0 B28R3.83859715 Cc1cc(c(n1c2ccc(cc2)Br)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000178395 [0,0,0,0,0,0|1,0,0]=1 1 B28R3.83859715 Cc1cc(c(n1c2ccc(cc2)Cl)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000182381 [0,0,0,0,0,0|1,0,0]=1 2 B28R3.83859715 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100000187854 [0,0,0,0,0,0|2,0,0]=2 3 B28R3.83859715 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000187854 [0,0,0,0,0,0|1,0,0]=1 4 B28R3.83859715 Cc1cc(c(n1c2ccc(cc2)I)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000183415 [0,0,0,0,0,0|1,0,0]=1 5 B27R3.3273552 Cc1cc(c(n1c2ccc(cc2)Br)C)C=NNc3ccc(cn3)C#N 4a_100011198082_100000178395 [1,0,0,0,0,0|3,0,0]=4 6 B27R3.3273552 Cc1cc(c(n1c2ccc(cc2)Cl)C)C=NNc3ccc(cn3)C#N 4a_100011198082_100000182381 [1,0,0,0,0,0|3,0,0]=4 7 B27R3.3273552 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)C#N 4a_100011198082_100000187854 [1,0,0,0,0,0|3,0,0]=4 8 B27R3.3273552 Cc1cc(c(n1c2ccc(cc2)I)C)C=NNc3ccc(cn3)C#N 4a_100011198082_100000183415 [1,0,0,0,0,0|3,0,0]=4 9 B27R3.40183777 Cc1cc(c(n1c2ccccc2)C)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100000181884 [1,0,0,0,0,0|1,0,0]=2 10 B27R3.40183777 Cc1cc(c(n1c2ccccc2)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000181884 [1,0,0,0,0,0|0,0,0]=1 11 B29R3.815525645 Cc1cc(ccc1Br)n2c(cc(c2C)C=NNc3ccc(cn3)[N+](=O)[O-])C 4a_100000737981_200000261989 [0,1,0,0,0,0|1,0,0]=2 12 B29R3.815525645 Cc1cc(ccc1I)n2c(cc(c2C)C=NNc3ccc(cn3)[N+](=O)[O-])C 4a_100000737981_100015185400 [0,1,0,0,0,0|1,0,0]=2 13 B29R3.815525645 Cc1ccc(cc1C)n2c(cc(c2C)C=NNc3ccc(cn3)[N+](=O)[O-])C 4a_100000737981_100000261047 [0,1,0,0,0,0|0,0,0]=1 14 B29R3.816863267 Cc1cc(c(n1c2ccc(cc2)Cl)C)C(=O)CNc3ccc(cc3)[N+](=O)[O-] 2230a_100015195142_100000595257 [0,1,0,0,0,0|3,0,0]=4 15 B29R3.816863267 Cc1cc(c(n1c2ccc(cc2)F)C)C(=O)CNc3ccc(cc3)[N+](=O)[O-] 2230a_100015195142_100000595138 [0,1,0,0,0,0|3,0,0]=4 16 B29R3.816863267 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNc3ccc(cc3)[N+](=O)[O-])C 2230a_100015195142_100000595116 [0,1,0,0,0,0|2,0,0]=3 17 B29R3.816863267 Cc1ccc(cc1)n2c(cc(c2C)C(=O)COc3ccc(cc3)[N+](=O)[O-])C 7a_100000185810_100000595116 [0,1,0,0,0,0|3,0,0]=4 18 B29R3.816867381 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ncc(cc3Br)[N+](=O)[O-] 4a_200011934111_100000187854 [0,1,0,0,0,0|1,0,0]=2 19 B29R3.1500611686 Cc1cc(c(n1c2ccc(cc2F)Br)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_200000261784 [0,1,0,0,0,0|1,0,0]=2 20 B27R3.59287038 Cc1cc(c(n1c2ccc(cc2)F)C)CNc3ccc(cc3)[N+](=O)[O-] 270302a_100015195142_100000187854 [0,0,0,0,1,0|2,0,1]=4 21 B26R3.2732076 Cc1ccc(cc1)c2ccc(o2)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000186494 [2,0,0,0,0,0|2,0,0]=4 22 B26R3.2732076 Cc1ccc(cc1)n2cc(cn2)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100011225146 [2,0,0,0,0,0|2,0,0]=4 23 B26R3.2732076 Cc1ccc(cc1)n2cc(cn2)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100011225146 [2,0,0,0,0,0|1,0,0]=3 24 B26R3.2732076 O=[N+]([O-])c1ccc(nc1)NN=Cc2cnn(c2)c3ccc(cc3)Br 4a_100000737981_100000741562 [2,0,0,0,0,0|2,0,0]=4 25 B26R3.2732076 O=[N+]([O-])c1ccc(nc1)NN=Cc2cnn(c2)c3ccc(cc3)Cl 4a_100000737981_100000741272 [2,0,0,0,0,0|2,0,0]=4 26 B26R3.2732076 O=[N+]([O-])c1ccc(nc1)NN=Cc2cnn(c2)c3ccc(cc3)F 4a_100000737981_100000751346 [2,0,0,0,0,0|2,0,0]=4 27 B26R3.36655 Cc1cc(c(n1c2ccccc2)C)C=NNc3ccc(cn3)C#N 4a_100011198082_100000181884 [2,0,0,0,0,0|2,0,0]=4 28 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)Br)C)C=NNc3ccc(cn3)F 4a_100000753838_100000178395 [2,0,0,0,0,0|2,0,0]=4 29 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)Cl)C)C=NNc3ccc(cn3)F 4a_100000753838_100000182381 [2,0,0,0,0,0|2,0,0]=4 30 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)Br 4a_100000750576_100000187854 [2,0,0,0,0,0|2,0,0]=4 31 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)Cl 4a_100011206499_100000187854 [2,0,0,0,0,0|2,0,0]=4 32 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)F 4a_100000753838_100000187854 [2,0,0,0,0,0|2,0,0]=4 33 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3ccc(cn3)I 4a_100010221006_100000187854 [2,0,0,0,0,0|2,0,0]=4 34 B26R3.483914 Cc1cc(c(n1c2ccc(cc2)I)C)C=NNc3ccc(cn3)F 4a_100000753838_100000183415 [2,0,0,0,0,0|2,0,0]=4 35 B26R3.483914 Cc1ccc(nc1)NN=Cc2cc(n(c2C)c3ccc(cc3)Cl)C 4a_100000746693_100000182381 [2,0,0,0,0,0|2,0,0]=4 36 B26R3.483914 Cc1ccc(nc1)NN=Cc2cc(n(c2C)c3ccc(cc3)F)C 4a_100000746693_100000187854 [2,0,0,0,0,0|2,0,0]=4 37 B26R3.483914 Cc1ccc(nc1)NN=Cc2cc(n(c2C)c3ccc(cc3)I)C 4a_100000746693_100000183415 [2,0,0,0,0,0|2,0,0]=4 38 B28R3.3700217 Cc1ccc(cc1C)n2c(cc(c2C)C=NNc3ccc(cn3)C#N)C 4a_100011198082_100000261047 [1,1,0,0,0,0|2,0,0]=4 39 B28R3.26270673 Cc1ccc(cc1)n2nc(c(c2Cl)C=NNc3ccc(cn3)[N+](=O)[O-])C 4a_100000737981_100000184642 [1,1,0,0,0,0|2,0,0]=4 40 B28R3.26270673 Cc1nn(c(c1C=NNc2ccc(cn2)[N+](=O)[O-])C)c3ccc(cc3)Br 4a_100000737981_100000742279 [1,1,0,0,0,0|2,0,0]=4 41 B28R3.26270673 Cc1nn(c(c1C=NNc2ccc(cn2)[N+](=O)[O-])C)c3ccc(cc3)Cl 4a_100000737981_100000742448 [1,1,0,0,0,0|2,0,0]=4 42 B28R3.26270673 Cc1nn(c(c1C=NNc2ccc(cn2)[N+](=O)[O-])C)c3ccc(cc3)F 4a_100000737981_100000198564 [1,1,0,0,0,0|2,0,0]=4 43 B28R3.25242334 Cc1cc(c(n1c2ccccc2)C)C=NNc3ncc(cc3Br)[N+](=O)[O-] 4a_200011934111_100000181884 [1,1,0,0,0,0|0,0,0]=2 44 B28R3.27504665 Cc1cc(c(n1c2ccccc2)C)C(=O)CNc3ccc(cc3)[N+](=O)[O-] 2230a_100015195142_100000260882 [1,1,0,0,0,0|2,0,0]=4 45 B28R3.28840298 Cc1cc(c(n1c2ccccc2Br)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_200000246826 [1,1,0,0,0,0|0,0,0]=2 46 B28R3.28840298 Cc1cc(c(n1c2ccccc2Cl)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000246806 [1,1,0,0,0,0|0,0,0]=2 47 B28R3.28840298 Cc1cc(c(n1c2ccccc2F)C)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100000187105 [1,1,0,0,0,0|1,0,0]=3 48 B28R3.28840298 Cc1cc(c(n1c2ccccc2F)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000187105 [1,1,0,0,0,0|0,0,0]=2 49 B28R3.122281165 Cc1c(c(=O)n(n1C)c2ccccc2)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000289574 [1,1,0,0,0,0|2,0,0]=4 50 B28R3.393929215 Cc1cc(c(n1c2cccc(c2)Br)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000760814 [1,1,0,0,0,0|0,0,0]=2 51 B28R3.393929215 Cc1cc(c(n1c2cccc(c2)F)C)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100000187106 [1,1,0,0,0,0|1,0,0]=3 52 B28R3.393929215 Cc1cc(c(n1c2cccc(c2)F)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000187106 [1,1,0,0,0,0|0,0,0]=2 53 B28R3.393929215 Cc1cccc(c1)n2c(cc(c2C)C=NNc3ccc(cc3)[N+](=O)[O-])C 4a_100000006255_100000183207 [1,1,0,0,0,0|1,0,0]=3 54 B28R3.393929215 Cc1cccc(c1)n2c(cc(c2C)C=NNc3ccc(cn3)[N+](=O)[O-])C 4a_100000737981_100000183207 [1,1,0,0,0,0|0,0,0]=2 55 B30R3.800950613 Cc1cc(c(n1c2ccc(cc2)Br)C)C=NNC(=O)c3ccc(cc3)[N+](=O)[O-] 4a_100000187932_100000178395 [0,1,0,0,0,1|2,0,0]=4 56 B30R3.800950613 Cc1cc(c(n1c2ccc(cc2)Cl)C)C=NNC(=O)c3ccc(cc3)[N+](=O)[O-] 4a_100000187932_100000182381 [0,1,0,0,0,1|2,0,0]=4 57 B30R3.800950613 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNC(=O)c3ccc(cc3)[N+](=O)[O-] 4a_100000187932_100000187854 [0,1,0,0,0,1|2,0,0]=4 58 B30R3.800950613 Cc1cc(c(n1c2ccc(cc2)I)C)C=NNC(=O)c3ccc(cc3)[N+](=O)[O-] 4a_100000187932_100000183415 [0,1,0,0,0,1|2,0,0]=4 59 B30R3.800954419 Cc1ccc(cc1)n2c(cc(c2C)C=CC(=O)Nc3ccc(cc3)[N+](=O)[O-])C 11a_100015195142_100000695406 [0,1,0,0,0,1|2,0,0]=4 60 B30R3.800954419 Cc1ccc(cc1)n2c(cc(c2C)C=CC(=O)Nc3ccc(cc3)[N+](=O)[O-])C 1626a_100015195142_100000695406 [0,1,0,0,0,1|2,0,0]=4 61 B30R3.800962284 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNCc3ccc(cc3)[N+](=O)[O-])C 2230a_100000742766_100000595116 [0,1,0,0,0,1|2,0,0]=4 62 B30R3.50723030 Cc1cc(c(n1c2ccc(cc2)C(C)C)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000403597 [0,2,0,0,0,0|0,0,0]=2 63 B30R3.50723030 Cc1cc(c(n1c2ccc(cc2)N(C)C)C)C=NNc3ccc(cc3)[N+](=O)[O-] 4a_100000006255_100000460540 [0,2,0,0,0,0|1,0,0]=3 64 B30R3.50723030 Cc1cc(c(n1c2ccc(cc2)N(C)C)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000460540 [0,2,0,0,0,0|0,0,0]=2 65 B30R3.800954384 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CN(C)c3ccc(cc3)[N+](=O)[O-])C 2230a_100000156523_100000595116 [0,2,0,0,0,0|2,0,0]=4 66 B30R3.800954384 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CN(C)c3ccc(cc3)[N+](=O)[O-])C 269982a_100000156523_100000595116 [0,2,0,0,0,0|2,0,0]=4 67 B30R3.5997283531 Cc1ccc(cc1C)n2c(cc(c2C)C(=O)CNc3ccc(cc3)[N+](=O)[O-])C 2230a_100015195142_100000595258 [0,2,0,0,0,0|2,0,0]=4 68 B30R3.5997283531 Cc1ccc(cc1F)n2c(cc(c2C)C(=O)CNc3ccc(cc3)[N+](=O)[O-])C 2230a_100015195142_100000595412 [0,2,0,0,0,0|2,0,0]=4 69 B30R3.5989091033 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNc3ccc(cc3C)[N+](=O)[O-])C 2230a_100000184110_100000595116 [0,2,0,0,0,0|2,0,0]=4 70 B30R3.5989091033 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNc3ccc(cc3C)[N+](=O)[O-])C 7a_100000184110_100000595116 [0,2,0,0,0,0|2,0,0]=4 71 B30R3.5989091657 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNc3ccc(c(c3)C)[N+](=O)[O-])C 7a_100000745639_100000595116 [0,2,0,0,0,0|2,0,0]=4 72 B30R3.5989091657 Cc1ccc(cc1)n2c(cc(c2C)C(=O)CNc3ccc(c(c3)F)[N+](=O)[O-])C 7a_100000741728_100000595116 [0,2,0,0,0,0|2,0,0]=4 73 B26R3.36363024 Cc1cc(c(n1c2ccccc2)C)CNc3ccc(cc3)[N+](=O)[O-] 270302a_100015195142_100000181884 [1,0,0,0,1,0|1,0,1]=4 74 B26R3.150425389 Cc1cc(c(n1c2nccs2)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_200000203708 [1,0,0,0,1,0|2,0,0]=4 75 B28R3.83859717 Cc1cc(c(n1c2ccc(cc2)F)C)C=NNc3cccc(c3)[N+](=O)[O-] 4a_103437854219_100000187854 [0,0,0,0,1,1|1,0,0]=3 76 B30R3.173108437 Cc1cc(c(n1CCc2ccc(cc2)Cl)C)C=NNc3ccc(cn3)[N+](=O)[O-] 4a_100000737981_100000594751 [0,0,0,0,0,2|1,0,0]=3