0 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)C 271570a_100000694244_100000691760 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)N 271570a_100000694244_100000162331 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.585 CC(=O)Cc1ccc(cc1)B(O)O 1458a_100000070787_100009813762 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000070787_100000756337 [0,0,0,0,0,0|3,0,0]=3 4 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000070787_100000231043 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000070787_100000181262 [0,0,0,0,0,0|4,0,0]=4 6 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_200000210301 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.585 CC(=O)Cc1ccc(cc1)C(F)F 1458a_100000070787_200012343607 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.585 CC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_200000210301 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000181861 [0,0,0,0,0,0|1,0,0]=1 10 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200000210301 [0,0,0,0,0,0|1,0,0]=1 11 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C 1458a_100000185149_200000210301 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 11a_100000210537_100015343762 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 1626a_100000210537_100015343762 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 22a_100000210537_100000070787 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 527a_100000210537_100103153847 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)[13CH3] 1458a_100000185149_200025704644 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.585 CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100015343762 [0,0,0,0,0,0|2,0,0]=2 18 B13R1.585 CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100015343762 [0,0,0,0,0,0|2,0,0]=2 19 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210206 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210206 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210206 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210206 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.585 CC(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000689720_200025704644 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_200000210301 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100102631434_100000181861 [0,0,0,0,0,0|3,0,0]=3 26 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_200000210301 [0,0,0,0,0,0|3,0,0]=3 27 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100102631434_100000184243 [0,0,0,0,0,0|3,0,0]=3 28 B13R1.585 CN(C)Cc1ccc(cc1)[N+](=O)[O-] 270004a_100102631434_100000189386 [0,0,0,0,0,0|3,0,0]=3 29 B13R1.585 CN(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011218386_200025704644 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.585 CN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_200025704644 [0,0,0,0,0,0|3,0,0]=3 31 B13R1.585 CN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_200025704644 [0,0,0,0,0,0|3,0,0]=3 32 B13R1.585 [13CH3]C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200025704644 [0,0,0,0,0,0|1,0,0]=1 33 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000140223 [1,0,0,0,0,0|3,0,0]=4 34 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_200009884166_200000210301 [1,0,0,0,0,0|3,0,0]=4 35 B12R1.4 C#Cc1ccc(cc1)CC(=O)[13CH3] 1458a_200009884166_200025704644 [1,0,0,0,0,0|3,0,0]=4 36 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000034074 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 271570a_100011290941_100000691760 [1,0,0,0,0,0|3,0,0]=4 38 B12R1.4 C=Cc1ccc(cc1)CC(=O)N 271570a_100011290941_100000162331 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000070787_100000184898 [1,0,0,0,0,0|3,0,0]=4 40 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200000210301 [1,0,0,0,0,0|3,0,0]=4 41 B12R1.4 CC(=O)Cc1ccc(cc1)C=O 1458a_100000070787_100000075337 [1,0,0,0,0,0|2,0,0]=3 42 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [1,0,0,0,0,0|2,0,1]=4 43 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [1,0,0,0,0,0|2,0,1]=4 44 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [1,0,0,0,0,0|3,0,0]=4 45 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [1,0,0,0,0,0|3,0,0]=4 46 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000691760_200025704644 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000691760 [1,0,0,0,0,0|3,0,0]=4 48 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_100000070787_100000747183 [1,0,0,0,0,0|3,0,0]=4 49 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_200000759805_200000210301 [1,0,0,0,0,0|3,0,0]=4 50 B12R1.4 CCc1ccc(cc1)CC(=O)[13CH3] 1458a_200000759805_200025704644 [1,0,0,0,0,0|3,0,0]=4 51 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [1,0,0,0,0,0|2,0,1]=4 52 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [1,0,0,0,0,0|2,0,1]=4 53 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [1,0,0,0,0,0|3,0,0]=4 57 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [1,0,0,0,0,0|3,0,0]=4 58 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000070787_100000181263 [1,0,0,0,0,0|3,0,0]=4 59 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000756958_200000210301 [1,0,0,0,0,0|3,0,0]=4 60 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_100000691760_200000210301 [1,0,0,0,0,0|3,0,0]=4 61 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_200000210301_100000691760 [1,0,0,0,0,0|3,0,0]=4 62 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [1,0,0,0,0,0|3,0,0]=4 63 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [1,0,0,0,0,0|3,0,0]=4 64 B12R1.4 CSc1ccc(cc1)CC(=O)[13CH3] 1458a_100000756958_200025704644 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200025704644 [1,0,0,0,0,0|3,0,0]=4 66 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [1,0,0,0,0,0|2,0,1]=4 67 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [1,0,0,0,0,0|2,0,1]=4 68 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [1,0,0,0,0,0|2,0,1]=4 69 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [1,0,0,0,0,0|3,0,0]=4 70 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [1,0,0,0,0,0|3,0,0]=4 71 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [1,0,0,0,0,0|3,0,0]=4 72 B12R1.113 C=C(C)c1ccc(cc1)CC=O 271570a_100000694244_100011361690 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.113 CC(=O)c1ccc(cc1)CCO 1458a_100000078963_200000210301 [1,0,0,0,0,0|2,0,1]=4 74 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210202 [1,0,0,0,0,0|2,0,1]=4 75 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210202 [1,0,0,0,0,0|2,0,1]=4 76 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210202 [1,0,0,0,0,0|2,0,1]=4 77 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210202 [1,0,0,0,0,0|2,0,1]=4 78 B12R1.113 CNCc1ccc(cc1)C(=O)[O-] 26a_100102657272_100016998105 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 207a_100102657272_100000189386 [1,0,0,0,0,0|2,0,0]=3 80 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200000210301 [1,0,0,0,0,0|2,0,0]=3 81 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000181861 [1,0,0,0,0,0|2,0,0]=3 82 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 26a_100102657272_100000185810 [1,0,0,0,0,0|2,0,0]=3 83 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 270004a_106832991635_100000189386 [1,0,0,0,0,0|2,0,0]=3 84 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200000210301 [1,0,0,0,0,0|2,0,0]=3 85 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100102657272_100000181861 [1,0,0,0,0,0|2,0,0]=3 86 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000181861 [1,0,0,0,0,0|2,0,0]=3 87 B12R1.113 COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_200000210301 [1,0,0,0,0,0|2,0,0]=3 88 B12R1.113 COCc1ccc(cc1)[N+](=O)[O-] 34a_100138415774_100000181861 [1,0,0,0,0,0|2,0,0]=3 89 B12R1.113 CSCc1ccc(cc1)[N+](=O)[O-] 62a_200000210301_100000184243 [1,0,0,0,0,0|2,0,0]=3 90 B12R1.113 O=[N+]([O-])c1ccc(cc1)NCF 34a_100015195142_100015361967 [1,0,0,0,0,0|2,0,1]=4 91 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 34a_100000185810_100015361967 [1,0,0,0,0,0|2,0,1]=4 92 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 7a_100000185810_100015361967 [1,0,0,0,0,0|2,0,1]=4 93 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CCO 1458a_100000078963_200025704644 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200025704644 [1,0,0,0,0,0|2,0,0]=3 95 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200025704644 [1,0,0,0,0,0|2,0,0]=3 96 B12R1.113 [13CH3]OCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_200025704644 [1,0,0,0,0,0|2,0,0]=3 97 B12R1.113 [13CH3]SCc1ccc(cc1)[N+](=O)[O-] 62a_200025704644_100000184243 [1,0,0,0,0,0|2,0,0]=3 98 B14R1.124 CC(=O)Cc1ccc(cc1Br)C(=O)C 1458a_100000070787_100010884425 [0,1,0,0,0,0|3,0,0]=4 99 B14R1.124 CC(=O)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000070787_100000741879 [0,1,0,0,0,0|1,0,0]=2 100 B14R1.124 CC(=O)Cc1ccc(cc1C)[N+](=O)[O-] 1458a_100000070787_100010218038 [0,1,0,0,0,0|1,0,0]=2 101 B14R1.124 CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000070787_100000747184 [0,1,0,0,0,0|1,0,0]=2 102 B14R1.124 CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_200000210301 [0,1,0,0,0,0|1,0,0]=2 103 B14R1.124 CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000070787_100000759423 [0,1,0,0,0,0|1,0,0]=2 104 B14R1.124 CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_200000210301 [0,1,0,0,0,0|1,0,0]=2 105 B14R1.124 CC(=O)Nc1ccc(cc1C)[N+](=O)[O-] 11a_100000184110_100015343762 [0,1,0,0,0,0|2,0,0]=3 106 B14R1.124 CC(=O)Nc1ccc(cc1Cl)[N+](=O)[O-] 11a_100000185723_100015343762 [0,1,0,0,0,0|2,0,0]=3 107 B14R1.124 CC(=O)Nc1ccc(cc1F)[N+](=O)[O-] 11a_100000745739_100015343762 [0,1,0,0,0,0|2,0,0]=3 108 B14R1.124 CC(=O)Nc1ccc(cc1F)[N+](=O)[O-] 1626a_100000745739_100015343762 [0,1,0,0,0,0|2,0,0]=3 109 B14R1.124 CC(=O)Nc1ccc(cc1I)[N+](=O)[O-] 1626a_100012047210_100015343762 [0,1,0,0,0,0|2,0,0]=3 110 B14R1.124 CC(=O)Nc1ccc(cc1O)[N+](=O)[O-] 22a_100000210499_100000070787 [0,1,0,0,0,0|2,0,0]=3 111 B14R1.124 CC(=O)Nc1ccc(cc1O)[N+](=O)[O-] 527a_100000210499_100103153847 [0,1,0,0,0,0|2,0,0]=3 112 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 2230a_100102631434_100000741879 [0,1,0,0,0,0|3,0,0]=4 113 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 269982a_100102631434_100000741879 [0,1,0,0,0,0|3,0,0]=4 114 B14R1.124 CN(C)Cc1ccc(cc1Br)[N+](=O)[O-] 270004a_100102631434_100011202981 [0,1,0,0,0,0|3,0,0]=4 115 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 2230a_100102631434_100000747184 [0,1,0,0,0,0|3,0,0]=4 116 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 269982a_100102631434_100000747184 [0,1,0,0,0,0|3,0,0]=4 117 B14R1.124 CN(C)Cc1ccc(cc1Cl)[N+](=O)[O-] 270004a_100102631434_100000755334 [0,1,0,0,0,0|3,0,0]=4 118 B14R1.124 CN(C)Cc1ccc(cc1F)[N+](=O)[O-] 2230a_100102631434_100000759423 [0,1,0,0,0,0|3,0,0]=4 119 B14R1.124 CN(C)Cc1ccc(cc1F)[N+](=O)[O-] 269982a_100102631434_100000759423 [0,1,0,0,0,0|3,0,0]=4 120 B14R1.124 Cc1cc(ccc1CN(C)C)[N+](=O)[O-] 2230a_100102631434_100010218038 [0,1,0,0,0,0|3,0,0]=4 121 B14R1.124 Cc1cc(ccc1CN(C)C)[N+](=O)[O-] 269982a_100102631434_100010218038 [0,1,0,0,0,0|3,0,0]=4 122 B14R1.124 [13CH3]C(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_200025704644 [0,1,0,0,0,0|1,0,0]=2 123 B14R1.124 [13CH3]C(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_200025704644 [0,1,0,0,0,0|1,0,0]=2 124 B14R1.414 CS(=O)(=O)Nc1ccc(cc1)[N+](=O)[O-] 40a_100015195142_100000738038 [0,1,0,0,0,0|2,0,1]=4 125 B14R1.717 CNC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000753832 [0,1,0,0,0,0|3,0,0]=4 126 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000735637 [0,1,0,0,0,0|2,0,1]=4 127 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100012277402_200000210301 [0,1,0,0,0,0|2,0,1]=4 128 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100012277402_200025704644 [0,1,0,0,0,0|2,0,1]=4 129 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)C 1458a_100000070787_100000717844 [0,1,0,0,0,0|2,0,1]=4 130 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)C 1458a_100011219842_200000210301 [0,1,0,0,0,0|2,0,1]=4 131 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000070787_200012292325 [0,1,0,0,0,0|2,0,1]=4 132 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000751520_200000210301 [0,1,0,0,0,0|2,0,1]=4 133 B14R1.806 CS(=O)(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011219842_200025704644 [0,1,0,0,0,0|2,0,1]=4 134 B14R1.806 [13CH3]C(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000751520_200025704644 [0,1,0,0,0,0|2,0,1]=4 135 B14R1.2879 C#CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000211873_100000756337 [0,1,0,0,0,0|3,0,0]=4 136 B14R1.2879 C#CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000211873_100000231043 [0,1,0,0,0,0|3,0,0]=4 137 B14R1.2879 C#CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000211873_100000181861 [0,1,0,0,0,0|1,0,0]=2 138 B14R1.2879 C=C(C)c1ccc(cc1)CC(=O)OC 271570a_100000694244_100000149743 [0,1,0,0,0,0|3,0,0]=4 139 B14R1.2879 C=CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000185746_100000756337 [0,1,0,0,0,0|3,0,0]=4 140 B14R1.2879 C=CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000185746_100000231043 [0,1,0,0,0,0|3,0,0]=4 141 B14R1.2879 C=CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000185746_100000181861 [0,1,0,0,0,0|1,0,0]=2 142 B14R1.2879 C=CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000185746 [0,1,0,0,0,0|2,0,0]=3 143 B14R1.2879 CC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000756337 [0,1,0,0,0,0|2,0,0]=3 144 B14R1.2879 CC(C)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181262 [0,1,0,0,0,0|3,0,0]=4 145 B14R1.2879 CC(CO)Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100012180447 [0,1,0,0,0,0|2,0,1]=4 146 B14R1.2879 CC(CO)Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100012180447 [0,1,0,0,0,0|2,0,1]=4 147 B14R1.2879 CC(CO)Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100012180447 [0,1,0,0,0,0|2,0,1]=4 148 B14R1.2879 CC(CO)Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100012180447 [0,1,0,0,0,0|2,0,1]=4 149 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000210414_100000756337 [0,1,0,0,0,0|3,0,0]=4 150 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000210414_100000231043 [0,1,0,0,0,0|3,0,0]=4 151 B14R1.2879 CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210414_100000181861 [0,1,0,0,0,0|1,0,0]=2 152 B14R1.2879 CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000210202 [0,1,0,0,0,0|1,0,0]=2 153 B14R1.2879 CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000210414 [0,1,0,0,0,0|2,0,0]=3 154 B14R1.2879 CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000210414 [0,1,0,0,0,0|2,0,0]=3 155 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100000225621_100000181861 [0,1,0,0,0,0|3,0,0]=4 156 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_100000210202 [0,1,0,0,0,0|3,0,0]=4 157 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100103154555_200000210301 [0,1,0,0,0,0|3,0,0]=4 158 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100000225621_100000184243 [0,1,0,0,0,0|3,0,0]=4 159 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100000204670 [0,1,0,0,0,0|3,0,0]=4 160 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100103154555_200000210301 [0,1,0,0,0,0|3,0,0]=4 161 B14R1.2879 CCN(C)Cc1ccc(cc1)[N+](=O)[O-] 26a_100000225621_100000185810 [0,1,0,0,0,0|3,0,0]=4 162 B14R1.2879 CCN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 2230a_100103154555_200025704644 [0,1,0,0,0,0|3,0,0]=4 163 B14R1.2879 CCN([13CH3])Cc1ccc(cc1)[N+](=O)[O-] 269982a_100103154555_200025704644 [0,1,0,0,0,0|3,0,0]=4 164 B14R1.2879 CN(CF)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100015361967 [0,1,0,0,0,0|3,0,0]=4 165 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000210908 [0,1,0,0,0,0|1,0,0]=2 166 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000210908 [0,1,0,0,0,0|1,0,0]=2 167 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000210908 [0,1,0,0,0,0|1,0,0]=2 168 B14R1.2879 CNC(=O)Nc1ccc(cc1)[N+](=O)[O-] 2430a_100015195142_100102657272 [0,1,0,0,0,0|2,0,0]=3 169 B14R1.2879 CNC(C)Cc1ccc(cc1)[N+](=O)[O-] 270004a_106832991635_100011217814 [0,1,0,0,0,0|2,0,1]=4 170 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000111013_200000210301 [0,1,0,0,0,0|2,0,0]=3 171 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000111013_200025704644 [0,1,0,0,0,0|2,0,0]=3 172 B14R1.2879 NC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000231043 [0,1,0,0,0,0|2,0,0]=3 173 B14R1.2879 NC(=O)c1ccc(cc1)NC(=O)CO 22a_100000210537_100000210174 [0,1,0,0,0,0|3,0,0]=4 174 B14R1.2879 NC(=O)c1ccc(cc1)NC(=O)CO 527a_100000210537_100000210174 [0,1,0,0,0,0|3,0,0]=4 175 B14R1.2879 O=C(CF)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100015361967 [0,1,0,0,0,0|1,0,0]=2 176 B14R1.2879 O=C(CO)Cc1ccc(cc1)B(O)O 1458a_100000210174_100009813762 [0,1,0,0,0,0|1,0,2]=4 177 B14R1.2879 O=C(CO)Cc1ccc(cc1)C(F)F 1458a_100000210174_200012343607 [0,1,0,0,0,0|3,0,0]=4 178 B14R1.2879 O=C(CO)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210174_100000181861 [0,1,0,0,0,0|0,0,0]=1 179 B14R1.5801 CC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_200000210301 [0,1,0,0,0,0|1,0,0]=2 180 B14R1.5801 CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000070787_100009816690 [0,1,0,0,0,0|1,0,0]=2 181 B14R1.5801 CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100011935184_200000210301 [0,1,0,0,0,0|1,0,0]=2 182 B14R1.5801 CC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000070787_100000687068 [0,1,0,0,0,0|1,0,0]=2 183 B14R1.5801 CC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_200000210301 [0,1,0,0,0,0|1,0,0]=2 184 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)[N+](=O)[O-] 11a_100000693983_100015343762 [0,1,0,0,0,0|2,0,0]=3 185 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)[N+](=O)[O-] 527a_100000693983_100103153847 [0,1,0,0,0,0|2,0,0]=3 186 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 11a_100000745639_100015343762 [0,1,0,0,0,0|2,0,0]=3 187 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 22a_100000745639_100000070787 [0,1,0,0,0,0|2,0,0]=3 188 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 527a_100000745639_100103153847 [0,1,0,0,0,0|2,0,0]=3 189 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 11a_100000750973_100015343762 [0,1,0,0,0,0|2,0,0]=3 190 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 1626a_100000750973_100015343762 [0,1,0,0,0,0|2,0,0]=3 191 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)[N+](=O)[O-] 11a_100000741728_100015343762 [0,1,0,0,0,0|2,0,0]=3 192 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)[N+](=O)[O-] 1626a_100000741728_100015343762 [0,1,0,0,0,0|2,0,0]=3 193 B14R1.5801 CN(C)Cc1ccc(c(c1)Br)[N+](=O)[O-] 270004a_100102631434_100009998837 [0,1,0,0,0,0|3,0,0]=4 194 B14R1.5801 CN(C)Cc1ccc(c(c1)Cl)[N+](=O)[O-] 270004a_100102631434_100000070945 [0,1,0,0,0,0|3,0,0]=4 195 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 2230a_100102631434_100000687068 [0,1,0,0,0,0|3,0,0]=4 196 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 269982a_100102631434_100000687068 [0,1,0,0,0,0|3,0,0]=4 197 B14R1.5801 CN(C)Cc1ccc(c(c1)F)[N+](=O)[O-] 270004a_100102631434_100011934122 [0,1,0,0,0,0|3,0,0]=4 198 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CC(=O)[13CH3] 1458a_100011935184_200025704644 [0,1,0,0,0,0|1,0,0]=2 199 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 2230a_100102631434_100009816690 [0,1,0,0,0,0|3,0,0]=4 200 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 269982a_100102631434_100009816690 [0,1,0,0,0,0|3,0,0]=4 201 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CN(C)C 270004a_100102631434_100000050484 [0,1,0,0,0,0|3,0,0]=4 202 B14R1.5801 [13CH3]C(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_200025704644 [0,1,0,0,0,0|1,0,0]=2 203 B14R1.5801 [13CH3]C(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_200025704644 [0,1,0,0,0,0|1,0,0]=2 204 B14R1.6402 CC(=O)C(C)c1ccc(cc1)C(=O)N 1458a_200011092970_200000210301 [0,1,0,0,0,0|3,0,0]=4 205 B14R1.6402 CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000684656 [0,1,0,0,0,0|1,0,0]=2 206 B14R1.6402 CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_200000210301 [0,1,0,0,0,0|1,0,0]=2 207 B14R1.6402 CC(=O)N(C)c1ccc(cc1)[N+](=O)[O-] 11a_100000156523_100015343762 [0,1,0,0,0,0|2,0,0]=3 208 B14R1.6402 CC(C(=O)[13CH3])c1ccc(cc1)C(=O)N 1458a_200011092970_200025704644 [0,1,0,0,0,0|3,0,0]=4 209 B14R1.6402 CC(C(=O)[13CH3])c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_200025704644 [0,1,0,0,0,0|1,0,0]=2 210 B14R1.6402 CC(c1ccc(cc1)[N+](=O)[O-])N(C)C 2230a_100102631434_100000684656 [0,1,0,0,0,0|3,0,0]=4 211 B14R1.6402 CC(c1ccc(cc1)[N+](=O)[O-])N(C)C 269982a_100102631434_100000684656 [0,1,0,0,0,0|3,0,0]=4 212 B14R2.601 CC(=O)c1ccc2[nH]c(=O)oc2c1 1458a_100000744649_200000210301 [0,0,0,1,0,0|3,0,0]=4 213 B14R2.601 CN1Cc2ccc(cc2C1)[N+](=O)[O-] 2230a_100000763510_200000210301 [0,0,0,1,0,0|3,0,0]=4 214 B14R2.601 CN1Cc2ccc(cc2C1)[N+](=O)[O-] 269982a_100000763510_200000210301 [0,0,0,1,0,0|3,0,0]=4 215 B14R2.601 [13CH3]C(=O)c1ccc2[nH]c(=O)oc2c1 1458a_100000744649_200025704644 [0,0,0,1,0,0|3,0,0]=4 216 B14R2.601 [13CH3]N1Cc2ccc(cc2C1)[N+](=O)[O-] 2230a_100000763510_200025704644 [0,0,0,1,0,0|3,0,0]=4 217 B14R2.601 [13CH3]N1Cc2ccc(cc2C1)[N+](=O)[O-] 269982a_100000763510_200025704644 [0,0,0,1,0,0|3,0,0]=4 218 B12R1.256 CC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200000210301 [0,0,0,0,1,0|3,0,0]=4 219 B12R1.256 CC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_200000210301 [0,0,0,0,1,0|3,0,0]=4 220 B12R1.256 CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200000210301 [0,0,0,0,1,0|1,0,0]=2 221 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200000210301 [0,0,0,0,1,0|3,0,0]=4 222 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200000210301 [0,0,0,0,1,0|3,0,0]=4 223 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200000210301 [0,0,0,0,1,0|3,0,0]=4 224 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200025704644 [0,0,0,0,1,0|3,0,0]=4 225 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200025704644 [0,0,0,0,1,0|3,0,0]=4 226 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200025704644 [0,0,0,0,1,0|3,0,0]=4 227 B12R1.256 CS(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_200000217594_200025704644 [0,0,0,0,1,0|3,0,0]=4 228 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200025704644 [0,0,0,0,1,0|3,0,0]=4 229 B12R1.256 [13CH3]C(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200025704644 [0,0,0,0,1,0|1,0,0]=2 230 B12R1.389 CC(=O)Cc1ccc(o1)[N+](=O)[O-] 1458a_100000070787_200011215689 [0,0,0,0,1,0|2,0,0]=3 231 B12R1.389 CC(=O)Cc1ccc(s1)[N+](=O)[O-] 1458a_100000070787_200010296502 [0,0,0,0,1,0|2,0,0]=3 232 B12R1.389 CC(=O)Cn1cc(cn1)[N+](=O)[O-] 1458a_100000736791_200000210301 [0,0,0,0,1,0|3,0,0]=4 233 B12R1.389 CC(=O)Cn1ccc(n1)[N+](=O)[O-] 1458a_100000741340_200000210301 [0,0,0,0,1,0|3,0,0]=4 234 B12R1.389 CC(=O)Cn1cnc(c1)[N+](=O)[O-] 1458a_100160446419_200000210301 [0,0,0,0,1,0|3,0,0]=4 235 B12R1.389 [13CH3]C(=O)Cn1cc(cn1)[N+](=O)[O-] 1458a_100000736791_200025704644 [0,0,0,0,1,0|3,0,0]=4 236 B12R1.389 [13CH3]C(=O)Cn1ccc(n1)[N+](=O)[O-] 1458a_100000741340_200025704644 [0,0,0,0,1,0|3,0,0]=4 237 B12R1.389 [13CH3]C(=O)Cn1cnc(c1)[N+](=O)[O-] 1458a_100160446419_200025704644 [0,0,0,0,1,0|3,0,0]=4 238 B14R1.419 C=C(C)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000748629 [0,0,0,0,0,1|2,0,0]=3 239 B14R1.419 C=C(C)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000748629 [0,0,0,0,0,1|2,0,0]=3 240 B14R1.419 C=C(C)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000748629 [0,0,0,0,0,1|2,0,0]=3 241 B14R1.419 C=C(C)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000748629 [0,0,0,0,0,1|2,0,0]=3 242 B14R1.419 C=C(C)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000748629 [0,0,0,0,0,1|3,0,0]=4 243 B14R1.419 C=C(F)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100009893438 [0,0,0,0,0,1|2,0,0]=3 244 B14R1.419 C=C(F)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100009893438 [0,0,0,0,0,1|2,0,0]=3 245 B14R1.419 C=C(F)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100009893438 [0,0,0,0,0,1|2,0,0]=3 246 B14R1.419 C=C(F)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000042424 [0,0,0,0,0,1|2,0,0]=3 247 B14R1.419 C=C(F)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000042424 [0,0,0,0,0,1|3,0,0]=4 248 B14R1.419 CC(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000182685_200000210301 [0,0,0,0,0,1|1,0,1]=3 249 B14R1.419 CC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000070787_200000038727 [0,0,0,0,0,1|3,0,0]=4 250 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000736421 [0,0,0,0,0,1|1,0,0]=2 251 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200000210301 [0,0,0,0,0,1|1,0,0]=2 252 B14R1.419 CC(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200000210301 [0,0,0,0,0,1|1,0,0]=2 253 B14R1.419 CC(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200000210301 [0,0,0,0,0,1|1,0,0]=2 254 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)C 1458a_100000193300_200000210301 [0,0,0,0,0,1|3,0,0]=4 255 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 11a_100000185037_100015343762 [0,0,0,0,0,1|3,0,0]=4 256 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 1626a_100000185037_100015343762 [0,0,0,0,0,1|3,0,0]=4 257 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 240690a_100000185037_100015343762 [0,0,0,0,0,1|3,0,0]=4 258 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 527a_100000185037_100103153847 [0,0,0,0,0,1|3,0,0]=4 259 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)[13CH3] 1458a_100000193300_200025704644 [0,0,0,0,0,1|3,0,0]=4 260 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 11a_100000742766_100015343762 [0,0,0,0,0,1|1,0,0]=2 261 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_100015343762 [0,0,0,0,0,1|1,0,0]=2 262 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 527a_100000742766_100103153847 [0,0,0,0,0,1|1,0,0]=2 263 B14R1.419 CC(=O)NNc1ccc(cc1)[N+](=O)[O-] 22a_100000006255_100000070787 [0,0,0,0,0,1|2,0,0]=3 264 B14R1.419 CC(=O)NNc1ccc(cn1)[N+](=O)[O-] 22a_100000737981_100000070787 [0,0,0,0,0,1|3,0,0]=4 265 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)C 1458a_100000006716_200000210301 [0,0,0,0,0,1|3,0,0]=4 266 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)[13CH3] 1458a_100000006716_200025704644 [0,0,0,0,0,1|3,0,0]=4 267 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200000210301 [0,0,0,0,0,1|3,0,0]=4 268 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 34a_100000185113_100000187820 [0,0,0,0,0,1|3,0,0]=4 269 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 7a_100000185113_100000187820 [0,0,0,0,0,1|3,0,0]=4 270 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)[O-] 34a_100000185113_100020667443 [0,0,0,0,0,1|2,0,1]=4 271 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000185465_100000747473 [0,0,0,0,0,1|3,0,0]=4 272 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000185465 [0,0,0,0,0,1|3,0,0]=4 273 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100000185465_100020667443 [0,0,0,0,0,1|2,0,1]=4 274 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185465 [0,0,0,0,0,1|2,0,1]=4 275 B14R1.419 CC(C)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210760 [0,0,0,0,0,1|2,0,1]=4 276 B14R1.419 CC(C)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210624 [0,0,0,0,0,1|2,0,1]=4 277 B14R1.419 CC(C)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210624 [0,0,0,0,0,1|2,0,1]=4 278 B14R1.419 CC(C)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210760 [0,0,0,0,0,1|2,0,1]=4 279 B14R1.419 CC(C)NCc1ccc(cc1)[N+](=O)[O-] 207a_100138425928_100000189386 [0,0,0,0,0,1|2,0,1]=4 280 B14R1.419 CC(C)NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000210206 [0,0,0,0,0,1|2,0,1]=4 281 B14R1.419 CC(C)NCc1ccc(cc1)[N+](=O)[O-] 2230a_100138425928_100000181861 [0,0,0,0,0,1|2,0,1]=4 282 B14R1.419 CC(C)NCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000210206 [0,0,0,0,0,1|2,0,1]=4 283 B14R1.419 CC(C)NCc1ccc(cc1)[N+](=O)[O-] 34a_100138425928_100000181861 [0,0,0,0,0,1|2,0,1]=4 284 B14R1.419 CC(C)OCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000210206 [0,0,0,0,0,1|2,0,1]=4 285 B14R1.419 CC(C)OCc1ccc(cc1)[N+](=O)[O-] 34a_100000212225_100000181861 [0,0,0,0,0,1|2,0,1]=4 286 B14R1.419 CC(C)SCc1ccc(cc1)[N+](=O)[O-] 62a_100000210206_100000184243 [0,0,0,0,0,1|2,0,1]=4 287 B14R1.419 CC(O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100011218427 [0,0,0,0,0,1|1,0,1]=3 288 B14R1.419 CC(O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100011218427 [0,0,0,0,0,1|1,0,1]=3 289 B14R1.419 CC(O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100011218427 [0,0,0,0,0,1|1,0,1]=3 290 B14R1.419 CC(O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100011218427 [0,0,0,0,0,1|1,0,1]=3 291 B14R1.419 CC(O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100011218427 [0,0,0,0,0,1|2,0,1]=4 292 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 2230a_100000009637_200000210301 [0,0,0,0,0,1|3,0,0]=4 293 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 2230a_100102631434_100000736421 [0,0,0,0,0,1|3,0,0]=4 294 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 269982a_100000009637_200000210301 [0,0,0,0,0,1|3,0,0]=4 295 B14R1.419 CN(C)CCc1ccc(cc1)[N+](=O)[O-] 269982a_100102631434_100000736421 [0,0,0,0,0,1|3,0,0]=4 296 B14R1.419 CN([13CH3])CCc1ccc(cc1)[N+](=O)[O-] 2230a_100000009637_200025704644 [0,0,0,0,0,1|3,0,0]=4 297 B14R1.419 CN([13CH3])CCc1ccc(cc1)[N+](=O)[O-] 269982a_100000009637_200025704644 [0,0,0,0,0,1|3,0,0]=4 298 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 34a_200000064373_100000187820 [0,0,0,0,0,1|3,0,0]=4 299 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 7a_200000064373_100000187820 [0,0,0,0,0,1|3,0,0]=4 300 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)[O-] 34a_200000064373_100020667443 [0,0,0,0,0,1|2,0,1]=4 301 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)N 62a_100009816266_100000747473 [0,0,0,0,0,1|3,0,0]=4 302 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100009816266_100020667443 [0,0,0,0,0,1|2,0,1]=4 303 B14R1.419 C[C@@H](O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100009817552 [0,0,0,0,0,1|1,0,1]=3 304 B14R1.419 C[C@@H](O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100009817552 [0,0,0,0,0,1|1,0,1]=3 305 B14R1.419 C[C@@H](O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100009817552 [0,0,0,0,0,1|1,0,1]=3 306 B14R1.419 C[C@@H](O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100009817552 [0,0,0,0,0,1|1,0,1]=3 307 B14R1.419 C[C@@H](O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100009817552 [0,0,0,0,0,1|2,0,1]=4 308 B14R1.419 NC(=O)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000187820 [0,0,0,0,0,1|3,0,0]=4 309 B14R1.419 NC(=O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000747473 [0,0,0,0,0,1|1,0,0]=2 310 B14R1.419 NC(=O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000187820 [0,0,0,0,0,1|1,0,0]=2 311 B14R1.419 NC(=O)COc1ccc(cc1)C(=O)N 34a_100000746352_100000187820 [0,0,0,0,0,1|3,0,0]=4 312 B14R1.419 NC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000187820 [0,0,0,0,0,1|3,0,0]=4 313 B14R1.419 NC(=O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000187820 [0,0,0,0,0,1|1,0,0]=2 314 B14R1.419 NC(=O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000187820 [0,0,0,0,0,1|1,0,0]=2 315 B14R1.419 NC(=O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000187820 [0,0,0,0,0,1|2,0,0]=3 316 B14R1.419 NC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000747473 [0,0,0,0,0,1|3,0,0]=4 317 B14R1.419 NC(=O)CSc1ccc(cc1)C(=O)N 62a_100000747473_100000162191 [0,0,0,0,0,1|3,0,0]=4 318 B14R1.419 NC(=O)c1ccc(cc1)NCC(=O)[O-] 34a_100000210537_100020667443 [0,0,0,0,0,1|2,0,1]=4 319 B14R1.419 NC(=O)c1ccc(cc1)OCC(=O)[O-] 34a_100000746352_100020667443 [0,0,0,0,0,1|2,0,1]=4 320 B14R1.419 NC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100000162191_100020667443 [0,0,0,0,0,1|2,0,1]=4 321 B14R1.419 NC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000162191 [0,0,0,0,0,1|2,0,1]=4 322 B14R1.419 O=C([O-])CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100020667443 [0,0,0,0,0,1|0,0,1]=2 323 B14R1.419 O=C([O-])COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100020667443 [0,0,0,0,0,1|0,0,1]=2 324 B14R1.419 O=[N+]([O-])CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000761209 [0,0,0,0,0,1|1,0,1]=3 325 B14R1.419 O=[N+]([O-])COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000761209 [0,0,0,0,0,1|1,0,1]=3 326 B14R1.419 O=[N+]([O-])c1ccc(cc1)NCC(F)F 2230a_100015195142_100011934356 [0,0,0,0,0,1|2,0,1]=4 327 B14R1.419 O=[N+]([O-])c1ccc(cc1)NCC(F)F 34a_100015195142_100011934356 [0,0,0,0,0,1|2,0,1]=4 328 B14R1.419 O=[N+]([O-])c1ccc(cc1)OCC(F)F 34a_100000185810_100011934356 [0,0,0,0,0,1|2,0,1]=4 329 B14R1.419 O=[N+]([O-])c1ccc(cc1)OCC(F)F 7a_100000185810_100011934356 [0,0,0,0,0,1|2,0,1]=4 330 B14R1.419 [13CH3]C(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000182685_200025704644 [0,0,0,0,0,1|1,0,1]=3 331 B14R1.419 [13CH3]C(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200025704644 [0,0,0,0,0,1|1,0,0]=2 332 B14R1.419 [13CH3]C(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200025704644 [0,0,0,0,0,1|1,0,0]=2 333 B14R1.419 [13CH3]C(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200025704644 [0,0,0,0,0,1|1,0,0]=2 334 B14R1.419 [13CH3]C(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200025704644 [0,0,0,0,0,1|3,0,0]=4 335 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000070787_100000731167 [0,0,0,0,0,1|3,0,0]=4 336 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000199044_200000210301 [0,0,0,0,0,1|3,0,0]=4 337 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 11a_100000738315_100015343762 [0,0,0,0,0,1|3,0,0]=4 338 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 1626a_100000738315_100015343762 [0,0,0,0,0,1|3,0,0]=4 339 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 22a_100000738315_100000070787 [0,0,0,0,0,1|3,0,0]=4 340 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 527a_100000738315_100103153847 [0,0,0,0,0,1|3,0,0]=4 341 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)[13CH3] 1458a_100000199044_200025704644 [0,0,0,0,0,1|3,0,0]=4 342 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [2,0,0,0,0,0|2,0,0]=4 343 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [2,0,0,0,0,0|2,0,0]=4 344 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [2,0,0,0,0,0|2,0,0]=4 345 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [2,0,0,0,0,0|2,0,0]=4 348 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [2,0,0,0,0,0|2,0,0]=4 349 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [2,0,0,0,0,0|2,0,0]=4 351 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [2,0,0,0,0,0|2,0,0]=4 352 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [2,0,0,0,0,0|1,0,1]=4 353 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [2,0,0,0,0,0|1,0,1]=4 354 B11R1.20 CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000210301 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [2,0,0,0,0,0|2,0,0]=4 356 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [2,0,0,0,0,0|1,0,1]=4 357 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [2,0,0,0,0,0|2,0,0]=4 360 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [2,0,0,0,0,0|2,0,0]=4 361 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [2,0,0,0,0,0|1,0,1]=4 362 B11R1.20 [13CH3]C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200025704644 [2,0,0,0,0,0|2,0,0]=4 363 B11R1.83 C=Cc1ccc(cc1)CC=O 271570a_100011290941_100011361690 [2,0,0,0,0,0|2,0,0]=4 364 B11R1.83 CSc1ccc(cc1)CC=O 62a_100011361690_200000210301 [2,0,0,0,0,0|2,0,0]=4 365 B11R1.83 CSc1ccc(cc1)CC=O 62a_200000210301_100011361690 [2,0,0,0,0,0|2,0,0]=4 366 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_100011361690_200025704644 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_200025704644_100011361690 [2,0,0,0,0,0|2,0,0]=4 368 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [2,0,0,0,0,0|2,0,0]=4 369 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200000210301 [2,0,0,0,0,0|1,0,1]=4 370 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200000210301 [2,0,0,0,0,0|1,0,1]=4 371 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [2,0,0,0,0,0|1,0,1]=4 372 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [2,0,0,0,0,0|1,0,1]=4 373 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [2,0,0,0,0,0|2,0,0]=4 374 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200025704644 [2,0,0,0,0,0|1,0,1]=4 375 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200025704644 [2,0,0,0,0,0|1,0,1]=4 376 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [2,0,0,0,0,0|1,0,1]=4 377 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [2,0,0,0,0,0|1,0,1]=4 378 B13R1.5 C#CC(=O)Cc1ccc(cc1)C=O 1458a_100000211873_100000075337 [1,1,0,0,0,0|2,0,0]=4 379 B13R1.5 C#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000140223 [1,1,0,0,0,0|2,0,0]=4 380 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=O 1458a_100000185746_100000075337 [1,1,0,0,0,0|2,0,0]=4 381 B13R1.5 C=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000034074 [1,1,0,0,0,0|2,0,0]=4 382 B13R1.5 C=Cc1ccc(cc1)CC(=O)OC 271570a_100011290941_100000149743 [1,1,0,0,0,0|2,0,0]=4 383 B13R1.5 CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210414_100000075337 [1,1,0,0,0,0|2,0,0]=4 384 B13R1.5 CCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000747183 [1,1,0,0,0,0|2,0,0]=4 385 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [1,1,0,0,0,0|2,0,0]=4 386 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [1,1,0,0,0,0|2,0,0]=4 387 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [1,1,0,0,0,0|2,0,0]=4 388 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [1,1,0,0,0,0|2,0,0]=4 389 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [1,1,0,0,0,0|2,0,0]=4 390 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [1,1,0,0,0,0|2,0,0]=4 391 B13R1.5 CSc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181263 [1,1,0,0,0,0|2,0,0]=4 392 B13R1.5 N#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000184898 [1,1,0,0,0,0|2,0,0]=4 393 B13R1.5 O=C(CO)Cc1ccc(cc1)CO 1458a_100000210174_100000067286 [1,1,0,0,0,0|1,0,1]=4 394 B13R1.5 O=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000075337 [1,1,0,0,0,0|1,0,0]=3 395 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C=O 1458a_100000070787_100010142638 [1,1,0,0,0,0|2,0,0]=4 396 B13R1.142 CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_200000210301 [1,1,0,0,0,0|1,0,1]=4 397 B13R1.142 [13CH3]NCc1ccc(cc1)CC(=O)O 269956a_100016989728_200025704644 [1,1,0,0,0,0|1,0,1]=4 398 B13R1.74 C#CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000038162 [1,1,0,0,0,0|1,0,1]=4 399 B13R1.74 C#CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000184674 [1,1,0,0,0,0|1,0,1]=4 400 B13R1.74 C#CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000184674 [1,1,0,0,0,0|1,0,1]=4 401 B13R1.74 C#CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000038162 [1,1,0,0,0,0|1,0,1]=4 402 B13R1.74 C=CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210623 [1,1,0,0,0,0|1,0,0]=3 403 B13R1.74 C=CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100015514636 [1,1,0,0,0,0|1,0,0]=3 404 B13R1.74 C=CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100015514636 [1,1,0,0,0,0|1,0,0]=3 405 B13R1.74 C=CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100015514636 [1,1,0,0,0,0|1,0,0]=3 406 B13R1.74 C=CCOc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100015514636 [1,1,0,0,0,0|2,0,0]=4 407 B13R1.74 CC(=O)c1ccc(cc1)OCC=O 34a_100000185113_200009817547 [1,1,0,0,0,0|2,0,0]=4 408 B13R1.74 CC(=O)c1ccc(cc1)OCC=O 7a_100000185113_200015260668 [1,1,0,0,0,0|2,0,0]=4 409 B13R1.74 CC(=O)c1ccc(cc1)SCC=O 62a_100000185465_200015260668 [1,1,0,0,0,0|2,0,0]=4 410 B13R1.74 CC(=O)c1ccc(cc1)SCC=O 62a_200015260668_100000185465 [1,1,0,0,0,0|2,0,0]=4 411 B13R1.74 CC=NNc1ccc(cc1)[N+](=O)[O-] 4a_100000006255_200000210099 [1,1,0,0,0,0|2,0,0]=4 412 B13R1.74 CCCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210303 [1,1,0,0,0,0|1,0,1]=4 413 B13R1.74 CCCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210303 [1,1,0,0,0,0|1,0,1]=4 414 B13R1.74 CCCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210303 [1,1,0,0,0,0|1,0,1]=4 415 B13R1.74 CCCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210303 [1,1,0,0,0,0|1,0,1]=4 416 B13R1.74 CCNCc1ccc(cc1)[N+](=O)[O-] 207a_100015525214_100000189386 [1,1,0,0,0,0|1,0,1]=4 417 B13R1.74 CCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000210202 [1,1,0,0,0,0|1,0,1]=4 418 B13R1.74 CCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100015525214_100000181861 [1,1,0,0,0,0|1,0,1]=4 419 B13R1.74 CCNCc1ccc(cc1)[N+](=O)[O-] 270004a_100015525214_100000189386 [1,1,0,0,0,0|1,0,1]=4 420 B13R1.74 CCNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000210202 [1,1,0,0,0,0|1,0,1]=4 421 B13R1.74 CCOCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000210202 [1,1,0,0,0,0|1,0,1]=4 422 B13R1.74 CCOCc1ccc(cc1)[N+](=O)[O-] 34a_100121572206_100000181861 [1,1,0,0,0,0|1,0,1]=4 423 B13R1.74 CCSCc1ccc(cc1)[N+](=O)[O-] 62a_100000210202_100000184243 [1,1,0,0,0,0|1,0,1]=4 424 B13R1.74 CNCCc1ccc(cc1)[N+](=O)[O-] 2230a_100000744123_200000210301 [1,1,0,0,0,0|1,0,1]=4 425 B13R1.74 CNCCc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000736421 [1,1,0,0,0,0|1,0,1]=4 426 B13R1.74 CNCCc1ccc(cc1)[N+](=O)[O-] 34a_100000744123_200000210301 [1,1,0,0,0,0|1,0,1]=4 427 B13R1.74 CNCCc1ccc(cc1)[N+](=O)[O-] 34a_100102657272_100000736421 [1,1,0,0,0,0|1,0,1]=4 428 B13R1.74 CNCCc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000736421 [1,1,0,0,0,0|1,0,1]=4 429 B13R1.74 COCCc1ccc(cc1)[N+](=O)[O-] 34a_100000704122_200000210301 [1,1,0,0,0,0|0,0,1]=3 430 B13R1.74 COCCc1ccc(cc1)[N+](=O)[O-] 34a_100138415774_100000736421 [1,1,0,0,0,0|0,0,1]=3 431 B13R1.74 COCCc1ccc(cc1)[N+](=O)[O-] 7a_100000704122_200000210301 [1,1,0,0,0,0|0,0,1]=3 432 B13R1.74 COCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000766300 [1,1,0,0,0,0|1,0,1]=4 433 B13R1.74 CS(=O)c1ccc(cc1)OCC=O 34a_200000064373_200009817547 [1,1,0,0,0,0|2,0,0]=4 434 B13R1.74 CS(=O)c1ccc(cc1)OCC=O 7a_200000064373_200015260668 [1,1,0,0,0,0|2,0,0]=4 435 B13R1.74 CS(=O)c1ccc(cc1)SCC=O 62a_100009816266_200015260668 [1,1,0,0,0,0|2,0,0]=4 436 B13R1.74 CSCCc1ccc(cc1)[N+](=O)[O-] 62a_200000210301_100000736421 [1,1,0,0,0,0|0,1,1]=4 437 B13R1.74 CSCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100011218213 [1,1,0,0,0,0|2,0,0]=4 438 B13R1.74 CSCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100011218213 [1,1,0,0,0,0|2,0,0]=4 439 B13R1.74 CSCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100011218213 [1,1,0,0,0,0|2,0,0]=4 440 B13R1.74 N#CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100011215382 [1,1,0,0,0,0|1,0,1]=4 441 B13R1.74 N#CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100011215382 [1,1,0,0,0,0|1,0,1]=4 442 B13R1.74 NC(=O)c1ccc(cc1)NCC=O 34a_100000210537_200009817547 [1,1,0,0,0,0|2,0,0]=4 443 B13R1.74 NC(=O)c1ccc(cc1)OCC=O 34a_100000746352_200009817547 [1,1,0,0,0,0|2,0,0]=4 444 B13R1.74 NC(=O)c1ccc(cc1)OCC=O 7a_100000746352_200015260668 [1,1,0,0,0,0|2,0,0]=4 445 B13R1.74 NC(=O)c1ccc(cc1)SCC=O 62a_100000162191_200015260668 [1,1,0,0,0,0|2,0,0]=4 446 B13R1.74 NC(=O)c1ccc(cc1)SCC=O 62a_200015260668_100000162191 [1,1,0,0,0,0|2,0,0]=4 447 B13R1.74 O=CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200015260668 [1,1,0,0,0,0|0,0,0]=2 448 B13R1.74 O=CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200009817547 [1,1,0,0,0,0|0,0,0]=2 449 B13R1.74 O=CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200009817547 [1,1,0,0,0,0|0,0,0]=2 450 B13R1.74 O=CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200015260668 [1,1,0,0,0,0|0,0,0]=2 451 B13R1.74 O=CCOc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_200015260668 [1,1,0,0,0,0|1,0,0]=3 452 B13R1.74 O=[N+]([O-])c1ccc(cc1)CNCF 34a_100000742766_100015361967 [1,1,0,0,0,0|1,0,1]=4 453 B13R1.74 O=[N+]([O-])c1ccc(cc1)COCF 34a_100000211695_100015361967 [1,1,0,0,0,0|1,0,1]=4 454 B13R1.74 O=[N+]([O-])c1ccc(cc1)CSCF 62a_100015361967_100000184243 [1,1,0,0,0,0|1,0,1]=4 455 B13R1.74 O=[N+]([O-])c1ccc(cc1)NCCF 2230a_100015195142_100011217306 [1,1,0,0,0,0|1,0,1]=4 456 B13R1.74 O=[N+]([O-])c1ccc(cc1)NCCF 34a_100015195142_100011217306 [1,1,0,0,0,0|1,0,1]=4 457 B13R1.74 O=[N+]([O-])c1ccc(cc1)NCCO 2230a_100015195142_100000211926 [1,1,0,0,0,0|0,0,1]=3 458 B13R1.74 O=[N+]([O-])c1ccc(cc1)NCCO 34a_100015195142_100000211926 [1,1,0,0,0,0|0,0,1]=3 459 B13R1.74 O=[N+]([O-])c1ccc(cc1)OCCF 34a_100000185810_100011217306 [1,1,0,0,0,0|1,0,1]=4 460 B13R1.74 O=[N+]([O-])c1ccc(cc1)OCCF 7a_100000185810_100011217306 [1,1,0,0,0,0|1,0,1]=4 461 B13R1.74 O=[N+]([O-])c1ccc(cc1)OCCO 34a_100000185810_100000211926 [1,1,0,0,0,0|0,0,1]=3 462 B13R1.74 O=[N+]([O-])c1ccc(cc1)OCCO 7a_100000185810_100000211926 [1,1,0,0,0,0|0,0,1]=3 463 B13R1.74 O=[N+]([O-])c1ccc(cn1)OCCO 7a_100000060138_100000211926 [1,1,0,0,0,0|1,0,1]=4 464 B13R1.74 [13CH3]NCCc1ccc(cc1)[N+](=O)[O-] 2230a_100000744123_200025704644 [1,1,0,0,0,0|1,0,1]=4 465 B13R1.74 [13CH3]NCCc1ccc(cc1)[N+](=O)[O-] 34a_100000744123_200025704644 [1,1,0,0,0,0|1,0,1]=4 466 B13R1.74 [13CH3]OCCc1ccc(cc1)[N+](=O)[O-] 34a_100000704122_200025704644 [1,1,0,0,0,0|0,0,1]=3 467 B13R1.74 [13CH3]OCCc1ccc(cc1)[N+](=O)[O-] 7a_100000704122_200025704644 [1,1,0,0,0,0|0,0,1]=3 468 B13R1.74 [13CH3]SCCc1ccc(cc1)[N+](=O)[O-] 62a_200025704644_100000736421 [1,1,0,0,0,0|0,1,1]=4 469 B13R1.144 CNCc1ccc(cc1Br)[N+](=O)[O-] 2230a_106832991635_100000741879 [1,1,0,0,0,0|2,0,0]=4 470 B13R1.144 CNCc1ccc(cc1Br)[N+](=O)[O-] 26a_100102657272_100000756651 [1,1,0,0,0,0|2,0,0]=4 471 B13R1.144 CNCc1ccc(cc1Br)[N+](=O)[O-] 270004a_106832991635_100011202981 [1,1,0,0,0,0|2,0,0]=4 472 B13R1.144 CNCc1ccc(cc1Br)[N+](=O)[O-] 34a_100102657272_100000741879 [1,1,0,0,0,0|2,0,0]=4 473 B13R1.144 CNCc1ccc(cc1Br)[N+](=O)[O-] 7a_106832991635_100000741879 [1,1,0,0,0,0|2,0,0]=4 474 B13R1.144 CNCc1ccc(cc1C)[N+](=O)[O-] 207a_100102657272_100000695237 [1,1,0,0,0,0|2,0,0]=4 475 B13R1.144 CNCc1ccc(cc1C)[N+](=O)[O-] 2230a_106832991635_100010218038 [1,1,0,0,0,0|2,0,0]=4 476 B13R1.144 CNCc1ccc(cc1C)[N+](=O)[O-] 26a_100102657272_100000744956 [1,1,0,0,0,0|2,0,0]=4 477 B13R1.144 CNCc1ccc(cc1C)[N+](=O)[O-] 34a_100102657272_100010218038 [1,1,0,0,0,0|2,0,0]=4 478 B13R1.144 CNCc1ccc(cc1C)[N+](=O)[O-] 7a_106832991635_100010218038 [1,1,0,0,0,0|2,0,0]=4 479 B13R1.144 CNCc1ccc(cc1Cl)[N+](=O)[O-] 2230a_106832991635_100000747184 [1,1,0,0,0,0|2,0,0]=4 480 B13R1.144 CNCc1ccc(cc1Cl)[N+](=O)[O-] 26a_100102657272_100000206008 [1,1,0,0,0,0|2,0,0]=4 481 B13R1.144 CNCc1ccc(cc1Cl)[N+](=O)[O-] 270004a_106832991635_100000755334 [1,1,0,0,0,0|2,0,0]=4 482 B13R1.144 CNCc1ccc(cc1Cl)[N+](=O)[O-] 34a_100102657272_100000747184 [1,1,0,0,0,0|2,0,0]=4 483 B13R1.144 CNCc1ccc(cc1Cl)[N+](=O)[O-] 7a_106832991635_100000747184 [1,1,0,0,0,0|2,0,0]=4 484 B13R1.144 CNCc1ccc(cc1F)[N+](=O)[O-] 2230a_106832991635_100000759423 [1,1,0,0,0,0|2,0,0]=4 485 B13R1.144 CNCc1ccc(cc1F)[N+](=O)[O-] 26a_100102657272_100000739697 [1,1,0,0,0,0|2,0,0]=4 486 B13R1.144 CNCc1ccc(cc1F)[N+](=O)[O-] 34a_100016989035_200000210301 [1,1,0,0,0,0|2,0,0]=4 487 B13R1.144 CNCc1ccc(cc1F)[N+](=O)[O-] 34a_100102657272_100000759423 [1,1,0,0,0,0|2,0,0]=4 488 B13R1.144 CNCc1ccc(cc1F)[N+](=O)[O-] 7a_106832991635_100000759423 [1,1,0,0,0,0|2,0,0]=4 489 B13R1.144 CNCc1ccc(cc1I)[N+](=O)[O-] 26a_100102657272_100012047213 [1,1,0,0,0,0|2,0,0]=4 490 B13R1.144 COCc1ccc(cc1Br)[N+](=O)[O-] 34a_100138415774_100000741879 [1,1,0,0,0,0|2,0,0]=4 491 B13R1.144 COCc1ccc(cc1C)[N+](=O)[O-] 34a_100009883322_200000210301 [1,1,0,0,0,0|2,0,0]=4 492 B13R1.144 COCc1ccc(cc1C)[N+](=O)[O-] 34a_100138415774_100010218038 [1,1,0,0,0,0|2,0,0]=4 493 B13R1.144 COCc1ccc(cc1C)[N+](=O)[O-] 7a_100009883322_200000210301 [1,1,0,0,0,0|2,0,0]=4 494 B13R1.144 COCc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000694850_200000210301 [1,1,0,0,0,0|2,0,0]=4 495 B13R1.144 COCc1ccc(cc1Cl)[N+](=O)[O-] 34a_100138415774_100000747184 [1,1,0,0,0,0|2,0,0]=4 496 B13R1.144 COCc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000694850_200000210301 [1,1,0,0,0,0|2,0,0]=4 497 B13R1.144 COCc1ccc(cc1F)[N+](=O)[O-] 34a_100012002375_200000210301 [1,1,0,0,0,0|2,0,0]=4 498 B13R1.144 COCc1ccc(cc1F)[N+](=O)[O-] 34a_100138415774_100000759423 [1,1,0,0,0,0|2,0,0]=4 499 B13R1.144 COCc1ccc(cc1F)[N+](=O)[O-] 7a_100012002375_200000210301 [1,1,0,0,0,0|2,0,0]=4 500 B13R1.144 COCc1ccc(cc1I)[N+](=O)[O-] 7a_200010150283_200000210301 [1,1,0,0,0,0|2,0,0]=4 501 B13R1.144 COCc1ccc(cc1N)[N+](=O)[O-] 34a_100011934201_200000210301 [1,1,0,0,0,0|2,0,0]=4 502 B13R1.144 CSCc1ccc(cc1Br)[N+](=O)[O-] 62a_100000741879_200000210301 [1,1,0,0,0,0|2,0,0]=4 503 B13R1.144 Cc1cc(ccc1CO[13CH3])[N+](=O)[O-] 34a_100009883322_200025704644 [1,1,0,0,0,0|2,0,0]=4 504 B13R1.144 Cc1cc(ccc1CO[13CH3])[N+](=O)[O-] 7a_100009883322_200025704644 [1,1,0,0,0,0|2,0,0]=4 505 B13R1.144 [13CH3]NCc1ccc(cc1F)[N+](=O)[O-] 34a_100016989035_200025704644 [1,1,0,0,0,0|2,0,0]=4 506 B13R1.144 [13CH3]OCc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000694850_200025704644 [1,1,0,0,0,0|2,0,0]=4 507 B13R1.144 [13CH3]OCc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000694850_200025704644 [1,1,0,0,0,0|2,0,0]=4 508 B13R1.144 [13CH3]OCc1ccc(cc1F)[N+](=O)[O-] 34a_100012002375_200025704644 [1,1,0,0,0,0|2,0,0]=4 509 B13R1.144 [13CH3]OCc1ccc(cc1F)[N+](=O)[O-] 7a_100012002375_200025704644 [1,1,0,0,0,0|2,0,0]=4 510 B13R1.144 [13CH3]OCc1ccc(cc1I)[N+](=O)[O-] 7a_200010150283_200025704644 [1,1,0,0,0,0|2,0,0]=4 511 B13R1.144 [13CH3]OCc1ccc(cc1N)[N+](=O)[O-] 34a_100011934201_200025704644 [1,1,0,0,0,0|2,0,0]=4 512 B13R1.144 [13CH3]SCc1ccc(cc1Br)[N+](=O)[O-] 62a_100000741879_200025704644 [1,1,0,0,0,0|2,0,0]=4 513 B13R1.385 CNCc1ccc(c(c1)Br)[N+](=O)[O-] 26a_100102657272_100012356988 [1,1,0,0,0,0|2,0,0]=4 514 B13R1.385 CNCc1ccc(c(c1)Br)[N+](=O)[O-] 270004a_106832991635_100009998837 [1,1,0,0,0,0|2,0,0]=4 515 B13R1.385 CNCc1ccc(c(c1)C)[N+](=O)[O-] 207a_100102657272_100000050484 [1,1,0,0,0,0|2,0,0]=4 516 B13R1.385 CNCc1ccc(c(c1)C)[N+](=O)[O-] 2230a_106832991635_100009816690 [1,1,0,0,0,0|2,0,0]=4 517 B13R1.385 CNCc1ccc(c(c1)C)[N+](=O)[O-] 270004a_106832991635_100000050484 [1,1,0,0,0,0|2,0,0]=4 518 B13R1.385 CNCc1ccc(c(c1)C)[N+](=O)[O-] 34a_100102657272_100009816690 [1,1,0,0,0,0|2,0,0]=4 519 B13R1.385 CNCc1ccc(c(c1)C)[N+](=O)[O-] 7a_106832991635_100009816690 [1,1,0,0,0,0|2,0,0]=4 520 B13R1.385 CNCc1ccc(c(c1)Cl)[N+](=O)[O-] 26a_100102657272_100000746235 [1,1,0,0,0,0|2,0,0]=4 521 B13R1.385 CNCc1ccc(c(c1)Cl)[N+](=O)[O-] 270004a_106832991635_100000070945 [1,1,0,0,0,0|2,0,0]=4 522 B13R1.385 CNCc1ccc(c(c1)F)[N+](=O)[O-] 2230a_106832991635_100000687068 [1,1,0,0,0,0|2,0,0]=4 523 B13R1.385 CNCc1ccc(c(c1)F)[N+](=O)[O-] 270004a_106832991635_100011934122 [1,1,0,0,0,0|2,0,0]=4 524 B13R1.385 CNCc1ccc(c(c1)F)[N+](=O)[O-] 34a_100102657272_100000687068 [1,1,0,0,0,0|2,0,0]=4 525 B13R1.385 CNCc1ccc(c(c1)F)[N+](=O)[O-] 7a_106832991635_100000687068 [1,1,0,0,0,0|2,0,0]=4 526 B13R1.385 COCc1ccc(c(c1)C)[N+](=O)[O-] 34a_100138415774_100009816690 [1,1,0,0,0,0|2,0,0]=4 527 B13R1.385 COCc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000032365_200000210301 [1,1,0,0,0,0|2,0,0]=4 528 B13R1.385 COCc1ccc(c(c1)F)[N+](=O)[O-] 34a_100138415774_100000687068 [1,1,0,0,0,0|2,0,0]=4 529 B13R1.385 COCc1ccc(c(c1)F)[N+](=O)[O-] 7a_100011219895_200000210301 [1,1,0,0,0,0|2,0,0]=4 530 B13R1.385 CSCc1ccc(c(c1)F)[N+](=O)[O-] 62a_100000687068_200000210301 [1,1,0,0,0,0|2,0,0]=4 531 B13R1.385 Cc1cc(ccc1[N+](=O)[O-])CO[13CH3] 7a_100000032365_200025704644 [1,1,0,0,0,0|2,0,0]=4 532 B13R1.385 [13CH3]OCc1ccc(c(c1)F)[N+](=O)[O-] 7a_100011219895_200025704644 [1,1,0,0,0,0|2,0,0]=4 533 B13R1.385 [13CH3]SCc1ccc(c(c1)F)[N+](=O)[O-] 62a_100000687068_200025704644 [1,1,0,0,0,0|2,0,0]=4 534 B13R1.537 CC(O[13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000246459_200025704644 [1,1,0,0,0,0|2,0,0]=4 535 B13R1.537 CC(O[13CH3])c1ccc(cc1)[N+](=O)[O-] 7a_100000246459_200025704644 [1,1,0,0,0,0|2,0,0]=4 536 B13R1.537 CNC(C)c1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000684656 [1,1,0,0,0,0|2,0,0]=4 537 B13R1.537 CNC(C)c1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000684656 [1,1,0,0,0,0|2,0,0]=4 538 B13R1.537 CN[C@@H](C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000008510_200000210301 [1,1,0,0,0,0|2,0,0]=4 539 B13R1.537 COC(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000246459_200000210301 [1,1,0,0,0,0|2,0,0]=4 540 B13R1.537 COC(C)c1ccc(cc1)[N+](=O)[O-] 7a_100000246459_200000210301 [1,1,0,0,0,0|2,0,0]=4 541 B13R1.537 C[C@H](N[13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000008510_200025704644 [1,1,0,0,0,0|2,0,0]=4 542 B13R1.120 CC(=O)c1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000188653_200000210301 [0,1,0,0,1,0|1,0,0]=3 543 B13R1.120 CC(=O)c1ccc(c(c1)O)[N+](=O)[O-] 1458a_100000195568_200000210301 [0,1,0,0,1,0|1,0,0]=3 544 B13R1.120 CC(=O)c1ccc(cc1Br)[N+](=O)[O-] 1458a_100000758870_200000210301 [0,1,0,0,1,0|1,0,0]=3 545 B13R1.120 CC(=O)c1ccc(cc1C)[N+](=O)[O-] 1458a_100000745847_200000210301 [0,1,0,0,1,0|1,0,0]=3 546 B13R1.120 CC(=O)c1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000188674_200000210301 [0,1,0,0,1,0|1,0,0]=3 547 B13R1.120 CC(=O)c1ccc(cc1F)[N+](=O)[O-] 1458a_100000743136_200000210301 [0,1,0,0,1,0|1,0,0]=3 548 B13R1.120 CC(=O)c1ccc(cc1I)[N+](=O)[O-] 1458a_100000749225_200000210301 [0,1,0,0,1,0|1,0,0]=3 549 B13R1.120 CC(=O)c1ccc(cc1O)[N+](=O)[O-] 1458a_100000746214_200000210301 [0,1,0,0,1,0|1,0,0]=3 550 B13R1.120 Cc1cc(ccc1C(=O)[13CH3])[N+](=O)[O-] 1458a_100000745847_200025704644 [0,1,0,0,1,0|1,0,0]=3 551 B13R1.120 Cc1cc(ccc1[N+](=O)[O-])C(=O)[13CH3] 1458a_100000188653_200025704644 [0,1,0,0,1,0|1,0,0]=3 552 B13R1.120 [13CH3]C(=O)c1ccc(c(c1)O)[N+](=O)[O-] 1458a_100000195568_200025704644 [0,1,0,0,1,0|1,0,0]=3 553 B13R1.120 [13CH3]C(=O)c1ccc(cc1Br)[N+](=O)[O-] 1458a_100000758870_200025704644 [0,1,0,0,1,0|1,0,0]=3 554 B13R1.120 [13CH3]C(=O)c1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000188674_200025704644 [0,1,0,0,1,0|1,0,0]=3 555 B13R1.120 [13CH3]C(=O)c1ccc(cc1F)[N+](=O)[O-] 1458a_100000743136_200025704644 [0,1,0,0,1,0|1,0,0]=3 556 B13R1.120 [13CH3]C(=O)c1ccc(cc1I)[N+](=O)[O-] 1458a_100000749225_200025704644 [0,1,0,0,1,0|1,0,0]=3 557 B13R1.120 [13CH3]C(=O)c1ccc(cc1O)[N+](=O)[O-] 1458a_100000746214_200025704644 [0,1,0,0,1,0|1,0,0]=3 558 B13R1.1706 C#CC(=O)Cc1ccc(o1)[N+](=O)[O-] 1458a_100000211873_200011215689 [0,1,0,0,1,0|2,0,0]=4 559 B13R1.1706 C#CC(=O)Cc1ccc(s1)[N+](=O)[O-] 1458a_100000211873_200010296502 [0,1,0,0,1,0|2,0,0]=4 560 B13R1.1706 C=CC(=O)Cc1ccc(o1)[N+](=O)[O-] 1458a_100000185746_200011215689 [0,1,0,0,1,0|2,0,0]=4 561 B13R1.1706 C=CC(=O)Cc1ccc(s1)[N+](=O)[O-] 1458a_100000185746_200010296502 [0,1,0,0,1,0|2,0,0]=4 562 B13R1.1706 CCC(=O)Cc1ccc(o1)[N+](=O)[O-] 1458a_100000210414_200011215689 [0,1,0,0,1,0|2,0,0]=4 563 B13R1.1706 CCC(=O)Cc1ccc(s1)[N+](=O)[O-] 1458a_100000210414_200010296502 [0,1,0,0,1,0|2,0,0]=4 564 B13R1.1706 O=C(CO)Cc1ccc(o1)[N+](=O)[O-] 1458a_100000210174_200011215689 [0,1,0,0,1,0|1,0,0]=3 565 B13R1.1706 O=C(CO)Cc1ccc(s1)[N+](=O)[O-] 1458a_100000210174_200010296502 [0,1,0,0,1,0|1,0,0]=3 566 B15R1.495 C=C(C)C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000185857_100000181861 [0,1,0,0,0,1|2,0,0]=4 567 B15R1.495 CC(=O)C(=O)Nc1ccc(cc1)[N+](=O)[O-] 1458a_200011217059_200000210301 [0,1,0,0,0,1|1,0,1]=4 568 B15R1.495 CC(=O)C(C)Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100009814033 [0,1,0,0,0,1|1,0,0]=3 569 B15R1.495 CC(=O)C(C)Oc1ccc(cc1)[N+](=O)[O-] 1458a_100000191202_200000210301 [0,1,0,0,0,1|1,0,0]=3 570 B15R1.495 CC(=O)C(C)Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000179758 [0,1,0,0,0,1|1,0,0]=3 571 B15R1.495 CC(=O)C(C)Oc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000179758 [0,1,0,0,0,1|2,0,0]=4 572 B15R1.495 CC(=O)C(C)Sc1ccc(cc1)[N+](=O)[O-] 1458a_100000156773_200000210301 [0,1,0,0,0,1|1,0,0]=3 573 B15R1.495 CC(=O)N(C)Cc1ccc(cc1)[N+](=O)[O-] 240690a_100015189985_100015343762 [0,1,0,0,0,1|1,0,0]=3 574 B15R1.495 CC(=O)N(C)Cc1ccc(cc1)[N+](=O)[O-] 527a_100015189985_100103153847 [0,1,0,0,0,1|1,0,0]=3 575 B15R1.495 CC(Nc1ccc(cc1)[N+](=O)[O-])C(=O)N 2230a_100015195142_100000702099 [0,1,0,0,0,1|1,0,0]=3 576 B15R1.495 CC(Nc1ccc(cc1)[N+](=O)[O-])C(=O)N 34a_100015195142_100000702099 [0,1,0,0,0,1|1,0,0]=3 577 B15R1.495 CC(Oc1ccc(cc1)[N+](=O)[O-])C(=O)N 34a_100000185810_100000702099 [0,1,0,0,0,1|1,0,0]=3 578 B15R1.495 CC(Oc1ccc(cc1)[N+](=O)[O-])C(=O)N 7a_100000185810_100000702099 [0,1,0,0,0,1|1,0,0]=3 579 B15R1.495 CC(Oc1ccc(cc1)[N+](=O)[O-])C(=O)[13CH3] 1458a_100000191202_200025704644 [0,1,0,0,0,1|1,0,0]=3 580 B15R1.495 CC(Oc1ccc(nc1)[N+](=O)[O-])C(=O)N 7a_100000060138_100000702099 [0,1,0,0,0,1|2,0,0]=4 581 B15R1.495 CC(Sc1ccc(cc1)[N+](=O)[O-])C(=O)[13CH3] 1458a_100000156773_200025704644 [0,1,0,0,0,1|1,0,0]=3 582 B15R1.495 C[C@@H](O)C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000717761_100000181861 [0,1,0,0,0,1|1,0,1]=4 583 B15R1.495 C[C@H](O)C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_217856618621_100000181861 [0,1,0,0,0,1|1,0,1]=4 584 B15R1.495 NC(=O)C(F)Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100009813875 [0,1,0,0,0,1|1,0,0]=3 585 B15R1.495 NC(=O)C(F)Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100009813875 [0,1,0,0,0,1|1,0,0]=3 586 B15R1.495 NC(=O)C(F)Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100009813875 [0,1,0,0,0,1|1,0,0]=3 587 B15R1.495 NC(=O)C(F)Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100009813875 [0,1,0,0,0,1|1,0,0]=3 588 B15R1.495 NC(=O)C(F)Oc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100009813875 [0,1,0,0,0,1|2,0,0]=4 589 B15R1.495 O=C(Cc1ccc(cc1)[N+](=O)[O-])C(O)O 1458a_100000233687_100000181861 [0,1,0,0,0,1|0,0,2]=4 590 B15R1.495 O=C([O-])C(F)Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100020610796 [0,1,0,0,0,1|0,0,1]=3 591 B15R1.495 O=C([O-])C(F)Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100020610796 [0,1,0,0,0,1|0,0,1]=3 592 B15R1.495 [13CH3]C(=O)C(=O)Nc1ccc(cc1)[N+](=O)[O-] 1458a_200011217059_200025704644 [0,1,0,0,0,1|1,0,1]=4 593 B15R1.498 CC(=O)CCc1ccc(cc1)S(=O)(=O)[O-] 1458a_100000070787_100010175982 [0,1,0,0,0,1|2,0,0]=4 594 B15R1.498 NC(=O)COc1ccc(cc1)S(=O)(=O)[O-] 7a_100000698548_100000187820 [0,1,0,0,0,1|2,0,0]=4 595 B15R1.956 C#CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000211873_100000736421 [0,1,0,0,0,1|1,0,0]=3 596 B15R1.956 C=C(C#N)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000694840 [0,1,0,0,0,1|2,0,0]=4 597 B15R1.956 C=C(C#N)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000694840 [0,1,0,0,0,1|2,0,0]=4 598 B15R1.956 C=C(C#N)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000694840 [0,1,0,0,0,1|2,0,0]=4 599 B15R1.956 C=CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000185746_100000736421 [0,1,0,0,0,1|1,0,0]=3 600 B15R1.956 C=CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_200121576911 [0,1,0,0,0,1|1,0,0]=3 601 B15R1.956 C=CC(=O)NNc1ccc(cc1)[N+](=O)[O-] 22a_100000006255_100000185746 [0,1,0,0,0,1|2,0,0]=4 602 B15R1.956 C=CC(O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000730141 [0,1,0,0,0,1|1,0,1]=4 603 B15R1.956 C=CC(O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000730141 [0,1,0,0,0,1|1,0,1]=4 604 B15R1.956 C=CC(O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000730141 [0,1,0,0,0,1|1,0,1]=4 605 B15R1.956 C=CC(O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000730141 [0,1,0,0,0,1|1,0,1]=4 606 B15R1.956 CC(=NNc1ccc(cc1)[N+](=O)[O-])CO 4a_100000006255_100000211253 [0,1,0,0,0,1|2,0,0]=4 607 B15R1.956 CC(=O)c1ccc(cc1)CCC(=O)CO 1458a_100000210174_200000038727 [0,1,0,0,0,1|2,0,0]=4 608 B15R1.956 CC(CCc1ccc(cc1)[N+](=O)[O-])O[13CH3] 34a_200011539411_200025704644 [0,1,0,0,0,1|1,0,1]=4 609 B15R1.956 CC(CCc1ccc(cc1)[N+](=O)[O-])O[13CH3] 7a_200011539411_200025704644 [0,1,0,0,0,1|1,0,1]=4 610 B15R1.956 CC(CO)NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100012180447 [0,1,0,0,0,1|1,0,1]=4 611 B15R1.956 CC(CO)NCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100012180447 [0,1,0,0,0,1|1,0,1]=4 612 B15R1.956 CC(CO)OCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100012180447 [0,1,0,0,0,1|1,0,1]=4 613 B15R1.956 CC(CO)SCc1ccc(cc1)[N+](=O)[O-] 62a_100012180447_100000184243 [0,1,0,0,0,1|1,0,1]=4 614 B15R1.956 CCC(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000182685_100000210202 [0,1,0,0,0,1|1,0,1]=4 615 B15R1.956 CCC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000210414_100000736421 [0,1,0,0,0,1|1,0,0]=3 616 B15R1.956 CCC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_100000210202 [0,1,0,0,0,1|1,0,0]=3 617 B15R1.956 CCC(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_100000210202 [0,1,0,0,0,1|1,0,0]=3 618 B15R1.956 CCC(=O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000747405 [0,1,0,0,0,1|1,0,0]=3 619 B15R1.956 CCC(=O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000747405 [0,1,0,0,0,1|2,0,0]=4 620 B15R1.956 CCC(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_100000210202 [0,1,0,0,0,1|1,0,0]=3 621 B15R1.956 CCC(=O)NCc1ccc(cc1)[N+](=O)[O-] 11a_100000742766_100000210414 [0,1,0,0,0,1|1,0,0]=3 622 B15R1.956 CCC(=O)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_100000210414 [0,1,0,0,0,1|1,0,0]=3 623 B15R1.956 CCC(=O)NCc1ccc(cc1)[N+](=O)[O-] 527a_100000742766_100000210414 [0,1,0,0,0,1|1,0,0]=3 624 B15R1.956 CCC(=O)NNc1ccc(cc1)[N+](=O)[O-] 22a_100000006255_100000210414 [0,1,0,0,0,1|2,0,0]=4 625 B15R1.956 CCC(O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100011218378 [0,1,0,0,0,1|1,0,1]=4 626 B15R1.956 CCC(O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100011218378 [0,1,0,0,0,1|1,0,1]=4 627 B15R1.956 CCC(O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100011218378 [0,1,0,0,0,1|1,0,1]=4 628 B15R1.956 CCC(O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100011218378 [0,1,0,0,0,1|1,0,1]=4 629 B15R1.956 CNC(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000182685 [0,1,0,0,0,1|1,0,1]=4 630 B15R1.956 CNC(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000182685 [0,1,0,0,0,1|1,0,1]=4 631 B15R1.956 CNC(=O)C=Cc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000182685 [0,1,0,0,0,1|1,0,1]=4 632 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000741710 [0,1,0,0,0,1|1,0,0]=3 633 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000741710 [0,1,0,0,0,1|1,0,0]=3 634 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000741710 [0,1,0,0,0,1|1,0,0]=3 635 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000741710 [0,1,0,0,0,1|1,0,0]=3 636 B15R1.956 CNC(=O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000183359 [0,1,0,0,0,1|1,0,0]=3 637 B15R1.956 CNC(=O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000183359 [0,1,0,0,0,1|1,0,0]=3 638 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000181393 [0,1,0,0,0,1|1,0,0]=3 639 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000181393 [0,1,0,0,0,1|1,0,0]=3 640 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000181393 [0,1,0,0,0,1|1,0,0]=3 641 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000183359 [0,1,0,0,0,1|1,0,0]=3 642 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000181393 [0,1,0,0,0,1|1,0,0]=3 643 B15R1.956 CNC(=O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000183359 [0,1,0,0,0,1|1,0,0]=3 644 B15R1.956 CNC(=O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000183359 [0,1,0,0,0,1|2,0,0]=4 645 B15R1.956 CNC(=O)CSc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000156286 [0,1,0,0,0,1|1,0,0]=3 646 B15R1.956 CNC(=O)CSc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000156286 [0,1,0,0,0,1|1,0,0]=3 647 B15R1.956 CNC(=O)CSc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000156286 [0,1,0,0,0,1|1,0,0]=3 648 B15R1.956 CNC(=O)CSc1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000156286 [0,1,0,0,0,1|1,0,0]=3 649 B15R1.956 CNC(=O)NCc1ccc(cc1)[N+](=O)[O-] 2708a_100102657272_100000742766 [0,1,0,0,0,1|1,0,0]=3 650 B15R1.956 CNC(=O)NCc1ccc(cc1)[N+](=O)[O-] 273464a_100000742766_100102657272 [0,1,0,0,0,1|1,0,0]=3 651 B15R1.956 CNC(=O)NCc1ccc(cc1)[N+](=O)[O-] 273464a_100102657272_100000742766 [0,1,0,0,0,1|1,0,0]=3 652 B15R1.956 CNC(=O)NCc1ccc(cc1)[N+](=O)[O-] 512a_100000742766_100102657272 [0,1,0,0,0,1|1,0,0]=3 653 B15R1.956 CNC(=O)NCc1ccc(cc1)[N+](=O)[O-] 512a_106832991638_100000742766 [0,1,0,0,0,1|1,0,0]=3 654 B15R1.956 CNC(=O)NNc1ccc(cc1)[N+](=O)[O-] 273464a_100102657272_100000006255 [0,1,0,0,0,1|2,0,0]=4 655 B15R1.956 CNC(=O)NNc1ccc(cc1)[N+](=O)[O-] 512a_106832991638_100000006255 [0,1,0,0,0,1|2,0,0]=4 656 B15R1.956 COC(=O)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000747449 [0,1,0,0,0,1|2,0,0]=4 657 B15R1.956 COC(=O)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000747449 [0,1,0,0,0,1|0,0,0]=2 658 B15R1.956 COC(=O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000747449 [0,1,0,0,0,1|0,0,0]=2 659 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)C 34a_100000185113_100000747449 [0,1,0,0,0,1|2,0,0]=4 660 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)C 7a_100000185113_100000747449 [0,1,0,0,0,1|2,0,0]=4 661 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)N 34a_100000746352_100000747449 [0,1,0,0,0,1|2,0,0]=4 662 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000747449 [0,1,0,0,0,1|2,0,0]=4 663 B15R1.956 COC(=O)COc1ccc(cc1)S(=O)C 34a_200000064373_100000747449 [0,1,0,0,0,1|2,0,0]=4 664 B15R1.956 COC(=O)COc1ccc(cc1)S(=O)C 7a_200000064373_100000747449 [0,1,0,0,0,1|2,0,0]=4 665 B15R1.956 COC(=O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000747449 [0,1,0,0,0,1|0,0,0]=2 666 B15R1.956 COC(=O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000747449 [0,1,0,0,0,1|0,0,0]=2 667 B15R1.956 COC(=O)COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000747449 [0,1,0,0,0,1|1,0,0]=3 668 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000747449 [0,1,0,0,0,1|2,0,0]=4 669 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)C 62a_100000747449_100000185465 [0,1,0,0,0,1|2,0,0]=4 670 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000747449 [0,1,0,0,0,1|2,0,0]=4 671 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)N 62a_100000747449_100000162191 [0,1,0,0,0,1|2,0,0]=4 672 B15R1.956 COC(=O)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000747449 [0,1,0,0,0,1|2,0,0]=4 673 B15R1.956 COC(C)CCc1ccc(cc1)[N+](=O)[O-] 34a_200011539411_200000210301 [0,1,0,0,0,1|1,0,1]=4 674 B15R1.956 COC(C)CCc1ccc(cc1)[N+](=O)[O-] 7a_200011539411_200000210301 [0,1,0,0,0,1|1,0,1]=4 675 B15R1.956 COC(C)SCc1ccc(cc1)[N+](=O)[O-] 62a_100009879195_100000184243 [0,1,0,0,0,1|1,0,1]=4 676 B15R1.956 C[C@@H](CO)CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000059175 [0,1,0,0,0,1|1,0,1]=4 677 B15R1.956 C[C@@H](CO)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000059175 [0,1,0,0,0,1|1,0,1]=4 678 B15R1.956 C[C@@H](CO)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000059175 [0,1,0,0,0,1|1,0,1]=4 679 B15R1.956 C[C@@H](CO)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000059175 [0,1,0,0,0,1|1,0,1]=4 680 B15R1.956 C[C@H](CO)NCc1ccc(cc1)[N+](=O)[O-] 207a_100000737577_100000189386 [0,1,0,0,0,1|1,0,1]=4 681 B15R1.956 C[C@H](CO)NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000737577_100000181861 [0,1,0,0,0,1|1,0,1]=4 682 B15R1.956 C[C@H](CO)NCc1ccc(cc1)[N+](=O)[O-] 270004a_100000737577_100000189386 [0,1,0,0,0,1|1,0,1]=4 683 B15R1.956 C[C@H](CO)SCc1ccc(cc1)[N+](=O)[O-] 62a_100016084084_100000184243 [0,1,0,0,0,1|1,0,1]=4 684 B15R1.956 NC(=O)c1ccc(cc1)CNC(=O)CO 240690a_100000185037_100000210174 [0,1,0,0,0,1|2,0,0]=4 685 B15R1.956 NC(=O)c1ccc(cc1)CNC(=O)CO 527a_100000185037_100000210174 [0,1,0,0,0,1|2,0,0]=4 686 B15R1.956 O=C(C=Cc1ccc(cc1)[N+](=O)[O-])CF 1458a_100000182685_100015361967 [0,1,0,0,0,1|1,0,1]=4 687 B15R1.956 O=C(CF)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_100015361967 [0,1,0,0,0,1|1,0,0]=3 688 B15R1.956 O=C(CF)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_100015361967 [0,1,0,0,0,1|1,0,0]=3 689 B15R1.956 O=C(CF)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_100015361967 [0,1,0,0,0,1|1,0,0]=3 690 B15R1.956 O=C(CO)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000210174_100000736421 [0,1,0,0,0,1|0,0,0]=2 691 B15R1.956 O=C(CO)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_100000210174 [0,1,0,0,0,1|0,0,0]=2 692 B15R1.956 O=C(CO)NCc1ccc(cc1)[N+](=O)[O-] 527a_100000742766_100000210174 [0,1,0,0,0,1|0,0,0]=2 693 B15R1.956 O=C(CO)NNc1ccc(cc1)[N+](=O)[O-] 22a_100000006255_100000210174 [0,1,0,0,0,1|1,0,0]=3 694 B15R1.956 O=C(CO)NNc1ccc(cn1)[N+](=O)[O-] 22a_100000737981_100000210174 [0,1,0,0,0,1|2,0,0]=4 695 B15R1.956 O=[N+]([O-])c1ccc(cc1)NCC(O)CO 2230a_100015195142_100011219619 [0,1,0,0,0,1|0,0,2]=4 696 B15R1.956 O=[N+]([O-])c1ccc(cc1)NCC(O)CO 34a_100015195142_100011219619 [0,1,0,0,0,1|0,0,2]=4 697 B15R1.956 O=[N+]([O-])c1ccc(cc1)NC[C@@H](O)CF 2230a_100015195142_100015614560 [0,1,0,0,0,1|1,0,1]=4 698 B15R1.956 O=[N+]([O-])c1ccc(cc1)NC[C@@H](O)CF 34a_100015195142_100015614560 [0,1,0,0,0,1|1,0,1]=4 699 B15R1.956 O=[N+]([O-])c1ccc(cc1)NC[C@@H](O)CO 2230a_100015195142_100009815848 [0,1,0,0,0,1|0,0,2]=4 700 B15R1.956 O=[N+]([O-])c1ccc(cc1)NC[C@@H](O)CO 34a_100015195142_100009815848 [0,1,0,0,0,1|0,0,2]=4 701 B15R1.956 O=[N+]([O-])c1ccc(cc1)OCC(O)CO 34a_100000185810_100011219619 [0,1,0,0,0,1|0,0,2]=4 702 B15R1.956 O=[N+]([O-])c1ccc(cc1)OCC(O)CO 7a_100000185810_100011219619 [0,1,0,0,0,1|0,0,2]=4 703 B15R1.956 O=[N+]([O-])c1ccc(cc1)OC[C@@H](O)CF 34a_100000185810_100015614560 [0,1,0,0,0,1|1,0,1]=4 704 B15R1.956 O=[N+]([O-])c1ccc(cc1)OC[C@@H](O)CF 7a_100000185810_100015614560 [0,1,0,0,0,1|1,0,1]=4 705 B15R1.956 O=[N+]([O-])c1ccc(cc1)OC[C@@H](O)CO 34a_100000185810_100009815848 [0,1,0,0,0,1|0,0,2]=4 706 B15R1.956 O=[N+]([O-])c1ccc(cc1)OC[C@@H](O)CO 7a_100000185810_100009815848 [0,1,0,0,0,1|0,0,2]=4 707 B15R1.5380 C=C(C)CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_100000748629 [0,1,0,0,0,1|2,0,0]=4 708 B15R1.5380 C=C(C)CNc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000745639_100000748629 [0,1,0,0,0,1|2,0,0]=4 709 B15R1.5380 C=C(C)CNc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000745639_100000748629 [0,1,0,0,0,1|2,0,0]=4 710 B15R1.5380 C=C(C)CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100000748629 [0,1,0,0,0,1|2,0,0]=4 711 B15R1.5380 C=C(C)CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_100000748629 [0,1,0,0,0,1|2,0,0]=4 712 B15R1.5380 C=C(C)COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100000748629 [0,1,0,0,0,1|2,0,0]=4 713 B15R1.5380 C=C(C)COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_100000748629 [0,1,0,0,0,1|2,0,0]=4 714 B15R1.5380 C=C(C)COc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000195451_100000748629 [0,1,0,0,0,1|2,0,0]=4 715 B15R1.5380 C=C(C)COc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000195451_100000748629 [0,1,0,0,0,1|2,0,0]=4 716 B15R1.5380 C=C(C)COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100000748629 [0,1,0,0,0,1|2,0,0]=4 717 B15R1.5380 C=C(C)COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_100000748629 [0,1,0,0,0,1|2,0,0]=4 718 B15R1.5380 C=C(C)COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_100000748629 [0,1,0,0,0,1|2,0,0]=4 719 B15R1.5380 C=C(C)COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_100000748629 [0,1,0,0,0,1|2,0,0]=4 720 B15R1.5380 C=C(C)COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_100000748629 [0,1,0,0,0,1|2,0,0]=4 721 B15R1.5380 C=C(F)CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_100000042424 [0,1,0,0,0,1|2,0,0]=4 722 B15R1.5380 C=C(F)CNc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000745639_100009893438 [0,1,0,0,0,1|2,0,0]=4 723 B15R1.5380 C=C(F)CNc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000745639_100000042424 [0,1,0,0,0,1|2,0,0]=4 724 B15R1.5380 C=C(F)CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100009893438 [0,1,0,0,0,1|2,0,0]=4 725 B15R1.5380 C=C(F)CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_100000042424 [0,1,0,0,0,1|2,0,0]=4 726 B15R1.5380 C=C(F)COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100009893438 [0,1,0,0,0,1|2,0,0]=4 727 B15R1.5380 C=C(F)COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_100000042424 [0,1,0,0,0,1|2,0,0]=4 728 B15R1.5380 C=C(F)COc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000195451_100009893438 [0,1,0,0,0,1|2,0,0]=4 729 B15R1.5380 C=C(F)COc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000195451_100000042424 [0,1,0,0,0,1|2,0,0]=4 730 B15R1.5380 C=C(F)COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100009893438 [0,1,0,0,0,1|2,0,0]=4 731 B15R1.5380 C=C(F)COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_100000042424 [0,1,0,0,0,1|2,0,0]=4 732 B15R1.5380 C=C(F)COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_100000042424 [0,1,0,0,0,1|2,0,0]=4 733 B15R1.5380 C=C(F)COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_100000042424 [0,1,0,0,0,1|2,0,0]=4 734 B15R1.5380 C=C(F)COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_100000042424 [0,1,0,0,0,1|2,0,0]=4 735 B15R1.5380 CC(=O)COc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000191406_200000210301 [0,1,0,0,0,1|1,0,0]=3 736 B15R1.5380 CC(=O)COc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000747220_200000210301 [0,1,0,0,0,1|1,0,0]=3 737 B15R1.5380 CC(O)CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_100011218427 [0,1,0,0,0,1|1,0,1]=4 738 B15R1.5380 CC(O)CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100011218427 [0,1,0,0,0,1|1,0,1]=4 739 B15R1.5380 CC(O)CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_100011218427 [0,1,0,0,0,1|1,0,1]=4 740 B15R1.5380 CC(O)COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100011218427 [0,1,0,0,0,1|1,0,1]=4 741 B15R1.5380 CC(O)COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_100011218427 [0,1,0,0,0,1|1,0,1]=4 742 B15R1.5380 CC(O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100011218427 [0,1,0,0,0,1|1,0,1]=4 743 B15R1.5380 CC(O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_100011218427 [0,1,0,0,0,1|1,0,1]=4 744 B15R1.5380 CC(O)COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_100011218427 [0,1,0,0,0,1|1,0,1]=4 745 B15R1.5380 CC(O)COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_100011218427 [0,1,0,0,0,1|1,0,1]=4 746 B15R1.5380 CC(O)COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_100011218427 [0,1,0,0,0,1|1,0,1]=4 747 B15R1.5380 C[C@@H](O)CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_100009817552 [0,1,0,0,0,1|1,0,1]=4 748 B15R1.5380 C[C@@H](O)CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100009817552 [0,1,0,0,0,1|1,0,1]=4 749 B15R1.5380 C[C@@H](O)CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_100009817552 [0,1,0,0,0,1|1,0,1]=4 750 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100009817552 [0,1,0,0,0,1|1,0,1]=4 751 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_100009817552 [0,1,0,0,0,1|1,0,1]=4 752 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100009817552 [0,1,0,0,0,1|1,0,1]=4 753 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_100009817552 [0,1,0,0,0,1|1,0,1]=4 754 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_100009817552 [0,1,0,0,0,1|1,0,1]=4 755 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_100009817552 [0,1,0,0,0,1|1,0,1]=4 756 B15R1.5380 C[C@@H](O)COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_100009817552 [0,1,0,0,0,1|1,0,1]=4 757 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NCC(=O)N 34a_100000745639_100000187820 [0,1,0,0,0,1|1,0,0]=3 758 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NCC(=O)N 7a_100000745639_100000187820 [0,1,0,0,0,1|1,0,0]=3 759 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NCC(=O)[O-] 34a_100000745639_100020667443 [0,1,0,0,0,1|0,0,1]=3 760 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NCC(C)O 34a_100000745639_100011218427 [0,1,0,0,0,1|1,0,1]=4 761 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NCC(C)O 7a_100000745639_100011218427 [0,1,0,0,0,1|1,0,1]=4 762 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NC[C@@H](C)O 34a_100000745639_100009817552 [0,1,0,0,0,1|1,0,1]=4 763 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NC[C@@H](C)O 7a_100000745639_100009817552 [0,1,0,0,0,1|1,0,1]=4 764 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])NC[N+](=O)[O-] 34a_100000745639_100000761209 [0,1,0,0,0,1|1,0,1]=4 765 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(=O)N 34a_100000195451_100000187820 [0,1,0,0,0,1|1,0,0]=3 766 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(=O)N 7a_100000195451_100000187820 [0,1,0,0,0,1|1,0,0]=3 767 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(=O)[13CH3] 1458a_100000191406_200025704644 [0,1,0,0,0,1|1,0,0]=3 768 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(=O)[O-] 34a_100000195451_100020667443 [0,1,0,0,0,1|0,0,1]=3 769 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(C)O 34a_100000195451_100011218427 [0,1,0,0,0,1|1,0,1]=4 770 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OCC(C)O 7a_100000195451_100011218427 [0,1,0,0,0,1|1,0,1]=4 771 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OC[C@@H](C)O 34a_100000195451_100009817552 [0,1,0,0,0,1|1,0,1]=4 772 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OC[C@@H](C)O 7a_100000195451_100009817552 [0,1,0,0,0,1|1,0,1]=4 773 B15R1.5380 Cc1cc(ccc1[N+](=O)[O-])OC[N+](=O)[O-] 34a_100000195451_100000761209 [0,1,0,0,0,1|1,0,1]=4 774 B15R1.5380 NC(=O)CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_100000187820 [0,1,0,0,0,1|1,0,0]=3 775 B15R1.5380 NC(=O)CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100000187820 [0,1,0,0,0,1|1,0,0]=3 776 B15R1.5380 NC(=O)CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_100000187820 [0,1,0,0,0,1|1,0,0]=3 777 B15R1.5380 NC(=O)COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100000187820 [0,1,0,0,0,1|1,0,0]=3 778 B15R1.5380 NC(=O)COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_100000187820 [0,1,0,0,0,1|1,0,0]=3 779 B15R1.5380 NC(=O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100000187820 [0,1,0,0,0,1|1,0,0]=3 780 B15R1.5380 NC(=O)COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_100000187820 [0,1,0,0,0,1|1,0,0]=3 781 B15R1.5380 NC(=O)COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_100000187820 [0,1,0,0,0,1|1,0,0]=3 782 B15R1.5380 NC(=O)COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_100000187820 [0,1,0,0,0,1|1,0,0]=3 783 B15R1.5380 NC(=O)COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_100000187820 [0,1,0,0,0,1|1,0,0]=3 784 B15R1.5380 O=C([O-])CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100020667443 [0,1,0,0,0,1|0,0,1]=3 785 B15R1.5380 O=C([O-])COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100020667443 [0,1,0,0,0,1|0,0,1]=3 786 B15R1.5380 O=C([O-])COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100020667443 [0,1,0,0,0,1|0,0,1]=3 787 B15R1.5380 O=[N+]([O-])CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_100000761209 [0,1,0,0,0,1|1,0,1]=4 788 B15R1.5380 O=[N+]([O-])COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_100000761209 [0,1,0,0,0,1|1,0,1]=4 789 B15R1.5380 O=[N+]([O-])COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_100000761209 [0,1,0,0,0,1|1,0,1]=4 790 B15R1.5380 [13CH3]C(=O)COc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000747220_200025704644 [0,1,0,0,0,1|1,0,0]=3 791 B15R1.5504 C=C(C)CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100000748629 [0,1,0,0,0,1|2,0,0]=4 792 B15R1.5504 C=C(C)CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000748629 [0,1,0,0,0,1|2,0,0]=4 793 B15R1.5504 C=C(C)CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000748629 [0,1,0,0,0,1|2,0,0]=4 794 B15R1.5504 C=C(C)CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000748629 [0,1,0,0,0,1|2,0,0]=4 795 B15R1.5504 C=C(F)CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100009893438 [0,1,0,0,0,1|2,0,0]=4 796 B15R1.5504 C=C(F)CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100009893438 [0,1,0,0,0,1|2,0,0]=4 797 B15R1.5504 C=C(F)CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100009893438 [0,1,0,0,0,1|2,0,0]=4 798 B15R1.5504 C=C(F)CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100009893438 [0,1,0,0,0,1|2,0,0]=4 799 B15R1.5504 CC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000195401 [0,1,0,0,0,1|1,0,0]=3 800 B15R1.5504 CC(=O)N[C@@H](C)c1ccc(cc1)[N+](=O)[O-] 11a_100000008510_100015343762 [0,1,0,0,0,1|1,0,0]=3 801 B15R1.5504 CC(=O)N[C@@H](C)c1ccc(cc1)[N+](=O)[O-] 240690a_100000008510_100015343762 [0,1,0,0,0,1|1,0,0]=3 802 B15R1.5504 CC(=O)N[C@@H](C)c1ccc(cc1)[N+](=O)[O-] 527a_100000008510_100103153847 [0,1,0,0,0,1|1,0,0]=3 803 B15R1.5504 CC(O)CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100011218427 [0,1,0,0,0,1|1,0,1]=4 804 B15R1.5504 CC(O)CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100011218427 [0,1,0,0,0,1|1,0,1]=4 805 B15R1.5504 CC(O)CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100011218427 [0,1,0,0,0,1|1,0,1]=4 806 B15R1.5504 CC(O)CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100011218427 [0,1,0,0,0,1|1,0,1]=4 807 B15R1.5504 CN(CC(=O)N)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100000747473 [0,1,0,0,0,1|1,0,0]=3 808 B15R1.5504 CN(CC(=O)N)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000187820 [0,1,0,0,0,1|1,0,0]=3 809 B15R1.5504 CN(CC(=O)N)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000187820 [0,1,0,0,0,1|1,0,0]=3 810 B15R1.5504 CN(CC(=O)O)c1ccc(cc1)[N+](=O)[O-] 269956a_100000204769_200000210301 [0,1,0,0,0,1|0,0,0]=2 811 B15R1.5504 CN(CC(=O)[O-])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100020667443 [0,1,0,0,0,1|0,0,1]=3 812 B15R1.5504 CN(CC(=O)[O-])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100020667443 [0,1,0,0,0,1|0,0,1]=3 813 B15R1.5504 CN(C[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100000761209 [0,1,0,0,0,1|1,0,1]=4 814 B15R1.5504 CN(C[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100000761209 [0,1,0,0,0,1|1,0,1]=4 815 B15R1.5504 C[C@@H](O)CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_100009817552 [0,1,0,0,0,1|1,0,1]=4 816 B15R1.5504 C[C@@H](O)CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_100009817552 [0,1,0,0,0,1|1,0,1]=4 817 B15R1.5504 C[C@@H](O)CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_100009817552 [0,1,0,0,0,1|1,0,1]=4 818 B15R1.5504 NC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100000187820 [0,1,0,0,0,1|1,0,0]=3 819 B15R1.5504 O=C(C[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100000761209 [0,1,0,0,0,1|1,0,1]=4 820 B15R1.5504 O=C([O-])CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100020667443 [0,1,0,0,0,1|0,0,1]=3 821 B15R1.5504 [13CH3]N(CC(=O)O)c1ccc(cc1)[N+](=O)[O-] 269956a_100000204769_200025704644 [0,1,0,0,0,1|0,0,0]=2 822 B15R1.8014 C=C(C)CNc1ccc(cc1C)[N+](=O)[O-] 2230a_100000184110_100000748629 [0,1,0,0,0,1|2,0,0]=4 823 B15R1.8014 C=C(C)CNc1ccc(cc1C)[N+](=O)[O-] 34a_100000184110_100000748629 [0,1,0,0,0,1|2,0,0]=4 824 B15R1.8014 C=C(C)CNc1ccc(cc1C)[N+](=O)[O-] 7a_100000184110_100000748629 [0,1,0,0,0,1|2,0,0]=4 825 B15R1.8014 C=C(C)CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100000748629 [0,1,0,0,0,1|2,0,0]=4 826 B15R1.8014 C=C(C)CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100000748629 [0,1,0,0,0,1|2,0,0]=4 827 B15R1.8014 C=C(C)COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100000748629 [0,1,0,0,0,1|2,0,0]=4 828 B15R1.8014 C=C(C)COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_100000748629 [0,1,0,0,0,1|2,0,0]=4 829 B15R1.8014 C=C(C)COc1ccc(cc1C)[N+](=O)[O-] 34a_100000744956_100000748629 [0,1,0,0,0,1|2,0,0]=4 830 B15R1.8014 C=C(C)COc1ccc(cc1C)[N+](=O)[O-] 7a_100000744956_100000748629 [0,1,0,0,0,1|2,0,0]=4 831 B15R1.8014 C=C(C)COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100000748629 [0,1,0,0,0,1|2,0,0]=4 832 B15R1.8014 C=C(C)COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_100000748629 [0,1,0,0,0,1|2,0,0]=4 833 B15R1.8014 C=C(C)COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100000748629 [0,1,0,0,0,1|2,0,0]=4 834 B15R1.8014 C=C(C)COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_100000748629 [0,1,0,0,0,1|2,0,0]=4 835 B15R1.8014 C=C(C)COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100000748629 [0,1,0,0,0,1|2,0,0]=4 836 B15R1.8014 C=C(C)COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_100000748629 [0,1,0,0,0,1|2,0,0]=4 837 B15R1.8014 C=C(C)COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_100000748629 [0,1,0,0,0,1|2,0,0]=4 838 B15R1.8014 C=C(C)COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_100000748629 [0,1,0,0,0,1|2,0,0]=4 839 B15R1.8014 C=C(F)CNc1ccc(cc1C)[N+](=O)[O-] 2230a_100000184110_100009893438 [0,1,0,0,0,1|2,0,0]=4 840 B15R1.8014 C=C(F)CNc1ccc(cc1C)[N+](=O)[O-] 34a_100000184110_100009893438 [0,1,0,0,0,1|2,0,0]=4 841 B15R1.8014 C=C(F)CNc1ccc(cc1C)[N+](=O)[O-] 7a_100000184110_100000042424 [0,1,0,0,0,1|2,0,0]=4 842 B15R1.8014 C=C(F)CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100009893438 [0,1,0,0,0,1|2,0,0]=4 843 B15R1.8014 C=C(F)CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100009893438 [0,1,0,0,0,1|2,0,0]=4 844 B15R1.8014 C=C(F)COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100009893438 [0,1,0,0,0,1|2,0,0]=4 845 B15R1.8014 C=C(F)COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_100000042424 [0,1,0,0,0,1|2,0,0]=4 846 B15R1.8014 C=C(F)COc1ccc(cc1C)[N+](=O)[O-] 34a_100000744956_100009893438 [0,1,0,0,0,1|2,0,0]=4 847 B15R1.8014 C=C(F)COc1ccc(cc1C)[N+](=O)[O-] 7a_100000744956_100000042424 [0,1,0,0,0,1|2,0,0]=4 848 B15R1.8014 C=C(F)COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100009893438 [0,1,0,0,0,1|2,0,0]=4 849 B15R1.8014 C=C(F)COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_100000042424 [0,1,0,0,0,1|2,0,0]=4 850 B15R1.8014 C=C(F)COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100009893438 [0,1,0,0,0,1|2,0,0]=4 851 B15R1.8014 C=C(F)COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_100000042424 [0,1,0,0,0,1|2,0,0]=4 852 B15R1.8014 C=C(F)COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100009893438 [0,1,0,0,0,1|2,0,0]=4 853 B15R1.8014 C=C(F)COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_100000042424 [0,1,0,0,0,1|2,0,0]=4 854 B15R1.8014 C=C(F)COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_100009893438 [0,1,0,0,0,1|2,0,0]=4 855 B15R1.8014 C=C(F)COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_100000042424 [0,1,0,0,0,1|2,0,0]=4 856 B15R1.8014 CC(=O)COc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000191379_200000210301 [0,1,0,0,0,1|1,0,0]=3 857 B15R1.8014 CC(=O)NCc1ccc(cc1F)[N+](=O)[O-] 11a_100016989035_100015343762 [0,1,0,0,0,1|1,0,0]=3 858 B15R1.8014 CC(=O)NCc1ccc(cc1F)[N+](=O)[O-] 1626a_100016989035_100015343762 [0,1,0,0,0,1|1,0,0]=3 859 B15R1.8014 CC(=O)NCc1ccc(cc1F)[N+](=O)[O-] 240690a_100016989035_100015343762 [0,1,0,0,0,1|1,0,0]=3 860 B15R1.8014 CC(=O)NCc1ccc(cc1F)[N+](=O)[O-] 527a_100016989035_100103153847 [0,1,0,0,0,1|1,0,0]=3 861 B15R1.8014 CC(=O)NNc1ccc(cc1Cl)[N+](=O)[O-] 22a_100000750812_100000070787 [0,1,0,0,0,1|2,0,0]=4 862 B15R1.8014 CC(O)CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100011218427 [0,1,0,0,0,1|1,0,1]=4 863 B15R1.8014 CC(O)CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100011218427 [0,1,0,0,0,1|1,0,1]=4 864 B15R1.8014 CC(O)COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100011218427 [0,1,0,0,0,1|1,0,1]=4 865 B15R1.8014 CC(O)COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_100011218427 [0,1,0,0,0,1|1,0,1]=4 866 B15R1.8014 CC(O)COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100011218427 [0,1,0,0,0,1|1,0,1]=4 867 B15R1.8014 CC(O)COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_100011218427 [0,1,0,0,0,1|1,0,1]=4 868 B15R1.8014 CC(O)COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100011218427 [0,1,0,0,0,1|1,0,1]=4 869 B15R1.8014 CC(O)COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_100011218427 [0,1,0,0,0,1|1,0,1]=4 870 B15R1.8014 CC(O)COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100011218427 [0,1,0,0,0,1|1,0,1]=4 871 B15R1.8014 CC(O)COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_100011218427 [0,1,0,0,0,1|1,0,1]=4 872 B15R1.8014 CC(O)COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_100011218427 [0,1,0,0,0,1|1,0,1]=4 873 B15R1.8014 CC(O)COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_100011218427 [0,1,0,0,0,1|1,0,1]=4 874 B15R1.8014 C[C@@H](O)CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100009817552 [0,1,0,0,0,1|1,0,1]=4 875 B15R1.8014 C[C@@H](O)CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100009817552 [0,1,0,0,0,1|1,0,1]=4 876 B15R1.8014 C[C@@H](O)COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100009817552 [0,1,0,0,0,1|1,0,1]=4 877 B15R1.8014 C[C@@H](O)COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_100009817552 [0,1,0,0,0,1|1,0,1]=4 878 B15R1.8014 C[C@@H](O)COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100009817552 [0,1,0,0,0,1|1,0,1]=4 879 B15R1.8014 C[C@@H](O)COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_100009817552 [0,1,0,0,0,1|1,0,1]=4 880 B15R1.8014 C[C@@H](O)COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100009817552 [0,1,0,0,0,1|1,0,1]=4 881 B15R1.8014 C[C@@H](O)COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_100009817552 [0,1,0,0,0,1|1,0,1]=4 882 B15R1.8014 C[C@@H](O)COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100009817552 [0,1,0,0,0,1|1,0,1]=4 883 B15R1.8014 C[C@@H](O)COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_100009817552 [0,1,0,0,0,1|1,0,1]=4 884 B15R1.8014 C[C@@H](O)COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_100009817552 [0,1,0,0,0,1|1,0,1]=4 885 B15R1.8014 C[C@@H](O)COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_100009817552 [0,1,0,0,0,1|1,0,1]=4 886 B15R1.8014 Cc1cc(ccc1NCC(=O)N)[N+](=O)[O-] 2230a_100000184110_100000747473 [0,1,0,0,0,1|1,0,0]=3 887 B15R1.8014 Cc1cc(ccc1NCC(=O)N)[N+](=O)[O-] 34a_100000184110_100000187820 [0,1,0,0,0,1|1,0,0]=3 888 B15R1.8014 Cc1cc(ccc1NCC(=O)N)[N+](=O)[O-] 7a_100000184110_100000187820 [0,1,0,0,0,1|1,0,0]=3 889 B15R1.8014 Cc1cc(ccc1NCC(=O)[O-])[N+](=O)[O-] 34a_100000184110_100020667443 [0,1,0,0,0,1|0,0,1]=3 890 B15R1.8014 Cc1cc(ccc1NCC(C)O)[N+](=O)[O-] 2230a_100000184110_100011218427 [0,1,0,0,0,1|1,0,1]=4 891 B15R1.8014 Cc1cc(ccc1NCC(C)O)[N+](=O)[O-] 34a_100000184110_100011218427 [0,1,0,0,0,1|1,0,1]=4 892 B15R1.8014 Cc1cc(ccc1NCC(C)O)[N+](=O)[O-] 7a_100000184110_100011218427 [0,1,0,0,0,1|1,0,1]=4 893 B15R1.8014 Cc1cc(ccc1NC[C@@H](C)O)[N+](=O)[O-] 2230a_100000184110_100009817552 [0,1,0,0,0,1|1,0,1]=4 894 B15R1.8014 Cc1cc(ccc1NC[C@@H](C)O)[N+](=O)[O-] 34a_100000184110_100009817552 [0,1,0,0,0,1|1,0,1]=4 895 B15R1.8014 Cc1cc(ccc1NC[C@@H](C)O)[N+](=O)[O-] 7a_100000184110_100009817552 [0,1,0,0,0,1|1,0,1]=4 896 B15R1.8014 Cc1cc(ccc1NC[N+](=O)[O-])[N+](=O)[O-] 34a_100000184110_100000761209 [0,1,0,0,0,1|1,0,1]=4 897 B15R1.8014 Cc1cc(ccc1OCC(=O)N)[N+](=O)[O-] 34a_100000744956_100000187820 [0,1,0,0,0,1|1,0,0]=3 898 B15R1.8014 Cc1cc(ccc1OCC(=O)N)[N+](=O)[O-] 7a_100000744956_100000187820 [0,1,0,0,0,1|1,0,0]=3 899 B15R1.8014 Cc1cc(ccc1OCC(=O)[O-])[N+](=O)[O-] 34a_100000744956_100020667443 [0,1,0,0,0,1|0,0,1]=3 900 B15R1.8014 Cc1cc(ccc1OCC(C)O)[N+](=O)[O-] 34a_100000744956_100011218427 [0,1,0,0,0,1|1,0,1]=4 901 B15R1.8014 Cc1cc(ccc1OCC(C)O)[N+](=O)[O-] 7a_100000744956_100011218427 [0,1,0,0,0,1|1,0,1]=4 902 B15R1.8014 Cc1cc(ccc1OC[C@@H](C)O)[N+](=O)[O-] 34a_100000744956_100009817552 [0,1,0,0,0,1|1,0,1]=4 903 B15R1.8014 Cc1cc(ccc1OC[C@@H](C)O)[N+](=O)[O-] 7a_100000744956_100009817552 [0,1,0,0,0,1|1,0,1]=4 904 B15R1.8014 Cc1cc(ccc1OC[N+](=O)[O-])[N+](=O)[O-] 34a_100000744956_100000761209 [0,1,0,0,0,1|1,0,1]=4 905 B15R1.8014 Cc1cc(ncc1OCC(=O)N)[N+](=O)[O-] 7a_100015695027_100000187820 [0,1,0,0,0,1|2,0,0]=4 906 B15R1.8014 Cc1nc(ccc1OCC(=O)N)[N+](=O)[O-] 7a_100009862445_100000187820 [0,1,0,0,0,1|2,0,0]=4 907 B15R1.8014 NC(=O)CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100000187820 [0,1,0,0,0,1|1,0,0]=3 908 B15R1.8014 NC(=O)CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100000187820 [0,1,0,0,0,1|1,0,0]=3 909 B15R1.8014 NC(=O)COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100000187820 [0,1,0,0,0,1|1,0,0]=3 910 B15R1.8014 NC(=O)COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_100000187820 [0,1,0,0,0,1|1,0,0]=3 911 B15R1.8014 NC(=O)COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100000187820 [0,1,0,0,0,1|1,0,0]=3 912 B15R1.8014 NC(=O)COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_100000187820 [0,1,0,0,0,1|1,0,0]=3 913 B15R1.8014 NC(=O)COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100000187820 [0,1,0,0,0,1|1,0,0]=3 914 B15R1.8014 NC(=O)COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_100000187820 [0,1,0,0,0,1|1,0,0]=3 915 B15R1.8014 NC(=O)COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100000187820 [0,1,0,0,0,1|1,0,0]=3 916 B15R1.8014 NC(=O)COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_100000187820 [0,1,0,0,0,1|1,0,0]=3 917 B15R1.8014 NC(=O)COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_100000187820 [0,1,0,0,0,1|1,0,0]=3 918 B15R1.8014 NC(=O)COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_100000187820 [0,1,0,0,0,1|1,0,0]=3 919 B15R1.8014 NC(=O)COc1ncc(cc1F)[N+](=O)[O-] 34a_100000100219_100000187820 [0,1,0,0,0,1|2,0,0]=4 920 B15R1.8014 Nc1cc(ccc1OCC(=O)[O-])[N+](=O)[O-] 34a_100000181223_100020667443 [0,1,0,0,0,1|0,0,1]=3 921 B15R1.8014 Nc1cc(ccc1OC[N+](=O)[O-])[N+](=O)[O-] 34a_100000181223_100000761209 [0,1,0,0,0,1|1,0,1]=4 922 B15R1.8014 O=C([O-])CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100020667443 [0,1,0,0,0,1|0,0,1]=3 923 B15R1.8014 O=C([O-])CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100020667443 [0,1,0,0,0,1|0,0,1]=3 924 B15R1.8014 O=C([O-])COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100020667443 [0,1,0,0,0,1|0,0,1]=3 925 B15R1.8014 O=C([O-])COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100020667443 [0,1,0,0,0,1|0,0,1]=3 926 B15R1.8014 O=C([O-])COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100020667443 [0,1,0,0,0,1|0,0,1]=3 927 B15R1.8014 O=C([O-])COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100020667443 [0,1,0,0,0,1|0,0,1]=3 928 B15R1.8014 O=C([O-])COc1ncc(cc1F)[N+](=O)[O-] 34a_100000100219_100020667443 [0,1,0,0,0,1|1,0,1]=4 929 B15R1.8014 O=[N+]([O-])CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_100000761209 [0,1,0,0,0,1|1,0,1]=4 930 B15R1.8014 O=[N+]([O-])CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_100000761209 [0,1,0,0,0,1|1,0,1]=4 931 B15R1.8014 O=[N+]([O-])COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_100000761209 [0,1,0,0,0,1|1,0,1]=4 932 B15R1.8014 O=[N+]([O-])COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_100000761209 [0,1,0,0,0,1|1,0,1]=4 933 B15R1.8014 O=[N+]([O-])COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_100000761209 [0,1,0,0,0,1|1,0,1]=4 934 B15R1.8014 O=[N+]([O-])COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_100000761209 [0,1,0,0,0,1|1,0,1]=4 935 B15R1.8014 [13CH3]C(=O)COc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000191379_200025704644 [0,1,0,0,0,1|1,0,0]=3 936 B15R1.8946 CC(C)(O)CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000764493 [0,1,0,0,0,1|1,0,1]=4 937 B15R1.8946 CC(C)(O)COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000764493 [0,1,0,0,0,1|1,0,1]=4 938 B15R1.8946 CC(C)(O)COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000764493 [0,1,0,0,0,1|1,0,1]=4 939 B15R1.8946 CS(=O)(=O)NCc1ccc(cc1)[N+](=O)[O-] 40a_100000742766_100000738038 [0,1,0,0,0,1|1,0,1]=4 940 B15R1.8946 O=[N+]([O-])c1ccc(cc1)NCS(=O)(=O)[O-] 34a_100015195142_100009817235 [0,1,0,0,0,1|1,0,1]=4 941 B15R1.8946 O=[N+]([O-])c1ccc(cc1)OCS(=O)(=O)[O-] 34a_100000185810_100009817235 [0,1,0,0,0,1|1,0,1]=4 942 B15R1.2997 CC(=O)Nc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000731167 [0,1,0,0,0,1|2,0,0]=4 943 B15R1.2997 COC(=O)Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100009816886 [0,1,0,0,0,1|2,0,0]=4 944 B15R1.2997 COC(=O)Cc1ccc(cc1)CC(=O)C 1458a_100010217620_200000210301 [0,1,0,0,0,1|2,0,0]=4 945 B15R1.2997 COC(=O)Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100010217620_200025704644 [0,1,0,0,0,1|2,0,0]=4 946 B15R1.2997 COC(=O)Cc1ccc(cc1)NC(=O)C 188690a_100000745640_100015343762 [0,1,0,0,0,1|2,0,0]=4 947 B15R1.37 CC(=O)Cc1ccc(cc1C#N)[N+](=O)[O-] 1458a_100000070787_100012145663 [0,2,0,0,0,0|1,0,0]=3 948 B15R1.37 CC(=O)Nc1ccc(cc1C#N)[N+](=O)[O-] 1626a_100000188651_100015343762 [0,2,0,0,0,0|2,0,0]=4 949 B15R1.37 CC(=O)Nc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000193061_200025704644 [0,2,0,0,0,0|2,0,0]=4 950 B15R1.37 CC(=O)Nc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000193061_200025704644 [0,2,0,0,0,0|2,0,0]=4 951 B15R1.37 COc1cc(ccc1CC(=O)C)[N+](=O)[O-] 1458a_100000070787_100010150584 [0,2,0,0,0,0|1,0,0]=3 952 B15R1.37 COc1cc(ccc1NC(=O)C)[N+](=O)[O-] 11a_100000211086_100015343762 [0,2,0,0,0,0|2,0,0]=4 953 B15R1.37 COc1cc(ccc1NC(=O)C)[N+](=O)[O-] 1626a_100000211086_100015343762 [0,2,0,0,0,0|2,0,0]=4 954 B15R1.37 COc1cc(ccc1NC(=O)C)[N+](=O)[O-] 34a_100000193061_200000210301 [0,2,0,0,0,0|2,0,0]=4 955 B15R1.37 COc1cc(ccc1NC(=O)C)[N+](=O)[O-] 7a_100000193061_200000210301 [0,2,0,0,0,0|2,0,0]=4 956 B15R1.2999 C#CC(=O)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000211873_100000741879 [0,2,0,0,0,0|1,0,0]=3 957 B15R1.2999 C#CC(=O)Cc1ccc(cc1C)[N+](=O)[O-] 1458a_100000211873_100010218038 [0,2,0,0,0,0|1,0,0]=3 958 B15R1.2999 C#CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000211873_100000747184 [0,2,0,0,0,0|1,0,0]=3 959 B15R1.2999 C#CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000211873_100000759423 [0,2,0,0,0,0|1,0,0]=3 960 B15R1.2999 C=CC(=O)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000185746_100000741879 [0,2,0,0,0,0|1,0,0]=3 961 B15R1.2999 C=CC(=O)Cc1ccc(cc1C)[N+](=O)[O-] 1458a_100000185746_100010218038 [0,2,0,0,0,0|1,0,0]=3 962 B15R1.2999 C=CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000185746_100000747184 [0,2,0,0,0,0|1,0,0]=3 963 B15R1.2999 C=CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000185746_100000759423 [0,2,0,0,0,0|1,0,0]=3 964 B15R1.2999 C=CC(=O)Nc1ccc(cc1F)[N+](=O)[O-] 1626a_100000745739_100000185746 [0,2,0,0,0,0|2,0,0]=4 965 B15R1.2999 C=CC(=O)Nc1ccc(cc1I)[N+](=O)[O-] 1626a_100012047210_100000185746 [0,2,0,0,0,0|2,0,0]=4 966 B15R1.2999 C=CC(=O)Nc1ccc(cc1O)[N+](=O)[O-] 22a_100000210499_100000185746 [0,2,0,0,0,0|2,0,0]=4 967 B15R1.2999 CC(=O)c1ccc(c(c1)Br)CC(=O)CO 1458a_100000210174_100010884425 [0,2,0,0,0,0|2,0,0]=4 968 B15R1.2999 CCC(=O)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000210414_100000741879 [0,2,0,0,0,0|1,0,0]=3 969 B15R1.2999 CCC(=O)Cc1ccc(cc1C)[N+](=O)[O-] 1458a_100000210414_100010218038 [0,2,0,0,0,0|1,0,0]=3 970 B15R1.2999 CCC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000210414_100000747184 [0,2,0,0,0,0|1,0,0]=3 971 B15R1.2999 CCC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_100000210202 [0,2,0,0,0,0|1,0,0]=3 972 B15R1.2999 CCC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000210414_100000759423 [0,2,0,0,0,0|1,0,0]=3 973 B15R1.2999 CCC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_100000210202 [0,2,0,0,0,0|1,0,0]=3 974 B15R1.2999 CCC(=O)Nc1ccc(cc1C)[N+](=O)[O-] 11a_100000184110_100000210414 [0,2,0,0,0,0|2,0,0]=4 975 B15R1.2999 CCC(=O)Nc1ccc(cc1Cl)[N+](=O)[O-] 11a_100000185723_100000210414 [0,2,0,0,0,0|2,0,0]=4 976 B15R1.2999 CCC(=O)Nc1ccc(cc1F)[N+](=O)[O-] 11a_100000745739_100000210414 [0,2,0,0,0,0|2,0,0]=4 977 B15R1.2999 CCC(=O)Nc1ccc(cc1F)[N+](=O)[O-] 1626a_100000745739_100000210414 [0,2,0,0,0,0|2,0,0]=4 978 B15R1.2999 CCC(=O)Nc1ccc(cc1I)[N+](=O)[O-] 1626a_100012047210_100000210414 [0,2,0,0,0,0|2,0,0]=4 979 B15R1.2999 CCC(=O)Nc1ccc(cc1O)[N+](=O)[O-] 22a_100000210499_100000210414 [0,2,0,0,0,0|2,0,0]=4 980 B15R1.2999 CCC(=O)Nc1ccc(cc1O)[N+](=O)[O-] 527a_100000210499_100000210414 [0,2,0,0,0,0|2,0,0]=4 981 B15R1.2999 CNC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 11a_106832991635_100000757483 [0,2,0,0,0,0|1,0,0]=3 982 B15R1.2999 CNC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1626a_100102657272_100000757483 [0,2,0,0,0,0|1,0,0]=3 983 B15R1.2999 CNC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 240690a_100102657272_100000757483 [0,2,0,0,0,0|1,0,0]=3 984 B15R1.2999 CNC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 11a_106832991635_100000688093 [0,2,0,0,0,0|1,0,0]=3 985 B15R1.2999 CNC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1626a_100102657272_100000688093 [0,2,0,0,0,0|1,0,0]=3 986 B15R1.2999 CNC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 240690a_100102657272_100000688093 [0,2,0,0,0,0|1,0,0]=3 987 B15R1.2999 CNC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 527a_100102657272_100000688093 [0,2,0,0,0,0|1,0,0]=3 988 B15R1.2999 CNC(=O)Nc1ccc(cc1C)[N+](=O)[O-] 2430a_100000184110_100102657272 [0,2,0,0,0,0|2,0,0]=4 989 B15R1.2999 Cc1cc(ccc1CC(=O)CO)[N+](=O)[O-] 1458a_100000210174_100010218038 [0,2,0,0,0,0|0,0,0]=2 990 B15R1.2999 O=C(CF)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_100015361967 [0,2,0,0,0,0|1,0,0]=3 991 B15R1.2999 O=C(CF)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_100015361967 [0,2,0,0,0,0|1,0,0]=3 992 B15R1.2999 O=C(CO)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000210174_100000741879 [0,2,0,0,0,0|0,0,0]=2 993 B15R1.2999 O=C(CO)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000210174_100000747184 [0,2,0,0,0,0|0,0,0]=2 994 B15R1.2999 O=C(CO)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000210174_100000759423 [0,2,0,0,0,0|0,0,0]=2 995 B15R1.2999 O=C(CO)Nc1ccc(cc1O)[N+](=O)[O-] 22a_100000210499_100000210174 [0,2,0,0,0,0|1,0,0]=3 996 B15R1.2999 O=C(CO)Nc1ccc(cc1O)[N+](=O)[O-] 527a_100000210499_100000210174 [0,2,0,0,0,0|1,0,0]=3 997 B15R1.5381 CC(=O)N(C)c1ccc(cc1F)[N+](=O)[O-] 1626a_100011248812_100015343762 [0,2,0,0,0,0|2,0,0]=4 998 B15R1.8391 CC(=O)Cc1cc(c(cc1F)[N+](=O)[O-])F 1458a_100010202021_200000210301 [0,2,0,0,0,0|1,0,0]=3 999 B15R1.8391 CC(=O)Nc1cc(c(cc1C)[N+](=O)[O-])Br 11a_200010826999_100015343762 [0,2,0,0,0,0|2,0,0]=4 1000 B15R1.8391 CC(=O)Nc1cc(c(cc1C)[N+](=O)[O-])C 11a_106256046237_100015343762 [0,2,0,0,0,0|2,0,0]=4 1001 B15R1.8391 CC(=O)Nc1cc(c(cc1C)[N+](=O)[O-])Cl 11a_100000701678_100015343762 [0,2,0,0,0,0|2,0,0]=4 1002 B15R1.8391 CC(=O)Nc1cc(c(cc1C)[N+](=O)[O-])F 11a_100000085368_100015343762 [0,2,0,0,0,0|2,0,0]=4 1003 B15R1.8391 CC(=O)Nc1cc(c(cc1C)[N+](=O)[O-])F 1626a_100000085368_100015343762 [0,2,0,0,0,0|2,0,0]=4 1004 B15R1.8391 CC(=O)Nc1cc(c(cc1F)[N+](=O)[O-])F 11a_100000071221_100015343762 [0,2,0,0,0,0|2,0,0]=4 1005 B15R1.8391 CC(=O)Nc1cc(c(cc1F)[N+](=O)[O-])F 1626a_100000071221_100015343762 [0,2,0,0,0,0|2,0,0]=4 1006 B15R1.8391 CC(=O)Nc1cc(c(cc1O)[N+](=O)[O-])Cl 22a_100000211395_100000070787 [0,2,0,0,0,0|2,0,0]=4 1007 B15R1.8391 CC(=O)Nc1cc(c(cc1O)[N+](=O)[O-])Cl 527a_100000211395_100103153847 [0,2,0,0,0,0|2,0,0]=4 1008 B15R1.8391 [13CH3]C(=O)Cc1cc(c(cc1F)[N+](=O)[O-])F 1458a_100010202021_200025704644 [0,2,0,0,0,0|1,0,0]=3 1009 B15R1.25855 CC(=O)Nc1ccc(c(c1C)C)[N+](=O)[O-] 11a_100000074975_100015343762 [0,2,0,0,0,0|2,0,0]=4 1010 B15R1.25855 CC(=O)Nc1ccc(c(c1C)C)[N+](=O)[O-] 527a_100000074975_100103153847 [0,2,0,0,0,0|2,0,0]=4 1011 B15R1.25855 CC(=O)Nc1ccc(c(c1C)Cl)[N+](=O)[O-] 11a_200000090439_100015343762 [0,2,0,0,0,0|2,0,0]=4 1012 B15R1.25855 CC(=O)Nc1ccc(c(c1C)F)[N+](=O)[O-] 11a_100000090441_100015343762 [0,2,0,0,0,0|2,0,0]=4 1013 B15R1.28960 CC(=O)Cc1c(cc(cc1Br)[N+](=O)[O-])Br 1458a_100000070787_200020889872 [0,2,0,0,0,0|1,0,0]=3 1014 B15R1.28960 CC(=O)Nc1c(cc(cc1C)[N+](=O)[O-])C 11a_100000765414_100015343762 [0,2,0,0,0,0|2,0,0]=4 1015 B15R1.28960 CC(=O)Nc1c(cc(cc1F)[N+](=O)[O-])F 11a_100011217156_100015343762 [0,2,0,0,0,0|2,0,0]=4 1016 B15R1.28960 CC(=O)Nc1c(cc(cc1F)[N+](=O)[O-])F 1626a_100011217156_100015343762 [0,2,0,0,0,0|2,0,0]=4 1017 B15R1.28960 CC(=O)Nc1c(cc(cc1I)[N+](=O)[O-])F 1626a_100020743797_100015343762 [0,2,0,0,0,0|2,0,0]=4 1018 B15R1.28960 CC(=O)Nc1c(cc(cc1I)[N+](=O)[O-])I 1626a_100000033350_100015343762 [0,2,0,0,0,0|2,0,0]=4 1019 B15R1.7698 CNS(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 270084a_100102657272_100000735625 [0,2,0,0,0,0|1,0,1]=4 1020 B15R1.7698 CNS(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 274078a_100102657272_100000735625 [0,2,0,0,0,0|1,0,1]=4 1021 B15R1.7698 CNS(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-] 40a_100102657272_100015196453 [0,2,0,0,0,0|1,0,1]=4 1022 B15R1.317 CNS(=O)(=O)c1ccc(cc1)CC(=O)O 270084a_100102657272_100000740367 [0,2,0,0,0,0|1,0,1]=4 1023 B15R1.317 CNS(=O)(=O)c1ccc(cc1)CC(=O)O 274078a_100102657272_100000740367 [0,2,0,0,0,0|1,0,1]=4 1024 B15R1.2994 CCC(=O)c1ccc(cc1)CC(=O)OC 1458a_100000111013_100000210202 [0,2,0,0,0,0|2,0,0]=4 1025 B15R1.2994 CNC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000753832 [0,2,0,0,0,0|2,0,0]=4 1026 B15R1.2994 CNC(=O)c1ccc(cc1)CC(=O)OC 11a_106832991635_100000111013 [0,2,0,0,0,0|2,0,0]=4 1027 B15R1.2994 CNC(=O)c1ccc(cc1)CC(=O)OC 1626a_100102657272_100000111013 [0,2,0,0,0,0|2,0,0]=4 1028 B15R1.2994 CNC(=O)c1ccc(cc1)CC(=O)OC 240690a_100102657272_100000111013 [0,2,0,0,0,0|2,0,0]=4 1029 B15R1.2994 COC(=O)Cc1ccc(cc1)C(=O)CF 1458a_100000111013_100015361967 [0,2,0,0,0,0|2,0,0]=4 1030 B15R1.2994 COC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000735637 [0,2,0,0,0,0|1,0,1]=4 1031 B15R1.2995 CS(=O)(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000717844 [0,2,0,0,0,0|1,0,1]=4 1032 B15R1.2995 NS(=O)(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_200012292325 [0,2,0,0,0,0|1,0,1]=4 1033 B15R1.1262 C#CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000184674 [0,2,0,0,0,0|1,0,0]=3 1034 B15R1.1262 C#CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100011220946_100000181861 [0,2,0,0,0,0|1,0,0]=3 1035 B15R1.1262 C#CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100011220946 [0,2,0,0,0,0|2,0,0]=4 1036 B15R1.1262 C=CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210193_100000181861 [0,2,0,0,0,0|1,0,0]=3 1037 B15R1.1262 C=CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000210623 [0,2,0,0,0,0|1,0,0]=3 1038 B15R1.1262 C=CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000210193 [0,2,0,0,0,0|2,0,0]=4 1039 B15R1.1262 C=CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000210193 [0,2,0,0,0,0|2,0,0]=4 1040 B15R1.1262 CC#CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000763181_100000181861 [0,2,0,0,0,0|1,0,0]=3 1041 B15R1.1262 CC(=O)c1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000756337 [0,2,0,0,0,0|2,0,0]=4 1042 B15R1.1262 CC=CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210699_100000181861 [0,2,0,0,0,0|1,0,0]=3 1043 B15R1.1262 CC=CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000210699 [0,2,0,0,0,0|2,0,0]=4 1044 B15R1.1262 CC=CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000210699 [0,2,0,0,0,0|2,0,0]=4 1045 B15R1.1262 CCCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000210303 [0,2,0,0,0,0|1,0,0]=3 1046 B15R1.1262 CCCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000211992_100000181861 [0,2,0,0,0,0|1,0,0]=3 1047 B15R1.1262 CCCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000211992 [0,2,0,0,0,0|2,0,0]=4 1048 B15R1.1262 CCCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000211992 [0,2,0,0,0,0|2,0,0]=4 1049 B15R1.1262 CCNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 11a_100015525214_100000210908 [0,2,0,0,0,0|1,0,0]=3 1050 B15R1.1262 CCNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 240690a_100015525214_100000210908 [0,2,0,0,0,0|1,0,0]=3 1051 B15R1.1262 CCNC(=O)Nc1ccc(cc1)[N+](=O)[O-] 2430a_100015195142_100015525214 [0,2,0,0,0,0|2,0,0]=4 1052 B15R1.1262 CN(CC=O)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_200015260668 [0,2,0,0,0,0|2,0,0]=4 1053 B15R1.1262 CN(CC=O)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_200015260668 [0,2,0,0,0,0|2,0,0]=4 1054 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100000210263_100000181861 [0,2,0,0,0,0|2,0,0]=4 1055 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_100000211926 [0,2,0,0,0,0|2,0,0]=4 1056 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100000210263_100000184243 [0,2,0,0,0,0|2,0,0]=4 1057 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100000211926 [0,2,0,0,0,0|2,0,0]=4 1058 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 26a_100000210263_100000185810 [0,2,0,0,0,0|2,0,0]=4 1059 B15R1.1262 CN(CCO)Cc1ccc(cc1)[N+](=O)[O-] 270004a_100000210263_100000189386 [0,2,0,0,0,0|2,0,0]=4 1060 B15R1.1262 CNCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000182378 [0,2,0,0,0,0|2,0,0]=4 1061 B15R1.1262 CNCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 2230a_200000168472_200000210301 [0,2,0,0,0,0|2,0,0]=4 1062 B15R1.1262 CNCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000182378 [0,2,0,0,0,0|2,0,0]=4 1063 B15R1.1262 CNCC(=O)Oc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100009813447 [0,2,0,0,0,0|2,0,0]=4 1064 B15R1.1262 CNCC(=O)Oc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100009813447 [0,2,0,0,0,0|2,0,0]=4 1065 B15R1.1262 CNNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 22a_100016993582_100000210908 [0,2,0,0,0,0|1,0,0]=3 1066 B15R1.1262 COCC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000210968_100000756337 [0,2,0,0,0,0|2,0,0]=4 1067 B15R1.1262 COCC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000210968_100000231043 [0,2,0,0,0,0|2,0,0]=4 1068 B15R1.1262 COCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210968_100000181861 [0,2,0,0,0,0|0,0,0]=2 1069 B15R1.1262 COCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000210968 [0,2,0,0,0,0|1,0,0]=3 1070 B15R1.1262 COCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000210968 [0,2,0,0,0,0|1,0,0]=3 1071 B15R1.1262 COCN(C)Cc1ccc(cc1)[N+](=O)[O-] 2230a_100015189985_100000766300 [0,2,0,0,0,0|2,0,0]=4 1072 B15R1.1262 COCN(C)Cc1ccc(cc1)[N+](=O)[O-] 269982a_100015189985_100000766300 [0,2,0,0,0,0|2,0,0]=4 1073 B15R1.1262 CSCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000184570_100000181861 [0,2,0,0,0,0|0,1,0]=3 1074 B15R1.1262 CSCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100000184570 [0,2,0,0,0,0|1,1,0]=4 1075 B15R1.1262 CSCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100000184570 [0,2,0,0,0,0|1,1,0]=4 1076 B15R1.1262 N#CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100011214920 [0,2,0,0,0,0|1,0,0]=3 1077 B15R1.1262 N#CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100051588842_100000181861 [0,2,0,0,0,0|1,0,0]=3 1078 B15R1.1262 N#CCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100051588842 [0,2,0,0,0,0|2,0,0]=4 1079 B15R1.1262 NC(=O)c1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000231043 [0,2,0,0,0,0|2,0,0]=4 1080 B15R1.1262 O=C(C=CBr)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100016273825_100000181861 [0,2,0,0,0,0|1,0,0]=3 1081 B15R1.1262 O=C(C=CBr)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100016273825 [0,2,0,0,0,0|2,0,0]=4 1082 B15R1.1262 O=C(C=CCl)Cc1ccc(cc1)[N+](=O)[O-] 1458a_200016279998_100000181861 [0,2,0,0,0,0|1,0,0]=3 1083 B15R1.1262 O=C(C=CCl)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_200016279998 [0,2,0,0,0,0|2,0,0]=4 1084 B15R1.1262 O=C(C=CCl)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_200016279998 [0,2,0,0,0,0|2,0,0]=4 1085 B15R1.1262 O=C(C=CI)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100016256311_100000181861 [0,2,0,0,0,0|1,0,0]=3 1086 B15R1.1262 O=C(C=CI)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100016256311 [0,2,0,0,0,0|2,0,0]=4 1087 B15R1.1262 O=C(CCF)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100011217306 [0,2,0,0,0,0|1,0,0]=3 1088 B15R1.1262 O=C(CCO)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000211926 [0,2,0,0,0,0|0,0,0]=2 1089 B15R1.1262 O=C(CCO)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100011216618_100000181861 [0,2,0,0,0,0|0,0,0]=2 1090 B15R1.1262 [13CH3]NCC(=O)Nc1ccc(cc1)[N+](=O)[O-] 2230a_200000168472_200025704644 [0,2,0,0,0,0|2,0,0]=4 1091 B15R1.1333 C#CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000211873_100000684656 [0,2,0,0,0,0|1,0,0]=3 1092 B15R1.1333 C=CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185746_100000684656 [0,2,0,0,0,0|1,0,0]=3 1093 B15R1.1333 CC(C(=O)CF)c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_100015361967 [0,2,0,0,0,0|1,0,0]=3 1094 B15R1.1333 CC(C(=O)CO)c1ccc(cc1)[N+](=O)[O-] 1458a_100000210174_100000684656 [0,2,0,0,0,0|0,0,0]=2 1095 B15R1.1333 CCC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000210414_100000684656 [0,2,0,0,0,0|1,0,0]=3 1096 B15R1.1333 CCC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_100000210202 [0,2,0,0,0,0|1,0,0]=3 1097 B15R1.1333 CCC(=O)N(C)c1ccc(cc1)[N+](=O)[O-] 11a_100000156523_100000210414 [0,2,0,0,0,0|2,0,0]=4 1098 B15R1.1333 CNC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100011215393 [0,2,0,0,0,0|1,0,0]=3 1099 B15R1.1333 CNC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100011215393 [0,2,0,0,0,0|1,0,0]=3 1100 B15R1.1333 CNC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100011215393 [0,2,0,0,0,0|1,0,0]=3 1101 B15R1.1333 CNC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100011215393 [0,2,0,0,0,0|1,0,0]=3 1102 B15R1.3848 C#CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000211873_100009816690 [0,2,0,0,0,0|1,0,0]=3 1103 B15R1.3848 C#CC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000211873_100000687068 [0,2,0,0,0,0|1,0,0]=3 1104 B15R1.3848 C=CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000185746_100009816690 [0,2,0,0,0,0|1,0,0]=3 1105 B15R1.3848 C=CC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000185746_100000687068 [0,2,0,0,0,0|1,0,0]=3 1106 B15R1.3848 C=CC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 22a_100000745639_100000185746 [0,2,0,0,0,0|2,0,0]=4 1107 B15R1.3848 C=CC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 1626a_100000750973_100000185746 [0,2,0,0,0,0|2,0,0]=4 1108 B15R1.3848 C=CC(=O)Nc1ccc(c(c1)F)[N+](=O)[O-] 1626a_100000741728_100000185746 [0,2,0,0,0,0|2,0,0]=4 1109 B15R1.3848 CCC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_100000210202 [0,2,0,0,0,0|1,0,0]=3 1110 B15R1.3848 CCC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000210414_100009816690 [0,2,0,0,0,0|1,0,0]=3 1111 B15R1.3848 CCC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100011935184_100000210202 [0,2,0,0,0,0|1,0,0]=3 1112 B15R1.3848 CCC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000210414_100000687068 [0,2,0,0,0,0|1,0,0]=3 1113 B15R1.3848 CCC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_100000210202 [0,2,0,0,0,0|1,0,0]=3 1114 B15R1.3848 CCC(=O)Nc1ccc(c(c1)Br)[N+](=O)[O-] 11a_100000693983_100000210414 [0,2,0,0,0,0|2,0,0]=4 1115 B15R1.3848 CCC(=O)Nc1ccc(c(c1)Br)[N+](=O)[O-] 527a_100000693983_100000210414 [0,2,0,0,0,0|2,0,0]=4 1116 B15R1.3848 CCC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 11a_100000745639_100000210414 [0,2,0,0,0,0|2,0,0]=4 1117 B15R1.3848 CCC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 22a_100000745639_100000210414 [0,2,0,0,0,0|2,0,0]=4 1118 B15R1.3848 CCC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 527a_100000745639_100000210414 [0,2,0,0,0,0|2,0,0]=4 1119 B15R1.3848 CCC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 11a_100000750973_100000210414 [0,2,0,0,0,0|2,0,0]=4 1120 B15R1.3848 CCC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 1626a_100000750973_100000210414 [0,2,0,0,0,0|2,0,0]=4 1121 B15R1.3848 CCC(=O)Nc1ccc(c(c1)F)[N+](=O)[O-] 11a_100000741728_100000210414 [0,2,0,0,0,0|2,0,0]=4 1122 B15R1.3848 CCC(=O)Nc1ccc(c(c1)F)[N+](=O)[O-] 1626a_100000741728_100000210414 [0,2,0,0,0,0|2,0,0]=4 1123 B15R1.3848 CNC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 11a_106832991635_100010245527 [0,2,0,0,0,0|1,0,0]=3 1124 B15R1.3848 CNC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1626a_100102657272_100010245527 [0,2,0,0,0,0|1,0,0]=3 1125 B15R1.3848 CNC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 240690a_100102657272_100010245527 [0,2,0,0,0,0|1,0,0]=3 1126 B15R1.3848 CNC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 527a_100102657272_100010245527 [0,2,0,0,0,0|1,0,0]=3 1127 B15R1.3848 CNC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 11a_106832991635_100011935184 [0,2,0,0,0,0|1,0,0]=3 1128 B15R1.3848 CNC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1626a_100102657272_100011935184 [0,2,0,0,0,0|1,0,0]=3 1129 B15R1.3848 CNC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 240690a_100102657272_100011935184 [0,2,0,0,0,0|1,0,0]=3 1130 B15R1.3848 CNC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 527a_100102657272_100011935184 [0,2,0,0,0,0|1,0,0]=3 1131 B15R1.3848 CNC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 11a_106832991635_200011217010 [0,2,0,0,0,0|1,0,0]=3 1132 B15R1.3848 CNC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1626a_100102657272_200011217010 [0,2,0,0,0,0|1,0,0]=3 1133 B15R1.3848 CNC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 240690a_100102657272_200011217010 [0,2,0,0,0,0|1,0,0]=3 1134 B15R1.3848 CNC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 527a_100102657272_200011217010 [0,2,0,0,0,0|1,0,0]=3 1135 B15R1.3848 CNC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 11a_106832991635_100009873053 [0,2,0,0,0,0|1,0,0]=3 1136 B15R1.3848 CNC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 240690a_100102657272_100009873053 [0,2,0,0,0,0|1,0,0]=3 1137 B15R1.3848 CNC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 527a_100102657272_100009873053 [0,2,0,0,0,0|1,0,0]=3 1138 B15R1.3848 CNC(=O)Nc1ccc(c(c1)C)[N+](=O)[O-] 2430a_100000745639_100102657272 [0,2,0,0,0,0|2,0,0]=4 1139 B15R1.3848 CNC(=O)Nc1ccc(c(c1)Cl)[N+](=O)[O-] 2430a_100000750973_100102657272 [0,2,0,0,0,0|2,0,0]=4 1140 B15R1.3848 Cc1cc(ccc1[N+](=O)[O-])CC(=O)CF 1458a_100011935184_100015361967 [0,2,0,0,0,0|1,0,0]=3 1141 B15R1.3848 Cc1cc(ccc1[N+](=O)[O-])CC(=O)CO 1458a_100000210174_100009816690 [0,2,0,0,0,0|0,0,0]=2 1142 B15R1.3848 Cc1cc(ccc1[N+](=O)[O-])NC(=O)CO 22a_100000745639_100000210174 [0,2,0,0,0,0|1,0,0]=3 1143 B15R1.3848 Cc1cc(ccc1[N+](=O)[O-])NC(=O)CO 527a_100000745639_100000210174 [0,2,0,0,0,0|1,0,0]=3 1144 B15R1.3848 O=C(CF)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_100015361967 [0,2,0,0,0,0|1,0,0]=3 1145 B15R1.3848 O=C(CF)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_100015361967 [0,2,0,0,0,0|1,0,0]=3 1146 B15R1.3848 O=C(CO)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000210174_100000687068 [0,2,0,0,0,0|0,0,0]=2 1147 B15R1.3848 O=C(CO)Nc1ccc(c(c1)Br)[N+](=O)[O-] 527a_100000693983_100000210174 [0,2,0,0,0,0|1,0,0]=3 1148 B15R1.5379 CC(=O)N(C)c1ccc(c(c1)C)[N+](=O)[O-] 11a_100000686994_100015343762 [0,2,0,0,0,0|2,0,0]=4 1149 B15R1.12449 COc1cc(ccc1[N+](=O)[O-])CC(=O)C 1458a_100012357509_200000210301 [0,2,0,0,0,0|1,0,0]=3 1150 B15R1.12449 COc1cc(ccc1[N+](=O)[O-])CC(=O)[13CH3] 1458a_100012357509_200025704644 [0,2,0,0,0,0|1,0,0]=3 1151 B15R1.12449 COc1cc(ccc1[N+](=O)[O-])NC(=O)C 11a_102125277084_100015343762 [0,2,0,0,0,0|2,0,0]=4 1152 B15R1.12449 COc1cc(ccc1[N+](=O)[O-])NC(=O)C 1626a_102125277084_100015343762 [0,2,0,0,0,0|2,0,0]=4 1153 B15R1.12449 COc1cc(ccc1[N+](=O)[O-])NC(=O)C 527a_102125277084_100103153847 [0,2,0,0,0,0|2,0,0]=4 1154 B15R1.28953 CC(=O)Nc1cc(c(c(c1)F)[N+](=O)[O-])F 11a_200000043003_100015343762 [0,2,0,0,0,0|2,0,0]=4 1155 B15R1.28953 CC(=O)Nc1cc(c(c(c1)F)[N+](=O)[O-])F 1626a_200000043003_100015343762 [0,2,0,0,0,0|2,0,0]=4 1156 B15R1.1354 CCC(C(=O)C)c1ccc(cc1)[N+](=O)[O-] 1458a_100012339478_200000210301 [0,2,0,0,0,0|1,0,0]=3 1157 B15R1.1354 CCC(C(=O)[13CH3])c1ccc(cc1)[N+](=O)[O-] 1458a_100012339478_200025704644 [0,2,0,0,0,0|1,0,0]=3 1158 B15R1.1354 CCN(C(=O)C)c1ccc(cc1)[N+](=O)[O-] 1626a_100000156571_100015343762 [0,2,0,0,0,0|2,0,0]=4 1159 B15R1.8948 CC(=O)C(C)(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000238309_200000210301 [0,2,0,0,0,0|1,0,0]=3 1160 B15R1.8948 CC(C)(C(=O)[13CH3])c1ccc(cc1)[N+](=O)[O-] 1458a_100000238309_200025704644 [0,2,0,0,0,0|1,0,0]=3 1161 B15R2.16216 O=[N+]([O-])c1ccc(cc1)NCC2CO2 2230a_100015195142_100011216344 [0,0,0,1,0,1|1,0,1]=4 1162 B15R2.16216 O=[N+]([O-])c1ccc(cc1)NCC2CO2 34a_100015195142_102125554688 [0,0,0,1,0,1|1,0,1]=4 1163 B15R2.16216 O=[N+]([O-])c1ccc(cc1)OCC2CO2 34a_100000185810_102125554688 [0,0,0,1,0,1|1,0,1]=4 1164 B15R2.16216 O=[N+]([O-])c1ccc(cc1)OCC2CO2 7a_100000185810_102125554688 [0,0,0,1,0,1|1,0,1]=4 1165 B15R2.16216 O=[N+]([O-])c1ccc(cc1)OC[C@@H]2CO2 7a_100000185810_100000745022 [0,0,0,1,0,1|1,0,1]=4 1166 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000747473 [1,0,0,0,0,1|2,0,0]=4 1167 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000747473_100000188517 [1,0,0,0,0,1|2,0,0]=4 1168 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100000188517_100020667443 [1,0,0,0,0,1|1,0,1]=4 1169 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000188517 [1,0,0,0,0,1|1,0,1]=4 1170 B13R1.587 CC(=O)Cc1cc(ccn1)[N+](=O)[O-] 1458a_100000070787_100010177786 [0,0,0,0,1,1|1,0,0]=3 1171 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000070787_100000737091 [0,0,0,0,1,1|1,0,0]=3 1172 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200000210301 [0,0,0,0,1,1|1,0,0]=3 1173 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 11a_100000184103_100015343762 [0,0,0,0,1,1|2,0,0]=4 1174 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 1626a_100000184103_100015343762 [0,0,0,0,1,1|2,0,0]=4 1175 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 22a_100000184103_100000070787 [0,0,0,0,1,1|2,0,0]=4 1176 B13R1.587 [13CH3]C(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200025704644 [0,0,0,0,1,1|1,0,0]=3 1177 B15R1.1080 C=C(C)CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000730704 [0,0,0,0,0,2|2,0,0]=4 1178 B15R1.1080 C=C(C)CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000730704 [0,0,0,0,0,2|2,0,0]=4 1179 B15R1.1080 C=C(C)CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000730704 [0,0,0,0,0,2|2,0,0]=4 1180 B15R1.1080 C=C(C)CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000730704 [0,0,0,0,0,2|2,0,0]=4 1181 B15R1.1080 C=C(C)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000748629 [0,0,0,0,0,2|2,0,0]=4 1182 B15R1.1080 C=C(C)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000748629 [0,0,0,0,0,2|2,0,0]=4 1183 B15R1.1080 C=C(C)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000210245_100000181861 [0,0,0,0,0,2|2,0,0]=4 1184 B15R1.1080 C=C(C)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000748629 [0,0,0,0,0,2|2,0,0]=4 1185 B15R1.1080 C=C(C)CSCc1ccc(cc1)[N+](=O)[O-] 62a_100000748629_100000184243 [0,0,0,0,0,2|2,0,0]=4 1186 B15R1.1080 C=C(F)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100009893438 [0,0,0,0,0,2|2,0,0]=4 1187 B15R1.1080 C=C(F)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100009893438 [0,0,0,0,0,2|2,0,0]=4 1188 B15R1.1080 C=C(F)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100009893438 [0,0,0,0,0,2|2,0,0]=4 1189 B15R1.1080 C=C(F)COCc1ccc(cc1)[N+](=O)[O-] 34a_200010262243_100000181861 [0,0,0,0,0,2|2,0,0]=4 1190 B15R1.1080 C=C(F)CSCc1ccc(cc1)[N+](=O)[O-] 62a_100000042424_100000184243 [0,0,0,0,0,2|2,0,0]=4 1191 B15R1.1080 CC(=CCNc1ccc(cc1)[N+](=O)[O-])C 2230a_100015195142_100000761012 [0,0,0,0,0,2|2,0,0]=4 1192 B15R1.1080 CC(=CCNc1ccc(cc1)[N+](=O)[O-])C 34a_100015195142_100000761012 [0,0,0,0,0,2|2,0,0]=4 1193 B15R1.1080 CC(=CCOc1ccc(cc1)[N+](=O)[O-])C 34a_100000185810_100000761012 [0,0,0,0,0,2|2,0,0]=4 1194 B15R1.1080 CC(=CCOc1ccc(cc1)[N+](=O)[O-])C 7a_100000185810_100000761012 [0,0,0,0,0,2|2,0,0]=4 1195 B15R1.1080 CC(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100010167727 [0,0,0,0,0,2|1,0,0]=3 1196 B15R1.1080 CC(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100011214885_200000210301 [0,0,0,0,0,2|1,0,0]=3 1197 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000742347 [0,0,0,0,0,2|1,0,0]=3 1198 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000738207_200000210301 [0,0,0,0,0,2|1,0,0]=3 1199 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000053229 [0,0,0,0,0,2|1,0,0]=3 1200 B15R1.1080 CC(=O)CCOc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000053229 [0,0,0,0,0,2|2,0,0]=4 1201 B15R1.1080 CC(=O)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211253_100000181861 [0,0,0,0,0,2|1,0,0]=3 1202 B15R1.1080 CC(=O)CSCc1ccc(cc1)[N+](=O)[O-] 1458a_100000150263_200000210301 [0,0,0,0,0,2|1,0,0]=3 1203 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 11a_100000744123_100015343762 [0,0,0,0,0,2|1,0,0]=3 1204 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 1626a_100000744123_100015343762 [0,0,0,0,0,2|1,0,0]=3 1205 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 240690a_100000744123_100015343762 [0,0,0,0,0,2|1,0,0]=3 1206 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 527a_100000744123_100103153847 [0,0,0,0,0,2|1,0,0]=3 1207 B15R1.1080 CC(=O)NN=Cc1ccc(cc1)[N+](=O)[O-] 4a_100000189765_100000189386 [0,0,0,0,0,2|1,0,1]=4 1208 B15R1.1080 CC(=O)OCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100009813279 [0,0,0,0,0,2|1,0,0]=3 1209 B15R1.1080 CC(=O)OCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100009813279 [0,0,0,0,0,2|1,0,0]=3 1210 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000756337 [0,0,0,0,0,2|2,0,0]=4 1211 B15R1.1080 CC(O)CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100012276601 [0,0,0,0,0,2|1,0,1]=4 1212 B15R1.1080 CC(O)CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100012276601 [0,0,0,0,0,2|1,0,1]=4 1213 B15R1.1080 CC(O)CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100012276601 [0,0,0,0,0,2|1,0,1]=4 1214 B15R1.1080 CC(O)CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100012276601 [0,0,0,0,0,2|1,0,1]=4 1215 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 207a_100000210904_100000189386 [0,0,0,0,0,2|1,0,1]=4 1216 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000210904_100000181861 [0,0,0,0,0,2|1,0,1]=4 1217 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100011218427 [0,0,0,0,0,2|1,0,1]=4 1218 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 270004a_100000210904_100000189386 [0,0,0,0,0,2|1,0,1]=4 1219 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000210904_100000181861 [0,0,0,0,0,2|1,0,1]=4 1220 B15R1.1080 CC(O)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100011218427 [0,0,0,0,0,2|1,0,1]=4 1221 B15R1.1080 CC(O)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100011218427 [0,0,0,0,0,2|1,0,1]=4 1222 B15R1.1080 CC(O)CSCc1ccc(cc1)[N+](=O)[O-] 62a_100011218427_100000184243 [0,0,0,0,0,2|1,0,1]=4 1223 B15R1.1080 C[C@@H](O)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100009817552 [0,0,0,0,0,2|1,0,1]=4 1224 B15R1.1080 C[C@@H](O)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100009817552 [0,0,0,0,0,2|1,0,1]=4 1225 B15R1.1080 C[C@@H](O)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100009817552 [0,0,0,0,0,2|1,0,1]=4 1226 B15R1.1080 C[C@@H](O)CSCc1ccc(cc1)[N+](=O)[O-] 62a_100009817552_100000184243 [0,0,0,0,0,2|1,0,1]=4 1227 B15R1.1080 NC(=O)CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000744528 [0,0,0,0,0,2|1,0,0]=3 1228 B15R1.1080 NC(=O)CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000731001 [0,0,0,0,0,2|1,0,0]=3 1229 B15R1.1080 NC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000731001 [0,0,0,0,0,2|1,0,0]=3 1230 B15R1.1080 NC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000744528 [0,0,0,0,0,2|1,0,0]=3 1231 B15R1.1080 NC(=O)CCOc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_100000744528 [0,0,0,0,0,2|2,0,0]=4 1232 B15R1.1080 NC(=O)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000711301_100000181861 [0,0,0,0,0,2|1,0,0]=3 1233 B15R1.1080 NC(=O)CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000747473 [0,0,0,0,0,2|1,0,0]=3 1234 B15R1.1080 NC(=O)CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000187820 [0,0,0,0,0,2|1,0,0]=3 1235 B15R1.1080 NC(=O)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000187820 [0,0,0,0,0,2|1,0,0]=3 1236 B15R1.1080 NC(=O)CSCc1ccc(cc1)[N+](=O)[O-] 62a_100000747473_100000184243 [0,0,0,0,0,2|1,0,0]=3 1237 B15R1.1080 NC(=O)c1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000231043 [0,0,0,0,0,2|2,0,0]=4 1238 B15R1.1080 O=C(O)CNCc1ccc(cc1)[N+](=O)[O-] 269956a_100016091260_100000181861 [0,0,0,0,0,2|0,0,0]=2 1239 B15R1.1080 O=C([O-])CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100020667443 [0,0,0,0,0,2|0,0,1]=3 1240 B15R1.1080 O=C([O-])COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100020667443 [0,0,0,0,0,2|0,0,1]=3 1241 B15R1.1080 O=C([O-])CSCc1ccc(cc1)[N+](=O)[O-] 62a_100020667443_100000184243 [0,0,0,0,0,2|0,0,1]=3 1242 B15R1.1080 O=[N+]([O-])CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000761209 [0,0,0,0,0,2|1,0,1]=4 1243 B15R1.1080 O=[N+]([O-])COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000761209 [0,0,0,0,0,2|1,0,1]=4 1244 B15R1.1080 [13CH3]C(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100011214885_200025704644 [0,0,0,0,0,2|1,0,0]=3 1245 B15R1.1080 [13CH3]C(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000738207_200025704644 [0,0,0,0,0,2|1,0,0]=3 1246 B15R1.1080 [13CH3]C(=O)CSCc1ccc(cc1)[N+](=O)[O-] 1458a_100000150263_200025704644 [0,0,0,0,0,2|1,0,0]=3