [1,1,0,0,0,0|2,0,0]=4 1869 B13R2.328 Sc1cc(Br)cc2cccnc12 Amb27193584 [1,1,0,0,0,0|2,0,0]=4 1870 B13R2.328 Sc1cc(Cl)cc2cccnc12 Amb27259871 [1,1,0,0,0,0|2,0,0]=4 1871 B13R2.328 [O-][n+]1cc(O)cc2ccccc21 Amb25873892 [1,1,0,0,0,0|1,0,1]=4 1872 B13R2.3683 Brc1ccc2cc(I)cnc2c1 Amb28124716 [1,1,0,0,0,0|2,0,0]=4 1873 B13R2.3683 Brc1ccc2nc(Br)ccc2c1 Amb22263970 [1,1,0,0,0,0|2,0,0]=4 1874 B13R2.3683 Brc1ccc2nc(Br)ccc2n1 Amb25826510 [1,1,0,0,0,0|1,0,1]=4 1875 B13R2.3683 Brc1cnc2cc(Br)ccc2c1 Amb22495197 [1,1,0,0,0,0|2,0,0]=4 1876 B13R2.3683 Brc1cnc2cc(Br)cnc2c1 Amb22263952 [1,1,0,0,0,0|1,0,1]=4 1877 B13R2.3683 Brc1cnc2cc(I)ccc2c1 Amb26893802 [1,1,0,0,0,0|2,0,0]=4 1878 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)N2 Amb18546035 [1,1,0,0,0,0|1,0,0]=3 1879 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 Amb18511482 [1,1,0,0,0,0|2,0,0]=4 1880 B13R2.3683 Cc1ccc2c(c1)C=NC(=O)N2 Amb24741810 [1,1,0,0,0,0|2,0,0]=4 1881 B13R2.3683 Cc1ccc2c(n1)NCC(=O)N2 Amb24401480 [1,1,0,0,0,0|1,0,1]=4 1882 B13R2.3683 Cc1ccc2c(n1)OCC(=O)N2 Amb24468180 [1,1,0,0,0,0|1,0,1]=4 1883 B13R2.3683 Cc1ccc2cc(Br)ccc2n1 Amb2685485 [1,1,0,0,0,0|2,0,0]=4 1884 B13R2.3683 Cc1ccc2cc(Br)cnc2c1 Amb28288254 [1,1,0,0,0,0|2,0,0]=4 1885 B13R2.3683 Cc1ccc2cc(Cl)ccc2n1 Amb2686458 [1,1,0,0,0,0|2,0,0]=4 1886 B13R2.3683 Cc1ccc2cc(F)ccc2n1 Amb2688236 [1,1,0,0,0,0|2,0,0]=4 1887 B13R2.3683 Cc1ccc2cc(I)ccc2n1 Amb17586361 [1,1,0,0,0,0|2,0,0]=4 1888 B13R2.3683 Cc1ccc2cc(N)ccc2n1 Amb1034891 [1,1,0,0,0,0|2,0,0]=4 1889 B13R2.3683 Cc1ccc2cc(N)cnc2c1 Amb20239508 [1,1,0,0,0,0|2,0,0]=4 1890 B13R2.3683 Cc1ccc2cc(N)cnc2c1 Amb25233126 [1,1,0,0,0,0|2,0,0]=4 1891 B13R2.3683 Cc1ccc2cc(O)ccc2c1 Amb21964548 [1,1,0,0,0,0|2,0,0]=4 1892 B13R2.3683 Cc1ccc2cc(O)ccc2n1 Amb3319419 [1,1,0,0,0,0|1,0,1]=4 1893 B13R2.3683 Cc1ccc2cc(O)cnc2c1 Amb24407164 [1,1,0,0,0,0|1,0,1]=4 1894 B13R2.3683 Cc1ccc2cc(S)ccc2n1 Amb28256298 [1,1,0,0,0,0|1,1,0]=4 1895 B13R2.3683 Cc1ccc2nc(Br)ccc2c1 Amb2610689 [1,1,0,0,0,0|2,0,0]=4 1896 B13R2.3683 Cc1ccc2nc(C)ccc2c1 Amb1152516 [1,1,0,0,0,0|2,0,0]=4 1897 B13R2.3683 Cc1ccc2nc(Cl)ccc2c1 Amb5718537 [1,1,0,0,0,0|2,0,0]=4 1898 B13R2.3683 Cc1ccc2nc(Cl)ccc2n1 Amb26866287 [1,1,0,0,0,0|1,0,1]=4 1899 B13R2.3683 Cc1ccc2nc(N)ccc2c1 Amb8386595 [1,1,0,0,0,0|2,0,0]=4 1900 B13R2.3683 Cc1ccc2nc(S)ccc2c1 Amb23536152 [1,1,0,0,0,0|2,0,0]=4 1901 B13R2.3683 Cc1cnc2cc(Br)ccc2c1 Amb24368689 [1,1,0,0,0,0|2,0,0]=4 1902 B13R2.3683 Cc1cnc2cc(C)ccc2c1 Amb17334417 [1,1,0,0,0,0|2,0,0]=4 1903 B13R2.3683 Cc1cnc2cc(F)ccc2c1 Amb24358980 [1,1,0,0,0,0|2,0,0]=4 1904 B13R2.3683 Cc1cnc2cc(N)ccc2c1 Amb30594180 [1,1,0,0,0,0|2,0,0]=4 1905 B13R2.3683 Cc1cnc2cc(O)ccc2c1 Amb25046100 [1,1,0,0,0,0|1,0,0]=3 1906 B13R2.3683 Clc1ccc2cc(Br)ccc2n1 Amb4449864 [1,1,0,0,0,0|2,0,0]=4 1907 B13R2.3683 Clc1ccc2cc(Br)cnc2c1 Amb21856471 [1,1,0,0,0,0|2,0,0]=4 1908 B13R2.3683 Clc1ccc2cc(I)ccc2n1 Amb4449865 [1,1,0,0,0,0|2,0,0]=4 1909 B13R2.3683 Clc1ccc2nc(Cl)ccc2c1 Amb4449863 [1,1,0,0,0,0|2,0,0]=4 1910 B13R2.3683 Clc1ccc2nc(Cl)ccc2n1 Amb21962772 [1,1,0,0,0,0|1,0,1]=4 1911 B13R2.3683 Clc1cnc2cc(Br)ccc2c1 Amb21858959 [1,1,0,0,0,0|2,0,0]=4 1912 B13R2.3683 Clc1cnc2cc(Br)cnc2c1 Amb26038576 [1,1,0,0,0,0|1,0,1]=4 1913 B13R2.3683 Clc1cnc2cc(Cl)ccc2c1 Amb22055067 [1,1,0,0,0,0|2,0,0]=4 1914 B13R2.3683 Fc1ccc2cc(Br)ccc2n1 Amb31289575 [1,1,0,0,0,0|2,0,0]=4 1915 B13R2.3683 Fc1ccc2cc(Br)cnc2c1 Amb22899304 [1,1,0,0,0,0|2,0,0]=4 1916 B13R2.3683 Fc1ccc2cc(Cl)ccc2n1 Amb27200639 [1,1,0,0,0,0|2,0,0]=4 1917 B13R2.3683 Fc1ccc2cc(I)cnc2c1 Amb24183792 [1,1,0,0,0,0|2,0,0]=4 1918 B13R2.3683 Fc1ccc2nc(Br)ccc2c1 Amb23448576 [1,1,0,0,0,0|2,0,0]=4 1919 B13R2.3683 Fc1ccc2nc(Cl)ccc2c1 Amb20171071 [1,1,0,0,0,0|2,0,0]=4 1920 B13R2.3683 Fc1ccc2nc(S)ccc2c1 Amb23536133 [1,1,0,0,0,0|2,0,0]=4 1921 B13R2.3683 Fc1cnc2cc(Br)ccc2c1 Amb22899360 [1,1,0,0,0,0|2,0,0]=4 1922 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)N2 Amb18545101 [1,1,0,0,0,0|1,0,0]=3 1923 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)O2 Amb18943698 [1,1,0,0,0,0|2,0,0]=4 1924 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)O2 Amb22732663 [1,1,0,0,0,0|2,0,0]=4 1925 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)S2 Amb18825000 [1,1,0,0,0,0|2,0,0]=4 1926 B13R2.3683 Nc1ccc2c(c1)N=CC(=O)N2 Amb22233899 [1,1,0,0,0,0|2,0,0]=4 1927 B13R2.3683 Nc1ccc2c(n1)NCC(=O)N2 Amb26445649 [1,1,0,0,0,0|1,0,1]=4 1928 B13R2.3683 Nc1ccc2cc(Br)ccc2n1 Amb33545190 [1,1,0,0,0,0|2,0,0]=4 1929 B13R2.3683 Nc1ccc2cc(Br)ccc2n1 Amb9134114 [1,1,0,0,0,0|2,0,0]=4 1930 B13R2.3683 Nc1ccc2cc(Br)cnc2c1 Amb22899267 [1,1,0,0,0,0|2,0,0]=4 1931 B13R2.3683 Nc1ccc2cc(Cl)ccc2n1 Amb8386594 [1,1,0,0,0,0|2,0,0]=4 1932 B13R2.3683 Nc1ccc2cc(Cl)cnc2c1 Amb22899380 [1,1,0,0,0,0|2,0,0]=4 1933 B13R2.3683 Nc1ccc2cc(F)ccc2n1 Amb8386593 [1,1,0,0,0,0|2,0,0]=4 1934 B13R2.3683 Nc1ccc2cc(F)cnc2c1 Amb22899379 [1,1,0,0,0,0|2,0,0]=4 1935 B13R2.3683 Nc1ccc2cc(O)ccc2c1 Amb17843066 [1,1,0,0,0,0|2,0,0]=4 1936 B13R2.3683 Nc1ccc2cc(O)cnc2c1 Amb22899407 [1,1,0,0,0,0|1,0,1]=4 1937 B13R2.3683 Nc1ccc2nc(Br)ccc2n1 Amb27187722 [1,1,0,0,0,0|1,0,1]=4 1938 B13R2.3683 Nc1ccc2nc(Cl)ccc2c1 Amb21963603 [1,1,0,0,0,0|2,0,0]=4 1939 B13R2.3683 Nc1ccc2nc(F)ccc2c1 Amb33035701 [1,1,0,0,0,0|2,0,0]=4 1940 B13R2.3683 Nc1ccc2nc(N)ccc2c1 Amb9310332 [1,1,0,0,0,0|2,0,0]=4 1941 B13R2.3683 Nc1ccc2nc(O)ccc2c1 Amb9310455 [1,1,0,0,0,0|2,0,0]=4 1942 B13R2.3683 Nc1ccc2nc(S)ccc2c1 Amb33529206 [1,1,0,0,0,0|2,0,0]=4 1943 B13R2.3683 Nc1cnc2cc(Br)ccc2c1 Amb17621718 [1,1,0,0,0,0|2,0,0]=4 1944 B13R2.3683 Nc1cnc2cc(Br)ccc2c1 Amb22235016 [1,1,0,0,0,0|2,0,0]=4 1945 B13R2.3683 Nc1cnc2cc(Br)cnc2c1 Amb30633833 [1,1,0,0,0,0|1,0,1]=4 1946 B13R2.3683 Nc1cnc2cc(Cl)ccc2c1 Amb19889367 [1,1,0,0,0,0|2,0,0]=4 1947 B13R2.3683 Nc1cnc2cc(Cl)cnc2c1 Amb31291261 [1,1,0,0,0,0|1,0,1]=4 1948 B13R2.3683 Nc1cnc2cc(F)ccc2c1 Amb17621722 [1,1,0,0,0,0|2,0,0]=4 1949 B13R2.3683 Nc1cnc2cc(F)ccc2c1 Amb22899303 [1,1,0,0,0,0|2,0,0]=4 1950 B13R2.3683 Nc1cnc2cc(F)cnc2c1 Amb31291391 [1,1,0,0,0,0|1,0,1]=4 1951 B13R2.3683 Nc1cnc2cc(O)ccc2c1 Amb27590358 [1,1,0,0,0,0|1,0,0]=3 1952 B13R2.3683 O=C1C=CC2=CC(=O)C=CC2=C1 Amb17778320 [1,1,0,0,0,0|2,0,0]=4 1953 B13R2.3683 O=C1C=CN2N=C(Cl)C=CC2=N1 Amb22304671 [1,1,0,0,0,0|1,0,1]=4 1954 B13R2.3683 O=C1C=Cc2cc(Br)ccc2N1 Amb17933294 [1,1,0,0,0,0|1,0,0]=3 1955 B13R2.3683 O=C1C=Cc2cc(Br)ccc2O1 Amb19957650 [1,1,0,0,0,0|2,0,0]=4 1956 B13R2.3683 O=C1C=Cc2cc(Br)cnc2N1 Amb19664780 [1,1,0,0,0,0|2,0,0]=4 1957 B13R2.3683 O=C1C=Cc2cc(Cl)ccc2N1 Amb18044542 [1,1,0,0,0,0|1,0,0]=3 1958 B13R2.3683 O=C1C=Cc2cc(Cl)cnc2N1 Amb19959273 [1,1,0,0,0,0|2,0,0]=4 1959 B13R2.3683 O=C1C=Cc2cc(Cl)ncc2N1 Amb22002290 [1,1,0,0,0,0|2,0,0]=4 1960 B13R2.3683 O=C1C=Cc2cc(F)ccc2N1 Amb17933800 [1,1,0,0,0,0|1,0,0]=3 1961 B13R2.3683 O=C1C=Cc2cc(I)ccc2O1 Amb27462170 [1,1,0,0,0,0|2,0,0]=4 1962 B13R2.3683 O=C1C=Cc2cc(O)ccc2N1 Amb18645437 [1,1,0,0,0,0|1,0,0]=3 1963 B13R2.3683 O=C1C=Cc2cc(O)ccc2O1 Amb18511478 [1,1,0,0,0,0|2,0,0]=4 1964 B13R2.3683 O=C1C=Cc2cc(O)ccc2S1 Amb28253939 [1,1,0,0,0,0|2,0,0]=4 1965 B13R2.3683 O=C1C=Cc2nc(Br)ccc2N1 Amb28399578 [1,1,0,0,0,0|0,0,0]=2 1966 B13R2.3683 O=C1C=Cc2nc(Cl)ccc2N1 Amb24717025 [1,1,0,0,0,0|0,0,0]=2 1967 B13R2.3683 O=C1C=Nc2cc(Br)ccc2N1 Amb20241318 [1,1,0,0,0,0|2,0,0]=4 1968 B13R2.3683 O=C1C=Nc2cc(Cl)ccc2N1 Amb19957505 [1,1,0,0,0,0|2,0,0]=4 1969 B13R2.3683 O=C1C=Nc2cc(F)ccc2N1 Amb19957557 [1,1,0,0,0,0|2,0,0]=4 1970 B13R2.3683 O=C1C=Nc2nc(Cl)ccc2N1 Amb22494027 [1,1,0,0,0,0|1,0,0]=3 1971 B13R2.3683 O=C1CCc2nc(Cl)ccc2N1 Amb25685202 [1,1,0,0,0,0|0,0,2]=4 1972 B13R2.3683 O=C1CNc2nc(Br)ccc2N1 Amb28454210 [1,1,0,0,0,0|1,0,1]=4 1973 B13R2.3683 O=C1CNc2nc(Cl)ccc2N1 Amb24664988 [1,1,0,0,0,0|1,0,1]=4 1974 B13R2.3683 O=C1COc2nc(Br)ccc2N1 Amb22234391 [1,1,0,0,0,0|1,0,1]=4 1975 B13R2.3683 O=C1COc2nc(Cl)ccc2N1 Amb25822025 [1,1,0,0,0,0|1,0,1]=4 1976 B13R2.3683 O=C1COc2nc(I)ccc2N1 Amb13890268 [1,1,0,0,0,0|1,0,1]=4 1977 B13R2.3683 O=C1N=Cc2cc(Br)ccc2N1 Amb21858215 [1,1,0,0,0,0|2,0,0]=4 1978 B13R2.3683 O=C1Nc2ccc(Cl)nc2CO1 Amb32692994 [1,1,0,0,0,0|1,0,1]=4 1979 B13R2.3683 Oc1ccc2cc(Br)ccc2c1 Amb1333685 [1,1,0,0,0,0|2,0,0]=4 1980 B13R2.3683 Oc1ccc2cc(Br)ccc2n1 Amb1994326 [1,1,0,0,0,0|2,0,0]=4 1981 B13R2.3683 Oc1ccc2cc(Br)cnc2c1 Amb22491312 [1,1,0,0,0,0|1,0,0]=3 1982 B13R2.3683 Oc1ccc2cc(Br)cnc2n1 Amb4560917 [1,1,0,0,0,0|2,0,0]=4 1983 B13R2.3683 Oc1ccc2cc(Cl)ccc2c1 Amb17777189 [1,1,0,0,0,0|2,0,0]=4 1984 B13R2.3683 Oc1ccc2cc(Cl)cnc2c1 Amb22494665 [1,1,0,0,0,0|1,0,0]=3 1985 B13R2.3683 Oc1ccc2cc(F)ccc2c1 Amb22751763 [1,1,0,0,0,0|2,0,0]=4 1986 B13R2.3683 Oc1ccc2cc(F)cnc2c1 Amb24102179 [1,1,0,0,0,0|1,0,0]=3 1987 B13R2.3683 Oc1ccc2cc(I)ccc2c1 Amb25669689 [1,1,0,0,0,0|2,0,0]=4 1988 B13R2.3683 Oc1ccc2cc(I)ccc2n1 Amb19958372 [1,1,0,0,0,0|2,0,0]=4 1989 B13R2.3683 Oc1ccc2cc(I)cnc2c1 Amb22494874 [1,1,0,0,0,0|1,0,0]=3 1990 B13R2.3683 Oc1ccc2cc(O)ccc2c1 Amb2708568 [1,1,0,0,0,0|2,0,0]=4 1991 B13R2.3683 Oc1ccc2cc(S)ccc2c1 Amb17594487 [1,1,0,0,0,0|2,0,0]=4 1992 B13R2.3683 Oc1ccc2nc(Br)ccc2c1 Amb22501097 [1,1,0,0,0,0|1,0,1]=4 1993 B13R2.3683 Oc1ccc2nc(Cl)ccc2c1 Amb21856139 [1,1,0,0,0,0|1,0,1]=4 1994 B13R2.3683 Oc1ccc2nc(Cl)cnc2c1 Amb18648441 [1,1,0,0,0,0|2,0,0]=4 1995 B13R2.3683 Oc1ccc2nc(F)ccc2c1 Amb26494930 [1,1,0,0,0,0|1,0,1]=4 1996 B13R2.3683 Oc1ccc2nc(I)ccc2c1 Amb26370795 [1,1,0,0,0,0|1,0,1]=4 1997 B13R2.3683 Oc1ccc2nc(O)ccc2c1 Amb9825996 [1,1,0,0,0,0|1,0,1]=4 1998 B13R2.3683 Oc1cnc2cc(Br)ccc2c1 Amb22494957 [1,1,0,0,0,0|1,0,1]=4 1999 B13R2.3683 Oc1cnc2cc(Br)cnc2c1 Amb31291388 [1,1,0,0,0,0|0,0,1]=3 2000 B13R2.3683 Oc1cnc2cc(Cl)ccc2c1 Amb24183780 [1,1,0,0,0,0|1,0,1]=4 2001 B13R2.3683 Oc1cnc2cc(Cl)cnc2c1 Amb31291392 [1,1,0,0,0,0|0,0,1]=3 2002 B13R2.3683 Oc1cnc2cc(F)ccc2c1 Amb24183788 [1,1,0,0,0,0|1,0,1]=4 2003 B13R2.3683 Oc1cnc2cc(F)cnc2c1 Amb31291393 [1,1,0,0,0,0|0,0,1]=3 2004 B13R2.3683 Oc1cnc2cc(I)ccc2c1 Amb25883423 [1,1,0,0,0,0|1,0,1]=4 2005 B13R2.3683 Oc1cnc2cc(O)ccc2c1 Amb27214209 [1,1,0,0,0,0|1,0,0]=3 2006 B13R2.3683 Sc1ccc2cc(Br)ccc2n1 Amb23536160 [1,1,0,0,0,0|2,0,0]=4 2007 B13R2.3683 Sc1ccc2cc(Cl)ccc2n1 Amb23536156 [1,1,0,0,0,0|2,0,0]=4 2008 B13R2.3683 [NH3+]c1ccc2c(c1)C=CC(=O)O2 Amb24113859 [1,1,0,0,0,0|2,0,0]=4 2009 B13R2.5179 Brc1ccc2c(Br)ccnc2c1 Amb9134344 [1,1,0,0,0,0|2,0,0]=4 2010 B13R2.5179 Brc1ccc2c(I)ccnc2c1 Amb22233821 [1,1,0,0,0,0|2,0,0]=4 2011 B13R2.5179 Brc1cnc2c(Br)ccnc2c1 Amb23440143 [1,1,0,0,0,0|1,0,1]=4 2012 B13R2.5179 Brc1cnc2c(I)ccnc2c1 Amb27765194 [1,1,0,0,0,0|1,0,1]=4 2013 B13R2.5179 Cc1ccc2c(Br)ccnc2c1 Amb9134333 [1,1,0,0,0,0|2,0,0]=4 2014 B13R2.5179 Cc1ccc2c(C)ccnc2c1 Amb24094524 [1,1,0,0,0,0|2,0,0]=4 2015 B13R2.5179 Cc1ccc2c(Cl)ccnc2c1 Amb1994640 [1,1,0,0,0,0|2,0,0]=4 2016 B13R2.5179 Cc1ccc2c(N)ccnc2c1 Amb1994612 [1,1,0,0,0,0|2,0,0]=4 2017 B13R2.5179 Cc1ccc2c(O)ccnc2c1 Amb1994825 [1,1,0,0,0,0|2,0,0]=4 2018 B13R2.5179 Cc1cccc2c1C=CC(=O)O2 Amb27449737 [1,1,0,0,0,0|2,0,0]=4 2019 B13R2.5179 Cc1cccc2cc(O)cnc12 Amb27878570 [1,1,0,0,0,0|1,0,1]=4 2020 B13R2.5179 Cc1ccnc2c1C=CC(=O)N2 Amb27243880 [1,1,0,0,0,0|2,0,0]=4 2021 B13R2.5179 Cc1ccnc2cc(Br)ccc12 Amb19108186 [1,1,0,0,0,0|2,0,0]=4 2022 B13R2.5179 Cc1ccnc2cc(F)ccc12 Amb23401195 [1,1,0,0,0,0|2,0,0]=4 2023 B13R2.5179 Cc1ccnc2cc(I)ccc12 Amb28051672 [1,1,0,0,0,0|2,0,0]=4 2024 B13R2.5179 Cc1ccnc2cc(N)ccc12 Amb18645064 [1,1,0,0,0,0|2,0,0]=4 2025 B13R2.5179 Cc1ccnc2cc(O)ccc12 Amb18645155 [1,1,0,0,0,0|1,0,0]=3 2026 B13R2.5179 Cc1cnc2c(O)ccnc2c1 Amb26549162 [1,1,0,0,0,0|1,0,1]=4 2027 B13R2.5179 Cc1nccc2c1C=CC(=O)N2 Amb21927041 [1,1,0,0,0,0|2,0,0]=4 2028 B13R2.5179 Clc1ccc2c(Br)ccnc2c1 Amb1994866 [1,1,0,0,0,0|2,0,0]=4 2029 B13R2.5179 Clc1ccc2c(Cl)ccnc2c1 Amb2725543 [1,1,0,0,0,0|2,0,0]=4 2030 B13R2.5179 Clc1ccc2c(I)ccnc2c1 Amb22337527 [1,1,0,0,0,0|2,0,0]=4 2031 B13R2.5179 Clc1ccnc2cc(Br)ccc12 Amb5638096 [1,1,0,0,0,0|2,0,0]=4 2032 B13R2.5179 Clc1ccnc2cc(Br)cnc12 Amb22405956 [1,1,0,0,0,0|1,0,1]=4 2033 B13R2.5179 Clc1ccnc2cc(I)ccc12 Amb10603930 [1,1,0,0,0,0|2,0,0]=4 2034 B13R2.5179 Clc1cnc2c(Cl)ccnc2c1 Amb22448457 [1,1,0,0,0,0|1,0,1]=4 2035 B13R2.5179 Fc1ccc2c(Br)ccnc2c1 Amb9134341 [1,1,0,0,0,0|2,0,0]=4 2036 B13R2.5179 Fc1ccc2c(Cl)ccnc2c1 Amb1994637 [1,1,0,0,0,0|2,0,0]=4 2037 B13R2.5179 Fc1ccc2c(F)ccnc2c1 Amb25218061 [1,1,0,0,0,0|2,0,0]=4 2038 B13R2.5179 Fc1ccnc2cc(Br)ccc12 Amb22292329 [1,1,0,0,0,0|2,0,0]=4 2039 B13R2.5179 Fc1ccnc2cc(Br)cnc12 Amb35653674 [1,1,0,0,0,0|1,0,1]=4 2040 B13R2.5179 Fc1ccnc2cc(Cl)ccc12 Amb26026226 [1,1,0,0,0,0|2,0,0]=4 2041 B13R2.5179 Fc1cnc2c(Br)ccnc2c1 Amb25125667 [1,1,0,0,0,0|1,0,1]=4 2042 B13R2.5179 Fc1cnc2c(Cl)ccnc2c1 Amb26038988 [1,1,0,0,0,0|1,0,1]=4 2043 B13R2.5179 Nc1ccc2c(Br)ccnc2c1 Amb24713524 [1,1,0,0,0,0|2,0,0]=4 2044 B13R2.5179 Nc1ccc2c(Cl)ccnc2c1 Amb19895193 [1,1,0,0,0,0|2,0,0]=4 2045 B13R2.5179 Nc1ccc2c(F)ccnc2c1 Amb33035635 [1,1,0,0,0,0|2,0,0]=4 2046 B13R2.5179 Nc1ccc2c(O)ccnc2c1 Amb21858674 [1,1,0,0,0,0|2,0,0]=4 2047 B13R2.5179 Nc1cccc2c1C=CC(=O)N2 Amb22500953 [1,1,0,0,0,0|1,0,0]=3 2048 B13R2.5179 Nc1cccc2cc(O)ccc12 Amb2776482 [1,1,0,0,0,0|2,0,0]=4 2049 B13R2.5179 Nc1cccc2cc(O)cnc12 Amb24183774 [1,1,0,0,0,0|1,0,1]=4 2050 B13R2.5179 Nc1ccnc2cc(Br)ccc12 Amb1994603 [1,1,0,0,0,0|2,0,0]=4 2051 B13R2.5179 Nc1ccnc2cc(Br)cnc12 Amb27146640 [1,1,0,0,0,0|1,0,1]=4 2052 B13R2.5179 Nc1ccnc2cc(Cl)ccc12 Amb1994607 [1,1,0,0,0,0|2,0,0]=4 2053 B13R2.5179 Nc1ccnc2cc(Cl)ccc12 Amb22235172 [1,1,0,0,0,0|2,0,0]=4 2054 B13R2.5179 Nc1ccnc2cc(F)ccc12 Amb1994609 [1,1,0,0,0,0|2,0,0]=4 2055 B13R2.5179 Nc1ccnc2cc(O)ccc12 Amb24738429 [1,1,0,0,0,0|1,0,0]=3 2056 B13R2.5179 Nc1ncnc2cc(O)ccc12 Amb24649773 [1,1,0,0,0,0|2,0,0]=4 2057 B13R2.5179 O=C1C=CNc2cc(O)ccc21 Amb19372691 [1,1,0,0,0,0|1,0,1]=4 2058 B13R2.5179 O=C1C=COc2cc(O)ccc21 Amb18645572 [1,1,0,0,0,0|2,0,0]=4 2059 B13R2.5179 O=C1C=Cc2c(Br)cccc2N1 Amb22263039 [1,1,0,0,0,0|1,0,0]=3 2060 B13R2.5179 O=C1C=Cc2c(Br)cccc2O1 Amb24682464 [1,1,0,0,0,0|2,0,0]=4 2061 B13R2.5179 O=C1C=Cc2c(Cl)cccc2O1 Amb24368459 [1,1,0,0,0,0|2,0,0]=4 2062 B13R2.5179 O=C1C=Cc2c(Cl)ccnc2N1 Amb27860185 [1,1,0,0,0,0|2,0,0]=4 2063 B13R2.5179 O=C1C=Cc2c(F)cccc2O1 Amb24675426 [1,1,0,0,0,0|2,0,0]=4 2064 B13R2.5179 O=C1C=Cc2c(I)cccc2O1 Amb27635036 [1,1,0,0,0,0|2,0,0]=4 2065 B13R2.5179 O=C1C=Cc2c(O)cccc2N1 Amb17933814 [1,1,0,0,0,0|1,0,0]=3 2066 B13R2.5179 O=C1C=Cc2c(O)cncc2N1 Amb18645583 [1,1,0,0,0,0|2,0,0]=4 2067 B13R2.5179 O=C1C=Cc2c(ccnc2Br)N1 Amb22754891 [1,1,0,0,0,0|2,0,0]=4 2068 B13R2.5179 O=C1C=Cc2c(ccnc2Cl)N1 Amb24658274 [1,1,0,0,0,0|2,0,0]=4 2069 B13R2.5179 O=C1C=Nc2c(Br)cccc2N1 Amb26895498 [1,1,0,0,0,0|2,0,0]=4 2070 B13R2.5179 O=C1N=Cc2c(Cl)cccc2N1 Amb24532716 [1,1,0,0,0,0|2,0,0]=4 2071 B13R2.5179 Oc1ccc2c(Br)cccc2c1 Amb17596082 [1,1,0,0,0,0|2,0,0]=4 2072 B13R2.5179 Oc1ccc2c(Cl)cccc2c1 Amb17594575 [1,1,0,0,0,0|2,0,0]=4 2073 B13R2.5179 Oc1ccc2c(Cl)ccnc2c1 Amb15692116 [1,1,0,0,0,0|1,0,0]=3 2074 B13R2.5179 Oc1ccc2c(Cl)ncnc2c1 Amb24073794 [1,1,0,0,0,0|2,0,0]=4 2075 B13R2.5179 Oc1ccc2c(F)cccc2c1 Amb28342977 [1,1,0,0,0,0|2,0,0]=4 2076 B13R2.5179 Oc1ccc2c(F)ccnc2c1 Amb27765950 [1,1,0,0,0,0|1,0,0]=3 2077 B13R2.5179 Oc1ccc2c(I)cccc2c1 Amb25883430 [1,1,0,0,0,0|2,0,0]=4 2078 B13R2.5179 Oc1ccc2c(I)ccnc2c1 Amb28363710 [1,1,0,0,0,0|1,0,0]=3 2079 B13R2.5179 Oc1ccc2c(O)cccc2c1 Amb6357829 [1,1,0,0,0,0|2,0,0]=4 2080 B13R2.5179 Oc1ccc2c(O)ncnc2c1 Amb10569613 [1,1,0,0,0,0|2,0,0]=4 2081 B13R2.5179 Oc1ccnc2cc(Br)ccc12 Amb1994853 [1,1,0,0,0,0|2,0,0]=4 2082 B13R2.5179 Oc1ccnc2cc(Br)cnc12 Amb18658996 [1,1,0,0,0,0|1,0,1]=4 2083 B13R2.5179 Oc1ccnc2cc(Cl)ccc12 Amb24066287 [1,1,0,0,0,0|2,0,0]=4 2084 B13R2.5179 Oc1ccnc2cc(F)ccc12 Amb1994260 [1,1,0,0,0,0|2,0,0]=4 2085 B13R2.5179 Oc1ccnc2cc(F)cnc12 Amb26051246 [1,1,0,0,0,0|1,0,1]=4 2086 B13R2.5179 Oc1cnc2c(Br)cccc2c1 Amb22494958 [1,1,0,0,0,0|1,0,1]=4 2087 B13R2.5179 Oc1cnc2c(Cl)cccc2c1 Amb24183739 [1,1,0,0,0,0|1,0,1]=4 2088 B13R2.5179 Oc1cnc2c(F)cccc2c1 Amb22899408 [1,1,0,0,0,0|1,0,1]=4 2089 B13R2.5179 Oc1cnc2c(O)cccc2c1 Amb27175611 [1,1,0,0,0,0|1,0,1]=4 2090 B13R2.5179 Sc1ccnc2cc(Cl)ccc12 Amb6373385 [1,1,0,0,0,0|2,0,0]=4 2091 B13R2.45 CCC1=Cc2ccccc2C1=O Amb27177754 [0,1,0,0,1,0|2,0,0]=4 2092 B13R2.45 COC1=Nc2ccccc2C1=O Amb28122389 [0,1,0,0,1,0|2,0,0]=4 2093 B13R2.45 Cc1c(C=O)sc2cccnc12 Amb18139838 [0,1,0,0,1,0|2,0,0]=4 2094 B13R2.45 NCC1=Cc2ccccc2C1=O Amb27466253 [0,1,0,0,1,0|2,0,0]=4 2095 B13R2.45 O=C1C(CO)=Cc2ccccc21 Amb27805332 [0,1,0,0,1,0|1,0,0]=3 2096 B13R2.45 O=C1C(NO)=Nc2ncccc21 Amb27193547 [0,1,0,0,1,0|1,0,0]=3 2097 B13R2.45 O=C1\C(=C\O)Nc2ccccc21 Amb27175913 [0,1,0,0,1,0|2,0,0]=4 2098 B13R2.45 O=C1\C(=N/O)Cc2ccccc21 Amb2610323 [0,1,0,0,1,0|1,0,1]=4 2099 B13R2.45 O=C1\C(=N\O)Cc2ccccc21 Amb22348033 [0,1,0,0,1,0|1,0,1]=4 2100 B13R2.45 O=Cc1oc2ccccc2c1O Amb27636087 [0,1,0,0,1,0|2,0,0]=4 2101 B13R2.45 O=Cc1oc2cccnc2c1Br Amb18160777 [0,1,0,0,1,0|2,0,0]=4 2102 B13R2.45 O=Cc1sc2ccccc2c1O Amb4303853 [0,1,0,0,1,0|2,0,0]=4 2103 B13R2.45 O=Cc1sc2cccnc2c1Br Amb18727447 [0,1,0,0,1,0|2,0,0]=4 2104 B13R2.45 O=Cc1sc2cccnc2c1Cl Amb18812040 [0,1,0,0,1,0|2,0,0]=4 2105 B13R2.135 CO[C@H]1C(=O)Nc2ccccc21 Amb28396684 [0,1,0,0,1,0|1,0,1]=4 2106 B13R2.135 N#CC1C(=O)Nc2cccnc21 Amb18645137 [0,1,0,0,1,0|1,0,1]=4 2107 B13R2.135 N\C=C1\C(=O)Nc2ccccc21 Amb27204232 [0,1,0,0,1,0|2,0,0]=4 2108 B13R2.135 N\N=C1/C(=O)Nc2ccccc21 Amb19959966 [0,1,0,0,1,0|2,0,0]=4 2109 B13R2.135 O=C1Cc2ccccc2\C1=C\O Amb28122463 [0,1,0,0,1,0|2,0,0]=4 2110 B13R2.135 O=C1Nc2ccccc2\C1=C/O Amb25917825 [0,1,0,0,1,0|1,0,0]=3 2111 B13R2.135 O=C1Nc2ccccc2\C1=C\O Amb22494713 [0,1,0,0,1,0|1,0,0]=3 2112 B13R2.135 O=C1Nc2ccccc2\C1=N/O Amb2221666 [0,1,0,0,1,0|1,0,0]=3 2113 B13R2.135 O=C1Nc2ccccc2\C1=N\O Amb19959979 [0,1,0,0,1,0|1,0,0]=3 2114 B13R2.135 O=C1Oc2ccccc2\C1=C/O Amb27652914 [0,1,0,0,1,0|2,0,0]=4 2115 B13R2.135 O=C1Oc2cccnc2N1CO Amb28064159 [0,1,0,0,1,0|2,0,0]=4 2116 B13R2.135 O=C1Sc2ccccc2\C1=C/O Amb27270923 [0,1,0,0,1,0|2,0,0]=4 2117 B13R2.135 [N-]=[N+]=C1C(=O)Nc2ccccc21 Amb4016311 [0,1,0,0,1,0|2,0,0]=4 2118 B13R2.359 CC1(C)C(=O)Nc2cccnc21 Amb27153679 [0,1,0,0,1,0|1,0,1]=4 2119 B13R2.359 CC1(O)C(=O)Nc2ccccc21 Amb22059446 [0,1,0,0,1,0|1,0,1]=4 2120 B13R2.359 C[C@@]1(O)C(=O)Nc2ccccc21 Amb27169490 [0,1,0,0,1,0|1,0,1]=4 2121 B13R2.359 C[C@]1(O)C(=O)Nc2ccccc21 Amb27390191 [0,1,0,0,1,0|1,0,1]=4 2122 B13R2.3028 C=C1C(=O)Nc2ccc(C)cc21 Amb25150884 [0,1,0,0,1,0|2,0,0]=4 2123 B13R2.3028 C=C1C(=O)Nc2ccc(Cl)cc21 Amb27785575 [0,1,0,0,1,0|2,0,0]=4 2124 B13R2.3028 C=C1C(=O)Nc2ccc(F)cc21 Amb27769973 [0,1,0,0,1,0|2,0,0]=4 2125 B13R2.3028 CC1=Cc2ccc(Cl)cc2C1=O Amb22753539 [0,1,0,0,1,0|2,0,0]=4 2126 B13R2.3028 Cc1ccc2c(c1)C(=N)C(=O)N2 Amb28243867 [0,1,0,0,1,0|2,0,0]=4 2127 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)N2 Amb6355801 [0,1,0,0,1,0|1,0,1]=4 2128 B13R2.3028 Cc1ccc2c(c1)C(O)C(=O)N2 Amb6705754 [0,1,0,0,1,0|1,0,1]=4 2129 B13R2.3028 Nc1ccc2c(c1)C(=O)C(=O)N2 Amb6298390 [0,1,0,0,1,0|1,0,1]=4 2130 B13R2.3028 O=C1C(Br)=Cc2ccc(Br)cc21 Amb28138101 [0,1,0,0,1,0|2,0,0]=4 2131 B13R2.3028 O=C1C(O)=Nc2ccc(Br)cc21 Amb1351906 [0,1,0,0,1,0|2,0,0]=4 2132 B13R2.3028 O=C1C(O)=Nc2ccc(F)cc21 Amb19860944 [0,1,0,0,1,0|2,0,0]=4 2133 B13R2.3028 O=C1Nc2ccc(Br)cc2C1=O Amb6364736 [0,1,0,0,1,0|1,0,1]=4 2134 B13R2.3028 O=C1Nc2ccc(Br)cc2C1O Amb2734958 [0,1,0,0,1,0|1,0,1]=4 2135 B13R2.3028 O=C1Nc2ccc(Cl)cc2C1=O Amb6335221 [0,1,0,0,1,0|1,0,1]=4 2136 B13R2.3028 O=C1Nc2ccc(Cl)cc2C1O Amb6705763 [0,1,0,0,1,0|1,0,1]=4 2137 B13R2.3028 O=C1Nc2ccc(F)cc2C1=O Amb6315494 [0,1,0,0,1,0|1,0,1]=4 2138 B13R2.3028 O=C1Nc2ccc(F)cc2C1O Amb9748247 [0,1,0,0,1,0|1,0,1]=4 2139 B13R2.3028 O=C1Nc2ccc(I)cc2C1=O Amb1038277 [0,1,0,0,1,0|1,0,1]=4 2140 B13R2.3028 O=C1Nc2ccc(O)cc2C1=O Amb33544078 [0,1,0,0,1,0|1,0,1]=4 2141 B13R2.3028 O=C1Nc2ncc(Br)cc2C1=O Amb22001488 [0,1,0,0,1,0|1,0,1]=4 2142 B13R2.3085 CC1=C(C)c2ccccc2C1=O Amb27177578 [0,1,0,0,1,0|2,0,0]=4 2143 B13R2.3085 CC1=C(N)c2ccccc2C1=O Amb28127184 [0,1,0,0,1,0|2,0,0]=4 2144 B13R2.3085 CN1C(=O)C(=O)c2ccccc21 Amb6335574 [0,1,0,0,1,0|1,0,1]=4 2145 B13R2.3085 CN1C(=O)C(=O)c2cccnc21 Amb24465137 [0,1,0,0,1,0|1,0,1]=4 2146 B13R2.3085 CN1C(=O)C(O)c2ccccc21 Amb2613141 [0,1,0,0,1,0|1,0,1]=4 2147 B13R2.3085 CN1C(=O)N(C)c2ncccc21 Amb21884677 [0,1,0,0,1,0|2,0,0]=4 2148 B13R2.3085 CN1C(=O)[C@@H](O)c2ccccc21 Amb27426901 [0,1,0,0,1,0|1,0,1]=4 2149 B13R2.3085 Cc1c(O)c2ccccc2n1C Amb32732864 [0,1,0,0,1,0|2,0,0]=4 2150 B13R2.3085 N=C1C(=O)c2ccccc2C1=O Amb27176138 [0,1,0,0,1,0|2,0,0]=4 2151 B13R2.3085 O=C1C(=O)N(Cl)c2ccccc21 Amb2720848 [0,1,0,0,1,0|1,0,1]=4 2152 B13R2.3085 O=C1C(=O)N(O)c2ccccc21 Amb27177861 [0,1,0,0,1,0|1,0,1]=4 2153 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,1,0,0,1,0|1,0,1]=4 2154 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,1,0,0,1,0|1,0,1]=4 2155 B13R2.3085 O=C1c2ccccc2C(=O)N1O Amb1351864 [0,1,0,0,1,0|2,0,0]=4 2156 B13R2.3085 O=C1c2cccnc2C(=O)N1Cl Amb27411157 [0,1,0,0,1,0|2,0,0]=4 2157 B13R2.3085 O=C1c2cccnc2C(=O)N1O Amb22001038 [0,1,0,0,1,0|1,0,0]=3 2158 B13R2.3085 O=C1c2cccnc2C(=O)N1O Amb34149531 [0,1,0,0,1,0|1,0,0]=3 2159 B13R2.3085 O=c1n(O)c2ccccc2n1O Amb1042148 [0,1,0,0,1,0|2,0,0]=4 2160 B13R2.4825 CC1=Cc2c(F)cccc2C1=O Amb28202100 [0,1,0,0,1,0|2,0,0]=4 2161 B13R2.4825 Cc1cccc2c1NC(=O)C2=O Amb6315565 [0,1,0,0,1,0|1,0,1]=4 2162 B13R2.4825 Cc1cccc2c1NC(=O)C2O Amb18792463 [0,1,0,0,1,0|1,0,1]=4 2163 B13R2.4825 Nc1cccc2c1NC(=O)C2=O Amb27243910 [0,1,0,0,1,0|1,0,1]=4 2164 B13R2.4825 O=C1Nc2c(Br)cccc2C1=O Amb1103377 [0,1,0,0,1,0|1,0,1]=4 2165 B13R2.4825 O=C1Nc2c(Br)cccc2C1O Amb24706346 [0,1,0,0,1,0|1,0,1]=4 2166 B13R2.4825 O=C1Nc2c(Cl)cccc2C1=O Amb6486658 [0,1,0,0,1,0|1,0,1]=4 2167 B13R2.4825 O=C1Nc2c(Cl)cccc2C1O Amb19045341 [0,1,0,0,1,0|1,0,1]=4 2168 B13R2.4825 O=C1Nc2c(F)cccc2C1=O Amb6549905 [0,1,0,0,1,0|1,0,1]=4 2169 B13R2.4825 O=C1Nc2c(F)cccc2C1O Amb18177845 [0,1,0,0,1,0|1,0,1]=4 2170 B13R2.4825 O=C1Nc2c(F)cccc2N1O Amb27633417 [0,1,0,0,1,0|2,0,0]=4 2171 B13R2.4825 O=C1Nc2c(I)cccc2C1=O Amb33543163 [0,1,0,0,1,0|1,0,1]=4 2172 B13R2.4825 O=C1Nc2c(I)cccc2C1O Amb32677074 [0,1,0,0,1,0|1,0,1]=4 2173 B13R2.4825 O=C1Nc2c(O)cccc2C1=O Amb27590902 [0,1,0,0,1,0|1,0,1]=4 2174 B13R2.4856 C=C1C(=O)Nc2cccc(Cl)c21 Amb27831475 [0,1,0,0,1,0|2,0,0]=4 2175 B13R2.4856 Cc1cccc2c1C(=O)C(=O)N2 Amb4140113 [0,1,0,0,1,0|1,0,1]=4 2176 B13R2.4856 Cc1cccc2c1C(O)C(=O)N2 Amb28434378 [0,1,0,0,1,0|1,0,1]=4 2177 B13R2.4856 Cc1cccc2c1N(O)C(=O)N2 Amb27633432 [0,1,0,0,1,0|2,0,0]=4 2178 B13R2.4856 Nc1cccc2c1C(=O)C(=O)N2 Amb27974583 [0,1,0,0,1,0|1,0,1]=4 2179 B13R2.4856 O=C1Nc2cccc(Br)c2C1=O Amb6374120 [0,1,0,0,1,0|1,0,1]=4 2180 B13R2.4856 O=C1Nc2cccc(Br)c2C1O Amb6705765 [0,1,0,0,1,0|1,0,1]=4 2181 B13R2.4856 O=C1Nc2cccc(Cl)c2C1=O Amb4017458 [0,1,0,0,1,0|1,0,1]=4 2182 B13R2.4856 O=C1Nc2cccc(Cl)c2C1O Amb19045343 [0,1,0,0,1,0|1,0,1]=4 2183 B13R2.4856 O=C1Nc2cccc(F)c2C1=O Amb8397161 [0,1,0,0,1,0|1,0,1]=4 2184 B13R2.4856 O=C1Nc2cccc(I)c2C1=O Amb8629770 [0,1,0,0,1,0|1,0,1]=4 2185 B13R2.4856 O=C1Nc2nccc(Br)c2C1=O Amb23402861 [0,1,0,0,1,0|1,0,1]=4 2186 B13R2.4856 O=C1Nc2nccc(Cl)c2C1=O Amb23402860 [0,1,0,0,1,0|1,0,1]=4 2187 B13R2.4856 O=C1Nc2nccc(F)c2C1=O Amb23402859 [0,1,0,0,1,0|1,0,1]=4 2188 B13R2.5190 CC1=C2C=CC(=O)C=C2NC1=O Amb27832009 [0,1,0,0,1,0|2,0,0]=4 2189 B13R2.5190 CC1=Cc2cc(O)ccc2C1=O Amb27177971 [0,1,0,0,1,0|2,0,0]=4 2190 B13R2.5190 CN1C(=O)Nc2cc(Cl)cnc21 Amb20661826 [0,1,0,0,1,0|2,0,0]=4 2191 B13R2.5190 Cc1ccc2c(c1)NC(=O)C2=O Amb1887200 [0,1,0,0,1,0|1,0,1]=4 2192 B13R2.5190 O=C1Nc2cc(Br)ccc2C1=O Amb6374119 [0,1,0,0,1,0|1,0,1]=4 2193 B13R2.5190 O=C1Nc2cc(Br)ccc2C1O Amb6705762 [0,1,0,0,1,0|1,0,1]=4 2194 B13R2.5190 O=C1Nc2cc(Cl)ccc2C1=O Amb2786130 [0,1,0,0,1,0|1,0,1]=4 2195 B13R2.5190 O=C1Nc2cc(Cl)ccc2C1=S Amb28074077 [0,1,0,0,1,0|1,1,0]=4 2196 B13R2.5190 O=C1Nc2cc(F)ccc2C1=O Amb1155086 [0,1,0,0,1,0|1,0,1]=4 2197 B13R2.5190 O=C1Nc2cc(F)ccc2C1O Amb9748287 [0,1,0,0,1,0|1,0,1]=4 2198 B13R2.5190 O=C1Nc2cc(I)ccc2C1=O Amb8629769 [0,1,0,0,1,0|1,0,1]=4 2199 B13R2.5190 O=C1Nc2cc(O)ccc2C1=O Amb6306510 [0,1,0,0,1,0|1,0,1]=4 2200 B13R2.599 COC1=CC2=CC=NC2=CC1=O Amb28144218 [0,1,0,0,1,0|2,0,0]=4 2201 B13R2.599 COC1=Cn2nccc2NC1=O Amb24525698 [0,1,0,0,1,0|1,0,0]=3 2202 B13R2.599 COC1=Cn2ncnc2NC1=O Amb25051830 [0,1,0,0,1,0|2,0,0]=4 2203 B13R2.599 N#CC1=Cc2sccc2NC1=O Amb18647966 [0,1,0,0,1,0|2,0,0]=4 2204 B13R2.599 O=CC1=CC2=NC=CC2=NC1=O Amb27752357 [0,1,0,0,1,0|0,0,2]=4 2205 B13R2.599 O=Cc1cc2ccsc2cc1O Amb18824897 [0,1,0,0,1,0|2,0,0]=4 2206 B13R2.4899 CC1=C(C)n2nccc2NC1=O Amb27416569 [0,1,0,0,1,0|2,0,0]=4 2207 B13R2.4899 CC1=C(N)n2nccc2NC1=O Amb33357729 [0,1,0,0,1,0|2,0,0]=4 2208 B13R2.4899 CC1=C(O)C(=O)C=C2C=CN=C21 Amb27262871 [0,1,0,0,1,0|1,0,0]=3 2209 B13R2.4899 CC1=C(O)c2sccc2NC1=O Amb24470831 [0,1,0,0,1,0|2,0,0]=4 2210 B13R2.4899 O=C1Nc2ccnn2C(O)=C1F Amb33345854 [0,1,0,0,1,0|2,0,0]=4 2211 B13R2.4899 O=C1Nc2scnc2C(=O)N1O Amb27828550 [0,1,0,0,1,0|2,0,0]=4 2212 B13R2.11634 Cc1noc2c1C=C(O)C(=O)N2 Amb27411869 [0,1,0,0,1,0|2,0,0]=4 2213 B13R2.11634 Cc1noc2c1NC(=O)C(O)=C2 Amb27646588 [0,1,0,0,1,0|2,0,0]=4 2214 B13R2.11634 Cc1onc2c1C=C(O)C(=O)N2 Amb27770135 [0,1,0,0,1,0|2,0,0]=4 2215 B13R2.11634 Cn1ncc2c1NC(=O)C(O)=C2 Amb27873488 [0,1,0,0,1,0|2,0,0]=4 2216 B13R2.13083 Cc1cc2c(o1)C=C(O)C(=O)N2 Amb28366674 [0,1,0,0,1,0|1,0,0]=3 2217 B13R2.13083 Cc1cc2c(s1)C=C(O)C(=O)N2 Amb28208444 [0,1,0,0,1,0|1,0,0]=3 2218 B13R2.13083 Cc1nc2c(o1)NC(=O)C(O)=C2 Amb27646582 [0,1,0,0,1,0|1,0,0]=3 2219 B15R2.2114 COC1CNc2ncccc2NC1=O Amb27601123 [0,1,0,0,0,1|0,0,2]=4 2220 B15R2.2114 N#CC1=CNc2ccccc2NC1=O Amb17750302 [0,1,0,0,0,1|2,0,0]=4 2221 B15R2.117 COc1cc2ccccc2cc1C=O Amb18649283 [0,2,0,0,0,0|2,0,0]=4 2222 B15R2.117 COc1cc2ccccc2nc1C=O Amb27388258 [0,2,0,0,0,0|1,0,1]=4 2223 B15R2.117 COc1cc2cccnc2cc1OC Amb19108431 [0,2,0,0,0,0|1,0,1]=4 2224 B15R2.274 CC1=C(C#N)C(=O)Nc2ccccc21 Amb18648878 [0,2,0,0,0,0|2,0,0]=4 2225 B15R2.274 CC1=C(CN)C(=O)Nc2ccccc21 Amb23571584 [0,2,0,0,0,0|2,0,0]=4 2226 B15R2.274 CCC1=C(N)c2ccccc2NC1=O Amb18649966 [0,2,0,0,0,0|2,0,0]=4 2227 B15R2.274 CCC1=C(O)c2ccccc2NC1=O Amb19667948 [0,2,0,0,0,0|2,0,0]=4 2228 B15R2.274 COC1=C(C)c2cccnc2NC1=O Amb27403561 [0,2,0,0,0,0|2,0,0]=4 2229 B15R2.274 COC1=C(O)c2ccccc2OC1=O Amb22753606 [0,2,0,0,0,0|2,0,0]=4 2230 B15R2.274 CON1C(=O)Nc2ccccc2C1=O Amb28183753 [0,2,0,0,0,0|2,0,0]=4 2231 B15R2.274 N#CC1=C(Cl)c2ccccc2NC1=O Amb19894803 [0,2,0,0,0,0|2,0,0]=4 2232 B15R2.274 N#CC1=C(N)c2ccccc2NC1=O Amb18548454 [0,2,0,0,0,0|2,0,0]=4 2233 B15R2.274 N#CC1=C(O)c2ccccc2NC1=O Amb19665378 [0,2,0,0,0,0|2,0,0]=4 2234 B15R2.274 O=C1Nc2ccccc2C(=O)\C1=N\O Amb22520701 [0,2,0,0,0,0|1,0,0]=3 2235 B15R2.274 O=C1Oc2ccccc2C(=O)\C1=C/O Amb27658450 [0,2,0,0,0,0|2,0,0]=4 2236 B15R2.274 O=NC1=C(O)c2ccccc2NC1=O Amb27403552 [0,2,0,0,0,0|1,0,1]=4 2237 B15R2.274 [N-]=[N+]=C1C(=O)Nc2ccccc2C1=O Amb27640952 [0,2,0,0,0,0|2,0,0]=4 2238 B15R2.888 CCCC1=Cc2ccccc2NC1=O Amb28058881 [0,2,0,0,0,0|2,0,0]=4 2239 B15R2.888 CCOC1=Nc2ccccc2NC1=O Amb19651674 [0,2,0,0,0,0|2,0,0]=4 2240 B15R2.888 CNCC1=Cc2ccccc2NC1=O Amb18563363 [0,2,0,0,0,0|2,0,0]=4 2241 B15R2.888 CSCC1=Cc2ccccc2NC1=O Amb27145551 [0,2,0,0,0,0|1,1,0]=4 2242 B15R2.888 N#CCC1=Cc2ccccc2NC1=O Amb18528574 [0,2,0,0,0,0|2,0,0]=4 2243 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18010538 [0,2,0,0,0,0|2,0,0]=4 2244 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18909682 [0,2,0,0,0,0|2,0,0]=4 2245 B15R2.888 O=C1N=c2ccccc2=C\C1=C\NO Amb22270131 [0,2,0,0,0,0|1,0,1]=4 2246 B15R2.888 O=C1Nc2ccccc2C=C1CCCl Amb22723323 [0,2,0,0,0,0|2,0,0]=4 2247 B15R2.888 O=C1Nc2ccccc2C=C1\C=N\O Amb19372570 [0,2,0,0,0,0|1,0,0]=3 2248 B15R2.888 O=C1Nc2ccccc2N=C1CCO Amb20245615 [0,2,0,0,0,0|2,0,0]=4 2249 B15R2.984 CC(=O)c1cc2ccccc2cc1O Amb18129613 [0,2,0,0,0,0|2,0,0]=4 2250 B15R2.984 CC(N)c1cc2cccnc2cc1O Amb27873423 [0,2,0,0,0,0|2,0,0]=4 2251 B15R2.984 CC(O)C1=Cc2ccccc2NC1=O Amb18015645 [0,2,0,0,0,0|1,0,0]=3 2252 B15R2.984 C[C@H](N)c1cc2cccnc2cc1O Amb27263406 [0,2,0,0,0,0|2,0,0]=4 2253 B15R2.984 Cc1cc2ncccc2cc1[N+](=O)[O-] Amb4034952 [0,2,0,0,0,0|2,0,0]=4 2254 B15R2.984 NC(=O)c1cc2ccccc2cc1O Amb3941049 [0,2,0,0,0,0|2,0,0]=4 2255 B15R2.984 NC(=O)c1cc2cccnc2nc1O Amb18650091 [0,2,0,0,0,0|2,0,0]=4 2256 B15R2.984 Nc1cc2ncccc2cc1[N+](=O)[O-] Amb27967098 [0,2,0,0,0,0|2,0,0]=4 2257 B15R2.984 O=C(Cl)C1=Cc2ccccc2NC1=O Amb26332443 [0,2,0,0,0,0|1,0,1]=4 2258 B15R2.984 O=C(Cl)c1cc2ccccc2cc1O Amb17595532 [0,2,0,0,0,0|2,0,0]=4 2259 B15R2.984 O=C(Cl)c1cc2cccnc2cc1O Amb25364028 [0,2,0,0,0,0|1,0,0]=3 2260 B15R2.984 O=C(Cl)c1nc2ccccc2cc1O Amb27808978 [0,2,0,0,0,0|1,0,1]=4 2261 B15R2.984 O=C(O)C1=Cc2ccccc2NC1=O Amb17933901 [0,2,0,0,0,0|1,0,0]=3 2262 B15R2.984 O=C(O)C1=Cc2ccccc2OC1=O Amb17988932 [0,2,0,0,0,0|2,0,0]=4 2263 B15R2.984 O=C(O)C1=Cc2cccnc2NC1=O Amb18023998 [0,2,0,0,0,0|2,0,0]=4 2264 B15R2.984 O=C(O)C1=Cc2ccncc2NC1=O Amb27403180 [0,2,0,0,0,0|2,0,0]=4 2265 B15R2.984 O=C(O)C1=Cc2cnccc2NC1=O Amb23440666 [0,2,0,0,0,0|2,0,0]=4 2266 B15R2.984 O=C(O)C1=Nc2ccccc2NC1=O Amb19957530 [0,2,0,0,0,0|2,0,0]=4 2267 B15R2.984 O=C(O)C1=Nc2ncccc2NC1=O Amb24330707 [0,2,0,0,0,0|1,0,0]=3 2268 B15R2.984 O=C(O)c1cc2ccccc2cc1O Amb2714487 [0,2,0,0,0,0|2,0,0]=4 2269 B15R2.984 O=C(O)c1cc2cccnc2cc1Cl Amb27412424 [0,2,0,0,0,0|2,0,0]=4 2270 B15R2.984 O=C(O)c1cc2cccnc2cc1F Amb27614309 [0,2,0,0,0,0|2,0,0]=4 2271 B15R2.984 O=C(O)c1cc2ncccc2cc1Cl Amb35748157 [0,2,0,0,0,0|2,0,0]=4 2272 B15R2.984 O=C(O)c1cc2ncccc2cc1Cl Amb35748184 [0,2,0,0,0,0|2,0,0]=4 2273 B15R2.984 O=C(O)c1cc2ncccc2cc1O Amb23448900 [0,2,0,0,0,0|1,0,1]=4 2274 B15R2.984 O=C([O-])c1cc2ccccc2cc1O Amb22547753 [0,2,0,0,0,0|2,0,0]=4 2275 B15R2.984 O=C1Nc2ccccc2C=C1B(O)O Amb22372294 [0,2,0,0,0,0|1,0,0]=3 2276 B15R2.984 O=C1Nc2cccnc2C=C1[N+](=O)[O-] Amb22235422 [0,2,0,0,0,0|0,0,1]=3 2277 B15R2.984 O=[N+]([O-])c1cc2ccccc2cc1O Amb28239713 [0,2,0,0,0,0|2,0,0]=4 2278 B15R2.984 O=[N+]([O-])c1cc2cccnc2cc1Br Amb27392083 [0,2,0,0,0,0|2,0,0]=4 2279 B15R2.984 O=[N+]([O-])c1cc2cccnc2cc1Cl Amb24682604 [0,2,0,0,0,0|2,0,0]=4 2280 B15R2.984 O=[N+]([O-])c1cc2cccnc2cc1O Amb27475621 [0,2,0,0,0,0|1,0,0]=3 2281 B15R2.984 O=[N+]([O-])c1cc2cccnc2nc1O Amb21963400 [0,2,0,0,0,0|2,0,0]=4 2282 B15R2.984 O=[N+]([O-])c1nc2ccccc2cc1O Amb9767543 [0,2,0,0,0,0|1,0,1]=4 2283 B15R2.984 OB(O)c1cc2cccnc2cc1O Amb27476141 [0,2,0,0,0,0|1,0,1]=4 2284 B15R2.984 Oc1cc2ncccc2cc1C(F)F Amb27983511 [0,2,0,0,0,0|2,0,0]=4 2285 B15R2.1754 COC1=Cc2ccc(O)cc2OC1=O Amb18651005 [0,2,0,0,0,0|2,0,0]=4 2286 B15R2.1754 COC1=Cc2cnc(Cl)cc2NC1=O Amb27450829 [0,2,0,0,0,0|2,0,0]=4 2287 B15R2.1754 Cc1ccc2c(c1)NC(=O)C(C#N)=C2 Amb18527855 [0,2,0,0,0,0|2,0,0]=4 2288 B15R2.1754 Cc1ccc2c(c1)NC(=O)C(C=O)=C2 Amb18014584 [0,2,0,0,0,0|1,0,1]=4 2289 B15R2.1754 Cc1ccc2c(c1)NC(=O)C(CCl)=C2 Amb18015273 [0,2,0,0,0,0|2,0,0]=4 2290 B15R2.1754 Cc1ccc2c(c1)NC(=O)C(CN)=C2 Amb18015330 [0,2,0,0,0,0|2,0,0]=4 2291 B15R2.1754 Cc1ccc2c(c1)NC(=O)C(CO)=C2 Amb18015651 [0,2,0,0,0,0|1,0,0]=3 2292 B15R2.1754 N#CC1=Cc2ccc(Br)cc2NC1=O Amb18527868 [0,2,0,0,0,0|2,0,0]=4 2293 B15R2.1754 N#CC1=Cc2ccc(Cl)cc2NC1=O Amb18527862 [0,2,0,0,0,0|2,0,0]=4 2294 B15R2.1754 N#CC1=Cc2ccc(F)cc2NC1=O Amb18014603 [0,2,0,0,0,0|2,0,0]=4 2295 B15R2.1754 NCC1=Cc2ccc(Br)cc2NC1=O Amb18528499 [0,2,0,0,0,0|2,0,0]=4 2296 B15R2.1754 NCC1=Cc2ccc(Cl)cc2NC1=O Amb18015334 [0,2,0,0,0,0|2,0,0]=4 2297 B15R2.1754 NCC1=Cc2ccc(F)cc2NC1=O Amb18528495 [0,2,0,0,0,0|2,0,0]=4 2298 B15R2.1754 NCC1=Cc2ccc(F)cc2NC1=O Amb22586863 [0,2,0,0,0,0|2,0,0]=4 2299 B15R2.1754 Nc1ccc2c(c1)NC(=O)C(C=O)=C2 Amb27847511 [0,2,0,0,0,0|1,0,1]=4 2300 B15R2.1754 Nc1ccc2c(c1)NC(=O)C(CBr)=C2 Amb27419556 [0,2,0,0,0,0|2,0,0]=4 2301 B15R2.1754 O=C1Nc2cc(Br)ccc2C=C1CBr Amb27419667 [0,2,0,0,0,0|2,0,0]=4 2302 B15R2.1754 O=C1Nc2cc(Br)ccc2C=C1CCl Amb18528567 [0,2,0,0,0,0|2,0,0]=4 2303 B15R2.1754 O=C1Nc2cc(Br)ccc2C=C1CO Amb18528802 [0,2,0,0,0,0|1,0,0]=3 2304 B15R2.1754 O=C1Nc2cc(Cl)ccc2C=C1CBr Amb27181987 [0,2,0,0,0,0|2,0,0]=4 2305 B15R2.1754 O=C1Nc2cc(Cl)ccc2C=C1CCl Amb18528560 [0,2,0,0,0,0|2,0,0]=4 2306 B15R2.1754 O=C1Nc2cc(Cl)ccc2C=C1CO Amb18015646 [0,2,0,0,0,0|1,0,0]=3 2307 B15R2.1754 O=C1Nc2cc(F)ccc2C=C1CBr Amb27463264 [0,2,0,0,0,0|2,0,0]=4 2308 B15R2.1754 O=C1Nc2cc(F)ccc2C=C1CCl Amb18015369 [0,2,0,0,0,0|2,0,0]=4 2309 B15R2.1754 O=C1Nc2cc(F)ccc2C=C1CO Amb18528800 [0,2,0,0,0,0|1,0,0]=3 2310 B15R2.1754 O=C1Oc2cc(O)ccc2C=C1CO Amb28365183 [0,2,0,0,0,0|2,0,0]=4 2311 B15R2.1754 O=CC1=Cc2ccc(Br)cc2NC1=O Amb18527825 [0,2,0,0,0,0|1,0,1]=4 2312 B15R2.1754 O=CC1=Cc2ccc(Cl)cc2NC1=O Amb18014594 [0,2,0,0,0,0|1,0,1]=4 2313 B15R2.1754 O=CC1=Cc2ccc(F)cc2NC1=O Amb18014591 [0,2,0,0,0,0|1,0,1]=4 2314 B15R2.1754 O=Cc1cc2ccc(O)cc2cc1O Amb27973038 [0,2,0,0,0,0|2,0,0]=4 2315 B15R2.1824 C=CC1=Cc2cc(Cl)ccc2NC1=O Amb27173684 [0,2,0,0,0,0|2,0,0]=4 2316 B15R2.1824 COC1=Cc2cc(Br)ccc2NC1=O Amb25106004 [0,2,0,0,0,0|1,0,0]=3 2317 B15R2.1824 COC1=Cc2cc(Br)cnc2NC1=O Amb28385051 [0,2,0,0,0,0|2,0,0]=4 2318 B15R2.1824 COC1=Cc2cc(C)ccc2NC1=O Amb28125664 [0,2,0,0,0,0|1,0,0]=3 2319 B15R2.1824 COC1=Nc2cc(Cl)ccc2NC1=O Amb27957661 [0,2,0,0,0,0|2,0,0]=4 2320 B15R2.1824 COc1cc2nc(C)ccc2cc1O Amb27189455 [0,2,0,0,0,0|1,0,1]=4 2321 B15R2.1824 COc1cc2nc(Cl)ccc2cc1Cl Amb28191185 [0,2,0,0,0,0|2,0,0]=4 2322 B15R2.1824 Cc1ccc2c(c1)C=C(C#N)C(=O)N2 Amb18527831 [0,2,0,0,0,0|2,0,0]=4 2323 B15R2.1824 Cc1ccc2c(c1)C=C(C=O)C(=O)N2 Amb18014585 [0,2,0,0,0,0|1,0,1]=4 2324 B15R2.1824 Cc1ccc2c(c1)C=C(CCl)C(=O)N2 Amb18528428 [0,2,0,0,0,0|2,0,0]=4 2325 B15R2.1824 Cc1ccc2c(c1)C=C(CN)C(=O)N2 Amb18015331 [0,2,0,0,0,0|2,0,0]=4 2326 B15R2.1824 Cc1ccc2c(c1)C=C(CN)C(=O)N2 Amb18909677 [0,2,0,0,0,0|2,0,0]=4 2327 B15R2.1824 Cc1ccc2c(c1)C=C(CO)C(=O)N2 Amb18015682 [0,2,0,0,0,0|1,0,0]=3 2328 B15R2.1824 N#CC1=Cc2cc(Br)ccc2NC1=O Amb18527869 [0,2,0,0,0,0|2,0,0]=4 2329 B15R2.1824 N#CC1=Cc2cc(Cl)ccc2NC1=O Amb18527863 [0,2,0,0,0,0|2,0,0]=4 2330 B15R2.1824 N#CC1=Cc2cc(F)ccc2NC1=O Amb18527860 [0,2,0,0,0,0|2,0,0]=4 2331 B15R2.1824 NCC1=Cc2cc(Br)ccc2NC1=O Amb18528500 [0,2,0,0,0,0|2,0,0]=4 2332 B15R2.1824 NCC1=Cc2cc(Cl)ccc2NC1=O Amb18015335 [0,2,0,0,0,0|2,0,0]=4 2333 B15R2.1824 NCC1=Cc2cc(F)ccc2NC1=O Amb18528496 [0,2,0,0,0,0|2,0,0]=4 2334 B15R2.1824 O=C1Nc2ccc(Br)cc2C=C1CBr Amb27419634 [0,2,0,0,0,0|2,0,0]=4 2335 B15R2.1824 O=C1Nc2ccc(Br)cc2C=C1CCl Amb18528568 [0,2,0,0,0,0|2,0,0]=4 2336 B15R2.1824 O=C1Nc2ccc(Br)cc2C=C1CO Amb18528803 [0,2,0,0,0,0|1,0,0]=3 2337 B15R2.1824 O=C1Nc2ccc(Cl)cc2C=C1CCl Amb18363950 [0,2,0,0,0,0|2,0,0]=4 2338 B15R2.1824 O=C1Nc2ccc(Cl)cc2C=C1CO Amb18015647 [0,2,0,0,0,0|1,0,0]=3 2339 B15R2.1824 O=C1Nc2ccc(F)cc2C=C1CCl Amb18015374 [0,2,0,0,0,0|2,0,0]=4 2340 B15R2.1824 O=C1Nc2ccc(F)cc2C=C1CO Amb18528763 [0,2,0,0,0,0|1,0,0]=3 2341 B15R2.1824 O=CC1=Cc2cc(Br)ccc2NC1=O Amb18372852 [0,2,0,0,0,0|1,0,1]=4 2342 B15R2.1824 O=CC1=Cc2cc(Cl)ccc2NC1=O Amb18014595 [0,2,0,0,0,0|1,0,1]=4 2343 B15R2.1824 O=CC1=Cc2cc(F)ccc2NC1=O Amb18014592 [0,2,0,0,0,0|1,0,1]=4 2344 B15R2.2039 COC1=Cc2cccc(Br)c2NC1=O Amb24507901 [0,2,0,0,0,0|1,0,0]=3 2345 B15R2.2039 COC1=Nc2cccc(C)c2NC1=O Amb27957659 [0,2,0,0,0,0|2,0,0]=4 2346 B15R2.2039 COc1cc2nccc(Cl)c2cc1Br Amb24183505 [0,2,0,0,0,0|2,0,0]=4 2347 B15R2.2039 COc1cc2nccc(Cl)c2cc1Br Amb32663976 [0,2,0,0,0,0|2,0,0]=4 2348 B15R2.2039 Cc1cccc2c1NC(=O)C(C#N)=C2 Amb18527854 [0,2,0,0,0,0|2,0,0]=4 2349 B15R2.2039 Cc1cccc2c1NC(=O)C(C=O)=C2 Amb18014583 [0,2,0,0,0,0|1,0,1]=4 2350 B15R2.2039 Cc1cccc2c1NC(=O)C(CCl)=C2 Amb18015385 [0,2,0,0,0,0|2,0,0]=4 2351 B15R2.2039 Cc1cccc2c1NC(=O)C(CN)=C2 Amb18015329 [0,2,0,0,0,0|2,0,0]=4 2352 B15R2.2039 Cc1cccc2c1NC(=O)C(CO)=C2 Amb18015689 [0,2,0,0,0,0|1,0,0]=3 2353 B15R2.2039 N#CC1=Cc2cccc(Br)c2NC1=O Amb18527867 [0,2,0,0,0,0|2,0,0]=4 2354 B15R2.2039 N#CC1=Cc2cccc(Cl)c2NC1=O Amb18527861 [0,2,0,0,0,0|2,0,0]=4 2355 B15R2.2039 N#CC1=Cc2cccc(F)c2NC1=O Amb18527859 [0,2,0,0,0,0|2,0,0]=4 2356 B15R2.2039 NCC1=Cc2cccc(Br)c2NC1=O Amb18528498 [0,2,0,0,0,0|2,0,0]=4 2357 B15R2.2039 NCC1=Cc2cccc(Cl)c2NC1=O Amb18015333 [0,2,0,0,0,0|2,0,0]=4 2358 B15R2.2039 NCC1=Cc2cccc(F)c2NC1=O Amb18528494 [0,2,0,0,0,0|2,0,0]=4 2359 B15R2.2039 O=C1Nc2c(Br)cccc2C=C1CCl Amb18528566 [0,2,0,0,0,0|2,0,0]=4 2360 B15R2.2039 O=C1Nc2c(Cl)cccc2C=C1CCl Amb18015379 [0,2,0,0,0,0|2,0,0]=4 2361 B15R2.2039 O=C1Nc2c(F)cccc2C=C1CCl Amb18015350 [0,2,0,0,0,0|2,0,0]=4 2362 B15R2.2039 O=CC1=Cc2cccc(Br)c2NC1=O Amb18527824 [0,2,0,0,0,0|1,0,1]=4 2363 B15R2.2039 O=CC1=Cc2cccc(Cl)c2NC1=O Amb18014593 [0,2,0,0,0,0|1,0,1]=4 2364 B15R2.2039 O=CC1=Cc2cccc(F)c2NC1=O Amb18014590 [0,2,0,0,0,0|1,0,1]=4 2365 B15R2.2393 COC1=Cc2c(Br)cccc2NC1=O Amb25832776 [0,2,0,0,0,0|1,0,0]=3 2366 B15R2.2393 COC1=Cc2c(F)cccc2NC1=O Amb28409797 [0,2,0,0,0,0|1,0,0]=3 2367 B15R2.2393 COC1=Cc2c(ccnc2Cl)NC1=O Amb27223972 [0,2,0,0,0,0|2,0,0]=4 2368 B15R2.2393 COc1cc2c(Cl)ccnc2cc1O Amb19957962 [0,2,0,0,0,0|1,0,1]=4 2369 B15R2.2393 N#CC1=Cc2c(F)cccc2NC1=O Amb28422422 [0,2,0,0,0,0|2,0,0]=4 2370 B15R2.21243 CCC1=Cc2ccccc2N(C)C1=O Amb25814513 [0,2,0,0,0,0|2,0,0]=4 2371 B15R2.21243 CN1C(=O)C(C#N)=Cc2ccccc21 Amb18528835 [0,2,0,0,0,0|2,0,0]=4 2372 B15R2.21243 CN1C(=O)C(C=O)=Cc2ccccc21 Amb18526958 [0,2,0,0,0,0|1,0,1]=4 2373 B15R2.21243 CN1C(=O)C(CCl)=Cc2ccccc21 Amb19516787 [0,2,0,0,0,0|2,0,0]=4 2374 B15R2.21243 CN1C(=O)C(CN)=Cc2ccccc21 Amb18280924 [0,2,0,0,0,0|2,0,0]=4 2375 B15R2.21243 CN1C(=O)C(CN)=Cc2ccccc21 Amb33552698 [0,2,0,0,0,0|2,0,0]=4 2376 B15R2.21243 CN1C(=O)C(CO)=Cc2ccccc21 Amb18006219 [0,2,0,0,0,0|1,0,0]=3 2377 B15R2.21243 CNC1=Cc2ccccc2N(C)C1=O Amb27170409 [0,2,0,0,0,0|2,0,0]=4 2378 B15R2.21243 COC1=Cc2ccccc2C(=O)C1=O Amb24744460 [0,2,0,0,0,0|2,0,0]=4 2379 B15R2.21243 CSC1=Cc2ccccc2N(C)C1=O Amb28206292 [0,2,0,0,0,0|1,1,0]=4 2380 B15R2.21243 Cn1c(=O)c(CCl)cc2ccccc21 Amb1102201 [0,2,0,0,0,0|2,0,0]=4 2381 B15R2.21243 O=Cc1cc2ccccc2c(Br)c1O Amb18667009 [0,2,0,0,0,0|2,0,0]=4 2382 B15R2.1007 CC1=C(F)C(=O)Nc2ccc(Cl)cc21 Amb27387675 [0,2,0,0,0,0|2,0,0]=4 2383 B15R2.1007 CC1=C(O)C(=O)Oc2ccc(O)cc21 Amb28321842 [0,2,0,0,0,0|2,0,0]=4 2384 B15R2.1007 CC1=C(O)c2cc(F)ccc2NC1=O Amb24592612 [0,2,0,0,0,0|2,0,0]=4 2385 B15R2.1007 CN1C(=O)C(=O)Nc2ccc(Cl)nc21 Amb32428226 [0,2,0,0,0,0|1,0,1]=4 2386 B15R2.1007 Cc1ccc2c(c1)C(O)=C(Br)C(=O)N2 Amb23533634 [0,2,0,0,0,0|2,0,0]=4 2387 B15R2.1007 O=C1Nc2ccc(F)cc2C(F)=C1O Amb27403508 [0,2,0,0,0,0|1,0,0]=3 2388 B15R2.1007 O=C1Oc2ccc(Cl)cc2C(O)=C1O Amb25071163 [0,2,0,0,0,0|2,0,0]=4 2389 B15R2.6237 CCC1=C(O)C(=O)Nc2ccccc21 Amb27182442 [0,2,0,0,0,0|1,0,0]=3 2390 B15R2.6237 CCN1C(=O)C(Cl)=Nc2ncccc21 Amb23557994 [0,2,0,0,0,0|2,0,0]=4 2391 B15R2.6237 CCN1C(=O)C(N)=Cc2ccccc21 Amb22372129 [0,2,0,0,0,0|2,0,0]=4 2392 B15R2.6237 CCN1C(=O)C(O)=Cc2ccccc21 Amb27491616 [0,2,0,0,0,0|1,0,0]=3 2393 B15R2.6237 CCN1C(=O)C(O)=Nc2ccccc21 Amb19651675 [0,2,0,0,0,0|2,0,0]=4 2394 B15R2.6237 CCN1C(=O)C(O)=Nc2ncccc21 Amb23557990 [0,2,0,0,0,0|1,0,0]=3 2395 B15R2.6237 COC1=C(O)C(=O)Oc2ccccc21 Amb22753605 [0,2,0,0,0,0|2,0,0]=4 2396 B15R2.6237 CON1C(=O)C(N)=Cc2ccccc21 Amb27870418 [0,2,0,0,0,0|2,0,0]=4 2397 B15R2.9032 CC1=C(N)C(=O)N(C)c2ccccc21 Amb23448332 [0,2,0,0,0,0|2,0,0]=4 2398 B15R2.9032 CC1=C(O)C(=O)N(C)c2ccccc21 Amb22751148 [0,2,0,0,0,0|1,0,0]=3 2399 B15R2.9032 CC1=C(O)C(=O)c2ccccc2N1C Amb20242314 [0,2,0,0,0,0|2,0,0]=4 2400 B15R2.9032 CC1=C(O)c2ccccc2N(C)C1=O Amb19668039 [0,2,0,0,0,0|2,0,0]=4 2401 B15R2.9032 CN1C(=O)C(=O)N(C)c2ncccc21 Amb20249396 [0,2,0,0,0,0|1,0,1]=4 2402 B15R2.9032 CN1C(=O)C(Br)=C(Cl)c2ccccc21 Amb32456024 [0,2,0,0,0,0|2,0,0]=4 2403 B15R2.9032 CN1C(=O)C(Br)=C(O)c2ccccc21 Amb20660833 [0,2,0,0,0,0|2,0,0]=4 2404 B15R2.9032 CN1C(=O)C(Cl)=C(O)c2ccccc21 Amb19520628 [0,2,0,0,0,0|2,0,0]=4 2405 B15R2.9032 CN1C(=O)C(I)=C(Cl)c2ccccc21 Amb23509158 [0,2,0,0,0,0|2,0,0]=4 2406 B15R2.9032 CN1C(=O)C(N)=C(O)c2ccccc21 Amb21927455 [0,2,0,0,0,0|2,0,0]=4 2407 B15R2.9032 CN1C(=O)C(O)=C(O)c2ccccc21 Amb21912831 [0,2,0,0,0,0|1,0,0]=3 2408 B15R2.9032 O=C1C(=O)c2cccnc2C(Cl)=C1Cl Amb27649152 [0,2,0,0,0,0|2,0,0]=4 2409 B15R2.9032 Oc1c(F)c(F)c2cccnc2c1F Amb28074690 [0,2,0,0,0,0|2,0,0]=4 2410 B15R2.13612 CC1=C(O)c2cccc(Br)c2NC1=O Amb25060386 [0,2,0,0,0,0|2,0,0]=4 2411 B15R2.13612 CC1=C(O)c2cccc(Cl)c2NC1=O Amb26866024 [0,2,0,0,0,0|2,0,0]=4 2412 B15R2.13612 O=C1Nc2c(F)cccc2C(F)=C1O Amb27950144 [0,2,0,0,0,0|1,0,0]=3 2413 B15R2.13612 O=C1Nc2c(F)cccc2C(O)=C1Br Amb25979715 [0,2,0,0,0,0|2,0,0]=4 2414 B15R2.13612 O=C1Nc2c(F)ccnc2C(F)=C1O Amb27237651 [0,2,0,0,0,0|0,0,0]=2 2415 B15R2.13612 O=C1Oc2c(O)cccc2C(O)=C1O Amb19886340 [0,2,0,0,0,0|2,0,0]=4 2416 B15R2.61372 CC1=C(C)c2c(O)cccc2NC1=O Amb27755062 [0,2,0,0,0,0|2,0,0]=4 2417 B15R2.61372 CN1C(=O)C(F)=Cc2cccc(F)c21 Amb22547155 [0,2,0,0,0,0|2,0,0]=4 2418 B15R2.61372 Cc1cccc2c1C(F)=C(O)C(=O)N2 Amb28434675 [0,2,0,0,0,0|1,0,0]=3 2419 B15R2.63893 CC1=C(O)C(=O)Oc2cc(N)ccc21 Amb28398149 [0,2,0,0,0,0|2,0,0]=4 2420 B15R2.63893 CC1=C(O)C(=O)Oc2cc(O)ccc21 Amb28202029 [0,2,0,0,0,0|2,0,0]=4 2421 B15R2.63893 CC1=Cc2cc(N)ccc2N(C)C1=O Amb22901108 [0,2,0,0,0,0|2,0,0]=4 2422 B15R2.63893 CN1C(=O)C(O)=Nc2cc(N)ccc21 Amb19882074 [0,2,0,0,0,0|2,0,0]=4 2423 B15R2.63893 CN1C(=O)C(O)=Nc2cc(N)ccc21 Amb21894572 [0,2,0,0,0,0|2,0,0]=4 2424 B15R2.63893 NC1=C(O)c2ccc(Cl)cc2NC1=O Amb28068797 [0,2,0,0,0,0|2,0,0]=4 2425 B15R2.63893 O=C1Nc2cc(F)ccc2C(F)=C1O Amb28251152 [0,2,0,0,0,0|1,0,0]=3 2426 B15R2.13981 O=C1Nc2c(ccc(Cl)c2Cl)C=C1Br Amb23509995 [0,2,0,0,0,0|2,0,0]=4 2427 B15R2.13981 O=C1Nc2ccc(Cl)c(F)c2C=C1O Amb27588076 [0,2,0,0,0,0|1,0,0]=3 2428 B15R2.13981 O=C1Nc2ccc(F)c(Cl)c2C=C1O Amb28345610 [0,2,0,0,0,0|1,0,0]=3 2429 B15R2.13981 O=C1Nc2ncc(Br)c(Cl)c2NC1=O Amb23400062 [0,2,0,0,0,0|1,0,1]=4 2430 B15R2.13981 O=C1Oc2c(ccc(O)c2O)C=C1O Amb28351365 [0,2,0,0,0,0|2,0,0]=4 2431 B15R2.21336 C=Cc1cnc2c(c1)NC(=O)C(=O)N2 Amb27790693 [0,2,0,0,0,0|1,0,1]=4 2432 B15R2.21336 CC1=Cc2cc(CCl)ccc2NC1=O Amb18529720 [0,2,0,0,0,0|2,0,0]=4 2433 B15R2.21336 CC1=Cc2cc(CN)ccc2NC1=O Amb18023596 [0,2,0,0,0,0|2,0,0]=4 2434 B15R2.21336 CC1=Cc2cc(CN)ccc2NC1=O Amb18364025 [0,2,0,0,0,0|2,0,0]=4 2435 B15R2.21336 CC1=Cc2ccc(CCl)cc2NC1=O Amb18529718 [0,2,0,0,0,0|2,0,0]=4 2436 B15R2.21336 COc1ccc2c(c1)C=C(C)C(=O)N2 Amb18368687 [0,2,0,0,0,0|2,0,0]=4 2437 B15R2.21336 COc1ccc2c(c1)C=C(F)C(=O)N2 Amb22641637 [0,2,0,0,0,0|2,0,0]=4 2438 B15R2.21336 COc1ccc2c(c1)NC(=O)C(Br)=C2 Amb25342187 [0,2,0,0,0,0|2,0,0]=4 2439 B15R2.21336 COc1ccc2c(c1)NC(=O)C(C)=C2 Amb18049043 [0,2,0,0,0,0|2,0,0]=4 2440 B15R2.21336 CSc1ccc2c(n1)NC(=O)C(=O)N2 Amb28047296 [0,2,0,0,0,0|1,0,1]=4 2441 B15R2.21336 N#Cc1ccc2cc(F)c(O)cc2n1 Amb27971571 [0,2,0,0,0,0|2,0,0]=4 2442 B15R2.59733 CC1=Cc2cc(C)cc(N)c2NC1=O Amb27396054 [0,2,0,0,0,0|2,0,0]=4 2443 B15R2.59733 CC1=Cc2cc(F)cc(N)c2NC1=O Amb25952757 [0,2,0,0,0,0|2,0,0]=4 2444 B15R2.59733 CC1=Cc2cc(N)cc(C)c2NC1=O Amb24345851 [0,2,0,0,0,0|2,0,0]=4 2445 B15R2.59733 CC1=Cc2cc(N)cc(F)c2NC1=O Amb28048080 [0,2,0,0,0,0|2,0,0]=4 2446 B15R2.59733 Cc1cc(C)c2c(c1)NC(=O)C(F)=C2 Amb22547380 [0,2,0,0,0,0|2,0,0]=4 2447 B15R2.59733 Cc1cc(C)c2c(n1)NC(=O)C(=O)N2 Amb27149879 [0,2,0,0,0,0|1,0,1]=4 2448 B15R2.59733 O=C1Nc2c(Cl)cc(Cl)cc2C=C1Cl Amb23509998 [0,2,0,0,0,0|2,0,0]=4 2449 B15R2.59733 O=C1Nc2c(Cl)cc(Cl)cc2N=C1O Amb19815277 [0,2,0,0,0,0|2,0,0]=4 2450 B15R2.59733 O=C1Oc2cc(O)cc(O)c2C=C1O Amb25987799 [0,2,0,0,0,0|2,0,0]=4 2451 B15R2.62227 CC1=Cc2cc(C)c(C)cc2NC1=O Amb18548646 [0,2,0,0,0,0|2,0,0]=4 2452 B15R2.62227 O=C1Nc2cc(F)c(F)cc2C=C1Br Amb28044974 [0,2,0,0,0,0|2,0,0]=4 2453 B15R2.62227 O=C1Oc2cc(O)c(O)cc2C=C1O Amb27612776 [0,2,0,0,0,0|2,0,0]=4 2454 B15R2.63633 CC1=Cc2c(C)ccc(C)c2NC1=O Amb18049041 [0,2,0,0,0,0|2,0,0]=4 2455 B15R2.63633 Cc1ccc(F)c2c1C=C(O)C(=O)N2 Amb27588075 [0,2,0,0,0,0|1,0,0]=3 2456 B15R2.63633 Cc1ccc(F)c2c1NC(=O)C(O)=C2 Amb28071117 [0,2,0,0,0,0|1,0,0]=3 2457 B15R2.63633 O=C1Nc2c(Cl)ccc(Cl)c2C=C1Br Amb23449366 [0,2,0,0,0,0|2,0,0]=4 2458 B15R2.63633 O=C1Nc2c(Cl)ccc(Cl)c2C=C1O Amb28241027 [0,2,0,0,0,0|1,0,0]=3 2459 B15R2.86973 CCc1cccc2c1NC(=O)C(F)=C2 Amb22547232 [0,2,0,0,0,0|2,0,0]=4 2460 B15R2.86973 CCc1cccc2c1NC(=O)C(O)=C2 Amb28325810 [0,2,0,0,0,0|1,0,0]=3 2461 B15R2.86973 CCc1ccnc2c1NC(=O)C(=O)N2 Amb27646771 [0,2,0,0,0,0|1,0,1]=4 2462 B15R2.86973 COc1cccc2c1C=C(C)C(=O)N2 Amb28409067 [0,2,0,0,0,0|2,0,0]=4 2463 B13R2.373 C=C1CN(c2ccccc2)C1=O Amb27808537 [0,0,1,1,0,0|2,0,0]=4 2464 B13R2.435 CC(=O)c1cc2ccccc2o1 Amb1212626 [0,0,1,1,0,0|2,0,0]=4 2465 B13R2.435 CC(=O)c1cc2nccnc2o1 Amb18829866 [0,0,1,1,0,0|2,0,0]=4 2466 B13R2.435 CC(=O)c1nc2ncccc2o1 Amb18829843 [0,0,1,1,0,0|2,0,0]=4 2467 B13R2.435 N=C(N)c1cc2ccccc2o1 Amb19374967 [0,0,1,1,0,0|2,0,0]=4 2468 B13R2.435 NC(=O)C1=Cc2ccccc2C1 Amb22227964 [0,0,1,1,0,0|2,0,0]=4 2469 B13R2.435 NC(=O)c1cc2ccccc2o1 Amb6337587 [0,0,1,1,0,0|1,0,0]=3 2470 B13R2.435 NC(=O)c1cc2ccccc2s1 Amb6341890 [0,0,1,1,0,0|1,1,0]=4 2471 B13R2.435 NC(=O)c1cc2ccccn2c1 Amb26349575 [0,0,1,1,0,0|1,0,1]=4 2472 B13R2.435 NC(=O)c1cc2ccccn2n1 Amb22002382 [0,0,1,1,0,0|1,0,1]=4 2473 B13R2.435 NC(=O)c1cc2ncccn2n1 Amb20514297 [0,0,1,1,0,0|2,0,0]=4 2474 B13R2.435 NC(=O)c1nc2ccccc2o1 Amb22500295 [0,0,1,1,0,0|2,0,0]=4 2475 B13R2.435 NC(=O)c1nc2cccnc2s1 Amb27983803 [0,0,1,1,0,0|2,0,0]=4 2476 B13R2.435 NC(=S)c1cc2ccccc2o1 Amb8834038 [0,0,1,1,0,0|1,1,0]=4 2477 B13R2.435 O=C(Cl)c1cc2ccccc2o1 Amb2684582 [0,0,1,1,0,0|2,0,0]=4 2478 B13R2.435 O=C(O)c1cc2ccccc2o1 Amb1203290 [0,0,1,1,0,0|2,0,0]=4 2479 B13R2.435 O=C(O)c1cc2ncccc2o1 Amb17774703 [0,0,1,1,0,0|1,0,0]=3 2480 B13R2.435 O=C(O)c1cc2ncccc2o1 Amb7173138 [0,0,1,1,0,0|1,0,0]=3 2481 B13R2.435 O=C(O)c1cc2ncccc2s1 Amb9677586 [0,0,1,1,0,0|1,1,0]=4 2482 B13R2.435 O=C(O)c1cc2nccnc2o1 Amb18829111 [0,0,1,1,0,0|2,0,0]=4 2483 B13R2.435 O=C(O)c1nc2ncccc2o1 Amb18829106 [0,0,1,1,0,0|2,0,0]=4 2484 B13R2.435 O=C([O-])c1nc2ncccc2o1 Amb32665276 [0,0,1,1,0,0|2,0,0]=4 2485 B13R2.336 O=C1NC=CC2=CC=CC=C1C2 Amb27449234 [0,0,1,1,0,0|2,0,0]=4 2486 B13R2.163 O=C1Nc2ccccc2C=NO1 Amb28255633 [0,0,1,1,0,0|2,0,0]=4 2487 B13R2.1613 O=Cc1cccc2ncccc12 Amb1995111 [0,0,1,1,0,0|2,0,0]=4 2488 B13R2.1613 O=Cc1nccc2ncccc12 Amb25898885 [0,0,1,1,0,0|2,0,0]=4 2489 B13R2.54 Cc1cccc2oc(C=O)cc12 Amb18830290 [0,0,1,1,0,0|2,0,0]=4 2490 B13R2.54 Nc1cccc2oc(C=O)cc12 Amb18830105 [0,0,1,1,0,0|1,0,0]=3 2491 B13R2.54 Nc1nccc2oc(C=O)cc12 Amb32659214 [0,0,1,1,0,0|2,0,0]=4 2492 B13R2.54 O=Cc1cc2c(Br)cccc2o1 Amb18754939 [0,0,1,1,0,0|2,0,0]=4 2493 B13R2.54 O=Cc1cc2c(O)cccc2o1 Amb27209821 [0,0,1,1,0,0|2,0,0]=4 2494 B13R3.28 C1=Cc2ccccc2N3C=C13 Amb26478756 [1,0,0,1,0,0|2,0,0]=4 2495 B13R3.28 c1cnc2c3c(ccc2c1)C3 Amb27781113 [1,0,0,1,0,0|2,0,0]=4 2496 B13R3.1970 c1cnc2cc3c(cc2c1)C3 Amb27595606 [1,0,0,1,0,0|2,0,0]=4 2497 B15R3.4266 c1cnc2cc3c(cc2c1)COC3 Amb28193304 [0,1,0,1,0,0|2,0,0]=4 2498 B15R3.4266 c1cnc2cc3c(cc2c1)OCO3 Amb28435929 [0,1,0,1,0,0|1,0,1]=4 2499 B11R1.35 C=C(C)C(=O)Nc1nccs1 Amb27176622 [0,0,1,0,1,0|2,0,0]=4 2500 B11R1.35 C=C(Cl)C(=O)Nc1ccsc1 Amb27217432 [0,0,1,0,1,0|2,0,0]=4 2501 B11R1.35 C=C(Cl)C(=O)Nc1cnoc1 Amb27247382 [0,0,1,0,1,0|2,0,0]=4 2502 B11R1.35 C=C(Cl)C(=O)Nc1cnsc1 Amb29860154 [0,0,1,0,1,0|2,0,0]=4 2503 B11R1.35 C=C(Cl)C(=O)Nn1cccc1 Amb27796037 [0,0,1,0,1,0|2,0,0]=4 2504 B11R1.35 C\C(=C/c1ccco1)C(N)=O Amb27231811 [0,0,1,0,1,0|2,0,0]=4 2505 B11R1.35 O=C(O)C(=O)Nc1cccs1 Amb27450757 [0,0,1,0,1,0|2,0,0]=4 2506 B11R1.35 O=C(O)C(=O)Nc1ccsc1 Amb27664522 [0,0,1,0,1,0|2,0,0]=4 2507 B11R1.35 O=C(O)C(=O)Nc1cnsc1 Amb30015415 [0,0,1,0,1,0|2,0,0]=4 2508 B11R1.35 O=C(O)C(=O)Nc1nccs1 Amb9284838 [0,0,1,0,1,0|2,0,0]=4 2509 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,0,1,0,1,0|2,0,0]=4 2510 B11R1.36 C=C(C(=O)O)c1cccnc1 Amb24578705 [0,0,1,0,1,0|2,0,0]=4 2511 B11R1.36 C=C(C)C(=O)c1ccccc1 Amb17593661 [0,0,1,0,1,0|2,0,0]=4 2512 B11R1.36 C=C(C)C(=O)c1cccnc1 Amb25139926 [0,0,1,0,1,0|1,0,0]=3 2513 B11R1.36 C=C(C)C(=O)c1cnccn1 Amb27602119 [0,0,1,0,1,0|2,0,0]=4 2514 B11R1.36 C=C(Cl)C(=O)c1ccccc1 Amb28075337 [0,0,1,0,1,0|2,0,0]=4 2515 B11R1.36 CC(=O)C(=O)c1ccccn1 Amb26880304 [0,0,1,0,1,0|1,0,1]=4 2516 B11R1.36 CC(=O)C(=O)c1cccnc1 Amb25152863 [0,0,1,0,1,0|0,0,2]=4 2517 B11R1.36 CC(=O)C(O)c1ccccn1 Amb24392468 [0,0,1,0,1,0|1,0,1]=4 2518 B11R1.36 CC(O)C(=O)c1cccnc1 Amb25712989 [0,0,1,0,1,0|0,0,2]=4 2519 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,1,0,1,0|1,0,1]=4 2520 B11R1.36 NC(=O)C(=O)c1cccnc1 Amb18063199 [0,0,1,0,1,0|1,0,1]=4 2521 B11R1.36 NC(=O)C(N)c1ccccn1 Amb17334311 [0,0,1,0,1,0|1,0,1]=4 2522 B11R1.36 NC(=O)C(O)c1ccccc1 Amb2611605 [0,0,1,0,1,0|1,0,1]=4 2523 B11R1.36 NC(=O)C(O)c1ccccn1 Amb24396108 [0,0,1,0,1,0|0,0,1]=3 2524 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,1,0,1,0|1,0,1]=4 2525 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,1,0,1,0|1,0,1]=4 2526 B11R1.36 O=C(Cl)C(=O)c1ccccn1 Amb27954072 [0,0,1,0,1,0|1,0,1]=4 2527 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,0,1,0,1,0|2,0,0]=4 2528 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,0,1,0,1,0|2,0,0]=4 2529 B11R1.36 O=C(O)C(=O)c1ccccn1 Amb18831273 [0,0,1,0,1,0|1,0,1]=4 2530 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb15701278 [0,0,1,0,1,0|1,0,0]=3 2531 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb22492371 [0,0,1,0,1,0|1,0,0]=3 2532 B11R1.36 O=C(O)C(=O)c1ccnnc1 Amb28189420 [0,0,1,0,1,0|2,0,0]=4 2533 B11R1.36 O=C(O)C(=O)c1cncnc1 Amb27751777 [0,0,1,0,1,0|2,0,0]=4 2534 B11R1.36 O=C(O)C(O)c1ccccn1 Amb18201201 [0,0,1,0,1,0|1,0,1]=4 2535 B11R1.36 O=C([O-])C(O)c1ccccn1 Amb23452663 [0,0,1,0,1,0|1,0,1]=4 2536 B11R1.222 C=CC(=O)c1cccnc1Br Amb33387824 [0,0,1,0,1,0|2,0,0]=4 2537 B11R1.222 C=CC(=O)c1cccnc1C Amb25893371 [0,0,1,0,1,0|1,0,1]=4 2538 B11R1.222 C=CC(=O)c1cccnc1Cl Amb28368650 [0,0,1,0,1,0|2,0,0]=4 2539 B11R1.222 C=CC(=O)c1cccnc1F Amb33377941 [0,0,1,0,1,0|2,0,0]=4 2540 B11R1.222 C=CC(=O)c1ncccc1N Amb25824774 [0,0,1,0,1,0|1,0,1]=4 2541 B11R1.222 C=CC(O)c1ncccc1N Amb35622501 [0,0,1,0,1,0|1,0,1]=4 2542 B11R1.222 Cc1ncccc1C(=O)NO Amb25675184 [0,0,1,0,1,0|1,0,1]=4 2543 B11R1.222 Nc1ncccc1C(=O)NO Amb27407097 [0,0,1,0,1,0|2,0,0]=4 2544 B11R1.222 O=C(NO)c1cccnc1Cl Amb8439449 [0,0,1,0,1,0|2,0,0]=4 2545 B11R1.222 O=C(NO)c1cccnc1F Amb26622975 [0,0,1,0,1,0|2,0,0]=4 2546 B11R2.1 Brc1ccn2ncccc12 Amb24464326 [1,0,0,0,1,0|2,0,0]=4 2547 B11R2.1 Brc1coc2cccnc12 Amb18187782 [1,0,0,0,1,0|2,0,0]=4 2548 B11R2.1 Brc1coc2ncccc12 Amb18811362 [1,0,0,0,1,0|2,0,0]=4 2549 B11R2.1 Brc1csc2cccnc12 Amb10070411 [1,0,0,0,1,0|2,0,0]=4 2550 B11R2.1 Brc1csc2ncccc12 Amb10070408 [1,0,0,0,1,0|2,0,0]=4 2551 B11R2.1 CC1=CCc2cccnc21 Amb27838911 [1,0,0,0,1,0|2,0,0]=4 2552 B11R2.1 Clc1csc2cccnc12 Amb25721818 [1,0,0,0,1,0|2,0,0]=4 2553 B11R2.1 Cn1ccc2ncccc21 Amb22900982 [1,0,0,0,1,0|2,0,0]=4 2554 B11R2.1 Ic1csc2cccnc12 Amb27613200 [1,0,0,0,1,0|2,0,0]=4 2555 B11R2.1 Nc1ccn2ncccc12 Amb28325554 [1,0,0,0,1,0|2,0,0]=4 2556 B11R2.1 Nc1coc2cccnc12 Amb24742644 [1,0,0,0,1,0|2,0,0]=4 2557 B11R2.1 Nc1coc2ncccc12 Amb18522246 [1,0,0,0,1,0|2,0,0]=4 2558 B11R2.1 Nc1csc2cccnc12 Amb10070407 [1,0,0,0,1,0|2,0,0]=4 2559 B11R2.1 Nc1csc2ncccc12 Amb10070405 [1,0,0,0,1,0|2,0,0]=4 2560 B11R2.1 O=C1C=CC2=NCC=CN12 Amb28254538 [1,0,0,0,1,0|1,0,1]=4 2561 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [1,0,0,0,1,0|1,0,0]=3 2562 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [1,0,0,0,1,0|0,0,2]=4 2563 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [1,0,0,0,1,0|0,0,2]=4 2564 B11R2.1 O=C1COc2ncccc21 Amb20242022 [1,0,0,0,1,0|1,0,1]=4 2565 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [1,0,0,0,1,0|1,0,1]=4 2566 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [1,0,0,0,1,0|2,0,0]=4 2567 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [1,0,0,0,1,0|1,0,1]=4 2568 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [1,0,0,0,1,0|1,0,1]=4 2569 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [1,0,0,0,1,0|2,0,0]=4 2570 B11R2.1 O=C1OCc2ncccc21 Amb2612059 [1,0,0,0,1,0|1,0,1]=4 2571 B11R2.1 O=c1nsc2ncccc12 Amb2759329 [1,0,0,0,1,0|2,0,0]=4 2572 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [1,0,0,0,1,0|2,0,0]=4 2573 B11R2.1 ON1NNc2cccnc21 Amb27242890 [1,0,0,0,1,0|2,0,0]=4 2574 B11R2.1 Oc1coc2ccccc12 Amb24097480 [1,0,0,0,1,0|2,0,0]=4 2575 B11R2.1 Oc1coc2cccnc12 Amb21963453 [1,0,0,0,1,0|1,0,0]=3 2576 B11R2.1 Oc1coc2cccnc12 Amb33996728 [1,0,0,0,1,0|1,0,0]=3 2577 B11R2.1 Oc1csc2ccccc12 Amb4009443 [1,0,0,0,1,0|2,0,0]=4 2578 B11R2.1 Oc1csc2ncccc12 Amb26464103 [1,0,0,0,1,0|1,0,1]=4 2579 B11R2.1 On1ccc2cccnc21 Amb25858298 [1,0,0,0,1,0|2,0,0]=4 2580 B11R2.10 Brc1cc2ncccc2o1 Amb25133797 [1,0,0,0,1,0|2,0,0]=4 2581 B11R2.10 Brc1cc2ncccc2o1 Amb32683420 [1,0,0,0,1,0|2,0,0]=4 2582 B11R2.10 Brc1cc2ncccc2s1 Amb18771328 [1,0,0,0,1,0|2,0,0]=4 2583 B11R2.10 Cc1cc2cccnc2o1 Amb25299352 [1,0,0,0,1,0|2,0,0]=4 2584 B11R2.10 Clc1cc2cccnc2s1 Amb22495233 [1,0,0,0,1,0|2,0,0]=4 2585 B11R2.10 Clc1cc2ncccc2s1 Amb22494669 [1,0,0,0,1,0|2,0,0]=4 2586 B11R2.10 Ic1cc2cccnc2s1 Amb22495219 [1,0,0,0,1,0|2,0,0]=4 2587 B11R2.10 Nc1cc2cccnc2s1 Amb18201492 [1,0,0,0,1,0|2,0,0]=4 2588 B11R2.10 Nc1cc2ncccc2s1 Amb18201882 [1,0,0,0,1,0|2,0,0]=4 2589 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,0,0,0,1,0|1,0,1]=4 2590 B11R2.10 O=C1C=C2C=CC=CN2N1 Amb21858515 [1,0,0,0,1,0|2,0,0]=4 2591 B11R2.10 O=C1C=C2N=CC=CN2N1 Amb24480959 [1,0,0,0,1,0|1,0,0]=3 2592 B11R2.10 O=C1Cc2ccccc2N1 Amb1351379 [1,0,0,0,1,0|1,0,1]=4 2593 B11R2.10 O=C1Cc2cccnc2N1 Amb22405864 [1,0,0,0,1,0|2,0,0]=4 2594 B11R2.10 O=C1Cc2cccnc2N1 Amb6307171 [1,0,0,0,1,0|2,0,0]=4 2595 B11R2.10 O=C1Cc2ncccc2N1 Amb6307736 [1,0,0,0,1,0|0,0,1]=3 2596 B11R2.10 O=C1Nc2ccccc2N1 Amb18375774 [1,0,0,0,1,0|2,0,0]=4 2597 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [1,0,0,0,1,0|2,0,0]=4 2598 B11R2.10 O=C1Nc2ccccc2S1 Amb17933260 [1,0,0,0,1,0|2,0,0]=4 2599 B11R2.10 O=C1Nc2cccnc2N1 Amb18043123 [1,0,0,0,1,0|1,0,0]=3 2600 B11R2.10 O=C1Nc2cccnc2O1 Amb18560583 [1,0,0,0,1,0|1,0,0]=3 2601 B11R2.10 O=C1Nc2ncccc2O1 Amb17933371 [1,0,0,0,1,0|2,0,0]=4 2602 B11R2.10 O=C1Nc2ncccc2S1 Amb23403194 [1,0,0,0,1,0|2,0,0]=4 2603 B11R2.10 O=C1Nc2nccnc2N1 Amb22496199 [1,0,0,0,1,0|2,0,0]=4 2604 B11R2.10 Oc1cc2ccccc2s1 Amb24518934 [1,0,0,0,1,0|2,0,0]=4 2605 B11R2.10 Oc1cc2ccccn2c1 Amb27841533 [1,0,0,0,1,0|2,0,0]=4 2606 B11R2.10 Oc1cc2ncccc2o1 Amb28385482 [1,0,0,0,1,0|1,0,0]=3 2607 B11R2.10 Oc1cn2cccnc2n1 Amb25063031 [1,0,0,0,1,0|2,0,0]=4 2608 B11R2.10 Oc1nc2ncccc2o1 Amb17949727 [1,0,0,0,1,0|2,0,0]=4 2609 B11R2.10 S=C1Nc2cccnc2N1 Amb18042944 [1,0,0,0,1,0|1,1,0]=4 2610 B11R2.10 S=C1Nc2cccnc2S1 Amb21857101 [1,0,0,0,1,0|1,1,0]=4 2611 B11R2.36 O=C1C=Cc2ccsc2N1 Amb24417184 [1,0,0,0,1,0|1,0,0]=3 2612 B11R2.36 O=C1C=Cc2nccn2N1 Amb22388527 [1,0,0,0,1,0|1,0,0]=3 2613 B11R2.36 O=C1C=Cc2nncn2N1 Amb20268572 [1,0,0,0,1,0|2,0,0]=4 2614 B11R2.36 O=C1C=Cc2nocc2C1 Amb27962578 [1,0,0,0,1,0|2,0,0]=4 2615 B11R2.36 O=C1C=Cc2sccc2N1 Amb28206306 [1,0,0,0,1,0|1,0,0]=3 2616 B11R2.36 O=C1C=Cn2nccc2N1 Amb21927423 [1,0,0,0,1,0|1,0,0]=3 2617 B11R2.36 O=C1C=Cn2ncnc2N1 Amb19372832 [1,0,0,0,1,0|2,0,0]=4 2618 B11R2.36 O=c1ccc2ccsc2o1 Amb5720014 [1,0,0,0,1,0|2,0,0]=4 2619 B11R2.36 O=c1ccc2sccc2o1 Amb5719894 [1,0,0,0,1,0|2,0,0]=4 2620 B11R2.36 Oc1ccc2c(c1)C=CC2 Amb18124353 [1,0,0,0,1,0|1,0,1]=4 2621 B11R2.36 Oc1ccc2ccnn2c1 Amb10067868 [1,0,0,0,1,0|2,0,0]=4 2622 B11R2.36 Oc1ccc2ccoc2c1 Amb18124404 [1,0,0,0,1,0|2,0,0]=4 2623 B11R2.36 Oc1ccc2ccsc2c1 Amb18644429 [1,0,0,0,1,0|2,0,0]=4 2624 B11R2.36 Oc1ccc2csnc2c1 Amb27389693 [1,0,0,0,1,0|2,0,0]=4 2625 B11R2.36 Oc1ccc2occc2c1 Amb16185813 [1,0,0,0,1,0|2,0,0]=4 2626 B11R2.36 Oc1ccc2ocnc2c1 Amb17479110 [1,0,0,0,1,0|2,0,0]=4 2627 B11R2.36 Oc1ccc2sccc2c1 Amb18644430 [1,0,0,0,1,0|2,0,0]=4 2628 B11R2.36 Oc1ccc2scnc2c1 Amb16231523 [1,0,0,0,1,0|2,0,0]=4 2629 B11R2.36 Oc1ccn2ccnc2c1 Amb17616040 [1,0,0,0,1,0|2,0,0]=4 2630 B11R2.36 Oc1ccn2ccnc2c1 Amb33339209 [1,0,0,0,1,0|2,0,0]=4 2631 B11R2.36 Oc1cnc2ccnn2c1 Amb28315099 [1,0,0,0,1,0|1,0,1]=4 2632 B11R2.36 Oc1cnc2ccsc2c1 Amb19959222 [1,0,0,0,1,0|1,0,1]=4 2633 B11R2.36 Oc1cnc2sccc2c1 Amb18644463 [1,0,0,0,1,0|1,0,1]=4 2634 B11R2.8 O=C1Nc2ccsc2C1O Amb27408328 [0,0,0,0,2,0|1,0,1]=4 2635 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [0,0,0,0,2,0|1,0,1]=4 2636 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [0,0,0,0,2,0|1,0,1]=4 2637 B13R1.348 C=C(C)CC(=O)Nc1cccnc1 Amb27187959 [0,0,1,0,0,1|1,0,0]=3 2638 B13R1.348 C=C(C)NC(=O)Nc1ccccc1 Amb28436709 [0,0,1,0,0,1|2,0,0]=4 2639 B13R1.348 C=C(C)OC(=O)Nc1cccnc1 Amb26453450 [0,0,1,0,0,1|1,0,0]=3 2640 B13R1.348 CC(=O)CC(=O)Nc1cccnc1 Amb3685830 [0,0,1,0,0,1|0,0,2]=4 2641 B13R1.348 CC(C)=CC(=O)Nc1cccnc1 Amb27754589 [0,0,1,0,0,1|1,0,1]=4 2642 B13R1.348 C\C(=C/c1ccccc1)CC(N)=O Amb33513125 [0,0,1,0,0,1|2,0,0]=4 2643 B13R1.348 C\C(=C\c1ccccc1)NC(N)=O Amb26490847 [0,0,1,0,0,1|2,0,0]=4 2644 B13R1.348 NC(=O)CC(=O)Nc1cccnc1 Amb27825994 [0,0,1,0,0,1|1,0,1]=4 2645 B13R1.348 NC(=O)NC(=S)Nc1ccccn1 Amb28125491 [0,0,1,0,0,1|1,1,0]=4 2646 B13R1.348 NC(=S)CC(=O)Nc1cccnc1 Amb7774993 [0,0,1,0,0,1|1,1,0]=4 2647 B13R1.348 O=C(O)CC(=O)Nc1ccccc1 Amb2436726 [0,0,1,0,0,1|2,0,0]=4 2648 B13R1.348 O=C(O)CC(=O)Nc1cccnc1 Amb18987417 [0,0,1,0,0,1|1,0,0]=3 2649 B13R1.348 O=C(O)CC(=O)Nc1cccnn1 Amb29872446 [0,0,1,0,0,1|2,0,0]=4 2650 B13R1.348 O=C(O)CC(=O)Nc1cnccn1 Amb35684653 [0,0,1,0,0,1|2,0,0]=4 2651 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 Amb27449585 [0,0,1,0,0,1|2,0,0]=4 2652 B13R1.351 C=C(Cl)C(=O)NCc1cccnn1 Amb27959900 [0,0,1,0,0,1|2,0,0]=4 2653 B13R1.351 C=C(Cl)C(=O)NCc1cnccn1 Amb35646277 [0,0,1,0,0,1|2,0,0]=4 2654 B13R1.351 CC(=O)C(=O)NCc1cccnc1 Amb17400655 [0,0,1,0,0,1|0,0,2]=4 2655 B13R1.351 CC(O)C(=O)NCc1cccnc1 Amb17400769 [0,0,1,0,0,1|0,0,2]=4 2656 B13R1.351 C\C(=N/Nc1cccnc1)C(=O)O Amb27608651 [0,0,1,0,0,1|2,0,0]=4 2657 B13R1.351 NC(=O)C(=O)NCc1cccnc1 Amb1830622 [0,0,1,0,0,1|1,0,1]=4 2658 B13R1.351 O=C(O)C(=O)NCc1ccccc1 Amb838961 [0,0,1,0,0,1|2,0,0]=4 2659 B13R1.351 O=C(O)C(=O)NCc1cccnc1 Amb9304022 [0,0,1,0,0,1|1,0,0]=3 2660 B13R1.351 O=C(O)C(=O)NNc1ccccc1 Amb18128574 [0,0,1,0,0,1|2,0,0]=4 2661 B13R1.351 O=C(O)C(=O)\C=C\c1ccccn1 Amb17470558 [0,0,1,0,0,1|1,0,1]=4 2662 B13R1.351 O=C(O)C(=O)\C=C\c1cccnc1 Amb17470559 [0,0,1,0,0,1|2,0,0]=4 2663 B13R1.528 C\C(C=O)=C\Nc1ccccc1N Amb27751221 [0,0,1,0,0,1|2,0,0]=4 2664 B13R1.528 Cc1ccccc1N\C=C(/O)C=O Amb28129816 [0,0,1,0,0,1|2,0,0]=4 2665 B13R1.528 O=C\C(O)=C/Nc1ccccc1O Amb27185973 [0,0,1,0,0,1|2,0,0]=4 2666 B13R2.33 CC1=NNc2ccccc2C=C1 Amb27421335 [1,0,0,0,0,1|2,0,0]=4 2667 B13R2.33 NC1=NNc2ccccc2C=C1 Amb27974235 [1,0,0,0,0,1|2,0,0]=4 2668 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [1,0,0,0,0,1|2,0,0]=4 2669 B13R2.33 O=C1C=Cc2ccccc2CC1 Amb17593958 [1,0,0,0,0,1|2,0,0]=4 2670 B13R2.33 O=C1C=Cc2ccccc2CN1 Amb8630983 [1,0,0,0,0,1|1,0,0]=3 2671 B13R2.33 O=C1C=Cc2ccccc2OC1 Amb27175937 [1,0,0,0,0,1|2,0,0]=4 2672 B13R2.33 O=C1C=Cc2cccnc2C=C1 Amb27854920 [1,0,0,0,0,1|1,0,0]=3 2673 B13R2.33 O=C1C=Nc2ccccc2CN1 Amb27643583 [1,0,0,0,0,1|2,0,0]=4 2674 B13R2.33 O=C1CNc2ncccc2CN1 Amb23580219 [1,0,0,0,0,1|1,0,1]=4