0 B14R1.903 C#CCCNc1ccccc1C(=O)N 34a_100000185089_100000688953 [0,0,0,0,0,0|3,0,1]=4 1 B14R1.903 C#CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000688953 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.903 C#CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000688953 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.903 C#CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000688953 [0,0,0,0,0,0|2,0,1]=3 4 B14R1.903 C#CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000688953 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.903 C#CCNCc1ccccc1[N+](=O)[O-] 34a_100000212058_100000181388 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.903 C#CCOCc1ccccc1[N+](=O)[O-] 34a_100000210247_100000181388 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.903 C#CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000038162 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.903 C#CCSCc1ccccc1[N+](=O)[O-] 62a_100000038162_100000181388 [0,0,0,0,0,0|3,0,1]=4 9 B14R1.903 C/C=C/COc1ccccc1[N+](=O)[O-] 34a_100000186319_100102629194 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.903 C/C=C/COc1ccccc1[N+](=O)[O-] 7a_100000186319_100102629194 [0,0,0,0,0,0|2,0,2]=4 11 B14R1.903 C=C(C)c1ccccc1NCCCC 34a_100000037685_100000210210 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.903 C=C(C)c1ccccc1NCCCF 34a_100000037685_100011934791 [0,0,0,0,0,0|4,0,0]=4 13 B14R1.903 C=C(C)c1ccccc1NCCCO 34a_100000037685_100000230001 [0,0,0,0,0,0|4,0,0]=4 14 B14R1.903 C=CCCNc1ccccc1C(=O)N 34a_100000185089_100000754431 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.903 C=CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000754431 [0,0,0,0,0,0|3,0,1]=4 16 B14R1.903 C=CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000754431 [0,0,0,0,0,0|2,0,1]=3 17 B14R1.903 C=CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000754431 [0,0,0,0,0,0|2,0,1]=3 18 B14R1.903 C=CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000754431 [0,0,0,0,0,0|3,0,1]=4 19 B14R1.903 C=CCNCc1ccccc1[N+](=O)[O-] 2230a_100020586998_100000181388 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.903 C=CCNCc1ccccc1[N+](=O)[O-] 270004a_100020586998_100000186027 [0,0,0,0,0,0|3,0,1]=4 21 B14R1.903 C=CCOCc1ccccc1[N+](=O)[O-] 34a_200000210373_100000181388 [0,0,0,0,0,0|3,0,1]=4 22 B14R1.903 C=CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100015514636 [0,0,0,0,0,0|3,0,1]=4 23 B14R1.903 C=CCSCc1ccccc1[N+](=O)[O-] 62a_100000210623_100000181388 [0,0,0,0,0,0|3,0,1]=4 24 B14R1.903 CC#CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000748600 [0,0,0,0,0,0|2,0,2]=4 25 B14R1.903 CC#CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000748600 [0,0,0,0,0,0|2,0,2]=4 26 B14R1.903 CC(=O)c1ccccc1SCCCF 62a_100000751169_100011934791 [0,0,0,0,0,0|4,0,0]=4 27 B14R1.903 CC(=O)c1ccccc1SCCCO 62a_100000751169_100011215043 [0,0,0,0,0,0|4,0,0]=4 28 B14R1.903 CC(=O)c1cccnc1NCCCF 27a_100015189416_100009816689 [0,0,0,0,0,0|4,0,0]=4 29 B14R1.903 CC(=O)c1cccnc1NCCCO 27a_100000182051_100009816689 [0,0,0,0,0,0|4,0,0]=4 30 B14R1.903 CC(=O)c1cnccc1NCCCF 27a_100015189416_100160469449 [0,0,0,0,0,0|4,0,0]=4 31 B14R1.903 CC(=O)c1cnccc1NCCCO 27a_100000182051_100160469449 [0,0,0,0,0,0|4,0,0]=4 32 B14R1.903 CC(C)c1ccccc1NCCCF 2230a_100000210643_100011934791 [0,0,0,0,0,0|4,0,0]=4 33 B14R1.903 CC(C)c1ccccc1NCCCF 34a_100000210643_100011934791 [0,0,0,0,0,0|4,0,0]=4 34 B14R1.903 CC(C)c1ccccc1NCCCF 7a_100000210643_100011934791 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.903 CC(C)c1ccccc1NCCCO 2230a_100000210643_100000230001 [0,0,0,0,0,0|4,0,0]=4 36 B14R1.903 CC(C)c1ccccc1NCCCO 34a_100000210643_100000230001 [0,0,0,0,0,0|4,0,0]=4 37 B14R1.903 CC(C)c1ccccc1NCCCO 7a_100000210643_100011215043 [0,0,0,0,0,0|4,0,0]=4 38 B14R1.903 CC(O)c1ccccc1NCCCF 2230a_100011405641_100011934791 [0,0,0,0,0,0|3,0,1]=4 39 B14R1.903 CC(O)c1ccccc1NCCCO 2230a_100011405641_100000230001 [0,0,0,0,0,0|3,0,1]=4 40 B14R1.903 CC=CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000070051 [0,0,0,0,0,0|2,0,2]=4 41 B14R1.903 CC=CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000070051 [0,0,0,0,0,0|2,0,2]=4 42 B14R1.903 CCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000210100 [0,0,0,0,0,0|2,0,1]=3 43 B14R1.903 CCC=NNc1ncccc1[N+](=O)[O-] 4a_100000687566_100000210100 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.903 CCCCNc1ccccc1C(=O)N 34a_100000185089_100000210210 [0,0,0,0,0,0|3,0,0]=3 45 B14R1.903 CCCCNc1ccccc1C(C)C 2230a_100000210643_100000210211 [0,0,0,0,0,0|4,0,0]=4 46 B14R1.903 CCCCNc1ccccc1C(C)C 34a_100000210643_100000210210 [0,0,0,0,0,0|4,0,0]=4 47 B14R1.903 CCCCNc1ccccc1C(C)C 7a_100000210643_100000210211 [0,0,0,0,0,0|4,0,0]=4 48 B14R1.903 CCCCNc1ccccc1C(C)O 2230a_100011405641_100000210211 [0,0,0,0,0,0|3,0,1]=4 49 B14R1.903 CCCCNc1ccccc1C(F)F 2230a_100000734540_100000210211 [0,0,0,0,0,0|4,0,0]=4 50 B14R1.903 CCCCNc1ccccc1C(F)F 34a_100000734540_100000210210 [0,0,0,0,0,0|4,0,0]=4 51 B14R1.903 CCCCNc1ccccc1C(F)F 7a_100000734540_100000210211 [0,0,0,0,0,0|4,0,0]=4 52 B14R1.903 CCCCNc1cccnc1C(=O)N 27a_100000102301_200012359670 [0,0,0,0,0,0|4,0,0]=4 53 B14R1.903 CCCCNc1ccncc1C(=O)C 27a_100000102301_100160469449 [0,0,0,0,0,0|4,0,0]=4 54 B14R1.903 CCCCNc1ccncc1C(=O)N 27a_100000102301_100000697804 [0,0,0,0,0,0|4,0,0]=4 55 B14R1.903 CCCCNc1ncccc1C(=O)C 27a_100000102301_100009816689 [0,0,0,0,0,0|4,0,0]=4 56 B14R1.903 CCCCNc1ncccc1C(=O)N 27a_100000102301_100000162199 [0,0,0,0,0,0|4,0,0]=4 57 B14R1.903 CCCCOc1ccccc1C(=O)C 1458a_100000215687_200000210301 [0,0,0,0,0,0|4,0,0]=4 58 B14R1.903 CCCCOc1ccccc1C(=O)N 34a_100000192804_100000210210 [0,0,0,0,0,0|4,0,0]=4 59 B14R1.903 CCCCOc1ccccc1C(=O)N 7a_100000192804_100000210211 [0,0,0,0,0,0|4,0,0]=4 60 B14R1.903 CCCCOc1ccccc1C(=O)[13CH3] 1458a_100000215687_200025704644 [0,0,0,0,0,0|4,0,0]=4 61 B14R1.903 CCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210211 [0,0,0,0,0,0|3,0,0]=3 62 B14R1.903 CCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210210 [0,0,0,0,0,0|2,0,0]=2 63 B14R1.903 CCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210211 [0,0,0,0,0,0|2,0,0]=2 64 B14R1.903 CCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210211 [0,0,0,0,0,0|3,0,0]=3 65 B14R1.903 CCCCSc1ccccc1C(=O)C 1458a_200000217314_200000210301 [0,0,0,0,0,0|4,0,0]=4 66 B14R1.903 CCCCSc1ccccc1C(=O)C 62a_100000751169_100000210210 [0,0,0,0,0,0|4,0,0]=4 67 B14R1.903 CCCCSc1ccccc1C(=O)N 62a_100000162227_100000210210 [0,0,0,0,0,0|4,0,0]=4 68 B14R1.903 CCCCSc1ccccc1C(=O)N 62a_100000210211_100000162227 [0,0,0,0,0,0|4,0,0]=4 69 B14R1.903 CCCCSc1ccccc1C(=O)O 62a_100000210211_100000734275 [0,0,0,0,0,0|3,0,1]=4 70 B14R1.903 CCCCSc1ccccc1C(=O)O 62a_202125556159_100000210210 [0,0,0,0,0,0|3,0,1]=4 71 B14R1.903 CCCCSc1ccccc1C(=O)[13CH3] 1458a_200000217314_200025704644 [0,0,0,0,0,0|4,0,0]=4 72 B14R1.903 CCCCSc1ccccc1S(=O)C 62a_100000734199_100000210210 [0,0,0,0,0,0|4,0,0]=4 73 B14R1.903 CCCNCc1ccccc1[N+](=O)[O-] 270004a_100020643023_100000186027 [0,0,0,0,0,0|3,0,0]=3 74 B14R1.903 CCCOCc1ccccc1[N+](=O)[O-] 34a_100000210258_100000181388 [0,0,0,0,0,0|3,0,0]=3 75 B14R1.903 CCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210303 [0,0,0,0,0,0|3,0,0]=3 76 B14R1.903 CCCSCc1ccccc1[N+](=O)[O-] 62a_100000210303_100000181388 [0,0,0,0,0,0|3,0,0]=3 77 B14R1.903 CCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210202 [0,0,0,0,0,0|3,0,0]=3 78 B14R1.903 CCNCCc1ccccc1[N+](=O)[O-] 2230a_100015525214_200011934512 [0,0,0,0,0,0|3,0,0]=3 79 B14R1.903 CCNN=Cc1ccccc1[N+](=O)[O-] 4a_100000756455_100000186027 [0,0,0,0,0,0|4,0,0]=4 80 B14R1.903 CCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000210202 [0,0,0,0,0,0|3,0,0]=3 81 B14R1.903 CCOCCc1ccccc1[N+](=O)[O-] 34a_100121572206_200011934512 [0,0,0,0,0,0|3,0,0]=3 82 B14R1.903 CCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000210202 [0,0,0,0,0,0|3,0,0]=3 83 B14R1.903 CNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_200000210301 [0,0,0,0,0,0|3,0,0]=3 84 B14R1.903 CNCCOc1ccccc1[N+](=O)[O-] 2230a_106832991635_100000741959 [0,0,0,0,0,0|3,0,0]=3 85 B14R1.903 CNCCOc1ccccc1[N+](=O)[O-] 34a_100102657272_100000741959 [0,0,0,0,0,0|3,0,0]=3 86 B14R1.903 CNCCOc1ccccc1[N+](=O)[O-] 7a_106832991635_100000741959 [0,0,0,0,0,0|3,0,0]=3 87 B14R1.903 COCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_200000210301 [0,0,0,0,0,0|3,0,0]=3 88 B14R1.903 COCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_200000210301 [0,0,0,0,0,0|3,0,0]=3 89 B14R1.903 COCCNc1ccccc1C(=O)N 34a_100000185089_100011201679 [0,0,0,0,0,0|4,0,0]=4 90 B14R1.903 COCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000233755 [0,0,0,0,0,0|4,0,0]=4 91 B14R1.903 COCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011201679 [0,0,0,0,0,0|3,0,0]=3 92 B14R1.903 COCCOc1ccccc1[N+](=O)[O-] 34a_100138415774_100000741959 [0,0,0,0,0,0|3,0,0]=3 93 B14R1.903 COCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000233755 [0,0,0,0,0,0|3,0,0]=3 94 B14R1.903 COCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000233755 [0,0,0,0,0,0|4,0,0]=4 95 B14R1.903 COCSCc1ccccc1[N+](=O)[O-] 62a_100000766300_100000181388 [0,0,0,0,0,0|4,0,0]=4 96 B14R1.903 CS(=O)c1ccccc1SCCCF 62a_100000734199_100011934791 [0,0,0,0,0,0|4,0,0]=4 97 B14R1.903 CS(=O)c1ccccc1SCCCO 62a_100000734199_100011215043 [0,0,0,0,0,0|4,0,0]=4 98 B14R1.903 CSCCNc1ccccc1C(=O)N 34a_100000185089_100000212216 [0,0,0,0,0,0|4,0,0]=4 99 B14R1.903 CSCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000212216 [0,0,0,0,0,0|4,0,0]=4 100 B14R1.903 CSCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000212216 [0,0,0,0,0,0|3,0,0]=3 101 B14R1.903 CSCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000212216 [0,0,0,0,0,0|3,0,0]=3 102 B14R1.903 CSCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000212216 [0,0,0,0,0,0|4,0,0]=4 103 B14R1.903 CSCSCc1ccccc1[N+](=O)[O-] 62a_100011218213_100000181388 [0,0,0,0,0,0|4,0,0]=4 104 B14R1.903 FCCCNc1ccccc1C(F)F 2230a_100000734540_100011934791 [0,0,0,0,0,0|4,0,0]=4 105 B14R1.903 FCCCNc1ccccc1C(F)F 34a_100000734540_100011934791 [0,0,0,0,0,0|4,0,0]=4 106 B14R1.903 FCCCNc1ccccc1C(F)F 7a_100000734540_100011934791 [0,0,0,0,0,0|4,0,0]=4 107 B14R1.903 N#CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000184422 [0,0,0,0,0,0|2,0,2]=4 108 B14R1.903 N#CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000184422 [0,0,0,0,0,0|1,0,2]=3 109 B14R1.903 N#CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000184422 [0,0,0,0,0,0|2,0,2]=4 110 B14R1.903 N#CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100011215382 [0,0,0,0,0,0|2,0,2]=4 111 B14R1.903 N#CCSCc1ccccc1[N+](=O)[O-] 62a_100011215382_100000181388 [0,0,0,0,0,0|2,0,2]=4 112 B14R1.903 NC(=O)c1ccccc1NCCCF 34a_100000185089_100011934791 [0,0,0,0,0,0|3,0,0]=3 113 B14R1.903 NC(=O)c1ccccc1NCCCO 34a_100000185089_100000230001 [0,0,0,0,0,0|3,0,0]=3 114 B14R1.903 NC(=O)c1ccccc1OCCCF 34a_100000192804_100011934791 [0,0,0,0,0,0|4,0,0]=4 115 B14R1.903 NC(=O)c1ccccc1OCCCF 7a_100000192804_100011934791 [0,0,0,0,0,0|4,0,0]=4 116 B14R1.903 NC(=O)c1ccccc1OCCCO 34a_100000192804_100000230001 [0,0,0,0,0,0|4,0,0]=4 117 B14R1.903 NC(=O)c1ccccc1OCCCO 7a_100000192804_100011215043 [0,0,0,0,0,0|4,0,0]=4 118 B14R1.903 NC(=O)c1ccccc1SCCCF 62a_100000162227_100011934791 [0,0,0,0,0,0|4,0,0]=4 119 B14R1.903 NC(=O)c1ccccc1SCCCF 62a_100011934791_100000162227 [0,0,0,0,0,0|4,0,0]=4 120 B14R1.903 NC(=O)c1ccccc1SCCCO 62a_100000162227_100011215043 [0,0,0,0,0,0|4,0,0]=4 121 B14R1.903 NC(=O)c1ccccc1SCCCO 62a_100011215043_100000162227 [0,0,0,0,0,0|4,0,0]=4 122 B14R1.903 NC(=O)c1cccnc1NCCCF 27a_100015189416_100000162199 [0,0,0,0,0,0|4,0,0]=4 123 B14R1.903 NC(=O)c1cccnc1NCCCO 27a_100000182051_100000162199 [0,0,0,0,0,0|4,0,0]=4 124 B14R1.903 NC(=O)c1cnccc1NCCCF 27a_100015189416_100000697804 [0,0,0,0,0,0|4,0,0]=4 125 B14R1.903 NC(=O)c1cnccc1NCCCO 27a_100000182051_100000697804 [0,0,0,0,0,0|4,0,0]=4 126 B14R1.903 NC(=O)c1ncccc1NCCCF 27a_100015189416_200012359670 [0,0,0,0,0,0|4,0,0]=4 127 B14R1.903 NC(=O)c1ncccc1NCCCO 27a_100000182051_200012359670 [0,0,0,0,0,0|4,0,0]=4 128 B14R1.903 NCCOCc1ccccc1[N+](=O)[O-] 34a_100000210304_100000181388 [0,0,0,0,0,0|2,0,0]=2 129 B14R1.903 O=C(O)c1ccccc1SCCCF 62a_100011934791_100000734275 [0,0,0,0,0,0|3,0,1]=4 130 B14R1.903 O=C(O)c1ccccc1SCCCF 62a_202125556159_100011934791 [0,0,0,0,0,0|3,0,1]=4 131 B14R1.903 O=C(O)c1ccccc1SCCCO 62a_100011215043_100000734275 [0,0,0,0,0,0|3,0,1]=4 132 B14R1.903 O=C(O)c1ccccc1SCCCO 62a_202125556159_100011215043 [0,0,0,0,0,0|3,0,1]=4 133 B14R1.903 O=C([O-])c1ccccc1OCCCF 7a_100015234032_100011934791 [0,0,0,0,0,0|3,0,0]=3 134 B14R1.903 O=C([O-])c1ccccc1OCCCO 7a_100015234032_100011215043 [0,0,0,0,0,0|3,0,0]=3 135 B14R1.903 O=CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_200015260668 [0,0,0,0,0,0|3,0,1]=4 136 B14R1.903 O=CCSCc1ccccc1[N+](=O)[O-] 62a_200015260668_100000181388 [0,0,0,0,0,0|3,0,1]=4 137 B14R1.903 O=[N+]([O-])c1ccccc1CCOCF 34a_100000749287_100015361967 [0,0,0,0,0,0|3,0,0]=3 138 B14R1.903 O=[N+]([O-])c1ccccc1CCOCF 7a_100000749287_100015361967 [0,0,0,0,0,0|3,0,0]=3 139 B14R1.903 O=[N+]([O-])c1ccccc1CNCCF 34a_100000724931_100000181388 [0,0,0,0,0,0|3,0,0]=3 140 B14R1.903 O=[N+]([O-])c1ccccc1CNCCO 2230a_100016997473_100000181388 [0,0,0,0,0,0|3,0,0]=3 141 B14R1.903 O=[N+]([O-])c1ccccc1CNCCO 270004a_100000210304_100000186027 [0,0,0,0,0,0|3,0,0]=3 142 B14R1.903 O=[N+]([O-])c1ccccc1CNCCO 34a_100016990907_100000181388 [0,0,0,0,0,0|3,0,0]=3 143 B14R1.903 O=[N+]([O-])c1ccccc1COCCBr 34a_100000211926_100000181388 [0,0,0,0,0,0|3,0,0]=3 144 B14R1.903 O=[N+]([O-])c1ccccc1COCCF 7a_100011218404_100011217306 [0,0,0,0,0,0|3,0,0]=3 145 B14R1.903 O=[N+]([O-])c1ccccc1COCCO 7a_100011218404_100000211926 [0,0,0,0,0,0|3,0,0]=3 146 B14R1.903 O=[N+]([O-])c1ccccc1CSCCF 62a_100011217306_100000181388 [0,0,0,0,0,0|3,0,0]=3 147 B14R1.903 O=[N+]([O-])c1ccccc1CSCCO 62a_100000211926_100000181388 [0,0,0,0,0,0|3,0,0]=3 148 B14R1.903 O=[N+]([O-])c1ccccc1OCCCF 34a_100000186319_100011934791 [0,0,0,0,0,0|2,0,0]=2 149 B14R1.903 O=[N+]([O-])c1ccccc1OCCCF 7a_100000186319_100011934791 [0,0,0,0,0,0|2,0,0]=2 150 B14R1.903 O=[N+]([O-])c1ccccc1OCCCO 34a_100000186319_100000230001 [0,0,0,0,0,0|2,0,0]=2 151 B14R1.903 O=[N+]([O-])c1ccccc1OCCCO 7a_100000186319_100011215043 [0,0,0,0,0,0|2,0,0]=2 152 B14R1.903 O=[N+]([O-])c1ncccc1OCCCF 7a_100000183951_100011934791 [0,0,0,0,0,0|3,0,0]=3 153 B14R1.903 O=[N+]([O-])c1ncccc1OCCCO 7a_100000183951_100011215043 [0,0,0,0,0,0|3,0,0]=3 154 B14R1.903 OCCCNc1ccccc1C(F)F 2230a_100000734540_100000230001 [0,0,0,0,0,0|4,0,0]=4 155 B14R1.903 OCCCNc1ccccc1C(F)F 34a_100000734540_100000230001 [0,0,0,0,0,0|4,0,0]=4 156 B14R1.903 OCCCNc1ccccc1C(F)F 7a_100000734540_100011215043 [0,0,0,0,0,0|4,0,0]=4 157 B14R1.903 [13CH3]NCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_200025704644 [0,0,0,0,0,0|3,0,0]=3 158 B14R1.903 [13CH3]OCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_200025704644 [0,0,0,0,0,0|3,0,0]=3 159 B14R1.903 [13CH3]OCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_200025704644 [0,0,0,0,0,0|3,0,0]=3 160 B13R1.84 C#Cc1ccccc1NCCCC 34a_100011470550_100000210210 [1,0,0,0,0,0|3,0,0]=4 161 B13R1.84 C#Cc1ccccc1NCCCF 34a_100011470550_100011934791 [1,0,0,0,0,0|3,0,0]=4 162 B13R1.84 C#Cc1ccccc1NCCCO 34a_100011470550_100000230001 [1,0,0,0,0,0|3,0,0]=4 163 B13R1.84 C=Cc1ccccc1NCCCC 34a_100012022501_100000210210 [1,0,0,0,0,0|3,0,0]=4 164 B13R1.84 C=Cc1ccccc1NCCCF 34a_100012022501_100011934791 [1,0,0,0,0,0|3,0,0]=4 165 B13R1.84 C=Cc1ccccc1NCCCO 34a_100012022501_100000230001 [1,0,0,0,0,0|3,0,0]=4 166 B13R1.84 CCCCNc1ccccc1C#N 34a_100000211148_100000210210 [1,0,0,0,0,0|3,0,0]=4 167 B13R1.84 CCCCNc1ccccc1CC 2230a_100000212081_100000210211 [1,0,0,0,0,0|3,0,0]=4 168 B13R1.84 CCCCNc1ccccc1CC 34a_100000212081_100000210210 [1,0,0,0,0,0|3,0,0]=4 169 B13R1.84 CCCCNc1ccccc1CC 7a_100000212081_100000210211 [1,0,0,0,0,0|3,0,0]=4 170 B13R1.84 CCCCNc1ccccc1CO 34a_100000212039_100000210210 [1,0,0,0,0,0|2,0,1]=4 171 B13R1.84 CCCCNc1ccccc1OC 34a_100000210025_100000210210 [1,0,0,0,0,0|3,0,0]=4 172 B13R1.84 CCCCNc1ccccc1SC 34a_100000211160_100000210210 [1,0,0,0,0,0|3,0,0]=4 173 B13R1.84 CCCCSc1ccccc1C=O 62a_100000210073_100000210210 [1,0,0,0,0,0|3,0,0]=4 174 B13R1.84 CCCCSc1ccccc1C=O 62a_100000210211_100000210073 [1,0,0,0,0,0|3,0,0]=4 175 B13R1.84 CCc1ccccc1NCCCF 2230a_100000212081_100011934791 [1,0,0,0,0,0|3,0,0]=4 176 B13R1.84 CCc1ccccc1NCCCF 34a_100000212081_100011934791 [1,0,0,0,0,0|3,0,0]=4 177 B13R1.84 CCc1ccccc1NCCCF 7a_100000212081_100011934791 [1,0,0,0,0,0|3,0,0]=4 178 B13R1.84 CCc1ccccc1NCCCO 2230a_100000212081_100000230001 [1,0,0,0,0,0|3,0,0]=4 179 B13R1.84 CCc1ccccc1NCCCO 34a_100000212081_100000230001 [1,0,0,0,0,0|3,0,0]=4 180 B13R1.84 CCc1ccccc1NCCCO 7a_100000212081_100011215043 [1,0,0,0,0,0|3,0,0]=4 181 B13R1.84 COc1ccccc1NCCCF 34a_100000210025_100011934791 [1,0,0,0,0,0|3,0,0]=4 182 B13R1.84 COc1ccccc1NCCCO 34a_100000210025_100000230001 [1,0,0,0,0,0|3,0,0]=4 183 B13R1.84 CSc1ccccc1NCCCF 34a_100000211160_100011934791 [1,0,0,0,0,0|3,0,0]=4 184 B13R1.84 CSc1ccccc1NCCCO 34a_100000211160_100000230001 [1,0,0,0,0,0|3,0,0]=4 185 B13R1.84 N#Cc1ccccc1NCCCF 34a_100000211148_100011934791 [1,0,0,0,0,0|3,0,0]=4 186 B13R1.84 N#Cc1ccccc1NCCCO 34a_100000211148_100000230001 [1,0,0,0,0,0|3,0,0]=4 187 B13R1.84 NCCOCc1ccccc1C=O 34a_100000210304_200009853537 [1,0,0,0,0,0|3,0,0]=4 188 B13R1.84 O=Cc1ccccc1SCCCF 62a_100000210073_100011934791 [1,0,0,0,0,0|3,0,0]=4 189 B13R1.84 O=Cc1ccccc1SCCCF 62a_100011934791_100000210073 [1,0,0,0,0,0|3,0,0]=4 190 B13R1.84 O=Cc1ccccc1SCCCO 62a_100000210073_100011215043 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.84 O=Cc1ccccc1SCCCO 62a_100011215043_100000210073 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.84 OCCCNc1ccccc1CO 34a_100000212039_100000230001 [1,0,0,0,0,0|2,0,1]=4 193 B13R1.84 OCc1ccccc1NCCCF 34a_100000212039_100011934791 [1,0,0,0,0,0|2,0,1]=4 194 B13R1.572 C#CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000184674 [1,0,0,0,0,0|1,0,2]=4 195 B13R1.572 C#CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000038162 [1,0,0,0,0,0|1,0,2]=4 196 B13R1.572 C=C(C)c1ccccc1NCCC 34a_100000037685_100000210303 [1,0,0,0,0,0|3,0,0]=4 197 B13R1.572 C=CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100015514636 [1,0,0,0,0,0|1,0,2]=4 198 B13R1.572 C=CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100015514636 [1,0,0,0,0,0|1,0,2]=4 199 B13R1.572 CC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_200000210099 [1,0,0,0,0,0|1,0,1]=3 200 B13R1.572 CC=NNc1ncccc1[N+](=O)[O-] 4a_100000687566_200000210099 [1,0,0,0,0,0|2,0,1]=4 201 B13R1.572 CCCCc1ccccc1C(=O)C 271570a_100020621405_100000751169 [1,0,0,0,0,0|3,0,0]=4 202 B13R1.572 CCCCc1ccccc1C(=O)N 271570a_100020621405_100000162227 [1,0,0,0,0,0|3,0,0]=4 203 B13R1.572 CCCCc1ccccc1S(=O)C 271570a_100020621405_100000734199 [1,0,0,0,0,0|3,0,0]=4 204 B13R1.572 CCCNc1ccccc1C(=O)N 34a_100000185089_100000210303 [1,0,0,0,0,0|2,0,0]=3 205 B13R1.572 CCCNc1ccccc1C(C)C 2230a_100000210643_100000210303 [1,0,0,0,0,0|3,0,0]=4 206 B13R1.572 CCCNc1ccccc1C(C)C 34a_100000210643_100000210303 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.572 CCCNc1ccccc1C(C)C 7a_100000210643_100000210303 [1,0,0,0,0,0|3,0,0]=4 208 B13R1.572 CCCNc1ccccc1C(C)O 2230a_100011405641_100000210303 [1,0,0,0,0,0|2,0,1]=4 209 B13R1.572 CCCNc1ccccc1C(F)F 2230a_100000734540_100000210303 [1,0,0,0,0,0|3,0,0]=4 210 B13R1.572 CCCNc1ccccc1C(F)F 34a_100000734540_100000210303 [1,0,0,0,0,0|3,0,0]=4 211 B13R1.572 CCCNc1ccccc1C(F)F 7a_100000734540_100000210303 [1,0,0,0,0,0|3,0,0]=4 212 B13R1.572 CCCOc1ccccc1C(=O)C 1458a_100000215688_200000210301 [1,0,0,0,0,0|3,0,0]=4 213 B13R1.572 CCCOc1ccccc1C(=O)N 34a_100000192804_100000210303 [1,0,0,0,0,0|3,0,0]=4 214 B13R1.572 CCCOc1ccccc1C(=O)N 7a_100000192804_100000210303 [1,0,0,0,0,0|3,0,0]=4 215 B13R1.572 CCCOc1ccccc1C(=O)[13CH3] 1458a_100000215688_200025704644 [1,0,0,0,0,0|3,0,0]=4 216 B13R1.572 CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210303 [1,0,0,0,0,0|2,0,0]=3 217 B13R1.572 CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210303 [1,0,0,0,0,0|1,0,0]=2 218 B13R1.572 CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210303 [1,0,0,0,0,0|1,0,0]=2 219 B13R1.572 CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210303 [1,0,0,0,0,0|2,0,0]=3 220 B13R1.572 CCCSc1ccccc1C(=O)C 1458a_100000217225_200000210301 [1,0,0,0,0,0|3,0,0]=4 221 B13R1.572 CCCSc1ccccc1C(=O)C 62a_100000751169_100000210303 [1,0,0,0,0,0|3,0,0]=4 222 B13R1.572 CCCSc1ccccc1C(=O)N 62a_100000162227_100000210303 [1,0,0,0,0,0|3,0,0]=4 223 B13R1.572 CCCSc1ccccc1C(=O)N 62a_100000210303_100000162227 [1,0,0,0,0,0|3,0,0]=4 224 B13R1.572 CCCSc1ccccc1C(=O)O 62a_100000210303_100000734275 [1,0,0,0,0,0|2,0,1]=4 225 B13R1.572 CCCSc1ccccc1C(=O)O 62a_202125556159_100000210303 [1,0,0,0,0,0|2,0,1]=4 226 B13R1.572 CCCSc1ccccc1C(=O)[13CH3] 1458a_100000217225_200025704644 [1,0,0,0,0,0|3,0,0]=4 227 B13R1.572 CCCSc1ccccc1S(=O)C 62a_100000734199_100000210303 [1,0,0,0,0,0|3,0,0]=4 228 B13R1.572 CCNCc1ccccc1[N+](=O)[O-] 2230a_100015525214_100000181388 [1,0,0,0,0,0|2,0,0]=3 229 B13R1.572 CCNCc1ccccc1[N+](=O)[O-] 270004a_100015525214_100000186027 [1,0,0,0,0,0|2,0,0]=3 230 B13R1.572 CCOCc1ccccc1[N+](=O)[O-] 34a_100121572206_100000181388 [1,0,0,0,0,0|2,0,0]=3 231 B13R1.572 CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210202 [1,0,0,0,0,0|2,0,0]=3 232 B13R1.572 CCSCc1ccccc1[N+](=O)[O-] 62a_100000210202_100000181388 [1,0,0,0,0,0|2,0,0]=3 233 B13R1.572 CNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_200000210301 [1,0,0,0,0,0|2,0,0]=3 234 B13R1.572 CNCCc1ccccc1[N+](=O)[O-] 2230a_106832991635_200011934512 [1,0,0,0,0,0|2,0,0]=3 235 B13R1.572 CNCCc1ccccc1[N+](=O)[O-] 34a_100102657272_200011934512 [1,0,0,0,0,0|2,0,0]=3 236 B13R1.572 CNCCc1ccccc1[N+](=O)[O-] 7a_106832991635_200011934512 [1,0,0,0,0,0|2,0,0]=3 237 B13R1.572 COCCc1ccccc1[N+](=O)[O-] 34a_100000749287_200000210301 [1,0,0,0,0,0|2,0,0]=3 238 B13R1.572 COCCc1ccccc1[N+](=O)[O-] 34a_100138415774_200011934512 [1,0,0,0,0,0|2,0,0]=3 239 B13R1.572 COCCc1ccccc1[N+](=O)[O-] 7a_100000749287_200000210301 [1,0,0,0,0,0|2,0,0]=3 240 B13R1.572 CSCNc1ccccc1C(=O)N 34a_100000185089_100011218213 [1,0,0,0,0,0|3,0,0]=4 241 B13R1.572 CSCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011218213 [1,0,0,0,0,0|2,0,0]=3 242 B13R1.572 N#CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215382 [1,0,0,0,0,0|1,0,2]=4 243 B13R1.572 NC(=O)c1ccccc1NCCF 34a_100000185089_100011217306 [1,0,0,0,0,0|3,0,0]=4 244 B13R1.572 NC(=O)c1ccccc1NCCO 34a_100000185089_100000211926 [1,0,0,0,0,0|3,0,0]=4 245 B13R1.572 O=C([O-])c1ccccc1OCCF 7a_100015234032_100011217306 [1,0,0,0,0,0|3,0,0]=4 246 B13R1.572 O=C([O-])c1ccccc1OCCO 7a_100015234032_100000211926 [1,0,0,0,0,0|3,0,0]=4 247 B13R1.572 O=CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_200009817547 [1,0,0,0,0,0|2,0,1]=4 248 B13R1.572 O=CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200015260668 [1,0,0,0,0,0|2,0,1]=4 249 B13R1.572 O=[N+]([O-])c1ccccc1COCF 7a_100011218404_100015361967 [1,0,0,0,0,0|2,0,0]=3 250 B13R1.572 O=[N+]([O-])c1ccccc1CSCF 62a_100015361967_100000181388 [1,0,0,0,0,0|2,0,0]=3 251 B13R1.572 O=[N+]([O-])c1ccccc1OCCF 34a_100000186319_100011217306 [1,0,0,0,0,0|2,0,0]=3 252 B13R1.572 O=[N+]([O-])c1ccccc1OCCF 7a_100000186319_100011217306 [1,0,0,0,0,0|2,0,0]=3 253 B13R1.572 O=[N+]([O-])c1ccccc1OCCO 34a_100000186319_100000211926 [1,0,0,0,0,0|2,0,0]=3 254 B13R1.572 O=[N+]([O-])c1ccccc1OCCO 7a_100000186319_100000211926 [1,0,0,0,0,0|2,0,0]=3 255 B13R1.572 O=[N+]([O-])c1ncccc1OCCF 7a_100000183951_100011217306 [1,0,0,0,0,0|3,0,0]=4 256 B13R1.572 O=[N+]([O-])c1ncccc1OCCO 7a_100000183951_100000211926 [1,0,0,0,0,0|3,0,0]=4 257 B13R1.572 [13CH3]NCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_200025704644 [1,0,0,0,0,0|2,0,0]=3 258 B13R1.572 [13CH3]OCCc1ccccc1[N+](=O)[O-] 34a_100000749287_200025704644 [1,0,0,0,0,0|2,0,0]=3 259 B13R1.572 [13CH3]OCCc1ccccc1[N+](=O)[O-] 7a_100000749287_200025704644 [1,0,0,0,0,0|2,0,0]=3 260 B15R1.241 C#CCCCNc1ccccc1C(=O)N 34a_100000185089_100000695029 [0,1,0,0,0,0|3,0,0]=4 261 B15R1.241 C#CCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100011215417 [0,1,0,0,0,0|3,0,0]=4 262 B15R1.241 C#CCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000695029 [0,1,0,0,0,0|2,0,0]=3 263 B15R1.241 C#CCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215417 [0,1,0,0,0,0|2,0,0]=3 264 B15R1.241 C#CCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100011215417 [0,1,0,0,0,0|3,0,0]=4 265 B15R1.241 C#CCCNCc1ccccc1[N+](=O)[O-] 34a_100000755551_100000181388 [0,1,0,0,0,0|1,0,1]=3 266 B15R1.241 C#CCCOCc1ccccc1[N+](=O)[O-] 34a_100011215631_100000181388 [0,1,0,0,0,0|2,0,1]=4 267 B15R1.241 C#CCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000688953 [0,1,0,0,0,0|2,0,1]=4 268 B15R1.241 C#CCCSCc1ccccc1[N+](=O)[O-] 62a_100000688953_100000181388 [0,1,0,0,0,0|2,0,1]=4 269 B15R1.241 C#CCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000038162 [0,1,0,0,0,0|2,0,1]=4 270 B15R1.241 C#CCNCCc1ccccc1[N+](=O)[O-] 34a_100000212058_200011934512 [0,1,0,0,0,0|2,0,1]=4 271 B15R1.241 C#CCOCCc1ccccc1[N+](=O)[O-] 34a_100000210247_200011934512 [0,1,0,0,0,0|2,0,1]=4 272 B15R1.241 C#CCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000184674 [0,1,0,0,0,0|2,0,1]=4 273 B15R1.241 C#CCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000038162 [0,1,0,0,0,0|2,0,1]=4 274 B15R1.241 C=CCCCNc1ccccc1C(=O)N 34a_100000185089_100000757094 [0,1,0,0,0,0|3,0,0]=4 275 B15R1.241 C=CCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000757094 [0,1,0,0,0,0|3,0,0]=4 276 B15R1.241 C=CCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000757094 [0,1,0,0,0,0|2,0,0]=3 277 B15R1.241 C=CCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000757094 [0,1,0,0,0,0|2,0,0]=3 278 B15R1.241 C=CCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000757094 [0,1,0,0,0,0|3,0,0]=4 279 B15R1.241 C=CCCNCc1ccccc1[N+](=O)[O-] 2230a_100015191253_100000181388 [0,1,0,0,0,0|1,0,1]=3 280 B15R1.241 C=CCCNCc1ccccc1[N+](=O)[O-] 270004a_100015191253_100000186027 [0,1,0,0,0,0|1,0,1]=3 281 B15R1.241 C=CCCOCc1ccccc1[N+](=O)[O-] 34a_100011205117_100000181388 [0,1,0,0,0,0|2,0,1]=4 282 B15R1.241 C=CCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000754431 [0,1,0,0,0,0|2,0,1]=4 283 B15R1.241 C=CCCSCc1ccccc1[N+](=O)[O-] 62a_100000754431_100000181388 [0,1,0,0,0,0|2,0,1]=4 284 B15R1.241 C=CCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210623 [0,1,0,0,0,0|2,0,1]=4 285 B15R1.241 C=CCNCCc1ccccc1[N+](=O)[O-] 2230a_100020586998_200011934512 [0,1,0,0,0,0|2,0,1]=4 286 B15R1.241 C=CCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100015514636 [0,1,0,0,0,0|2,0,1]=4 287 B15R1.241 C=CCOCCc1ccccc1[N+](=O)[O-] 34a_200000210373_200011934512 [0,1,0,0,0,0|2,0,1]=4 288 B15R1.241 C=CCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100015514636 [0,1,0,0,0,0|2,0,1]=4 289 B15R1.241 C=COCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000039644 [0,1,0,0,0,0|2,0,1]=4 290 B15R1.241 C=COCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000039644 [0,1,0,0,0,0|2,0,1]=4 291 B15R1.241 CC#CCNCc1ccccc1[N+](=O)[O-] 2230a_100000685387_100000181388 [0,1,0,0,0,0|1,0,2]=4 292 B15R1.241 CC#CCNCc1ccccc1[N+](=O)[O-] 34a_100000685387_100000181388 [0,1,0,0,0,0|1,0,2]=4 293 B15R1.241 CC/C=C\COc1ccccc1[N+](=O)[O-] 34a_100000186319_100103147603 [0,1,0,0,0,0|2,0,1]=4 294 B15R1.241 CC/C=C\COc1ccccc1[N+](=O)[O-] 7a_100000186319_100103147603 [0,1,0,0,0,0|2,0,1]=4 295 B15R1.241 CCC#CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100009813939 [0,1,0,0,0,0|2,0,1]=4 296 B15R1.241 CCC#CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100009813939 [0,1,0,0,0,0|2,0,1]=4 297 B15R1.241 CCCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000185831 [0,1,0,0,0,0|1,0,1]=3 298 B15R1.241 CCCC=NNc1ncccc1[N+](=O)[O-] 4a_100000687566_100000185831 [0,1,0,0,0,0|2,0,1]=4 299 B15R1.241 CCCCCNc1ccccc1C(=O)N 34a_100000185089_100000718602 [0,1,0,0,0,0|3,0,0]=4 300 B15R1.241 CCCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210326 [0,1,0,0,0,0|3,0,0]=4 301 B15R1.241 CCCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000718602 [0,1,0,0,0,0|2,0,0]=3 302 B15R1.241 CCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210326 [0,1,0,0,0,0|2,0,0]=3 303 B15R1.241 CCCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210326 [0,1,0,0,0,0|3,0,0]=4 304 B15R1.241 CCCCNCc1ccccc1C(=O)O 269956a_100015183376_100000210211 [0,1,0,0,0,0|2,0,1]=4 305 B15R1.241 CCCCNCc1ccccc1[N+](=O)[O-] 2230a_100000102301_100000181388 [0,1,0,0,0,0|1,0,0]=2 306 B15R1.241 CCCCNCc1ccccc1[N+](=O)[O-] 270004a_100000102301_100000186027 [0,1,0,0,0,0|1,0,0]=2 307 B15R1.241 CCCCNCc1ccccc1[N+](=O)[O-] 7a_106832991798_100000181388 [0,1,0,0,0,0|1,0,0]=2 308 B15R1.241 CCCCOCc1ccccc1[N+](=O)[O-] 34a_100000210227_100000181388 [0,1,0,0,0,0|2,0,0]=3 309 B15R1.241 CCCCOCc1ccccc1[N+](=O)[O-] 7a_100000210227_100000181388 [0,1,0,0,0,0|2,0,0]=3 310 B15R1.241 CCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210211 [0,1,0,0,0,0|2,0,0]=3 311 B15R1.241 CCCCSCc1ccccc1[N+](=O)[O-] 62a_100000210211_100000181388 [0,1,0,0,0,0|2,0,0]=3 312 B15R1.241 CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210303 [0,1,0,0,0,0|2,0,0]=3 313 B15R1.241 CCCNN=Cc1ccccc1[N+](=O)[O-] 4a_100000740057_100000186027 [0,1,0,0,0,0|2,0,1]=4 314 B15R1.241 CCCOCCc1ccccc1[N+](=O)[O-] 34a_100000210258_200011934512 [0,1,0,0,0,0|2,0,0]=3 315 B15R1.241 CCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000210303 [0,1,0,0,0,0|2,0,0]=3 316 B15R1.241 CCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000210303 [0,1,0,0,0,0|2,0,0]=3 317 B15R1.241 CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100015525214_100000741959 [0,1,0,0,0,0|2,0,0]=3 318 B15R1.241 CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000210202 [0,1,0,0,0,0|2,0,0]=3 319 B15R1.241 CCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100000210202 [0,1,0,0,0,0|2,0,0]=3 320 B15R1.241 CCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100000210202 [0,1,0,0,0,0|2,0,0]=3 321 B15R1.241 CCOCCNc1ccccc1C(=O)N 34a_100000185089_100000210147 [0,1,0,0,0,0|3,0,0]=4 322 B15R1.241 CCOCCOc1ccccc1C(=O)[O-] 7a_100015234032_100011215890 [0,1,0,0,0,0|3,0,0]=4 323 B15R1.241 CCOCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210147 [0,1,0,0,0,0|2,0,0]=3 324 B15R1.241 CCOCCOc1ccccc1[N+](=O)[O-] 34a_100121572206_100000741959 [0,1,0,0,0,0|2,0,0]=3 325 B15R1.241 CCOCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215890 [0,1,0,0,0,0|2,0,0]=3 326 B15R1.241 CCOCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100011215890 [0,1,0,0,0,0|3,0,0]=4 327 B15R1.241 CCOCSCc1ccccc1[N+](=O)[O-] 62a_100000739092_100000181388 [0,1,0,0,0,0|3,0,0]=4 328 B15R1.241 CCSCCNc1ccccc1C(=O)N 34a_100000185089_100000757381 [0,1,0,0,0,0|3,0,0]=4 329 B15R1.241 CCSCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000757381 [0,1,0,0,0,0|3,0,0]=4 330 B15R1.241 CCSCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000757381 [0,1,0,0,0,0|2,0,0]=3 331 B15R1.241 CCSCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000757381 [0,1,0,0,0,0|2,0,0]=3 332 B15R1.241 CCSCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000757381 [0,1,0,0,0,0|3,0,0]=4 333 B15R1.241 CNCCCOc1ccccc1[N+](=O)[O-] 2230a_106726388176_200000210301 [0,1,0,0,0,0|1,0,0]=2 334 B15R1.241 COCCCNc1ccccc1C(=O)N 34a_100000185089_100000740836 [0,1,0,0,0,0|3,0,0]=4 335 B15R1.241 COCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000740836 [0,1,0,0,0,0|3,0,0]=4 336 B15R1.241 COCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000740836 [0,1,0,0,0,0|2,0,0]=3 337 B15R1.241 COCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000740836 [0,1,0,0,0,0|2,0,0]=3 338 B15R1.241 COCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000740836 [0,1,0,0,0,0|3,0,0]=4 339 B15R1.241 COCCNCc1ccccc1[N+](=O)[O-] 2230a_100000209980_100000181388 [0,1,0,0,0,0|2,0,0]=3 340 B15R1.241 COCCNCc1ccccc1[N+](=O)[O-] 270004a_100000209980_100000186027 [0,1,0,0,0,0|2,0,0]=3 341 B15R1.241 COCCOCc1ccccc1[N+](=O)[O-] 34a_100000210237_100000181388 [0,1,0,0,0,0|3,0,0]=4 342 B15R1.241 COCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000233755 [0,1,0,0,0,0|3,0,0]=4 343 B15R1.241 COCCSCc1ccccc1[N+](=O)[O-] 62a_100000233755_100000181388 [0,1,0,0,0,0|3,0,0]=4 344 B15R1.241 COCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000766300 [0,1,0,0,0,0|3,0,0]=4 345 B15R1.241 CSCCNCc1ccccc1[N+](=O)[O-] 2230a_100020590264_100000181388 [0,1,0,0,0,0|2,0,0]=3 346 B15R1.241 CSCCNCc1ccccc1[N+](=O)[O-] 270004a_100020590264_100000186027 [0,1,0,0,0,0|2,0,0]=3 347 B15R1.241 CSCCOCc1ccccc1[N+](=O)[O-] 34a_100000230434_100000181388 [0,1,0,0,0,0|3,0,0]=4 348 B15R1.241 CSCCOCc1ccccc1[N+](=O)[O-] 7a_100000230434_100000181388 [0,1,0,0,0,0|3,0,0]=4 349 B15R1.241 CSCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000212216 [0,1,0,0,0,0|3,0,0]=4 350 B15R1.241 CSCCSCc1ccccc1[N+](=O)[O-] 62a_100000212216_100000181388 [0,1,0,0,0,0|3,0,0]=4 351 B15R1.241 CSCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100011218213 [0,1,0,0,0,0|3,0,0]=4 352 B15R1.241 CSCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100011218213 [0,1,0,0,0,0|3,0,0]=4 353 B15R1.241 N#CCCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000687738 [0,1,0,0,0,0|2,0,1]=4 354 B15R1.241 N#CCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000687738 [0,1,0,0,0,0|1,0,1]=3 355 B15R1.241 N#CCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000687738 [0,1,0,0,0,0|2,0,1]=4 356 B15R1.241 N#CCCNCc1ccccc1[N+](=O)[O-] 270004a_100000720768_100000186027 [0,1,0,0,0,0|0,0,2]=3 357 B15R1.241 N#CCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000184422 [0,1,0,0,0,0|1,0,2]=4 358 B15R1.241 N#CCCSCc1ccccc1[N+](=O)[O-] 62a_100011215226_100000181388 [0,1,0,0,0,0|1,0,2]=4 359 B15R1.241 N#CCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100011215382 [0,1,0,0,0,0|1,0,2]=4 360 B15R1.241 N#CCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100011215382 [0,1,0,0,0,0|1,0,2]=4 361 B15R1.241 NC(=O)c1ccccc1NCCCCF 34a_100000185089_100000729493 [0,1,0,0,0,0|3,0,0]=4 362 B15R1.241 NC(=O)c1ccccc1NCCCCO 34a_100000185089_100011216708 [0,1,0,0,0,0|3,0,0]=4 363 B15R1.241 NCCCOCc1ccccc1[N+](=O)[O-] 34a_100000182051_100000181388 [0,1,0,0,0,0|1,0,0]=2 364 B15R1.241 NCCOCCc1ccccc1[N+](=O)[O-] 34a_100000210304_200011934512 [0,1,0,0,0,0|1,0,0]=2 365 B15R1.241 NOCCOCc1ccccc1[N+](=O)[O-] 34a_100000700252_100000181388 [0,1,0,0,0,0|2,0,0]=3 366 B15R1.241 O=C(O)c1ccccc1CNCCCF 269956a_100015183376_100011934791 [0,1,0,0,0,0|2,0,1]=4 367 B15R1.241 O=C(O)c1ccccc1CNCCCO 269956a_100015183376_100011215043 [0,1,0,0,0,0|2,0,1]=4 368 B15R1.241 O=C([O-])c1ccccc1OCCCCF 7a_100015234032_100000729493 [0,1,0,0,0,0|3,0,0]=4 369 B15R1.241 O=C([O-])c1ccccc1OCCCCO 7a_100015234032_100000210776 [0,1,0,0,0,0|3,0,0]=4 370 B15R1.241 O=CCCCOc1ccccc1C(=O)[O-] 7a_100015234032_200011292268 [0,1,0,0,0,0|3,0,0]=4 371 B15R1.241 O=CCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200011292268 [0,1,0,0,0,0|2,0,0]=3 372 B15R1.241 O=CCCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_200011292268 [0,1,0,0,0,0|3,0,0]=4 373 B15R1.241 O=CCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_200015260668 [0,1,0,0,0,0|2,0,1]=4 374 B15R1.241 O=CCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_200009817547 [0,1,0,0,0,0|2,0,1]=4 375 B15R1.241 O=CCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_200015260668 [0,1,0,0,0,0|2,0,1]=4 376 B15R1.241 O=[N+]([O-])c1ccccc1C=NNCCO 4a_100000210001_100000186027 [0,1,0,0,0,0|2,0,1]=4 377 B15R1.241 O=[N+]([O-])c1ccccc1CCCOCF 34a_100000090589_100015361967 [0,1,0,0,0,0|2,0,0]=3 378 B15R1.241 O=[N+]([O-])c1ccccc1CCCOCF 7a_100000090589_100015361967 [0,1,0,0,0,0|2,0,0]=3 379 B15R1.241 O=[N+]([O-])c1ccccc1CCNCCF 2230a_100000723993_100011217306 [0,1,0,0,0,0|2,0,0]=3 380 B15R1.241 O=[N+]([O-])c1ccccc1CCNCCF 34a_100000724931_200011934512 [0,1,0,0,0,0|2,0,0]=3 381 B15R1.241 O=[N+]([O-])c1ccccc1CCNCCO 2230a_100000723993_100000211926 [0,1,0,0,0,0|2,0,0]=3 382 B15R1.241 O=[N+]([O-])c1ccccc1CCNCCO 2230a_100016997473_200011934512 [0,1,0,0,0,0|2,0,0]=3 383 B15R1.241 O=[N+]([O-])c1ccccc1CCNCCO 34a_100016990907_200011934512 [0,1,0,0,0,0|2,0,0]=3 384 B15R1.241 O=[N+]([O-])c1ccccc1CCOCCBr 34a_100000211926_200011934512 [0,1,0,0,0,0|2,0,0]=3 385 B15R1.241 O=[N+]([O-])c1ccccc1CCOCCF 34a_100000749287_100011217306 [0,1,0,0,0,0|2,0,0]=3 386 B15R1.241 O=[N+]([O-])c1ccccc1CCOCCF 7a_100000749287_100011217306 [0,1,0,0,0,0|2,0,0]=3 387 B15R1.241 O=[N+]([O-])c1ccccc1CCOCCO 34a_100000749287_100000211926 [0,1,0,0,0,0|2,0,0]=3 388 B15R1.241 O=[N+]([O-])c1ccccc1CCOCCO 7a_100000749287_100000211926 [0,1,0,0,0,0|2,0,0]=3 389 B15R1.241 O=[N+]([O-])c1ccccc1CNCCCF 2230a_100015189416_100000181388 [0,1,0,0,0,0|1,0,0]=2 390 B15R1.241 O=[N+]([O-])c1ccccc1CNCCCF 270004a_100015189416_100000186027 [0,1,0,0,0,0|1,0,0]=2 391 B15R1.241 O=[N+]([O-])c1ccccc1CNCCCF 34a_100015189416_100000181388 [0,1,0,0,0,0|1,0,0]=2 392 B15R1.241 O=[N+]([O-])c1ccccc1CNCCCO 270004a_100000182051_100000186027 [0,1,0,0,0,0|1,0,0]=2 393 B15R1.241 O=[N+]([O-])c1ccccc1COCCCBr 34a_100011217188_100000181388 [0,1,0,0,0,0|2,0,0]=3 394 B15R1.241 O=[N+]([O-])c1ccccc1COCCCCl 34a_100000230001_100000181388 [0,1,0,0,0,0|2,0,0]=3 395 B15R1.241 O=[N+]([O-])c1ccccc1COCCCF 34a_100000759539_100000181388 [0,1,0,0,0,0|2,0,0]=3 396 B15R1.241 O=[N+]([O-])c1ccccc1COCCCF 7a_100011218404_100011934791 [0,1,0,0,0,0|2,0,0]=3 397 B15R1.241 O=[N+]([O-])c1ccccc1COCCCO 7a_100011218404_100011215043 [0,1,0,0,0,0|2,0,0]=3 398 B15R1.241 O=[N+]([O-])c1ccccc1CSCCCF 62a_100011934791_100000181388 [0,1,0,0,0,0|2,0,0]=3 399 B15R1.241 O=[N+]([O-])c1ccccc1CSCCCO 62a_100011215043_100000181388 [0,1,0,0,0,0|2,0,0]=3 400 B15R1.241 O=[N+]([O-])c1ccccc1OCC#CCO 34a_100000186319_200000047223 [0,1,0,0,0,0|2,0,1]=4 401 B15R1.241 O=[N+]([O-])c1ccccc1OCC#CCO 7a_100000186319_200000047223 [0,1,0,0,0,0|2,0,1]=4 402 B15R1.241 O=[N+]([O-])c1ccccc1OCCCCF 34a_100000186319_100000729493 [0,1,0,0,0,0|2,0,0]=3 403 B15R1.241 O=[N+]([O-])c1ccccc1OCCCCF 7a_100000186319_100000729493 [0,1,0,0,0,0|2,0,0]=3 404 B15R1.241 O=[N+]([O-])c1ccccc1OCCCCO 34a_100000186319_100011216708 [0,1,0,0,0,0|2,0,0]=3 405 B15R1.241 O=[N+]([O-])c1ccccc1OCCCCO 7a_100000186319_100000210776 [0,1,0,0,0,0|2,0,0]=3 406 B15R1.241 O=[N+]([O-])c1ncccc1OCCCCF 7a_100000183951_100000729493 [0,1,0,0,0,0|3,0,0]=4 407 B15R1.241 O=[N+]([O-])c1ncccc1OCCCCO 7a_100000183951_100000210776 [0,1,0,0,0,0|3,0,0]=4 408 B15R1.241 [13CH3]NCCCOc1ccccc1[N+](=O)[O-] 2230a_106726388176_200025704644 [0,1,0,0,0,0|1,0,0]=2 409 B15R1.559 C#CCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000688953 [0,1,0,0,0,0|1,0,1]=3 410 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000688953 [0,1,0,0,0,0|2,0,1]=4 411 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000688953 [0,1,0,0,0,0|2,0,1]=4 412 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000688953 [0,1,0,0,0,0|2,0,1]=4 413 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000688953 [0,1,0,0,0,0|2,0,1]=4 414 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000688953 [0,1,0,0,0,0|2,0,1]=4 415 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000688953 [0,1,0,0,0,0|2,0,1]=4 416 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000688953 [0,1,0,0,0,0|2,0,1]=4 417 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000688953 [0,1,0,0,0,0|2,0,1]=4 418 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000688953 [0,1,0,0,0,0|2,0,1]=4 419 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000688953 [0,1,0,0,0,0|2,0,1]=4 420 B15R1.559 C#CCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000688953 [0,1,0,0,0,0|2,0,1]=4 421 B15R1.559 C/C=C/CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100102629194 [0,1,0,0,0,0|1,0,2]=4 422 B15R1.559 C=CCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000754431 [0,1,0,0,0,0|1,0,1]=3 423 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000754431 [0,1,0,0,0,0|2,0,1]=4 424 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000754431 [0,1,0,0,0,0|2,0,1]=4 425 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000754431 [0,1,0,0,0,0|2,0,1]=4 426 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000754431 [0,1,0,0,0,0|2,0,1]=4 427 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000754431 [0,1,0,0,0,0|2,0,1]=4 428 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000754431 [0,1,0,0,0,0|2,0,1]=4 429 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000754431 [0,1,0,0,0,0|2,0,1]=4 430 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000754431 [0,1,0,0,0,0|2,0,1]=4 431 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000754431 [0,1,0,0,0,0|2,0,1]=4 432 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000754431 [0,1,0,0,0,0|2,0,1]=4 433 B15R1.559 C=CCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000754431 [0,1,0,0,0,0|2,0,1]=4 434 B15R1.559 CC#CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000748600 [0,1,0,0,0,0|1,0,2]=4 435 B15R1.559 CC=CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000070051 [0,1,0,0,0,0|1,0,2]=4 436 B15R1.559 CCC=NNc1ccc(cc1[N+](=O)[O-])Br 4a_100011218155_100000210100 [0,1,0,0,0,0|2,0,1]=4 437 B15R1.559 CCCCNc1ccc(cc1C(=O)N)Br 27a_100000102301_200000162314 [0,1,0,0,0,0|3,0,0]=4 438 B15R1.559 CCCCNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000210210 [0,1,0,0,0,0|3,0,0]=4 439 B15R1.559 CCCCNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000210211 [0,1,0,0,0,0|3,0,0]=4 440 B15R1.559 CCCCNc1ccc(cc1C(=O)N)C 34a_100011692829_100000210210 [0,1,0,0,0,0|3,0,0]=4 441 B15R1.559 CCCCNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000210210 [0,1,0,0,0,0|3,0,0]=4 442 B15R1.559 CCCCNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000210211 [0,1,0,0,0,0|3,0,0]=4 443 B15R1.559 CCCCNc1ccc(cc1C(=O)N)F 34a_100000741173_100000210210 [0,1,0,0,0,0|3,0,0]=4 444 B15R1.559 CCCCNc1ccc(cc1C(=O)N)F 7a_100000741173_100000210211 [0,1,0,0,0,0|3,0,0]=4 445 B15R1.559 CCCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000210210 [0,1,0,0,0,0|1,0,0]=2 446 B15R1.559 CCCCOc1cc[n+](cc1[N+](=O)[O-])[O-] 7a_100000047301_100000210211 [0,1,0,0,0,0|3,0,0]=4 447 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000210210 [0,1,0,0,0,0|2,0,0]=3 448 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000210211 [0,1,0,0,0,0|2,0,0]=3 449 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000210210 [0,1,0,0,0,0|2,0,0]=3 450 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000210211 [0,1,0,0,0,0|2,0,0]=3 451 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000210210 [0,1,0,0,0,0|2,0,0]=3 452 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000210211 [0,1,0,0,0,0|2,0,0]=3 453 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000210210 [0,1,0,0,0,0|2,0,0]=3 454 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000210211 [0,1,0,0,0,0|2,0,0]=3 455 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000210211 [0,1,0,0,0,0|2,0,0]=3 456 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000210210 [0,1,0,0,0,0|2,0,0]=3 457 B15R1.559 CCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000210211 [0,1,0,0,0,0|2,0,0]=3 458 B15R1.559 CCCCOc1ccc(nc1[N+](=O)[O-])Br 7a_100000684561_100000210211 [0,1,0,0,0,0|3,0,0]=4 459 B15R1.559 CCCCOc1ccc(nc1[N+](=O)[O-])C 7a_100000211580_100000210211 [0,1,0,0,0,0|3,0,0]=4 460 B15R1.559 CCCCOc1ccc(nc1[N+](=O)[O-])Cl 7a_100000094143_100000210211 [0,1,0,0,0,0|3,0,0]=4 461 B15R1.559 CCCNCc1ccc(cc1[N+](=O)[O-])C 207a_100020643023_100000050315 [0,1,0,0,0,0|3,0,0]=4 462 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100000210258_100012353686 [0,1,0,0,0,0|3,0,0]=4 463 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])Br 7a_100012353685_100000210303 [0,1,0,0,0,0|3,0,0]=4 464 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])C 34a_100000210258_200009879986 [0,1,0,0,0,0|3,0,0]=4 465 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])C 7a_100000087798_100000210303 [0,1,0,0,0,0|3,0,0]=4 466 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000210258_100000748067 [0,1,0,0,0,0|3,0,0]=4 467 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])Cl 7a_100011219603_100000210303 [0,1,0,0,0,0|3,0,0]=4 468 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000085351_100000210303 [0,1,0,0,0,0|3,0,0]=4 469 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000210258_100012145688 [0,1,0,0,0,0|3,0,0]=4 470 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])F 7a_100000085351_100000210303 [0,1,0,0,0,0|3,0,0]=4 471 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])I 34a_100000210258_200010171343 [0,1,0,0,0,0|3,0,0]=4 472 B15R1.559 CCCOCc1ccc(cc1[N+](=O)[O-])I 7a_200000049922_100000210303 [0,1,0,0,0,0|3,0,0]=4 473 B15R1.559 CCCSCc1ccc(cc1[N+](=O)[O-])Br 62a_100012353686_100000210303 [0,1,0,0,0,0|3,0,0]=4 474 B15R1.559 CCCSCc1ccc(cc1[N+](=O)[O-])F 62a_100012145688_100000210303 [0,1,0,0,0,0|3,0,0]=4 475 B15R1.559 CCCSCc1ccc(cc1[N+](=O)[O-])I 62a_200010171343_100000210303 [0,1,0,0,0,0|3,0,0]=4 476 B15R1.559 COCCNc1ccc(cc1[N+](=O)[O-])Br 7a_200000176067_200000210301 [0,1,0,0,0,0|2,0,0]=3 477 B15R1.559 COCCNc1ccc(cc1[N+](=O)[O-])C 7a_200011273385_200000210301 [0,1,0,0,0,0|2,0,0]=3 478 B15R1.559 COCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100011201679 [0,1,0,0,0,0|2,0,0]=3 479 B15R1.559 COCCNc1ncc(cc1[N+](=O)[O-])Br 7a_200011432938_200000210301 [0,1,0,0,0,0|3,0,0]=4 480 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100011201679 [0,1,0,0,0,0|3,0,0]=4 481 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000233755 [0,1,0,0,0,0|3,0,0]=4 482 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100011201679 [0,1,0,0,0,0|3,0,0]=4 483 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000233755 [0,1,0,0,0,0|3,0,0]=4 484 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100011201679 [0,1,0,0,0,0|3,0,0]=4 485 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000233755 [0,1,0,0,0,0|3,0,0]=4 486 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100011201679 [0,1,0,0,0,0|3,0,0]=4 487 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000233755 [0,1,0,0,0,0|3,0,0]=4 488 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000233755 [0,1,0,0,0,0|3,0,0]=4 489 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100011201679 [0,1,0,0,0,0|3,0,0]=4 490 B15R1.559 COCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000233755 [0,1,0,0,0,0|3,0,0]=4 491 B15R1.559 CSCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000212216 [0,1,0,0,0,0|2,0,0]=3 492 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000212216 [0,1,0,0,0,0|3,0,0]=4 493 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000212216 [0,1,0,0,0,0|3,0,0]=4 494 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000212216 [0,1,0,0,0,0|3,0,0]=4 495 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000212216 [0,1,0,0,0,0|3,0,0]=4 496 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000212216 [0,1,0,0,0,0|3,0,0]=4 497 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000212216 [0,1,0,0,0,0|3,0,0]=4 498 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000212216 [0,1,0,0,0,0|3,0,0]=4 499 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000212216 [0,1,0,0,0,0|3,0,0]=4 500 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000212216 [0,1,0,0,0,0|3,0,0]=4 501 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000212216 [0,1,0,0,0,0|3,0,0]=4 502 B15R1.559 CSCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000212216 [0,1,0,0,0,0|3,0,0]=4 503 B15R1.559 Cc1ccc(c(c1)C(=O)N)NCCCF 34a_100011692829_100011934791 [0,1,0,0,0,0|3,0,0]=4 504 B15R1.559 Cc1ccc(c(c1)C(=O)N)NCCCO 34a_100011692829_100000230001 [0,1,0,0,0,0|3,0,0]=4 505 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])CNCCF 34a_100000724931_200009879986 [0,1,0,0,0,0|3,0,0]=4 506 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])CNCCO 207a_100000210304_100000050315 [0,1,0,0,0,0|3,0,0]=4 507 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])CNCCO 2230a_100016997473_200009879986 [0,1,0,0,0,0|3,0,0]=4 508 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])CNCCO 34a_100016990907_200009879986 [0,1,0,0,0,0|3,0,0]=4 509 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])COCCBr 34a_100000211926_200009879986 [0,1,0,0,0,0|3,0,0]=4 510 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])COCCF 7a_100000087798_100011217306 [0,1,0,0,0,0|3,0,0]=4 511 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])COCCN 34a_100000210304_200009879986 [0,1,0,0,0,0|2,0,0]=3 512 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])COCCO 7a_100000087798_100000211926 [0,1,0,0,0,0|3,0,0]=4 513 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])NCCO[13CH3] 7a_200011273385_200025704644 [0,1,0,0,0,0|2,0,0]=3 514 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])OCCC#N 7a_100000195567_100000184422 [0,1,0,0,0,0|1,0,2]=4 515 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])OCCCF 34a_100000195567_100011934791 [0,1,0,0,0,0|2,0,0]=3 516 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])OCCCF 7a_100000195567_100011934791 [0,1,0,0,0,0|2,0,0]=3 517 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])OCCCO 34a_100000195567_100000230001 [0,1,0,0,0,0|2,0,0]=3 518 B15R1.559 Cc1ccc(c(c1)[N+](=O)[O-])OCCCO 7a_100000195567_100011215043 [0,1,0,0,0,0|2,0,0]=3 519 B15R1.559 Cc1ccc(c(n1)[N+](=O)[O-])OCCCF 7a_100000211580_100011934791 [0,1,0,0,0,0|3,0,0]=4 520 B15R1.559 Cc1ccc(c(n1)[N+](=O)[O-])OCCCO 7a_100000211580_100011215043 [0,1,0,0,0,0|3,0,0]=4 521 B15R1.559 N#CCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000184422 [0,1,0,0,0,0|1,0,2]=4 522 B15R1.559 N#CCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000184422 [0,1,0,0,0,0|1,0,2]=4 523 B15R1.559 N#CCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000184422 [0,1,0,0,0,0|1,0,2]=4 524 B15R1.559 N#CCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000184422 [0,1,0,0,0,0|1,0,2]=4 525 B15R1.559 N#CCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000184422 [0,1,0,0,0,0|1,0,2]=4 526 B15R1.559 NC(=O)c1cc(ccc1NCCCF)Br 27a_100015189416_200000162314 [0,1,0,0,0,0|3,0,0]=4 527 B15R1.559 NC(=O)c1cc(ccc1NCCCF)Br 34a_100000740421_100011934791 [0,1,0,0,0,0|3,0,0]=4 528 B15R1.559 NC(=O)c1cc(ccc1NCCCF)Br 7a_100000740421_100011934791 [0,1,0,0,0,0|3,0,0]=4 529 B15R1.559 NC(=O)c1cc(ccc1NCCCF)Cl 34a_100000743835_100011934791 [0,1,0,0,0,0|3,0,0]=4 530 B15R1.559 NC(=O)c1cc(ccc1NCCCF)Cl 7a_100000743835_100011934791 [0,1,0,0,0,0|3,0,0]=4 531 B15R1.559 NC(=O)c1cc(ccc1NCCCF)F 34a_100000741173_100011934791 [0,1,0,0,0,0|3,0,0]=4 532 B15R1.559 NC(=O)c1cc(ccc1NCCCF)F 7a_100000741173_100011934791 [0,1,0,0,0,0|3,0,0]=4 533 B15R1.559 NC(=O)c1cc(ccc1NCCCO)Br 27a_100000182051_200000162314 [0,1,0,0,0,0|3,0,0]=4 534 B15R1.559 NC(=O)c1cc(ccc1NCCCO)Br 34a_100000740421_100000230001 [0,1,0,0,0,0|3,0,0]=4 535 B15R1.559 NC(=O)c1cc(ccc1NCCCO)Br 7a_100000740421_100011215043 [0,1,0,0,0,0|3,0,0]=4 536 B15R1.559 NC(=O)c1cc(ccc1NCCCO)Cl 34a_100000743835_100000230001 [0,1,0,0,0,0|3,0,0]=4 537 B15R1.559 NC(=O)c1cc(ccc1NCCCO)Cl 7a_100000743835_100011215043 [0,1,0,0,0,0|3,0,0]=4 538 B15R1.559 NC(=O)c1cc(ccc1NCCCO)F 34a_100000741173_100000230001 [0,1,0,0,0,0|3,0,0]=4 539 B15R1.559 NC(=O)c1cc(ccc1NCCCO)F 7a_100000741173_100011215043 [0,1,0,0,0,0|3,0,0]=4 540 B15R1.559 NCCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100000210304_100012353686 [0,1,0,0,0,0|2,0,0]=3 541 B15R1.559 NCCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000210304_100000748067 [0,1,0,0,0,0|2,0,0]=3 542 B15R1.559 NCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000210304_100012145688 [0,1,0,0,0,0|2,0,0]=3 543 B15R1.559 NCCOCc1ccc(cc1[N+](=O)[O-])I 34a_100000210304_200010171343 [0,1,0,0,0,0|2,0,0]=3 544 B15R1.559 Nc1ccc(c(c1)[N+](=O)[O-])OCCCF 34a_100000032192_100011934791 [0,1,0,0,0,0|2,0,0]=3 545 B15R1.559 Nc1ccc(c(c1)[N+](=O)[O-])OCCCF 7a_100000032192_100011934791 [0,1,0,0,0,0|2,0,0]=3 546 B15R1.559 Nc1ccc(c(c1)[N+](=O)[O-])OCCCO 34a_100000032192_100000230001 [0,1,0,0,0,0|2,0,0]=3 547 B15R1.559 Nc1ccc(c(c1)[N+](=O)[O-])OCCCO 7a_100000032192_100011215043 [0,1,0,0,0,0|2,0,0]=3 548 B15R1.559 O=[N+]([O-])c1c[n+](ccc1OCCCF)[O-] 7a_100000047301_100011934791 [0,1,0,0,0,0|3,0,0]=4 549 B15R1.559 O=[N+]([O-])c1c[n+](ccc1OCCCO)[O-] 7a_100000047301_100011215043 [0,1,0,0,0,0|3,0,0]=4 550 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCF)Br 34a_100000724931_100012353686 [0,1,0,0,0,0|3,0,0]=4 551 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCF)Cl 34a_100000724931_100000748067 [0,1,0,0,0,0|3,0,0]=4 552 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCF)F 34a_100000724931_100012145688 [0,1,0,0,0,0|3,0,0]=4 553 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCF)I 34a_100000724931_200010171343 [0,1,0,0,0,0|3,0,0]=4 554 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)Br 2230a_100016997473_100012353686 [0,1,0,0,0,0|3,0,0]=4 555 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)Br 34a_100016990907_100012353686 [0,1,0,0,0,0|3,0,0]=4 556 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)Cl 2230a_100016997473_100000748067 [0,1,0,0,0,0|3,0,0]=4 557 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)Cl 34a_100016990907_100000748067 [0,1,0,0,0,0|3,0,0]=4 558 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)F 2230a_100016997473_100012145688 [0,1,0,0,0,0|3,0,0]=4 559 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)F 34a_100016990907_100012145688 [0,1,0,0,0,0|3,0,0]=4 560 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)I 2230a_100016997473_200010171343 [0,1,0,0,0,0|3,0,0]=4 561 B15R1.559 O=[N+]([O-])c1cc(ccc1CNCCO)I 34a_100016990907_200010171343 [0,1,0,0,0,0|3,0,0]=4 562 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCBr)Br 34a_100000211926_100012353686 [0,1,0,0,0,0|3,0,0]=4 563 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCBr)Cl 34a_100000211926_100000748067 [0,1,0,0,0,0|3,0,0]=4 564 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCBr)F 34a_100000211926_100012145688 [0,1,0,0,0,0|3,0,0]=4 565 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCBr)I 34a_100000211926_200010171343 [0,1,0,0,0,0|3,0,0]=4 566 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCF)Br 7a_100012353685_100011217306 [0,1,0,0,0,0|3,0,0]=4 567 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCF)Cl 7a_100011219603_100011217306 [0,1,0,0,0,0|3,0,0]=4 568 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCF)F 34a_100000085351_100011217306 [0,1,0,0,0,0|3,0,0]=4 569 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCF)F 7a_100000085351_100011217306 [0,1,0,0,0,0|3,0,0]=4 570 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCF)I 7a_200000049922_100011217306 [0,1,0,0,0,0|3,0,0]=4 571 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCO)Br 7a_100012353685_100000211926 [0,1,0,0,0,0|3,0,0]=4 572 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCO)Cl 7a_100011219603_100000211926 [0,1,0,0,0,0|3,0,0]=4 573 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCO)F 34a_100000085351_100000211926 [0,1,0,0,0,0|3,0,0]=4 574 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCO)F 7a_100000085351_100000211926 [0,1,0,0,0,0|3,0,0]=4 575 B15R1.559 O=[N+]([O-])c1cc(ccc1COCCO)I 7a_200000049922_100000211926 [0,1,0,0,0,0|3,0,0]=4 576 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCF)Br 62a_100012353686_100011217306 [0,1,0,0,0,0|3,0,0]=4 577 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCF)F 62a_100012145688_100011217306 [0,1,0,0,0,0|3,0,0]=4 578 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCF)I 62a_200010171343_100011217306 [0,1,0,0,0,0|3,0,0]=4 579 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCO)Br 62a_100012353686_100000211926 [0,1,0,0,0,0|3,0,0]=4 580 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCO)F 62a_100012145688_100000211926 [0,1,0,0,0,0|3,0,0]=4 581 B15R1.559 O=[N+]([O-])c1cc(ccc1CSCCO)I 62a_200010171343_100000211926 [0,1,0,0,0,0|3,0,0]=4 582 B15R1.559 O=[N+]([O-])c1cc(ccc1NCCCF)F 34a_100000187532_100011934791 [0,1,0,0,0,0|1,0,0]=2 583 B15R1.559 O=[N+]([O-])c1cc(ccc1NCCCO)F 34a_100000187532_100000230001 [0,1,0,0,0,0|1,0,0]=2 584 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)Br 34a_100000757407_100011934791 [0,1,0,0,0,0|2,0,0]=3 585 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)Br 7a_100000757407_100011934791 [0,1,0,0,0,0|2,0,0]=3 586 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)Cl 34a_100000212152_100011934791 [0,1,0,0,0,0|2,0,0]=3 587 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)Cl 7a_100000212152_100011934791 [0,1,0,0,0,0|2,0,0]=3 588 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)F 34a_100000748789_100011934791 [0,1,0,0,0,0|2,0,0]=3 589 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)F 7a_100000748789_100011934791 [0,1,0,0,0,0|2,0,0]=3 590 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCF)I 7a_100000698543_100011934791 [0,1,0,0,0,0|2,0,0]=3 591 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)Br 34a_100000757407_100000230001 [0,1,0,0,0,0|2,0,0]=3 592 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)Br 7a_100000757407_100011215043 [0,1,0,0,0,0|2,0,0]=3 593 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)Cl 34a_100000212152_100000230001 [0,1,0,0,0,0|2,0,0]=3 594 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)Cl 7a_100000212152_100011215043 [0,1,0,0,0,0|2,0,0]=3 595 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)F 34a_100000748789_100000230001 [0,1,0,0,0,0|2,0,0]=3 596 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)F 7a_100000748789_100011215043 [0,1,0,0,0,0|2,0,0]=3 597 B15R1.559 O=[N+]([O-])c1cc(ccc1OCCCO)I 7a_100000698543_100011215043 [0,1,0,0,0,0|2,0,0]=3 598 B15R1.559 O=[N+]([O-])c1nc(ccc1OCCCF)Br 7a_100000684561_100011934791 [0,1,0,0,0,0|3,0,0]=4 599 B15R1.559 O=[N+]([O-])c1nc(ccc1OCCCF)Cl 7a_100000094143_100011934791 [0,1,0,0,0,0|3,0,0]=4 600 B15R1.559 O=[N+]([O-])c1nc(ccc1OCCCO)Br 7a_100000684561_100011215043 [0,1,0,0,0,0|3,0,0]=4 601 B15R1.559 O=[N+]([O-])c1nc(ccc1OCCCO)Cl 7a_100000094143_100011215043 [0,1,0,0,0,0|3,0,0]=4 602 B15R1.559 [13CH3]OCCNc1ccc(cc1[N+](=O)[O-])Br 7a_200000176067_200025704644 [0,1,0,0,0,0|2,0,0]=3 603 B15R1.559 [13CH3]OCCNc1ncc(cc1[N+](=O)[O-])Br 7a_200011432938_200025704644 [0,1,0,0,0,0|3,0,0]=4 604 B15R1.1108 C=CC(O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000730141 [0,1,0,0,0,0|2,0,1]=4 605 B15R1.1108 C=CC(O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000730141 [0,1,0,0,0,0|2,0,1]=4 606 B15R1.1108 CC(=NNc1ccccc1[N+](=O)[O-])CF 4a_100000737275_100000039719 [0,1,0,0,0,0|2,0,1]=4 607 B15R1.1108 CC(=NNc1ccccc1[N+](=O)[O-])CO 4a_100000737275_100000211253 [0,1,0,0,0,0|2,0,1]=4 608 B15R1.1108 CC(CF)OCc1ccccc1[N+](=O)[O-] 34a_100016041109_100000181388 [0,1,0,0,0,0|3,0,0]=4 609 B15R1.1108 CC(CF)OCc1ccccc1[N+](=O)[O-] 7a_100016041109_100000181388 [0,1,0,0,0,0|3,0,0]=4 610 B15R1.1108 CC(CN)OCc1ccccc1[N+](=O)[O-] 34a_100000210904_100000181388 [0,1,0,0,0,0|2,0,0]=3 611 B15R1.1108 CC(CO)OCc1ccccc1[N+](=O)[O-] 7a_100011218404_100012180447 [0,1,0,0,0,0|3,0,0]=4 612 B15R1.1108 CC(CO)SCc1ccccc1[N+](=O)[O-] 62a_100012180447_100000181388 [0,1,0,0,0,0|3,0,0]=4 613 B15R1.1108 CCC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000210414_200011934512 [0,1,0,0,0,0|2,0,1]=4 614 B15R1.1108 CCC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_100000210202 [0,1,0,0,0,0|2,0,1]=4 615 B15R1.1108 CCC(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100000210202 [0,1,0,0,0,0|2,0,1]=4 616 B15R1.1108 CCC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000747405 [0,1,0,0,0,0|2,0,1]=4 617 B15R1.1108 CCC(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_100000210202 [0,1,0,0,0,0|2,0,1]=4 618 B15R1.1108 CCC(=O)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100000210414 [0,1,0,0,0,0|2,0,1]=4 619 B15R1.1108 CCC(C)CNc1ccccc1C(=O)N 34a_100000185089_100000748023 [0,1,0,0,0,0|3,0,0]=4 620 B15R1.1108 CCC(C)COc1ccccc1C(=O)[O-] 7a_100015234032_100000748023 [0,1,0,0,0,0|3,0,0]=4 621 B15R1.1108 CCC(C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000748023 [0,1,0,0,0,0|2,0,0]=3 622 B15R1.1108 CCC(C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000748023 [0,1,0,0,0,0|2,0,0]=3 623 B15R1.1108 CCC(C)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100000748023 [0,1,0,0,0,0|3,0,0]=4 624 B15R1.1108 CCC(C)NCc1ccccc1[N+](=O)[O-] 2230a_100000209981_100000181388 [0,1,0,0,0,0|3,0,0]=4 625 B15R1.1108 CCC(C)NCc1ccccc1[N+](=O)[O-] 270004a_100000209981_100000186027 [0,1,0,0,0,0|3,0,0]=4 626 B15R1.1108 CCC(C)OCc1ccccc1[N+](=O)[O-] 7a_100000210228_100000181388 [0,1,0,0,0,0|3,0,0]=4 627 B15R1.1108 CCC(C)OCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000758301 [0,1,0,0,0,0|3,0,0]=4 628 B15R1.1108 CCC(C)SCc1ccccc1[N+](=O)[O-] 62a_100000758301_100000181388 [0,1,0,0,0,0|3,0,0]=4 629 B15R1.1108 CCC(O)CNc1ccccc1C(=O)N 34a_100000185089_100011218378 [0,1,0,0,0,0|3,0,0]=4 630 B15R1.1108 CCC(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100011218378 [0,1,0,0,0,0|3,0,0]=4 631 B15R1.1108 CCC(O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011218378 [0,1,0,0,0,0|2,0,0]=3 632 B15R1.1108 CCC(O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011218378 [0,1,0,0,0,0|2,0,0]=3 633 B15R1.1108 CCC(O)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100011218378 [0,1,0,0,0,0|3,0,0]=4 634 B15R1.1108 CCN(C)CCc1ccccc1[N+](=O)[O-] 2230a_100000225621_200011934512 [0,1,0,0,0,0|3,0,0]=4 635 B15R1.1108 CCN(C)CCc1ccccc1[N+](=O)[O-] 269982a_100000225621_200011934512 [0,1,0,0,0,0|3,0,0]=4 636 B15R1.1108 CC[C@H](C)CNc1ccccc1C(=O)N 34a_100000185089_100009816398 [0,1,0,0,0,0|3,0,0]=4 637 B15R1.1108 CC[C@H](C)COc1ccccc1C(=O)[O-] 7a_100015234032_100009816398 [0,1,0,0,0,0|3,0,0]=4 638 B15R1.1108 CC[C@H](C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100009816398 [0,1,0,0,0,0|2,0,0]=3 639 B15R1.1108 CC[C@H](C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100009816398 [0,1,0,0,0,0|2,0,0]=3 640 B15R1.1108 CC[C@H](C)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100009816398 [0,1,0,0,0,0|3,0,0]=4 641 B15R1.1108 CNC(C)CCc1ccccc1[N+](=O)[O-] 270004a_106832991635_200000760465 [0,1,0,0,0,0|3,0,0]=4 642 B15R1.1108 CNC(C)COc1ccccc1[N+](=O)[O-] 270004a_106832991635_100000150660 [0,1,0,0,0,0|3,0,0]=4 643 B15R1.1108 C[C@@H](CO)CNc1ccccc1C(=O)N 34a_100000185089_100000059175 [0,1,0,0,0,0|3,0,0]=4 644 B15R1.1108 C[C@@H](CO)COc1ccccc1C(=O)[O-] 7a_100015234032_100000059175 [0,1,0,0,0,0|3,0,0]=4 645 B15R1.1108 C[C@@H](CO)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000059175 [0,1,0,0,0,0|2,0,0]=3 646 B15R1.1108 C[C@@H](CO)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000059175 [0,1,0,0,0,0|2,0,0]=3 647 B15R1.1108 C[C@@H](CO)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100000059175 [0,1,0,0,0,0|3,0,0]=4 648 B15R1.1108 C[C@H](CF)NCc1ccccc1[N+](=O)[O-] 270004a_100102880703_100000186027 [0,1,0,0,0,0|3,0,0]=4 649 B15R1.1108 C[C@H](CO)NCc1ccccc1[N+](=O)[O-] 2230a_100000737577_100000181388 [0,1,0,0,0,0|3,0,0]=4 650 B15R1.1108 C[C@H](CO)NCc1ccccc1[N+](=O)[O-] 270004a_100000737577_100000186027 [0,1,0,0,0,0|3,0,0]=4 651 B15R1.1108 C[C@H](CO)SCc1ccccc1[N+](=O)[O-] 62a_100016084084_100000181388 [0,1,0,0,0,0|3,0,0]=4 652 B15R1.1108 NC(=O)c1ccccc1NCC(O)CO 34a_100000185089_100011219619 [0,1,0,0,0,0|3,0,0]=4 653 B15R1.1108 NC(=O)c1ccccc1NC[C@@H](O)CF 34a_100000185089_100015614560 [0,1,0,0,0,0|3,0,0]=4 654 B15R1.1108 NC(=O)c1ccccc1NC[C@@H](O)CO 34a_100000185089_100009815848 [0,1,0,0,0,0|3,0,0]=4 655 B15R1.1108 O=C(CF)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_100015361967 [0,1,0,0,0,0|2,0,1]=4 656 B15R1.1108 O=C(CF)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100015361967 [0,1,0,0,0,0|2,0,1]=4 657 B15R1.1108 O=C(CF)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_100015361967 [0,1,0,0,0,0|2,0,1]=4 658 B15R1.1108 O=C(CO)CCc1ccccc1[N+](=O)[O-] 1458a_100000210174_200011934512 [0,1,0,0,0,0|2,0,1]=4 659 B15R1.1108 O=C(CO)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100000210174 [0,1,0,0,0,0|2,0,1]=4 660 B15R1.1108 O=C([O-])c1ccccc1OCC(O)CO 7a_100015234032_100011219619 [0,1,0,0,0,0|3,0,0]=4 661 B15R1.1108 O=C([O-])c1ccccc1OC[C@@H](O)CF 7a_100015234032_100015614560 [0,1,0,0,0,0|3,0,0]=4 662 B15R1.1108 O=C([O-])c1ccccc1OC[C@@H](O)CO 7a_100015234032_100009815848 [0,1,0,0,0,0|3,0,0]=4 663 B15R1.1108 O=[N+]([O-])c1ccccc1OCC(O)CO 34a_100000186319_100011219619 [0,1,0,0,0,0|2,0,0]=3 664 B15R1.1108 O=[N+]([O-])c1ccccc1OCC(O)CO 7a_100000186319_100011219619 [0,1,0,0,0,0|2,0,0]=3 665 B15R1.1108 O=[N+]([O-])c1ccccc1OC[C@@H](O)CF 34a_100000186319_100015614560 [0,1,0,0,0,0|2,0,0]=3 666 B15R1.1108 O=[N+]([O-])c1ccccc1OC[C@@H](O)CF 7a_100000186319_100015614560 [0,1,0,0,0,0|2,0,0]=3 667 B15R1.1108 O=[N+]([O-])c1ccccc1OC[C@@H](O)CO 34a_100000186319_100009815848 [0,1,0,0,0,0|2,0,0]=3 668 B15R1.1108 O=[N+]([O-])c1ccccc1OC[C@@H](O)CO 7a_100000186319_100009815848 [0,1,0,0,0,0|2,0,0]=3 669 B15R1.1108 O=[N+]([O-])c1ncccc1OCC(O)CO 7a_100000183951_100011219619 [0,1,0,0,0,0|3,0,0]=4 670 B15R1.1108 O=[N+]([O-])c1ncccc1OC[C@@H](O)CF 7a_100000183951_100015614560 [0,1,0,0,0,0|3,0,0]=4 671 B15R1.1108 O=[N+]([O-])c1ncccc1OC[C@@H](O)CO 7a_100000183951_100009815848 [0,1,0,0,0,0|3,0,0]=4 672 B15R1.1159 C#CCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000688953 [0,1,0,0,0,0|1,0,1]=3 673 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000688953 [0,1,0,0,0,0|2,0,1]=4 674 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000688953 [0,1,0,0,0,0|2,0,1]=4 675 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000688953 [0,1,0,0,0,0|2,0,1]=4 676 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000688953 [0,1,0,0,0,0|2,0,1]=4 677 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000688953 [0,1,0,0,0,0|2,0,1]=4 678 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000688953 [0,1,0,0,0,0|2,0,1]=4 679 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000688953 [0,1,0,0,0,0|2,0,1]=4 680 B15R1.1159 C#CCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000688953 [0,1,0,0,0,0|2,0,1]=4 681 B15R1.1159 C/C=C/CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100102629194 [0,1,0,0,0,0|1,0,2]=4 682 B15R1.1159 C=CCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000754431 [0,1,0,0,0,0|1,0,1]=3 683 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000754431 [0,1,0,0,0,0|2,0,1]=4 684 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000754431 [0,1,0,0,0,0|2,0,1]=4 685 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000754431 [0,1,0,0,0,0|2,0,1]=4 686 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000754431 [0,1,0,0,0,0|2,0,1]=4 687 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000754431 [0,1,0,0,0,0|2,0,1]=4 688 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000754431 [0,1,0,0,0,0|2,0,1]=4 689 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000754431 [0,1,0,0,0,0|2,0,1]=4 690 B15R1.1159 C=CCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000754431 [0,1,0,0,0,0|2,0,1]=4 691 B15R1.1159 CC#CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000748600 [0,1,0,0,0,0|1,0,2]=4 692 B15R1.1159 CC(=O)c1ccc(cc1NCCCF)F 27a_100015189416_100000686192 [0,1,0,0,0,0|3,0,0]=4 693 B15R1.1159 CC(=O)c1ccc(cc1NCCCO)F 27a_100000182051_100000686192 [0,1,0,0,0,0|3,0,0]=4 694 B15R1.1159 CC=CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000070051 [0,1,0,0,0,0|1,0,2]=4 695 B15R1.1159 CCCCNc1cc(ccc1C(=O)C)F 27a_100000102301_100000686192 [0,1,0,0,0,0|3,0,0]=4 696 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)Br 27a_100000102301_100009815748 [0,1,0,0,0,0|3,0,0]=4 697 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000210211 [0,1,0,0,0,0|3,0,0]=4 698 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)C 34a_100011219537_100000210210 [0,1,0,0,0,0|3,0,0]=4 699 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)C 7a_100011219537_100000210211 [0,1,0,0,0,0|3,0,0]=4 700 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000210210 [0,1,0,0,0,0|3,0,0]=4 701 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000210211 [0,1,0,0,0,0|3,0,0]=4 702 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)F 27a_100000102301_100000206404 [0,1,0,0,0,0|3,0,0]=4 703 B15R1.1159 CCCCNc1cc(ccc1C(=O)N)F 34a_100011298637_100000210210 [0,1,0,0,0,0|3,0,0]=4 704 B15R1.1159 CCCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000210210 [0,1,0,0,0,0|1,0,0]=2 705 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000210211 [0,1,0,0,0,0|2,0,0]=3 706 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000210210 [0,1,0,0,0,0|2,0,0]=3 707 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000210211 [0,1,0,0,0,0|2,0,0]=3 708 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000210210 [0,1,0,0,0,0|2,0,0]=3 709 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000210211 [0,1,0,0,0,0|2,0,0]=3 710 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000210210 [0,1,0,0,0,0|2,0,0]=3 711 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000210211 [0,1,0,0,0,0|2,0,0]=3 712 B15R1.1159 CCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000210211 [0,1,0,0,0,0|2,0,0]=3 713 B15R1.1159 CCCCOc1cc(cnc1[N+](=O)[O-])Br 7a_100010201919_100000210211 [0,1,0,0,0,0|3,0,0]=4 714 B15R1.1159 CCCCOc1cc(cnc1[N+](=O)[O-])Cl 7a_100009862519_100000210211 [0,1,0,0,0,0|3,0,0]=4 715 B15R1.1159 CCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100020643023_100000692607 [0,1,0,0,0,0|3,0,0]=4 716 B15R1.1159 CCCNCc1cc(ccc1[N+](=O)[O-])C 207a_100020643023_100000050452 [0,1,0,0,0,0|3,0,0]=4 717 B15R1.1159 CCCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100020643023_100000050452 [0,1,0,0,0,0|3,0,0]=4 718 B15R1.1159 CCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100020643023_100000758460 [0,1,0,0,0,0|3,0,0]=4 719 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100000210258_100010245524 [0,1,0,0,0,0|3,0,0]=4 720 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])Br 7a_100012361455_100000210303 [0,1,0,0,0,0|3,0,0]=4 721 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])C 34a_100000210258_200000039114 [0,1,0,0,0,0|3,0,0]=4 722 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])C 7a_100000038506_100000210303 [0,1,0,0,0,0|3,0,0]=4 723 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000210258_100000765840 [0,1,0,0,0,0|3,0,0]=4 724 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])Cl 7a_100011216915_100000210303 [0,1,0,0,0,0|3,0,0]=4 725 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])F 34a_100000746263_100000210303 [0,1,0,0,0,0|3,0,0]=4 726 B15R1.1159 CCCOCc1cc(ccc1[N+](=O)[O-])F 7a_100000746263_100000210303 [0,1,0,0,0,0|3,0,0]=4 727 B15R1.1159 CCCSCc1cc(ccc1[N+](=O)[O-])Br 62a_100010245524_100000210303 [0,1,0,0,0,0|3,0,0]=4 728 B15R1.1159 COCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100011201679 [0,1,0,0,0,0|2,0,0]=3 729 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000233755 [0,1,0,0,0,0|3,0,0]=4 730 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100011201679 [0,1,0,0,0,0|3,0,0]=4 731 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000233755 [0,1,0,0,0,0|3,0,0]=4 732 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100011201679 [0,1,0,0,0,0|3,0,0]=4 733 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000233755 [0,1,0,0,0,0|3,0,0]=4 734 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100011201679 [0,1,0,0,0,0|3,0,0]=4 735 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000233755 [0,1,0,0,0,0|3,0,0]=4 736 B15R1.1159 COCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000233755 [0,1,0,0,0,0|3,0,0]=4 737 B15R1.1159 CSCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000212216 [0,1,0,0,0,0|2,0,0]=3 738 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000212216 [0,1,0,0,0,0|3,0,0]=4 739 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000212216 [0,1,0,0,0,0|3,0,0]=4 740 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000212216 [0,1,0,0,0,0|3,0,0]=4 741 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000212216 [0,1,0,0,0,0|3,0,0]=4 742 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000212216 [0,1,0,0,0,0|3,0,0]=4 743 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000212216 [0,1,0,0,0,0|3,0,0]=4 744 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000212216 [0,1,0,0,0,0|3,0,0]=4 745 B15R1.1159 CSCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000212216 [0,1,0,0,0,0|3,0,0]=4 746 B15R1.1159 Cc1ccc(c(c1)CNCCF)[N+](=O)[O-] 34a_100000724931_200000039114 [0,1,0,0,0,0|3,0,0]=4 747 B15R1.1159 Cc1ccc(c(c1)CNCCO)[N+](=O)[O-] 207a_100000210304_100000050452 [0,1,0,0,0,0|3,0,0]=4 748 B15R1.1159 Cc1ccc(c(c1)CNCCO)[N+](=O)[O-] 2230a_100016997473_200000039114 [0,1,0,0,0,0|3,0,0]=4 749 B15R1.1159 Cc1ccc(c(c1)CNCCO)[N+](=O)[O-] 270004a_100000210304_100000050452 [0,1,0,0,0,0|3,0,0]=4 750 B15R1.1159 Cc1ccc(c(c1)CNCCO)[N+](=O)[O-] 34a_100016990907_200000039114 [0,1,0,0,0,0|3,0,0]=4 751 B15R1.1159 Cc1ccc(c(c1)COCCBr)[N+](=O)[O-] 34a_100000211926_200000039114 [0,1,0,0,0,0|3,0,0]=4 752 B15R1.1159 Cc1ccc(c(c1)COCCF)[N+](=O)[O-] 7a_100000038506_100011217306 [0,1,0,0,0,0|3,0,0]=4 753 B15R1.1159 Cc1ccc(c(c1)COCCN)[N+](=O)[O-] 34a_100000210304_200000039114 [0,1,0,0,0,0|2,0,0]=3 754 B15R1.1159 Cc1ccc(c(c1)COCCO)[N+](=O)[O-] 7a_100000038506_100000211926 [0,1,0,0,0,0|3,0,0]=4 755 B15R1.1159 Cc1ccc(c(c1)NCCCF)C(=O)N 34a_100011219537_100011934791 [0,1,0,0,0,0|3,0,0]=4 756 B15R1.1159 Cc1ccc(c(c1)NCCCF)C(=O)N 7a_100011219537_100011934791 [0,1,0,0,0,0|3,0,0]=4 757 B15R1.1159 Cc1ccc(c(c1)NCCCO)C(=O)N 34a_100011219537_100000230001 [0,1,0,0,0,0|3,0,0]=4 758 B15R1.1159 Cc1ccc(c(c1)NCCCO)C(=O)N 7a_100011219537_100011215043 [0,1,0,0,0,0|3,0,0]=4 759 B15R1.1159 Cc1ccc(c(c1)OCCC#N)[N+](=O)[O-] 7a_100000195450_100000184422 [0,1,0,0,0,0|1,0,2]=4 760 B15R1.1159 Cc1ccc(c(c1)OCCCF)[N+](=O)[O-] 34a_100000195450_100011934791 [0,1,0,0,0,0|2,0,0]=3 761 B15R1.1159 Cc1ccc(c(c1)OCCCF)[N+](=O)[O-] 7a_100000195450_100011934791 [0,1,0,0,0,0|2,0,0]=3 762 B15R1.1159 Cc1ccc(c(c1)OCCCO)[N+](=O)[O-] 34a_100000195450_100000230001 [0,1,0,0,0,0|2,0,0]=3 763 B15R1.1159 Cc1ccc(c(c1)OCCCO)[N+](=O)[O-] 7a_100000195450_100011215043 [0,1,0,0,0,0|2,0,0]=3 764 B15R1.1159 N#CCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000184422 [0,1,0,0,0,0|1,0,2]=4 765 B15R1.1159 N#CCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000184422 [0,1,0,0,0,0|1,0,2]=4 766 B15R1.1159 N#CCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000184422 [0,1,0,0,0,0|1,0,2]=4 767 B15R1.1159 N#CCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000184422 [0,1,0,0,0,0|1,0,2]=4 768 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)Br 27a_100015189416_100009815748 [0,1,0,0,0,0|3,0,0]=4 769 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)Br 7a_100012349972_100011934791 [0,1,0,0,0,0|3,0,0]=4 770 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)Cl 34a_100000738103_100011934791 [0,1,0,0,0,0|3,0,0]=4 771 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)Cl 7a_100000738103_100011934791 [0,1,0,0,0,0|3,0,0]=4 772 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)F 27a_100015189416_100000206404 [0,1,0,0,0,0|3,0,0]=4 773 B15R1.1159 NC(=O)c1ccc(cc1NCCCF)F 34a_100011298637_100011934791 [0,1,0,0,0,0|3,0,0]=4 774 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)Br 27a_100000182051_100009815748 [0,1,0,0,0,0|3,0,0]=4 775 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)Br 7a_100012349972_100011215043 [0,1,0,0,0,0|3,0,0]=4 776 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)Cl 34a_100000738103_100000230001 [0,1,0,0,0,0|3,0,0]=4 777 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)Cl 7a_100000738103_100011215043 [0,1,0,0,0,0|3,0,0]=4 778 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)F 27a_100000182051_100000206404 [0,1,0,0,0,0|3,0,0]=4 779 B15R1.1159 NC(=O)c1ccc(cc1NCCCO)F 34a_100011298637_100000230001 [0,1,0,0,0,0|3,0,0]=4 780 B15R1.1159 NCCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100000210304_100010245524 [0,1,0,0,0,0|2,0,0]=3 781 B15R1.1159 NCCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000210304_100000765840 [0,1,0,0,0,0|2,0,0]=3 782 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCF)Br 34a_100000724931_100010245524 [0,1,0,0,0,0|3,0,0]=4 783 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCF)Cl 34a_100000724931_100000765840 [0,1,0,0,0,0|3,0,0]=4 784 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Br 2230a_100016997473_100010245524 [0,1,0,0,0,0|3,0,0]=4 785 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Br 270004a_100000210304_100000692607 [0,1,0,0,0,0|3,0,0]=4 786 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Br 34a_100016990907_100010245524 [0,1,0,0,0,0|3,0,0]=4 787 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Cl 2230a_100016997473_100000765840 [0,1,0,0,0,0|3,0,0]=4 788 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Cl 270004a_100000210304_100000758460 [0,1,0,0,0,0|3,0,0]=4 789 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)Cl 34a_100016990907_100000765840 [0,1,0,0,0,0|3,0,0]=4 790 B15R1.1159 O=[N+]([O-])c1ccc(cc1CNCCO)F 2230a_100016997473_100000740372 [0,1,0,0,0,0|3,0,0]=4 791 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCBr)Br 34a_100000211926_100010245524 [0,1,0,0,0,0|3,0,0]=4 792 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCBr)Cl 34a_100000211926_100000765840 [0,1,0,0,0,0|3,0,0]=4 793 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCF)Br 7a_100012361455_100011217306 [0,1,0,0,0,0|3,0,0]=4 794 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCF)Cl 7a_100011216915_100011217306 [0,1,0,0,0,0|3,0,0]=4 795 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCF)F 34a_100000746263_100011217306 [0,1,0,0,0,0|3,0,0]=4 796 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCF)F 7a_100000746263_100011217306 [0,1,0,0,0,0|3,0,0]=4 797 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCO)Br 7a_100012361455_100000211926 [0,1,0,0,0,0|3,0,0]=4 798 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCO)Cl 7a_100011216915_100000211926 [0,1,0,0,0,0|3,0,0]=4 799 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCO)F 34a_100000746263_100000211926 [0,1,0,0,0,0|3,0,0]=4 800 B15R1.1159 O=[N+]([O-])c1ccc(cc1COCCO)F 7a_100000746263_100000211926 [0,1,0,0,0,0|3,0,0]=4 801 B15R1.1159 O=[N+]([O-])c1ccc(cc1CSCCF)Br 62a_100010245524_100011217306 [0,1,0,0,0,0|3,0,0]=4 802 B15R1.1159 O=[N+]([O-])c1ccc(cc1CSCCO)Br 62a_100010245524_100000211926 [0,1,0,0,0,0|3,0,0]=4 803 B15R1.1159 O=[N+]([O-])c1ccc(cc1NCCCF)F 34a_100000746377_100011934791 [0,1,0,0,0,0|1,0,0]=2 804 B15R1.1159 O=[N+]([O-])c1ccc(cc1NCCCO)F 34a_100000746377_100000230001 [0,1,0,0,0,0|1,0,0]=2 805 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)Br 7a_100011934350_100011934791 [0,1,0,0,0,0|2,0,0]=3 806 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)Cl 34a_100000746067_100011934791 [0,1,0,0,0,0|2,0,0]=3 807 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)Cl 7a_100000746067_100011934791 [0,1,0,0,0,0|2,0,0]=3 808 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)F 34a_100000210785_100011934791 [0,1,0,0,0,0|2,0,0]=3 809 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)F 7a_100000210785_100011934791 [0,1,0,0,0,0|2,0,0]=3 810 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCF)I 7a_100000072657_100011934791 [0,1,0,0,0,0|2,0,0]=3 811 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)Br 7a_100011934350_100011215043 [0,1,0,0,0,0|2,0,0]=3 812 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)Cl 34a_100000746067_100000230001 [0,1,0,0,0,0|2,0,0]=3 813 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)Cl 7a_100000746067_100011215043 [0,1,0,0,0,0|2,0,0]=3 814 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)F 34a_100000210785_100000230001 [0,1,0,0,0,0|2,0,0]=3 815 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)F 7a_100000210785_100011215043 [0,1,0,0,0,0|2,0,0]=3 816 B15R1.1159 O=[N+]([O-])c1ccc(cc1OCCCO)I 7a_100000072657_100011215043 [0,1,0,0,0,0|2,0,0]=3 817 B15R1.1159 O=[N+]([O-])c1ncc(cc1OCCCF)Br 7a_100010201919_100011934791 [0,1,0,0,0,0|3,0,0]=4 818 B15R1.1159 O=[N+]([O-])c1ncc(cc1OCCCF)Cl 7a_100009862519_100011934791 [0,1,0,0,0,0|3,0,0]=4 819 B15R1.1159 O=[N+]([O-])c1ncc(cc1OCCCO)Br 7a_100010201919_100011215043 [0,1,0,0,0,0|3,0,0]=4 820 B15R1.1159 O=[N+]([O-])c1ncc(cc1OCCCO)Cl 7a_100009862519_100011215043 [0,1,0,0,0,0|3,0,0]=4 821 B15R1.1190 CCCCNc1ccccc1P(=O)(C)C 2230a_100010749338_100000210211 [0,1,0,0,0,0|2,1,0]=4 822 B15R1.1190 CCCCNc1ccccc1P(=O)(C)C 34a_100010749338_100000210210 [0,1,0,0,0,0|2,1,0]=4 823 B15R1.1190 CCCCNc1ccccc1S(=O)(=O)C 34a_100000241000_100000210210 [0,1,0,0,0,0|2,0,1]=4 824 B15R1.1190 CCCCNc1ccccc1S(=O)(=O)C 7a_100000241000_100000210211 [0,1,0,0,0,0|2,0,1]=4 825 B15R1.1190 CCCCNc1ccccc1S(=O)(=O)N 34a_100011204920_100000210210 [0,1,0,0,0,0|2,0,1]=4 826 B15R1.1190 CP(=O)(C)c1ccccc1NCCCF 2230a_100010749338_100011934791 [0,1,0,0,0,0|2,1,0]=4 827 B15R1.1190 CP(=O)(C)c1ccccc1NCCCF 34a_100010749338_100011934791 [0,1,0,0,0,0|2,1,0]=4 828 B15R1.1190 CP(=O)(C)c1ccccc1NCCCO 2230a_100010749338_100000230001 [0,1,0,0,0,0|2,1,0]=4 829 B15R1.1190 CP(=O)(C)c1ccccc1NCCCO 34a_100010749338_100000230001 [0,1,0,0,0,0|2,1,0]=4 830 B15R1.1190 CS(=O)(=O)c1ccccc1NCCCF 34a_100000241000_100011934791 [0,1,0,0,0,0|2,0,1]=4 831 B15R1.1190 CS(=O)(=O)c1ccccc1NCCCF 7a_100000241000_100011934791 [0,1,0,0,0,0|2,0,1]=4 832 B15R1.1190 CS(=O)(=O)c1ccccc1NCCCO 34a_100000241000_100000230001 [0,1,0,0,0,0|2,0,1]=4 833 B15R1.1190 CS(=O)(=O)c1ccccc1NCCCO 7a_100000241000_100011215043 [0,1,0,0,0,0|2,0,1]=4 834 B15R1.1190 NS(=O)(=O)c1ccccc1NCCCF 34a_100011204920_100011934791 [0,1,0,0,0,0|2,0,1]=4 835 B15R1.1190 NS(=O)(=O)c1ccccc1NCCCO 34a_100011204920_100000230001 [0,1,0,0,0,0|2,0,1]=4 836 B15R1.1191 CCCCNc1ccccc1C(=O)NC 27a_100000102301_100000155073 [0,1,0,0,0,0|3,0,0]=4 837 B15R1.1191 CCCCNc1ccccc1C(=O)NC 34a_100000185696_100000210210 [0,1,0,0,0,0|3,0,0]=4 838 B15R1.1191 CNC(=O)c1ccccc1NCCCF 27a_100015189416_100000155073 [0,1,0,0,0,0|3,0,0]=4 839 B15R1.1191 CNC(=O)c1ccccc1NCCCF 34a_100000185696_100011934791 [0,1,0,0,0,0|3,0,0]=4 840 B15R1.1191 CNC(=O)c1ccccc1NCCCO 27a_100000182051_100000155073 [0,1,0,0,0,0|3,0,0]=4 841 B15R1.1191 CNC(=O)c1ccccc1NCCCO 34a_100000185696_100000230001 [0,1,0,0,0,0|3,0,0]=4 842 B15R1.1239 C#CCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000753159 [0,1,0,0,0,0|2,0,1]=4 843 B15R1.1239 C#CCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000688953 [0,1,0,0,0,0|1,0,1]=3 844 B15R1.1239 C#CCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000730999 [0,1,0,0,0,0|1,0,1]=3 845 B15R1.1239 C/C=C/CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100102629194 [0,1,0,0,0,0|1,0,2]=4 846 B15R1.1239 C=CCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000754431 [0,1,0,0,0,0|2,0,1]=4 847 B15R1.1239 C=CCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000754431 [0,1,0,0,0,0|1,0,1]=3 848 B15R1.1239 C=CCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000754431 [0,1,0,0,0,0|1,0,1]=3 849 B15R1.1239 CC#CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000748600 [0,1,0,0,0,0|1,0,2]=4 850 B15R1.1239 CC(OCCF)c1ccccc1[N+](=O)[O-] 7a_100000246502_100011217306 [0,1,0,0,0,0|3,0,0]=4 851 B15R1.1239 CC(OCCO)c1ccccc1[N+](=O)[O-] 7a_100000246502_100000211926 [0,1,0,0,0,0|3,0,0]=4 852 B15R1.1239 CC=CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000070051 [0,1,0,0,0,0|1,0,2]=4 853 B15R1.1239 CCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210211 [0,1,0,0,0,0|2,0,0]=3 854 B15R1.1239 CCCCN(C)c1ccccc1C(=O)N 269982a_100000184419_100000210211 [0,1,0,0,0,0|3,0,0]=4 855 B15R1.1239 CCCCN(C)c1ccccc1C(=O)O 269956a_100000183030_200000210301 [0,1,0,0,0,0|2,0,1]=4 856 B15R1.1239 CCCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210211 [0,1,0,0,0,0|1,0,0]=2 857 B15R1.1239 CCCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210211 [0,1,0,0,0,0|1,0,0]=2 858 B15R1.1239 CCCCN([13CH3])c1ccccc1C(=O)O 269956a_100000183030_200025704644 [0,1,0,0,0,0|2,0,1]=4 859 B15R1.1239 CCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100020643023_100000188706 [0,1,0,0,0,0|3,0,0]=4 860 B15R1.1239 CCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100020643023_100000188706 [0,1,0,0,0,0|3,0,0]=4 861 B15R1.1239 CCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100020643023_100000188706 [0,1,0,0,0,0|3,0,0]=4 862 B15R1.1239 CCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100020643023_100000188706 [0,1,0,0,0,0|3,0,0]=4 863 B15R1.1239 CCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000210303 [0,1,0,0,0,0|3,0,0]=4 864 B15R1.1239 CCCOC(C)c1ccccc1[N+](=O)[O-] 7a_100000246502_100000210303 [0,1,0,0,0,0|3,0,0]=4 865 B15R1.1239 CCNCC(=O)c1ccccc1[N+](=O)[O-] 2230a_100015525214_100011219728 [0,1,0,0,0,0|3,0,0]=4 866 B15R1.1239 CCOCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000739092 [0,1,0,0,0,0|2,0,0]=3 867 B15R1.1239 CCSCC(=O)c1ccccc1[N+](=O)[O-] 62a_100011219728_100000210202 [0,1,0,0,0,0|3,0,0]=4 868 B15R1.1239 CN(CCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000002493_200000210301 [0,1,0,0,0,0|0,0,2]=3 869 B15R1.1239 CN(CCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011215226 [0,1,0,0,0,0|0,0,2]=3 870 B15R1.1239 CN(CCC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011215226 [0,1,0,0,0,0|0,0,2]=3 871 B15R1.1239 CN(CCCF)c1ccccc1C(=O)N 269982a_100000184419_100011934791 [0,1,0,0,0,0|3,0,0]=4 872 B15R1.1239 CN(CCCF)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011934791 [0,1,0,0,0,0|1,0,0]=2 873 B15R1.1239 CN(CCCF)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011934791 [0,1,0,0,0,0|1,0,0]=2 874 B15R1.1239 CN(CCCO)c1ccccc1C(=O)N 269982a_100000184419_100011215043 [0,1,0,0,0,0|3,0,0]=4 875 B15R1.1239 CN(CCCO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000230001 [0,1,0,0,0,0|1,0,0]=2 876 B15R1.1239 CN(CCCO)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011215043 [0,1,0,0,0,0|1,0,0]=2 877 B15R1.1239 CN(CSC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000211825 [0,1,0,0,0,0|1,0,2]=4 878 B15R1.1239 COCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000233755 [0,1,0,0,0,0|3,0,0]=4 879 B15R1.1239 COCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011201679 [0,1,0,0,0,0|2,0,0]=3 880 B15R1.1239 COCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000233755 [0,1,0,0,0,0|2,0,0]=3 881 B15R1.1239 CSCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000751147 [0,1,0,0,0,0|3,0,0]=4 882 B15R1.1239 CSCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000751147 [0,1,0,0,0,0|2,0,0]=3 883 B15R1.1239 CSCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000212216 [0,1,0,0,0,0|2,0,0]=3 884 B15R1.1239 C[C@@H](NCCF)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100011217306 [0,1,0,0,0,0|3,0,0]=4 885 B15R1.1239 C[C@@H](NCCO)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000211926 [0,1,0,0,0,0|3,0,0]=4 886 B15R1.1239 N#CCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011215226 [0,1,0,0,0,0|1,0,2]=4 887 B15R1.1239 O=C(CCCF)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011934791 [0,1,0,0,0,0|2,0,0]=3 888 B15R1.1239 O=C(CCCO)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011215043 [0,1,0,0,0,0|2,0,0]=3 889 B15R1.1239 O=C(CSCF)c1ccccc1[N+](=O)[O-] 62a_100011219728_100015361967 [0,1,0,0,0,0|3,0,0]=4 890 B15R1.1239 O=C(NCCF)c1ccccc1[N+](=O)[O-] 11a_100000724931_100000188706 [0,1,0,0,0,0|3,0,0]=4 891 B15R1.1239 O=C(NCCF)c1ccccc1[N+](=O)[O-] 1626a_100000724931_100000188706 [0,1,0,0,0,0|3,0,0]=4 892 B15R1.1239 O=C(NCCF)c1ccccc1[N+](=O)[O-] 240690a_100000724931_100000188706 [0,1,0,0,0,0|3,0,0]=4 893 B15R1.1239 O=C(NCCF)c1ccccc1[N+](=O)[O-] 527a_100000724931_100000188706 [0,1,0,0,0,0|3,0,0]=4 894 B15R1.1239 O=C(NCCO)c1ccccc1[N+](=O)[O-] 240690a_100000210304_100000188706 [0,1,0,0,0,0|3,0,0]=4 895 B15R1.1239 O=C(NCCO)c1ccccc1[N+](=O)[O-] 527a_100000210304_100000188706 [0,1,0,0,0,0|3,0,0]=4 896 B15R1.1239 [13CH3]N(CCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000002493_200025704644 [0,1,0,0,0,0|0,0,2]=3 897 B15R1.1274 CC(CC#N)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100009813641 [0,1,0,0,0,0|1,0,2]=4 898 B15R1.1274 CC(CCO)Nc1ccccc1C(=O)N 34a_100000185089_100009893172 [0,1,0,0,0,0|3,0,0]=4 899 B15R1.1274 CC(CCO)Oc1ccccc1C(=O)[O-] 7a_100015234032_100009893172 [0,1,0,0,0,0|3,0,0]=4 900 B15R1.1274 CC(CCO)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100009893172 [0,1,0,0,0,0|2,0,0]=3 901 B15R1.1274 CC(CCO)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100009893172 [0,1,0,0,0,0|2,0,0]=3 902 B15R1.1274 CC(CCO)Oc1cccnc1[N+](=O)[O-] 7a_100000183951_100009893172 [0,1,0,0,0,0|3,0,0]=4 903 B15R1.1274 CCCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100000210303 [0,1,0,0,0,0|2,0,1]=4 904 B15R1.1274 CCCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000211992_100000181388 [0,1,0,0,0,0|2,0,1]=4 905 B15R1.1274 CCCC(C)Nc1ccccc1C(=O)N 34a_100000185089_100000766640 [0,1,0,0,0,0|3,0,0]=4 906 B15R1.1274 CCCC(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000766640 [0,1,0,0,0,0|3,0,0]=4 907 B15R1.1274 CCCC(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100000766640 [0,1,0,0,0,0|2,0,0]=3 908 B15R1.1274 CCCC(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000766640 [0,1,0,0,0,0|2,0,0]=3 909 B15R1.1274 CCCC(C)Oc1cccnc1[N+](=O)[O-] 7a_100000183951_100000766640 [0,1,0,0,0,0|3,0,0]=4 910 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000201652_200000210301 [0,1,0,0,0,0|3,0,0]=4 911 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000210303 [0,1,0,0,0,0|3,0,0]=4 912 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000747261_100000181388 [0,1,0,0,0,0|3,0,0]=4 913 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000201652_200000210301 [0,1,0,0,0,0|3,0,0]=4 914 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000210303 [0,1,0,0,0,0|3,0,0]=4 915 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000747261_100000181388 [0,1,0,0,0,0|3,0,0]=4 916 B15R1.1274 CCCN(C)Cc1ccccc1[N+](=O)[O-] 270004a_100000747261_100000186027 [0,1,0,0,0,0|3,0,0]=4 917 B15R1.1274 CCCN([13CH3])Cc1ccccc1[N+](=O)[O-] 2230a_100000201652_200025704644 [0,1,0,0,0,0|3,0,0]=4 918 B15R1.1274 CCCN([13CH3])Cc1ccccc1[N+](=O)[O-] 269982a_100000201652_200025704644 [0,1,0,0,0,0|3,0,0]=4 919 B15R1.1274 CN(CCF)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100011217306 [0,1,0,0,0,0|3,0,0]=4 920 B15R1.1274 CN(CCF)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100011217306 [0,1,0,0,0,0|3,0,0]=4 921 B15R1.1274 CN(CCO)Cc1ccccc1[N+](=O)[O-] 2230a_100000210263_100000181388 [0,1,0,0,0,0|3,0,0]=4 922 B15R1.1274 CN(CCO)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000211926 [0,1,0,0,0,0|3,0,0]=4 923 B15R1.1274 CN(CCO)Cc1ccccc1[N+](=O)[O-] 269982a_100000210263_100000181388 [0,1,0,0,0,0|3,0,0]=4 924 B15R1.1274 CN(CCO)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000211926 [0,1,0,0,0,0|3,0,0]=4 925 B15R1.1274 CN(CCO)Cc1ccccc1[N+](=O)[O-] 270004a_100000210263_100000186027 [0,1,0,0,0,0|3,0,0]=4 926 B15R1.1274 CNCC(=O)Nc1ccccc1[N+](=O)[O-] 2230a_106832991635_100000182460 [0,1,0,0,0,0|2,0,1]=4 927 B15R1.1274 CNCC(=O)Nc1ccccc1[N+](=O)[O-] 7a_106832991635_100000182460 [0,1,0,0,0,0|2,0,1]=4 928 B15R1.1274 COCC(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100000765312 [0,1,0,0,0,0|3,0,0]=4 929 B15R1.1274 COCC(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000765312 [0,1,0,0,0,0|3,0,0]=4 930 B15R1.1274 O=C(CCF)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100011217306 [0,1,0,0,0,0|2,0,1]=4 931 B15R1.1274 O=C(CCO)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100000211926 [0,1,0,0,0,0|2,0,1]=4 932 B15R1.1274 O=C(CCO)Cc1ccccc1[N+](=O)[O-] 1458a_100011216618_100000181388 [0,1,0,0,0,0|2,0,1]=4 933 B15R1.3990 C#CCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000688953 [0,1,0,0,0,0|1,0,1]=3 934 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000688953 [0,1,0,0,0,0|2,0,1]=4 935 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000688953 [0,1,0,0,0,0|2,0,1]=4 936 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000688953 [0,1,0,0,0,0|2,0,1]=4 937 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000688953 [0,1,0,0,0,0|2,0,1]=4 938 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000688953 [0,1,0,0,0,0|2,0,1]=4 939 B15R1.3990 C#CCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000688953 [0,1,0,0,0,0|2,0,1]=4 940 B15R1.3990 C/C=C/CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100102629194 [0,1,0,0,0,0|1,0,2]=4 941 B15R1.3990 C=CCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000754431 [0,1,0,0,0,0|1,0,1]=3 942 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000754431 [0,1,0,0,0,0|2,0,1]=4 943 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000754431 [0,1,0,0,0,0|2,0,1]=4 944 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000754431 [0,1,0,0,0,0|2,0,1]=4 945 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000754431 [0,1,0,0,0,0|2,0,1]=4 946 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000754431 [0,1,0,0,0,0|2,0,1]=4 947 B15R1.3990 C=CCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000754431 [0,1,0,0,0,0|2,0,1]=4 948 B15R1.3990 CC#CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000748600 [0,1,0,0,0,0|1,0,2]=4 949 B15R1.3990 CC=CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000070051 [0,1,0,0,0,0|1,0,2]=4 950 B15R1.3990 CCCCNc1c(cccc1C(=O)N)C 34a_100000223273_100000210210 [0,1,0,0,0,0|3,0,0]=4 951 B15R1.3990 CCCCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000210210 [0,1,0,0,0,0|3,0,0]=4 952 B15R1.3990 CCCCNc1c(cccc1C(=O)N)F 34a_100011722151_100000210210 [0,1,0,0,0,0|3,0,0]=4 953 B15R1.3990 CCCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000210210 [0,1,0,0,0,0|1,0,0]=2 954 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000210210 [0,1,0,0,0,0|2,0,0]=3 955 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000210210 [0,1,0,0,0,0|2,0,0]=3 956 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000210211 [0,1,0,0,0,0|2,0,0]=3 957 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000210210 [0,1,0,0,0,0|2,0,0]=3 958 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000210211 [0,1,0,0,0,0|2,0,0]=3 959 B15R1.3990 CCCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000210210 [0,1,0,0,0,0|2,0,0]=3 960 B15R1.3990 CCCCOc1c(ccnc1C)[N+](=O)[O-] 34a_200000144590_100000210210 [0,1,0,0,0,0|3,0,0]=4 961 B15R1.3990 CCCCOc1c(ccnc1C)[N+](=O)[O-] 7a_200000144590_100000210211 [0,1,0,0,0,0|3,0,0]=4 962 B15R1.3990 CCCCOc1c(ccnc1Cl)[N+](=O)[O-] 34a_100009852515_100000210210 [0,1,0,0,0,0|3,0,0]=4 963 B15R1.3990 CCCCOc1c(ccnc1Cl)[N+](=O)[O-] 7a_100009852515_100000210211 [0,1,0,0,0,0|3,0,0]=4 964 B15R1.3990 CCCCOc1c(ccnc1[N+](=O)[O-])C 7a_100009875811_100000210211 [0,1,0,0,0,0|3,0,0]=4 965 B15R1.3990 CCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100020643023_100000735576 [0,1,0,0,0,0|3,0,0]=4 966 B15R1.3990 CCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100020643023_100011217401 [0,1,0,0,0,0|3,0,0]=4 967 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])Br 34a_100000210258_100011273477 [0,1,0,0,0,0|3,0,0]=4 968 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])C 34a_100000210258_100010254497 [0,1,0,0,0,0|3,0,0]=4 969 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])C 34a_100009850887_100000210303 [0,1,0,0,0,0|3,0,0]=4 970 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])C 7a_100009850887_100000210303 [0,1,0,0,0,0|3,0,0]=4 971 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100000210258_100000753779 [0,1,0,0,0,0|3,0,0]=4 972 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])Cl 7a_100011916443_100000210303 [0,1,0,0,0,0|3,0,0]=4 973 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000102360_100000210303 [0,1,0,0,0,0|3,0,0]=4 974 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000210258_100000751461 [0,1,0,0,0,0|3,0,0]=4 975 B15R1.3990 CCCOCc1c(cccc1[N+](=O)[O-])F 7a_100000102360_100000210303 [0,1,0,0,0,0|3,0,0]=4 976 B15R1.3990 CCCSCc1c(cccc1[N+](=O)[O-])Br 62a_100011273477_100000210303 [0,1,0,0,0,0|3,0,0]=4 977 B15R1.3990 COCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100011201679 [0,1,0,0,0,0|2,0,0]=3 978 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100011201679 [0,1,0,0,0,0|3,0,0]=4 979 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100011201679 [0,1,0,0,0,0|3,0,0]=4 980 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000233755 [0,1,0,0,0,0|3,0,0]=4 981 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100011201679 [0,1,0,0,0,0|3,0,0]=4 982 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000233755 [0,1,0,0,0,0|3,0,0]=4 983 B15R1.3990 COCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100011201679 [0,1,0,0,0,0|3,0,0]=4 984 B15R1.3990 CSCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000212216 [0,1,0,0,0,0|2,0,0]=3 985 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000212216 [0,1,0,0,0,0|3,0,0]=4 986 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000212216 [0,1,0,0,0,0|3,0,0]=4 987 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000212216 [0,1,0,0,0,0|3,0,0]=4 988 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000212216 [0,1,0,0,0,0|3,0,0]=4 989 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000212216 [0,1,0,0,0,0|3,0,0]=4 990 B15R1.3990 CSCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000212216 [0,1,0,0,0,0|3,0,0]=4 991 B15R1.3990 Cc1cccc(c1CNCCF)[N+](=O)[O-] 34a_100000724931_100010254497 [0,1,0,0,0,0|3,0,0]=4 992 B15R1.3990 Cc1cccc(c1CNCCO)[N+](=O)[O-] 2230a_100016997473_100010254497 [0,1,0,0,0,0|3,0,0]=4 993 B15R1.3990 Cc1cccc(c1CNCCO)[N+](=O)[O-] 34a_100016990907_100010254497 [0,1,0,0,0,0|3,0,0]=4 994 B15R1.3990 Cc1cccc(c1COCCBr)[N+](=O)[O-] 34a_100000211926_100010254497 [0,1,0,0,0,0|3,0,0]=4 995 B15R1.3990 Cc1cccc(c1COCCF)[N+](=O)[O-] 34a_100009850887_100011217306 [0,1,0,0,0,0|3,0,0]=4 996 B15R1.3990 Cc1cccc(c1COCCF)[N+](=O)[O-] 7a_100009850887_100011217306 [0,1,0,0,0,0|3,0,0]=4 997 B15R1.3990 Cc1cccc(c1COCCN)[N+](=O)[O-] 34a_100000210304_100010254497 [0,1,0,0,0,0|2,0,0]=3 998 B15R1.3990 Cc1cccc(c1COCCO)[N+](=O)[O-] 34a_100009850887_100000211926 [0,1,0,0,0,0|3,0,0]=4 999 B15R1.3990 Cc1cccc(c1COCCO)[N+](=O)[O-] 7a_100009850887_100000211926 [0,1,0,0,0,0|3,0,0]=4 1000 B15R1.3990 Cc1cccc(c1NCCCF)C(=O)N 34a_100000223273_100011934791 [0,1,0,0,0,0|3,0,0]=4 1001 B15R1.3990 Cc1cccc(c1NCCCO)C(=O)N 34a_100000223273_100000230001 [0,1,0,0,0,0|3,0,0]=4 1002 B15R1.3990 Cc1cccc(c1OCCC#N)[N+](=O)[O-] 7a_100000763257_100000184422 [0,1,0,0,0,0|1,0,2]=4 1003 B15R1.3990 Cc1cccc(c1OCCCF)[N+](=O)[O-] 34a_100000763257_100011934791 [0,1,0,0,0,0|2,0,0]=3 1004 B15R1.3990 Cc1cccc(c1OCCCF)[N+](=O)[O-] 7a_100000763257_100011934791 [0,1,0,0,0,0|2,0,0]=3 1005 B15R1.3990 Cc1cccc(c1OCCCO)[N+](=O)[O-] 34a_100000763257_100000230001 [0,1,0,0,0,0|2,0,0]=3 1006 B15R1.3990 Cc1cccc(c1OCCCO)[N+](=O)[O-] 7a_100000763257_100011215043 [0,1,0,0,0,0|2,0,0]=3 1007 B15R1.3990 Cc1ccnc(c1OCCCF)[N+](=O)[O-] 7a_100009875811_100011934791 [0,1,0,0,0,0|3,0,0]=4 1008 B15R1.3990 Cc1ccnc(c1OCCCO)[N+](=O)[O-] 7a_100009875811_100011215043 [0,1,0,0,0,0|3,0,0]=4 1009 B15R1.3990 Cc1nccc(c1OCCCF)[N+](=O)[O-] 34a_200000144590_100011934791 [0,1,0,0,0,0|3,0,0]=4 1010 B15R1.3990 Cc1nccc(c1OCCCF)[N+](=O)[O-] 7a_200000144590_100011934791 [0,1,0,0,0,0|3,0,0]=4 1011 B15R1.3990 Cc1nccc(c1OCCCO)[N+](=O)[O-] 34a_200000144590_100000230001 [0,1,0,0,0,0|3,0,0]=4 1012 B15R1.3990 Cc1nccc(c1OCCCO)[N+](=O)[O-] 7a_200000144590_100011215043 [0,1,0,0,0,0|3,0,0]=4 1013 B15R1.3990 N#CCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000184422 [0,1,0,0,0,0|1,0,2]=4 1014 B15R1.3990 NC(=O)c1cccc(c1NCCCF)Cl 34a_200011997947_100011934791 [0,1,0,0,0,0|3,0,0]=4 1015 B15R1.3990 NC(=O)c1cccc(c1NCCCF)F 34a_100011722151_100011934791 [0,1,0,0,0,0|3,0,0]=4 1016 B15R1.3990 NC(=O)c1cccc(c1NCCCO)Cl 34a_200011997947_100000230001 [0,1,0,0,0,0|3,0,0]=4 1017 B15R1.3990 NC(=O)c1cccc(c1NCCCO)F 34a_100011722151_100000230001 [0,1,0,0,0,0|3,0,0]=4 1018 B15R1.3990 NCCOCc1c(cccc1[N+](=O)[O-])Br 34a_100000210304_100011273477 [0,1,0,0,0,0|2,0,0]=3 1019 B15R1.3990 NCCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100000210304_100000753779 [0,1,0,0,0,0|2,0,0]=3 1020 B15R1.3990 NCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000210304_100000751461 [0,1,0,0,0,0|2,0,0]=3 1021 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCF)Br 34a_100000724931_100011273477 [0,1,0,0,0,0|3,0,0]=4 1022 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCF)Cl 34a_100000724931_100000753779 [0,1,0,0,0,0|3,0,0]=4 1023 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCF)F 34a_100000724931_100000751461 [0,1,0,0,0,0|3,0,0]=4 1024 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Br 2230a_100016997473_100011273477 [0,1,0,0,0,0|3,0,0]=4 1025 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Br 270004a_100000210304_100000735576 [0,1,0,0,0,0|3,0,0]=4 1026 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Br 34a_100016990907_100011273477 [0,1,0,0,0,0|3,0,0]=4 1027 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Cl 2230a_100016997473_100000753779 [0,1,0,0,0,0|3,0,0]=4 1028 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Cl 270004a_100000210304_100011217401 [0,1,0,0,0,0|3,0,0]=4 1029 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)Cl 34a_100016990907_100000753779 [0,1,0,0,0,0|3,0,0]=4 1030 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)F 2230a_100016997473_100000751461 [0,1,0,0,0,0|3,0,0]=4 1031 B15R1.3990 O=[N+]([O-])c1cccc(c1CNCCO)F 34a_100016990907_100000751461 [0,1,0,0,0,0|3,0,0]=4 1032 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCBr)Br 34a_100000211926_100011273477 [0,1,0,0,0,0|3,0,0]=4 1033 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCBr)Cl 34a_100000211926_100000753779 [0,1,0,0,0,0|3,0,0]=4 1034 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCBr)F 34a_100000211926_100000751461 [0,1,0,0,0,0|3,0,0]=4 1035 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCF)Cl 7a_100011916443_100011217306 [0,1,0,0,0,0|3,0,0]=4 1036 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCF)F 34a_100000102360_100011217306 [0,1,0,0,0,0|3,0,0]=4 1037 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCF)F 7a_100000102360_100011217306 [0,1,0,0,0,0|3,0,0]=4 1038 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCO)Cl 7a_100011916443_100000211926 [0,1,0,0,0,0|3,0,0]=4 1039 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCO)F 34a_100000102360_100000211926 [0,1,0,0,0,0|3,0,0]=4 1040 B15R1.3990 O=[N+]([O-])c1cccc(c1COCCO)F 7a_100000102360_100000211926 [0,1,0,0,0,0|3,0,0]=4 1041 B15R1.3990 O=[N+]([O-])c1cccc(c1CSCCF)Br 62a_100011273477_100011217306 [0,1,0,0,0,0|3,0,0]=4 1042 B15R1.3990 O=[N+]([O-])c1cccc(c1CSCCO)Br 62a_100011273477_100000211926 [0,1,0,0,0,0|3,0,0]=4 1043 B15R1.3990 O=[N+]([O-])c1cccc(c1NCCCF)F 34a_100000687224_100011934791 [0,1,0,0,0,0|1,0,0]=2 1044 B15R1.3990 O=[N+]([O-])c1cccc(c1NCCCO)F 34a_100000687224_100000230001 [0,1,0,0,0,0|1,0,0]=2 1045 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCF)Br 34a_100000689966_100011934791 [0,1,0,0,0,0|2,0,0]=3 1046 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCF)Cl 34a_100000686934_100011934791 [0,1,0,0,0,0|2,0,0]=3 1047 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCF)Cl 7a_100000686934_100011934791 [0,1,0,0,0,0|2,0,0]=3 1048 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCF)F 34a_100000690172_100011934791 [0,1,0,0,0,0|2,0,0]=3 1049 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCO)Br 34a_100000689966_100000230001 [0,1,0,0,0,0|2,0,0]=3 1050 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCO)Cl 34a_100000686934_100000230001 [0,1,0,0,0,0|2,0,0]=3 1051 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCO)Cl 7a_100000686934_100011215043 [0,1,0,0,0,0|2,0,0]=3 1052 B15R1.3990 O=[N+]([O-])c1cccc(c1OCCCO)F 34a_100000690172_100000230001 [0,1,0,0,0,0|2,0,0]=3 1053 B15R1.3990 O=[N+]([O-])c1ccnc(c1OCCCF)Cl 34a_100009852515_100011934791 [0,1,0,0,0,0|3,0,0]=4 1054 B15R1.3990 O=[N+]([O-])c1ccnc(c1OCCCF)Cl 7a_100009852515_100011934791 [0,1,0,0,0,0|3,0,0]=4 1055 B15R1.3990 O=[N+]([O-])c1ccnc(c1OCCCO)Cl 34a_100009852515_100000230001 [0,1,0,0,0,0|3,0,0]=4 1056 B15R1.3990 O=[N+]([O-])c1ccnc(c1OCCCO)Cl 7a_100009852515_100011215043 [0,1,0,0,0,0|3,0,0]=4 1057 B15R1.4455 C#CCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000688953 [0,1,0,0,0,0|1,0,1]=3 1058 B15R1.4455 C#CCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000688953 [0,1,0,0,0,0|1,0,1]=3 1059 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000688953 [0,1,0,0,0,0|2,0,1]=4 1060 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000688953 [0,1,0,0,0,0|2,0,1]=4 1061 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000688953 [0,1,0,0,0,0|2,0,1]=4 1062 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000688953 [0,1,0,0,0,0|2,0,1]=4 1063 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000688953 [0,1,0,0,0,0|2,0,1]=4 1064 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000688953 [0,1,0,0,0,0|2,0,1]=4 1065 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000688953 [0,1,0,0,0,0|2,0,1]=4 1066 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000688953 [0,1,0,0,0,0|2,0,1]=4 1067 B15R1.4455 C#CCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000688953 [0,1,0,0,0,0|2,0,1]=4 1068 B15R1.4455 C/C=C/CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100102629194 [0,1,0,0,0,0|1,0,2]=4 1069 B15R1.4455 C/C=C/CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100102629194 [0,1,0,0,0,0|1,0,2]=4 1070 B15R1.4455 C=CCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000754431 [0,1,0,0,0,0|1,0,1]=3 1071 B15R1.4455 C=CCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000754431 [0,1,0,0,0,0|1,0,1]=3 1072 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000754431 [0,1,0,0,0,0|2,0,1]=4 1073 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000754431 [0,1,0,0,0,0|2,0,1]=4 1074 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000754431 [0,1,0,0,0,0|2,0,1]=4 1075 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000754431 [0,1,0,0,0,0|2,0,1]=4 1076 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000754431 [0,1,0,0,0,0|2,0,1]=4 1077 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000754431 [0,1,0,0,0,0|2,0,1]=4 1078 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000754431 [0,1,0,0,0,0|2,0,1]=4 1079 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000754431 [0,1,0,0,0,0|2,0,1]=4 1080 B15R1.4455 C=CCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000754431 [0,1,0,0,0,0|2,0,1]=4 1081 B15R1.4455 CC#CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000748600 [0,1,0,0,0,0|1,0,2]=4 1082 B15R1.4455 CC#CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000748600 [0,1,0,0,0,0|1,0,2]=4 1083 B15R1.4455 CC=CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000070051 [0,1,0,0,0,0|1,0,2]=4 1084 B15R1.4455 CC=CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000070051 [0,1,0,0,0,0|1,0,2]=4 1085 B15R1.4455 CCCCNc1cccc(c1C(=O)N)C 34a_100102558177_100000210210 [0,1,0,0,0,0|3,0,0]=4 1086 B15R1.4455 CCCCNc1cccc(c1C(=O)N)C 7a_100102558177_100000210211 [0,1,0,0,0,0|3,0,0]=4 1087 B15R1.4455 CCCCNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000210210 [0,1,0,0,0,0|3,0,0]=4 1088 B15R1.4455 CCCCNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000210211 [0,1,0,0,0,0|3,0,0]=4 1089 B15R1.4455 CCCCNc1cccc(c1C(=O)N)F 27a_100000102301_100011219063 [0,1,0,0,0,0|3,0,0]=4 1090 B15R1.4455 CCCCNc1cccc(c1C(=O)N)F 34a_100000036109_100000210210 [0,1,0,0,0,0|3,0,0]=4 1091 B15R1.4455 CCCCNc1cccc(c1C(=O)N)F 7a_100000036109_100000210211 [0,1,0,0,0,0|3,0,0]=4 1092 B15R1.4455 CCCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000210210 [0,1,0,0,0,0|1,0,0]=2 1093 B15R1.4455 CCCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000210210 [0,1,0,0,0,0|1,0,0]=2 1094 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000210210 [0,1,0,0,0,0|2,0,0]=3 1095 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000210211 [0,1,0,0,0,0|2,0,0]=3 1096 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000210210 [0,1,0,0,0,0|2,0,0]=3 1097 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000210211 [0,1,0,0,0,0|2,0,0]=3 1098 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000210210 [0,1,0,0,0,0|2,0,0]=3 1099 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000210211 [0,1,0,0,0,0|2,0,0]=3 1100 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000210210 [0,1,0,0,0,0|2,0,0]=3 1101 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000210211 [0,1,0,0,0,0|2,0,0]=3 1102 B15R1.4455 CCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000210211 [0,1,0,0,0,0|2,0,0]=3 1103 B15R1.4455 CCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100020643023_100009996538 [0,1,0,0,0,0|3,0,0]=4 1104 B15R1.4455 CCCNCc1cccc(c1[N+](=O)[O-])C 207a_100020643023_100000050834 [0,1,0,0,0,0|3,0,0]=4 1105 B15R1.4455 CCCNCc1cccc(c1[N+](=O)[O-])C 270004a_100020643023_100000050834 [0,1,0,0,0,0|3,0,0]=4 1106 B15R1.4455 CCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100020643023_100000050954 [0,1,0,0,0,0|3,0,0]=4 1107 B15R1.4455 CCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100020643023_100000102507 [0,1,0,0,0,0|3,0,0]=4 1108 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])Br 34a_100000210258_100010145487 [0,1,0,0,0,0|3,0,0]=4 1109 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])Br 7a_100010147062_100000210303 [0,1,0,0,0,0|3,0,0]=4 1110 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])C 34a_100000032366_100000210303 [0,1,0,0,0,0|3,0,0]=4 1111 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])C 34a_100000210258_100010188692 [0,1,0,0,0,0|3,0,0]=4 1112 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])C 7a_100000032366_100000210303 [0,1,0,0,0,0|3,0,0]=4 1113 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100000210258_100009990124 [0,1,0,0,0,0|3,0,0]=4 1114 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])Cl 7a_100000067488_100000210303 [0,1,0,0,0,0|3,0,0]=4 1115 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])F 34a_100009840826_100000210303 [0,1,0,0,0,0|3,0,0]=4 1116 B15R1.4455 CCCOCc1cccc(c1[N+](=O)[O-])F 7a_100009840826_100000210303 [0,1,0,0,0,0|3,0,0]=4 1117 B15R1.4455 CCCSCc1cccc(c1[N+](=O)[O-])Br 62a_100010145487_100000210303 [0,1,0,0,0,0|3,0,0]=4 1118 B15R1.4455 CCCSCc1cccc(c1[N+](=O)[O-])C 62a_100000210303_100010188692 [0,1,0,0,0,0|3,0,0]=4 1119 B15R1.4455 COCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100011201679 [0,1,0,0,0,0|2,0,0]=3 1120 B15R1.4455 COCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100011201679 [0,1,0,0,0,0|2,0,0]=3 1121 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100011201679 [0,1,0,0,0,0|3,0,0]=4 1122 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000233755 [0,1,0,0,0,0|3,0,0]=4 1123 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100011201679 [0,1,0,0,0,0|3,0,0]=4 1124 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000233755 [0,1,0,0,0,0|3,0,0]=4 1125 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100011201679 [0,1,0,0,0,0|3,0,0]=4 1126 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000233755 [0,1,0,0,0,0|3,0,0]=4 1127 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100011201679 [0,1,0,0,0,0|3,0,0]=4 1128 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000233755 [0,1,0,0,0,0|3,0,0]=4 1129 B15R1.4455 COCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000233755 [0,1,0,0,0,0|3,0,0]=4 1130 B15R1.4455 CSCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000212216 [0,1,0,0,0,0|2,0,0]=3 1131 B15R1.4455 CSCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000212216 [0,1,0,0,0,0|2,0,0]=3 1132 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000212216 [0,1,0,0,0,0|3,0,0]=4 1133 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000212216 [0,1,0,0,0,0|3,0,0]=4 1134 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000212216 [0,1,0,0,0,0|3,0,0]=4 1135 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000212216 [0,1,0,0,0,0|3,0,0]=4 1136 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000212216 [0,1,0,0,0,0|3,0,0]=4 1137 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000212216 [0,1,0,0,0,0|3,0,0]=4 1138 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000212216 [0,1,0,0,0,0|3,0,0]=4 1139 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000212216 [0,1,0,0,0,0|3,0,0]=4 1140 B15R1.4455 CSCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000212216 [0,1,0,0,0,0|3,0,0]=4 1141 B15R1.4455 Cc1cccc(c1C(=O)N)NCCCF 34a_100102558177_100011934791 [0,1,0,0,0,0|3,0,0]=4 1142 B15R1.4455 Cc1cccc(c1C(=O)N)NCCCF 7a_100102558177_100011934791 [0,1,0,0,0,0|3,0,0]=4 1143 B15R1.4455 Cc1cccc(c1C(=O)N)NCCCO 34a_100102558177_100000230001 [0,1,0,0,0,0|3,0,0]=4 1144 B15R1.4455 Cc1cccc(c1C(=O)N)NCCCO 7a_100102558177_100011215043 [0,1,0,0,0,0|3,0,0]=4 1145 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CNCCF 34a_100000724931_100010188692 [0,1,0,0,0,0|3,0,0]=4 1146 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CNCCO 207a_100000210304_100000050834 [0,1,0,0,0,0|3,0,0]=4 1147 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CNCCO 2230a_100016997473_100010188692 [0,1,0,0,0,0|3,0,0]=4 1148 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CNCCO 270004a_100000210304_100000050834 [0,1,0,0,0,0|3,0,0]=4 1149 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CNCCO 34a_100016990907_100010188692 [0,1,0,0,0,0|3,0,0]=4 1150 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCBr 34a_100000211926_100010188692 [0,1,0,0,0,0|3,0,0]=4 1151 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCF 34a_100000032366_100011217306 [0,1,0,0,0,0|3,0,0]=4 1152 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCF 7a_100000032366_100011217306 [0,1,0,0,0,0|3,0,0]=4 1153 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCN 34a_100000210304_100010188692 [0,1,0,0,0,0|2,0,0]=3 1154 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCO 34a_100000032366_100000211926 [0,1,0,0,0,0|3,0,0]=4 1155 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])COCCO 7a_100000032366_100000211926 [0,1,0,0,0,0|3,0,0]=4 1156 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CSCCF 62a_100011217306_100010188692 [0,1,0,0,0,0|3,0,0]=4 1157 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])CSCCO 62a_100000211926_100010188692 [0,1,0,0,0,0|3,0,0]=4 1158 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])NCCCF 34a_100011424894_100011934791 [0,1,0,0,0,0|1,0,0]=2 1159 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])NCCCO 34a_100011424894_100000230001 [0,1,0,0,0,0|1,0,0]=2 1160 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])OCCC#N 7a_100000740142_100000184422 [0,1,0,0,0,0|1,0,2]=4 1161 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])OCCCF 34a_100000740142_100011934791 [0,1,0,0,0,0|2,0,0]=3 1162 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])OCCCF 7a_100000740142_100011934791 [0,1,0,0,0,0|2,0,0]=3 1163 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])OCCCO 34a_100000740142_100000230001 [0,1,0,0,0,0|2,0,0]=3 1164 B15R1.4455 Cc1cccc(c1[N+](=O)[O-])OCCCO 7a_100000740142_100011215043 [0,1,0,0,0,0|2,0,0]=3 1165 B15R1.4455 N#CCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000184422 [0,1,0,0,0,0|1,0,2]=4 1166 B15R1.4455 N#CCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000184422 [0,1,0,0,0,0|1,0,2]=4 1167 B15R1.4455 N#CCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000184422 [0,1,0,0,0,0|1,0,2]=4 1168 B15R1.4455 N#CCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000184422 [0,1,0,0,0,0|1,0,2]=4 1169 B15R1.4455 NC(=O)c1c(cccc1NCCCF)Cl 34a_100000764435_100011934791 [0,1,0,0,0,0|3,0,0]=4 1170 B15R1.4455 NC(=O)c1c(cccc1NCCCF)Cl 7a_100000764435_100011934791 [0,1,0,0,0,0|3,0,0]=4 1171 B15R1.4455 NC(=O)c1c(cccc1NCCCF)F 27a_100015189416_100011219063 [0,1,0,0,0,0|3,0,0]=4 1172 B15R1.4455 NC(=O)c1c(cccc1NCCCF)F 34a_100000036109_100011934791 [0,1,0,0,0,0|3,0,0]=4 1173 B15R1.4455 NC(=O)c1c(cccc1NCCCF)F 7a_100000036109_100011934791 [0,1,0,0,0,0|3,0,0]=4 1174 B15R1.4455 NC(=O)c1c(cccc1NCCCO)Cl 34a_100000764435_100000230001 [0,1,0,0,0,0|3,0,0]=4 1175 B15R1.4455 NC(=O)c1c(cccc1NCCCO)Cl 7a_100000764435_100011215043 [0,1,0,0,0,0|3,0,0]=4 1176 B15R1.4455 NC(=O)c1c(cccc1NCCCO)F 27a_100000182051_100011219063 [0,1,0,0,0,0|3,0,0]=4 1177 B15R1.4455 NC(=O)c1c(cccc1NCCCO)F 34a_100000036109_100000230001 [0,1,0,0,0,0|3,0,0]=4 1178 B15R1.4455 NC(=O)c1c(cccc1NCCCO)F 7a_100000036109_100011215043 [0,1,0,0,0,0|3,0,0]=4 1179 B15R1.4455 NCCOCc1cccc(c1[N+](=O)[O-])Br 34a_100000210304_100010145487 [0,1,0,0,0,0|2,0,0]=3 1180 B15R1.4455 NCCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100000210304_100009990124 [0,1,0,0,0,0|2,0,0]=3 1181 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCF)Br 34a_100000724931_100010145487 [0,1,0,0,0,0|3,0,0]=4 1182 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCF)Cl 34a_100000724931_100009990124 [0,1,0,0,0,0|3,0,0]=4 1183 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Br 2230a_100016997473_100010145487 [0,1,0,0,0,0|3,0,0]=4 1184 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Br 270004a_100000210304_100009996538 [0,1,0,0,0,0|3,0,0]=4 1185 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Br 34a_100016990907_100010145487 [0,1,0,0,0,0|3,0,0]=4 1186 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Cl 2230a_100016997473_100009990124 [0,1,0,0,0,0|3,0,0]=4 1187 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Cl 270004a_100000210304_100000050954 [0,1,0,0,0,0|3,0,0]=4 1188 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)Cl 34a_100016990907_100009990124 [0,1,0,0,0,0|3,0,0]=4 1189 B15R1.4455 O=[N+]([O-])c1c(cccc1CNCCO)F 270004a_100000210304_100000102507 [0,1,0,0,0,0|3,0,0]=4 1190 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCBr)Br 34a_100000211926_100010145487 [0,1,0,0,0,0|3,0,0]=4 1191 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCBr)Cl 34a_100000211926_100009990124 [0,1,0,0,0,0|3,0,0]=4 1192 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCF)Br 7a_100010147062_100011217306 [0,1,0,0,0,0|3,0,0]=4 1193 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCF)Cl 7a_100000067488_100011217306 [0,1,0,0,0,0|3,0,0]=4 1194 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCF)F 34a_100009840826_100011217306 [0,1,0,0,0,0|3,0,0]=4 1195 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCF)F 7a_100009840826_100011217306 [0,1,0,0,0,0|3,0,0]=4 1196 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCO)Br 7a_100010147062_100000211926 [0,1,0,0,0,0|3,0,0]=4 1197 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCO)Cl 7a_100000067488_100000211926 [0,1,0,0,0,0|3,0,0]=4 1198 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCO)F 34a_100009840826_100000211926 [0,1,0,0,0,0|3,0,0]=4 1199 B15R1.4455 O=[N+]([O-])c1c(cccc1COCCO)F 7a_100009840826_100000211926 [0,1,0,0,0,0|3,0,0]=4 1200 B15R1.4455 O=[N+]([O-])c1c(cccc1CSCCF)Br 62a_100010145487_100011217306 [0,1,0,0,0,0|3,0,0]=4 1201 B15R1.4455 O=[N+]([O-])c1c(cccc1CSCCO)Br 62a_100010145487_100000211926 [0,1,0,0,0,0|3,0,0]=4 1202 B15R1.4455 O=[N+]([O-])c1c(cccc1NCCCF)F 34a_100011219493_100011934791 [0,1,0,0,0,0|1,0,0]=2 1203 B15R1.4455 O=[N+]([O-])c1c(cccc1NCCCO)F 34a_100011219493_100000230001 [0,1,0,0,0,0|1,0,0]=2 1204 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)Br 34a_100011934925_100011934791 [0,1,0,0,0,0|2,0,0]=3 1205 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)Br 7a_100011934925_100011934791 [0,1,0,0,0,0|2,0,0]=3 1206 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)Cl 34a_100011999376_100011934791 [0,1,0,0,0,0|2,0,0]=3 1207 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)Cl 7a_100011999376_100011934791 [0,1,0,0,0,0|2,0,0]=3 1208 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)F 34a_100011217962_100011934791 [0,1,0,0,0,0|2,0,0]=3 1209 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)F 7a_100011217962_100011934791 [0,1,0,0,0,0|2,0,0]=3 1210 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCF)I 7a_100010150324_100011934791 [0,1,0,0,0,0|2,0,0]=3 1211 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)Br 34a_100011934925_100000230001 [0,1,0,0,0,0|2,0,0]=3 1212 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)Br 7a_100011934925_100011215043 [0,1,0,0,0,0|2,0,0]=3 1213 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)Cl 34a_100011999376_100000230001 [0,1,0,0,0,0|2,0,0]=3 1214 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)Cl 7a_100011999376_100011215043 [0,1,0,0,0,0|2,0,0]=3 1215 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)F 34a_100011217962_100000230001 [0,1,0,0,0,0|2,0,0]=3 1216 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)F 7a_100011217962_100011215043 [0,1,0,0,0,0|2,0,0]=3 1217 B15R1.4455 O=[N+]([O-])c1c(cccc1OCCCO)I 7a_100010150324_100011215043 [0,1,0,0,0,0|2,0,0]=3 1218 B15R1.8882 C=C(C)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000730704 [0,1,0,0,0,0|2,0,1]=4 1219 B15R1.8882 C=C(C)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000730704 [0,1,0,0,0,0|2,0,1]=4 1220 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000070787_100000741959 [0,1,0,0,0,0|2,0,1]=4 1221 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_200000210301 [0,1,0,0,0,0|2,0,1]=4 1222 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000053229 [0,1,0,0,0,0|2,0,1]=4 1223 B15R1.8882 CC(Br)COCc1ccccc1[N+](=O)[O-] 34a_100012180447_100000181388 [0,1,0,0,0,0|3,0,0]=4 1224 B15R1.8882 CC(C)C=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000210432 [0,1,0,0,0,0|2,0,1]=4 1225 B15R1.8882 CC(C)CCNc1ccccc1C(=O)N 34a_100000185089_100000210312 [0,1,0,0,0,0|3,0,0]=4 1226 B15R1.8882 CC(C)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210626 [0,1,0,0,0,0|3,0,0]=4 1227 B15R1.8882 CC(C)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210312 [0,1,0,0,0,0|2,0,0]=3 1228 B15R1.8882 CC(C)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210626 [0,1,0,0,0,0|2,0,0]=3 1229 B15R1.8882 CC(C)CCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210626 [0,1,0,0,0,0|3,0,0]=4 1230 B15R1.8882 CC(C)CNCc1ccccc1[N+](=O)[O-] 2230a_100000210953_100000181388 [0,1,0,0,0,0|3,0,0]=4 1231 B15R1.8882 CC(C)CNCc1ccccc1[N+](=O)[O-] 270004a_100000210953_100000186027 [0,1,0,0,0,0|3,0,0]=4 1232 B15R1.8882 CC(C)CNCc1ccccc1[N+](=O)[O-] 270004a_100000740939_100000210432 [0,1,0,0,0,0|3,0,0]=4 1233 B15R1.8882 CC(C)CNCc1ccccc1[N+](=O)[O-] 34a_100000210953_100000181388 [0,1,0,0,0,0|3,0,0]=4 1234 B15R1.8882 CC(C)COCc1ccccc1[N+](=O)[O-] 34a_100000210257_100000181388 [0,1,0,0,0,0|3,0,0]=4 1235 B15R1.8882 CC(C)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210760 [0,1,0,0,0,0|3,0,0]=4 1236 B15R1.8882 CC(C)CSCc1ccccc1[N+](=O)[O-] 62a_100000210624_100000181388 [0,1,0,0,0,0|3,0,0]=4 1237 B15R1.8882 CC(C)NCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210206 [0,1,0,0,0,0|3,0,0]=4 1238 B15R1.8882 CC(C)NCCc1ccccc1[N+](=O)[O-] 2230a_100138425928_200011934512 [0,1,0,0,0,0|3,0,0]=4 1239 B15R1.8882 CC(C)NCCc1ccccc1[N+](=O)[O-] 34a_100138425928_200011934512 [0,1,0,0,0,0|3,0,0]=4 1240 B15R1.8882 CC(C)OCCc1ccccc1[N+](=O)[O-] 34a_100000212225_200011934512 [0,1,0,0,0,0|3,0,0]=4 1241 B15R1.8882 CC(C)OCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000210206 [0,1,0,0,0,0|3,0,0]=4 1242 B15R1.8882 CC(C)OCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000210206 [0,1,0,0,0,0|3,0,0]=4 1243 B15R1.8882 CC(C)OCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000709892 [0,1,0,0,0,0|3,0,0]=4 1244 B15R1.8882 CC(F)COCc1ccccc1[N+](=O)[O-] 34a_100015925927_100000181388 [0,1,0,0,0,0|3,0,0]=4 1245 B15R1.8882 CC(O)CCNc1ccccc1C(=O)N 34a_100000185089_100012276601 [0,1,0,0,0,0|3,0,0]=4 1246 B15R1.8882 CC(O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100012276601 [0,1,0,0,0,0|3,0,0]=4 1247 B15R1.8882 CC(O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100012276601 [0,1,0,0,0,0|2,0,0]=3 1248 B15R1.8882 CC(O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100012276601 [0,1,0,0,0,0|2,0,0]=3 1249 B15R1.8882 CC(O)CCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100012276601 [0,1,0,0,0,0|3,0,0]=4 1250 B15R1.8882 CC(O)CNCc1ccccc1[N+](=O)[O-] 2230a_100000210904_100000181388 [0,1,0,0,0,0|3,0,0]=4 1251 B15R1.8882 CC(O)CNCc1ccccc1[N+](=O)[O-] 270004a_100000210904_100000186027 [0,1,0,0,0,0|3,0,0]=4 1252 B15R1.8882 CC(O)CNCc1ccccc1[N+](=O)[O-] 34a_100000210904_100000181388 [0,1,0,0,0,0|3,0,0]=4 1253 B15R1.8882 CC(O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100011218427 [0,1,0,0,0,0|3,0,0]=4 1254 B15R1.8882 CC(O)CSCc1ccccc1[N+](=O)[O-] 62a_100011218427_100000181388 [0,1,0,0,0,0|3,0,0]=4 1255 B15R1.8882 CN(C)CCOc1ccccc1[N+](=O)[O-] 2230a_100102631434_100000741959 [0,1,0,0,0,0|3,0,0]=4 1256 B15R1.8882 CN(C)CCOc1ccccc1[N+](=O)[O-] 269982a_100102631434_100000741959 [0,1,0,0,0,0|3,0,0]=4 1257 B15R1.8882 CN(C)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000755713 [0,1,0,0,0,0|3,0,0]=4 1258 B15R1.8882 C[C@@H](Cl)COCc1ccccc1[N+](=O)[O-] 34a_100016084084_100000181388 [0,1,0,0,0,0|3,0,0]=4 1259 B15R1.8882 C[C@@H](N)COCc1ccccc1[N+](=O)[O-] 34a_100000737577_100000181388 [0,1,0,0,0,0|2,0,0]=3 1260 B15R1.8882 C[C@@H](O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100009817552 [0,1,0,0,0,0|3,0,0]=4 1261 B15R1.8882 C[C@@H](O)CSCc1ccccc1[N+](=O)[O-] 62a_100009817552_100000181388 [0,1,0,0,0,0|3,0,0]=4 1262 B15R1.8882 NC(=O)CCNc1ccccc1C(=O)N 34a_100000185089_100000731001 [0,1,0,0,0,0|2,0,1]=4 1263 B15R1.8882 NC(=O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000744528 [0,1,0,0,0,0|2,0,1]=4 1264 B15R1.8882 NC(=O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000731001 [0,1,0,0,0,0|1,0,1]=3 1265 B15R1.8882 NC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000744528 [0,1,0,0,0,0|1,0,1]=3 1266 B15R1.8882 NC(=O)CCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000744528 [0,1,0,0,0,0|2,0,1]=4 1267 B15R1.8882 NC(=O)CNCc1ccccc1[N+](=O)[O-] 2230a_100000711301_100000181388 [0,1,0,0,0,0|2,0,1]=4 1268 B15R1.8882 NC(=O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000187820 [0,1,0,0,0,0|2,0,1]=4 1269 B15R1.8882 NC(=O)CSCc1ccccc1[N+](=O)[O-] 62a_100000747473_100000181388 [0,1,0,0,0,0|2,0,1]=4 1270 B15R1.8882 O=[N+]([O-])c1ccccc1CNCC(F)F 270004a_100000765723_100000186027 [0,1,0,0,0,0|3,0,0]=4 1271 B15R1.8882 O=[N+]([O-])c1ccccc1CNCC(F)F 34a_100000765723_100000181388 [0,1,0,0,0,0|3,0,0]=4 1272 B15R1.8882 O=[N+]([O-])c1ccccc1COCC(F)F 34a_100000743014_100000181388 [0,1,0,0,0,0|3,0,0]=4 1273 B15R1.8882 O=[N+]([O-])c1ccccc1COCC(F)F 7a_100011218404_100011934356 [0,1,0,0,0,0|3,0,0]=4 1274 B15R1.8882 O=[N+]([O-])c1ccccc1CSCC(F)F 62a_100011934356_100000181388 [0,1,0,0,0,0|3,0,0]=4 1275 B15R1.8882 [13CH3]C(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_200025704644 [0,1,0,0,0,0|2,0,1]=4 1276 B15R2.1221 CC(=O)c1ccccc1N2CCCC2 1458a_100025719298_200000210301 [0,0,0,1,0,0|3,0,0]=4 1277 B15R2.1221 [13CH3]C(=O)c1ccccc1N2CCCC2 1458a_100025719298_200025704644 [0,0,0,1,0,0|3,0,0]=4 1278 B15R2.16319 NC(=O)c1ccccc1NCC2CC2 34a_100000185089_100000742324 [0,0,0,1,0,0|3,0,0]=4 1279 B15R2.16319 NC(=O)c1ccccc1NCC2CO2 34a_100000185089_102125554688 [0,0,0,1,0,0|3,0,0]=4 1280 B15R2.16319 O=C([O-])c1ccccc1OCC2CC2 7a_100015234032_100000742324 [0,0,0,1,0,0|3,0,0]=4 1281 B15R2.16319 O=C([O-])c1ccccc1OCC2CO2 7a_100015234032_102125554688 [0,0,0,1,0,0|3,0,0]=4 1282 B15R2.16319 O=C([O-])c1ccccc1OCC2CS2 7a_100015234032_100000031435 [0,0,0,1,0,0|3,0,0]=4 1283 B15R2.16319 O=C([O-])c1ccccc1OC[C@@H]2CO2 7a_100015234032_100000745022 [0,0,0,1,0,0|3,0,0]=4 1284 B15R2.16319 O=[N+]([O-])c1ccccc1CNC2CC2 34a_100000212008_100000181388 [0,0,0,1,0,0|3,0,0]=4 1285 B15R2.16319 O=[N+]([O-])c1ccccc1OCC2CC2 34a_100000186319_100000742324 [0,0,0,1,0,0|2,0,0]=3 1286 B15R2.16319 O=[N+]([O-])c1ccccc1OCC2CC2 7a_100000186319_100000742324 [0,0,0,1,0,0|2,0,0]=3 1287 B15R2.16319 O=[N+]([O-])c1ccccc1OCC2CO2 34a_100000186319_102125554688 [0,0,0,1,0,0|2,0,0]=3 1288 B15R2.16319 O=[N+]([O-])c1ccccc1OCC2CO2 7a_100000186319_102125554688 [0,0,0,1,0,0|2,0,0]=3 1289 B15R2.16319 O=[N+]([O-])c1ccccc1OCC2CS2 7a_100000186319_100000031435 [0,0,0,1,0,0|2,0,0]=3 1290 B15R2.16319 O=[N+]([O-])c1ccccc1OC[C@@H]2CO2 7a_100000186319_100000745022 [0,0,0,1,0,0|2,0,0]=3 1291 B15R2.16319 O=[N+]([O-])c1ncccc1OCC2CC2 7a_100000183951_100000742324 [0,0,0,1,0,0|3,0,0]=4 1292 B15R2.16319 O=[N+]([O-])c1ncccc1OCC2CO2 7a_100000183951_102125554688 [0,0,0,1,0,0|3,0,0]=4 1293 B15R2.16319 O=[N+]([O-])c1ncccc1OCC2CS2 7a_100000183951_100000031435 [0,0,0,1,0,0|3,0,0]=4 1294 B15R2.16319 O=[N+]([O-])c1ncccc1OC[C@@H]2CO2 7a_100000183951_100000745022 [0,0,0,1,0,0|3,0,0]=4 1295 B15R2.16320 NC(=O)c1ccccc1NC2CCC2 34a_100000185089_100000749161 [0,0,0,1,0,0|3,0,0]=4 1296 B15R2.16320 O=[N+]([O-])c1ccccc1CN2CCC2 269982a_100000754969_100000181388 [0,0,0,1,0,0|3,0,0]=4 1297 B15R2.16320 O=[N+]([O-])c1ccccc1OC2CCC2 34a_100000186319_100000749161 [0,0,0,1,0,0|2,0,0]=3 1298 B15R2.16320 O=[N+]([O-])c1ccccc1OC2COC2 34a_100000186319_100009818527 [0,0,0,1,0,0|3,0,0]=4 1299 B15R2.16320 O=[N+]([O-])c1ccccc1OC2COC2 7a_100000186319_100009818527 [0,0,0,1,0,0|3,0,0]=4 1300 B15R1.1188 CC(=O)Nc1ccccc1NCCCF 34a_100011193560_100011934791 [0,0,0,0,0,1|3,0,0]=4 1301 B15R1.1188 CC(=O)Nc1ccccc1NCCCO 34a_100011193560_100000230001 [0,0,0,0,0,1|3,0,0]=4 1302 B15R1.1188 CCCCNc1ccccc1NC(=O)C 34a_100011193560_100000210210 [0,0,0,0,0,1|3,0,0]=4 1303 B12R1.121 C#Cc1ccccc1NCCC 34a_100011470550_100000210303 [2,0,0,0,0,0|2,0,0]=4 1304 B12R1.121 C=Cc1ccccc1NCCC 34a_100012022501_100000210303 [2,0,0,0,0,0|2,0,0]=4 1305 B12R1.121 CCCCc1ccccc1C=O 271570a_100020621405_100000211189 [2,0,0,0,0,0|2,0,0]=4 1306 B12R1.121 CCCNc1ccccc1C#N 34a_100000211148_100000210303 [2,0,0,0,0,0|2,0,0]=4 1307 B12R1.121 CCCNc1ccccc1CC 2230a_100000212081_100000210303 [2,0,0,0,0,0|2,0,0]=4 1308 B12R1.121 CCCNc1ccccc1CC 34a_100000212081_100000210303 [2,0,0,0,0,0|2,0,0]=4 1309 B12R1.121 CCCNc1ccccc1CC 7a_100000212081_100000210303 [2,0,0,0,0,0|2,0,0]=4 1310 B12R1.121 CCCNc1ccccc1CO 34a_100000212039_100000210303 [2,0,0,0,0,0|1,0,1]=4 1311 B12R1.121 CCCNc1ccccc1OC 34a_100000210025_100000210303 [2,0,0,0,0,0|2,0,0]=4 1312 B12R1.121 CCCNc1ccccc1SC 34a_100000211160_100000210303 [2,0,0,0,0,0|2,0,0]=4 1313 B12R1.121 CCCSc1ccccc1C=O 62a_100000210073_100000210303 [2,0,0,0,0,0|2,0,0]=4 1314 B12R1.121 CCCSc1ccccc1C=O 62a_100000210303_100000210073 [2,0,0,0,0,0|2,0,0]=4 1315 B12R1.267 CCCCNc1ccccc1Br 34a_100000210017_100000210210 [2,0,0,0,0,0|2,0,0]=4 1316 B12R1.267 CCCCNc1ccccc1C 34a_100015192222_100000210210 [2,0,0,0,0,0|2,0,0]=4 1317 B12R1.267 CCCCNc1ccccc1Cl 34a_100000185783_100000210210 [2,0,0,0,0,0|2,0,0]=4 1318 B12R1.267 CCCCNc1ccccc1F 34a_100000210422_100000210210 [2,0,0,0,0,0|2,0,0]=4 1319 B12R1.267 CCCCNc1ccccc1I 34a_100000210053_100000210210 [2,0,0,0,0,0|2,0,0]=4 1320 B12R1.267 CCCCNc1ccccc1O 34a_100000185747_100000210210 [2,0,0,0,0,0|1,0,1]=4 1321 B12R1.267 Cc1ccccc1NCCCF 34a_100015192222_100011934791 [2,0,0,0,0,0|2,0,0]=4 1322 B12R1.267 Cc1ccccc1NCCCO 34a_100015192222_100000230001 [2,0,0,0,0,0|2,0,0]=4 1323 B12R1.267 FCCCNc1ccccc1Br 34a_100000210017_100011934791 [2,0,0,0,0,0|2,0,0]=4 1324 B12R1.267 FCCCNc1ccccc1Cl 34a_100000185783_100011934791 [2,0,0,0,0,0|2,0,0]=4 1325 B12R1.267 FCCCNc1ccccc1F 34a_100000210422_100011934791 [2,0,0,0,0,0|2,0,0]=4 1326 B12R1.267 FCCCNc1ccccc1I 34a_100000210053_100011934791 [2,0,0,0,0,0|2,0,0]=4 1327 B12R1.267 OCCCNc1ccccc1Br 34a_100000210017_100000230001 [2,0,0,0,0,0|2,0,0]=4 1328 B12R1.267 OCCCNc1ccccc1Cl 34a_100000185783_100000230001 [2,0,0,0,0,0|2,0,0]=4 1329 B12R1.267 OCCCNc1ccccc1F 34a_100000210422_100000230001 [2,0,0,0,0,0|2,0,0]=4 1330 B12R1.267 OCCCNc1ccccc1I 34a_100000210053_100000230001 [2,0,0,0,0,0|2,0,0]=4 1331 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [2,0,0,0,0,0|1,0,1]=4 1332 B12R1.267 Oc1ccccc1NCCCF 34a_100000185747_100011934791 [2,0,0,0,0,0|1,0,1]=4 1333 B12R1.283 CCNc1ccccc1C(=O)N 34a_100000185089_100000210202 [2,0,0,0,0,0|2,0,0]=4 1334 B12R1.283 CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210202 [2,0,0,0,0,0|2,0,0]=4 1335 B12R1.283 CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210202 [2,0,0,0,0,0|1,0,0]=3 1336 B12R1.283 CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210202 [2,0,0,0,0,0|1,0,0]=3 1337 B12R1.283 CCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210202 [2,0,0,0,0,0|2,0,0]=4 1338 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 2230a_106832991635_100000181388 [2,0,0,0,0,0|1,0,0]=3 1339 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 270004a_106832991635_100000186027 [2,0,0,0,0,0|1,0,0]=3 1340 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 34a_100102657272_100000181388 [2,0,0,0,0,0|1,0,0]=3 1341 B12R1.283 CNCc1ccccc1[N+](=O)[O-] 7a_106832991635_100000181388 [2,0,0,0,0,0|1,0,0]=3 1342 B12R1.283 COCc1ccccc1[N+](=O)[O-] 34a_100138415774_100000181388 [2,0,0,0,0,0|1,0,0]=3 1343 B12R1.283 COCc1ccccc1[N+](=O)[O-] 7a_100011218404_200000210301 [2,0,0,0,0,0|1,0,0]=3 1344 B12R1.283 CSCc1ccccc1[N+](=O)[O-] 62a_200000210301_100000181388 [2,0,0,0,0,0|1,0,0]=3 1345 B12R1.283 O=[N+]([O-])c1ccccc1OCF 34a_100000186319_100015361967 [2,0,0,0,0,0|2,0,0]=4 1346 B12R1.283 O=[N+]([O-])c1ccccc1OCF 7a_100000186319_100015361967 [2,0,0,0,0,0|2,0,0]=4 1347 B12R1.283 [13CH3]OCc1ccccc1[N+](=O)[O-] 7a_100011218404_200025704644 [2,0,0,0,0,0|1,0,0]=3 1348 B12R1.283 [13CH3]SCc1ccccc1[N+](=O)[O-] 62a_200025704644_100000181388 [2,0,0,0,0,0|1,0,0]=3 1349 B14R1.476 CCCCNCc1ccccc1C=O 2230a_100000102301_200009853537 [1,1,0,0,0,0|2,0,0]=4 1350 B14R1.476 CCCCNCc1ccccc1C=O 7a_106832991798_200009853537 [1,1,0,0,0,0|2,0,0]=4 1351 B14R1.476 NCCCOCc1ccccc1C=O 34a_100000182051_200009853537 [1,1,0,0,0,0|2,0,0]=4 1352 B14R1.476 NCCOCCc1ccccc1C=O 34a_100000210304_100010186698 [1,1,0,0,0,0|2,0,0]=4 1353 B14R1.476 O=Cc1ccccc1CNCCCF 2230a_100015189416_200009853537 [1,1,0,0,0,0|2,0,0]=4 1354 B14R1.476 O=Cc1ccccc1CNCCCF 34a_100015189416_200009853537 [1,1,0,0,0,0|2,0,0]=4 1355 B14R1.67 C#CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000184674 [1,1,0,0,0,0|0,0,2]=4 1356 B14R1.67 C=CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100015514636 [1,1,0,0,0,0|0,0,2]=4 1357 B14R1.67 CC=NNc1ccc(cc1[N+](=O)[O-])Br 4a_100011218155_200000210099 [1,1,0,0,0,0|1,0,1]=4 1358 B14R1.67 CCCNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000210303 [1,1,0,0,0,0|2,0,0]=4 1359 B14R1.67 CCCNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000210303 [1,1,0,0,0,0|2,0,0]=4 1360 B14R1.67 CCCNc1ccc(cc1C(=O)N)C 34a_100011692829_100000210303 [1,1,0,0,0,0|2,0,0]=4 1361 B14R1.67 CCCNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000210303 [1,1,0,0,0,0|2,0,0]=4 1362 B14R1.67 CCCNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000210303 [1,1,0,0,0,0|2,0,0]=4 1363 B14R1.67 CCCNc1ccc(cc1C(=O)N)F 34a_100000741173_100000210303 [1,1,0,0,0,0|2,0,0]=4 1364 B14R1.67 CCCNc1ccc(cc1C(=O)N)F 7a_100000741173_100000210303 [1,1,0,0,0,0|2,0,0]=4 1365 B14R1.67 CCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000210303 [1,1,0,0,0,0|0,0,0]=2 1366 B14R1.67 CCCOc1cc[n+](cc1[N+](=O)[O-])[O-] 7a_100000047301_100000210303 [1,1,0,0,0,0|2,0,0]=4 1367 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000210303 [1,1,0,0,0,0|1,0,0]=3 1368 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000210303 [1,1,0,0,0,0|1,0,0]=3 1369 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000210303 [1,1,0,0,0,0|1,0,0]=3 1370 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000210303 [1,1,0,0,0,0|1,0,0]=3 1371 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000210303 [1,1,0,0,0,0|1,0,0]=3 1372 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000210303 [1,1,0,0,0,0|1,0,0]=3 1373 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000210303 [1,1,0,0,0,0|1,0,0]=3 1374 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000210303 [1,1,0,0,0,0|1,0,0]=3 1375 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000210303 [1,1,0,0,0,0|1,0,0]=3 1376 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000210303 [1,1,0,0,0,0|1,0,0]=3 1377 B14R1.67 CCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000210303 [1,1,0,0,0,0|1,0,0]=3 1378 B14R1.67 CCCOc1ccc(nc1[N+](=O)[O-])Br 7a_100000684561_100000210303 [1,1,0,0,0,0|2,0,0]=4 1379 B14R1.67 CCCOc1ccc(nc1[N+](=O)[O-])C 7a_100000211580_100000210303 [1,1,0,0,0,0|2,0,0]=4 1380 B14R1.67 CCCOc1ccc(nc1[N+](=O)[O-])Cl 7a_100000094143_100000210303 [1,1,0,0,0,0|2,0,0]=4 1381 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])Br 2230a_100015525214_100012353686 [1,1,0,0,0,0|2,0,0]=4 1382 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])C 207a_100015525214_100000050315 [1,1,0,0,0,0|2,0,0]=4 1383 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])C 2230a_100015525214_200009879986 [1,1,0,0,0,0|2,0,0]=4 1384 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])Cl 2230a_100015525214_100000748067 [1,1,0,0,0,0|2,0,0]=4 1385 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])F 2230a_100015525214_100012145688 [1,1,0,0,0,0|2,0,0]=4 1386 B14R1.67 CCNCc1ccc(cc1[N+](=O)[O-])I 2230a_100015525214_200010171343 [1,1,0,0,0,0|2,0,0]=4 1387 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100121572206_100012353686 [1,1,0,0,0,0|2,0,0]=4 1388 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])Br 7a_100012353685_100000210202 [1,1,0,0,0,0|2,0,0]=4 1389 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])C 34a_100121572206_200009879986 [1,1,0,0,0,0|2,0,0]=4 1390 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])C 7a_100000087798_100000210202 [1,1,0,0,0,0|2,0,0]=4 1391 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100121572206_100000748067 [1,1,0,0,0,0|2,0,0]=4 1392 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])Cl 7a_100011219603_100000210202 [1,1,0,0,0,0|2,0,0]=4 1393 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000085351_100000210202 [1,1,0,0,0,0|2,0,0]=4 1394 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])F 34a_100121572206_100012145688 [1,1,0,0,0,0|2,0,0]=4 1395 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])F 7a_100000085351_100000210202 [1,1,0,0,0,0|2,0,0]=4 1396 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])I 34a_100121572206_200010171343 [1,1,0,0,0,0|2,0,0]=4 1397 B14R1.67 CCOCc1ccc(cc1[N+](=O)[O-])I 7a_200000049922_100000210202 [1,1,0,0,0,0|2,0,0]=4 1398 B14R1.67 CCSCc1ccc(cc1[N+](=O)[O-])Br 62a_100012353686_100000210202 [1,1,0,0,0,0|2,0,0]=4 1399 B14R1.67 CCSCc1ccc(cc1[N+](=O)[O-])F 62a_100012145688_100000210202 [1,1,0,0,0,0|2,0,0]=4 1400 B14R1.67 CCSCc1ccc(cc1[N+](=O)[O-])I 62a_200010171343_100000210202 [1,1,0,0,0,0|2,0,0]=4 1401 B14R1.67 CSCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100011218213 [1,1,0,0,0,0|1,0,0]=3 1402 B14R1.67 CSCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100011218213 [1,1,0,0,0,0|2,0,0]=4 1403 B14R1.67 CSCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100011218213 [1,1,0,0,0,0|2,0,0]=4 1404 B14R1.67 CSCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100011218213 [1,1,0,0,0,0|2,0,0]=4 1405 B14R1.67 CSCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100011218213 [1,1,0,0,0,0|2,0,0]=4 1406 B14R1.67 CSCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100011218213 [1,1,0,0,0,0|2,0,0]=4 1407 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])COCF 7a_100000087798_100015361967 [1,1,0,0,0,0|2,0,0]=4 1408 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCCF 34a_100000195567_100011217306 [1,1,0,0,0,0|2,0,0]=4 1409 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCCF 7a_100000195567_100011217306 [1,1,0,0,0,0|2,0,0]=4 1410 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCCO 34a_100000195567_100000211926 [1,1,0,0,0,0|2,0,0]=4 1411 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCCO 7a_100000195567_100000211926 [1,1,0,0,0,0|2,0,0]=4 1412 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCCF 34a_100000032192_100011217306 [1,1,0,0,0,0|2,0,0]=4 1413 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCCF 7a_100000032192_100011217306 [1,1,0,0,0,0|2,0,0]=4 1414 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCCO 34a_100000032192_100000211926 [1,1,0,0,0,0|2,0,0]=4 1415 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCCO 7a_100000032192_100000211926 [1,1,0,0,0,0|2,0,0]=4 1416 B14R1.67 O=CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_200009817547 [1,1,0,0,0,0|1,0,1]=4 1417 B14R1.67 O=[N+]([O-])c1cc(ccc1COCF)Br 7a_100012353685_100015361967 [1,1,0,0,0,0|2,0,0]=4 1418 B14R1.67 O=[N+]([O-])c1cc(ccc1COCF)Cl 7a_100011219603_100015361967 [1,1,0,0,0,0|2,0,0]=4 1419 B14R1.67 O=[N+]([O-])c1cc(ccc1COCF)F 34a_100000085351_100015361967 [1,1,0,0,0,0|2,0,0]=4 1420 B14R1.67 O=[N+]([O-])c1cc(ccc1COCF)F 7a_100000085351_100015361967 [1,1,0,0,0,0|2,0,0]=4 1421 B14R1.67 O=[N+]([O-])c1cc(ccc1COCF)I 7a_200000049922_100015361967 [1,1,0,0,0,0|2,0,0]=4 1422 B14R1.67 O=[N+]([O-])c1cc(ccc1CSCF)Br 62a_100012353686_100015361967 [1,1,0,0,0,0|2,0,0]=4 1423 B14R1.67 O=[N+]([O-])c1cc(ccc1CSCF)F 62a_100012145688_100015361967 [1,1,0,0,0,0|2,0,0]=4 1424 B14R1.67 O=[N+]([O-])c1cc(ccc1CSCF)I 62a_200010171343_100015361967 [1,1,0,0,0,0|2,0,0]=4 1425 B14R1.67 O=[N+]([O-])c1cc(ccc1NCCF)F 34a_100000187532_100011217306 [1,1,0,0,0,0|1,0,0]=3 1426 B14R1.67 O=[N+]([O-])c1cc(ccc1NCCO)F 34a_100000187532_100000211926 [1,1,0,0,0,0|1,0,0]=3 1427 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)Br 34a_100000757407_100011217306 [1,1,0,0,0,0|2,0,0]=4 1428 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)Br 7a_100000757407_100011217306 [1,1,0,0,0,0|2,0,0]=4 1429 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)Cl 34a_100000212152_100011217306 [1,1,0,0,0,0|2,0,0]=4 1430 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)Cl 7a_100000212152_100011217306 [1,1,0,0,0,0|2,0,0]=4 1431 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)F 34a_100000748789_100011217306 [1,1,0,0,0,0|2,0,0]=4 1432 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)F 7a_100000748789_100011217306 [1,1,0,0,0,0|2,0,0]=4 1433 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCF)I 7a_100000698543_100011217306 [1,1,0,0,0,0|2,0,0]=4 1434 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)Br 34a_100000757407_100000211926 [1,1,0,0,0,0|2,0,0]=4 1435 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)Br 7a_100000757407_100000211926 [1,1,0,0,0,0|2,0,0]=4 1436 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)Cl 34a_100000212152_100000211926 [1,1,0,0,0,0|2,0,0]=4 1437 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)Cl 7a_100000212152_100000211926 [1,1,0,0,0,0|2,0,0]=4 1438 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)F 34a_100000748789_100000211926 [1,1,0,0,0,0|2,0,0]=4 1439 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)F 7a_100000748789_100000211926 [1,1,0,0,0,0|2,0,0]=4 1440 B14R1.67 O=[N+]([O-])c1cc(ccc1OCCO)I 7a_100000698543_100000211926 [1,1,0,0,0,0|2,0,0]=4 1441 B14R1.623 C#CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000038162 [1,1,0,0,0,0|0,0,2]=4 1442 B14R1.623 C=CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210623 [1,1,0,0,0,0|0,0,2]=4 1443 B14R1.623 C=CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210623 [1,1,0,0,0,0|0,0,2]=4 1444 B14R1.623 CC(OCF)c1ccccc1[N+](=O)[O-] 7a_100000246502_100015361967 [1,1,0,0,0,0|2,0,0]=4 1445 B14R1.623 CCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210303 [1,1,0,0,0,0|1,0,0]=3 1446 B14R1.623 CCCN(C)c1ccccc1C(=O)N 269982a_100000184419_100000210303 [1,1,0,0,0,0|2,0,0]=4 1447 B14R1.623 CCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210303 [1,1,0,0,0,0|0,0,0]=2 1448 B14R1.623 CCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210303 [1,1,0,0,0,0|0,0,0]=2 1449 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100015525214_100000188706 [1,1,0,0,0,0|2,0,0]=4 1450 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100015525214_100000188706 [1,1,0,0,0,0|2,0,0]=4 1451 B14R1.623 CCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100015525214_100000188706 [1,1,0,0,0,0|2,0,0]=4 1452 B14R1.623 CCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000210202 [1,1,0,0,0,0|2,0,0]=4 1453 B14R1.623 CCOC(C)c1ccccc1[N+](=O)[O-] 7a_100000246502_100000210202 [1,1,0,0,0,0|2,0,0]=4 1454 B14R1.623 CN(CC#N)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011215382 [1,1,0,0,0,0|0,0,2]=4 1455 B14R1.623 CN(CC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011214920 [1,1,0,0,0,0|0,0,2]=4 1456 B14R1.623 CN(CC=O)c1ccccc1[N+](=O)[O-] 2230a_100000156515_200015260668 [1,1,0,0,0,0|1,0,1]=4 1457 B14R1.623 CN(CC=O)c1ccccc1[N+](=O)[O-] 269982a_100000156515_200015260668 [1,1,0,0,0,0|1,0,1]=4 1458 B14R1.623 CN(CCF)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011217306 [1,1,0,0,0,0|1,0,0]=3 1459 B14R1.623 CN(CCF)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011217306 [1,1,0,0,0,0|1,0,0]=3 1460 B14R1.623 CN(CCO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000211926 [1,1,0,0,0,0|1,0,0]=3 1461 B14R1.623 CN(CCO)c1ccccc1[N+](=O)[O-] 269982a_100000156373_200000210301 [1,1,0,0,0,0|1,0,0]=3 1462 B14R1.623 CN(CCO)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000211926 [1,1,0,0,0,0|1,0,0]=3 1463 B14R1.623 CNCC(=O)c1ccccc1[N+](=O)[O-] 2230a_106832991635_100011219728 [1,1,0,0,0,0|2,0,0]=4 1464 B14R1.623 CNCC(=O)c1ccccc1[N+](=O)[O-] 7a_106832991635_100011219728 [1,1,0,0,0,0|2,0,0]=4 1465 B14R1.623 COCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000766300 [1,1,0,0,0,0|1,0,0]=3 1466 B14R1.623 COCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000766300 [1,1,0,0,0,0|1,0,0]=3 1467 B14R1.623 CSCC(=O)c1ccccc1[N+](=O)[O-] 62a_100011219728_200000210301 [1,1,0,0,0,0|2,0,0]=4 1468 B14R1.623 CSCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011218213 [1,1,0,0,0,0|1,0,0]=3 1469 B14R1.623 CSCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011218213 [1,1,0,0,0,0|1,0,0]=3 1470 B14R1.623 O=C(CCF)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011217306 [1,1,0,0,0,0|1,0,1]=4 1471 B14R1.623 O=C(CCO)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000211926 [1,1,0,0,0,0|1,0,1]=4 1472 B14R1.623 [13CH3]N(CCO)c1ccccc1[N+](=O)[O-] 269982a_100000156373_200025704644 [1,1,0,0,0,0|1,0,0]=3 1473 B14R1.623 [13CH3]SCC(=O)c1ccccc1[N+](=O)[O-] 62a_100011219728_200025704644 [1,1,0,0,0,0|2,0,0]=4 1474 B14R1.760 C#CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000184674 [1,1,0,0,0,0|0,0,2]=4 1475 B14R1.760 C=CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100015514636 [1,1,0,0,0,0|0,0,2]=4 1476 B14R1.760 CCCNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000210303 [1,1,0,0,0,0|2,0,0]=4 1477 B14R1.760 CCCNc1cc(ccc1C(=O)N)C 34a_100011219537_100000210303 [1,1,0,0,0,0|2,0,0]=4 1478 B14R1.760 CCCNc1cc(ccc1C(=O)N)C 7a_100011219537_100000210303 [1,1,0,0,0,0|2,0,0]=4 1479 B14R1.760 CCCNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000210303 [1,1,0,0,0,0|2,0,0]=4 1480 B14R1.760 CCCNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000210303 [1,1,0,0,0,0|2,0,0]=4 1481 B14R1.760 CCCNc1cc(ccc1C(=O)N)F 34a_100011298637_100000210303 [1,1,0,0,0,0|2,0,0]=4 1482 B14R1.760 CCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000210303 [1,1,0,0,0,0|0,0,0]=2 1483 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000210303 [1,1,0,0,0,0|1,0,0]=3 1484 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000210303 [1,1,0,0,0,0|1,0,0]=3 1485 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000210303 [1,1,0,0,0,0|1,0,0]=3 1486 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000210303 [1,1,0,0,0,0|1,0,0]=3 1487 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000210303 [1,1,0,0,0,0|1,0,0]=3 1488 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000210303 [1,1,0,0,0,0|1,0,0]=3 1489 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000210303 [1,1,0,0,0,0|1,0,0]=3 1490 B14R1.760 CCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000210303 [1,1,0,0,0,0|1,0,0]=3 1491 B14R1.760 CCCOc1cc(cnc1[N+](=O)[O-])Br 7a_100010201919_100000210303 [1,1,0,0,0,0|2,0,0]=4 1492 B14R1.760 CCCOc1cc(cnc1[N+](=O)[O-])Cl 7a_100009862519_100000210303 [1,1,0,0,0,0|2,0,0]=4 1493 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])Br 2230a_100015525214_100010245524 [1,1,0,0,0,0|2,0,0]=4 1494 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100015525214_100000692607 [1,1,0,0,0,0|2,0,0]=4 1495 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])C 207a_100015525214_100000050452 [1,1,0,0,0,0|2,0,0]=4 1496 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])C 2230a_100015525214_200000039114 [1,1,0,0,0,0|2,0,0]=4 1497 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100015525214_100000050452 [1,1,0,0,0,0|2,0,0]=4 1498 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])Cl 2230a_100015525214_100000765840 [1,1,0,0,0,0|2,0,0]=4 1499 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100015525214_100000758460 [1,1,0,0,0,0|2,0,0]=4 1500 B14R1.760 CCNCc1cc(ccc1[N+](=O)[O-])F 2230a_100015525214_100000740372 [1,1,0,0,0,0|2,0,0]=4 1501 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100121572206_100010245524 [1,1,0,0,0,0|2,0,0]=4 1502 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])Br 7a_100012361455_100000210202 [1,1,0,0,0,0|2,0,0]=4 1503 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])C 34a_100121572206_200000039114 [1,1,0,0,0,0|2,0,0]=4 1504 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])C 7a_100000038506_100000210202 [1,1,0,0,0,0|2,0,0]=4 1505 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100121572206_100000765840 [1,1,0,0,0,0|2,0,0]=4 1506 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])Cl 7a_100011216915_100000210202 [1,1,0,0,0,0|2,0,0]=4 1507 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])F 34a_100000746263_100000210202 [1,1,0,0,0,0|2,0,0]=4 1508 B14R1.760 CCOCc1cc(ccc1[N+](=O)[O-])F 7a_100000746263_100000210202 [1,1,0,0,0,0|2,0,0]=4 1509 B14R1.760 CCSCc1cc(ccc1[N+](=O)[O-])Br 62a_100010245524_100000210202 [1,1,0,0,0,0|2,0,0]=4 1510 B14R1.760 CSCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100011218213 [1,1,0,0,0,0|1,0,0]=3 1511 B14R1.760 CSCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100011218213 [1,1,0,0,0,0|2,0,0]=4 1512 B14R1.760 CSCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100011218213 [1,1,0,0,0,0|2,0,0]=4 1513 B14R1.760 CSCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100011218213 [1,1,0,0,0,0|2,0,0]=4 1514 B14R1.760 Cc1ccc(c(c1)COCF)[N+](=O)[O-] 7a_100000038506_100015361967 [1,1,0,0,0,0|2,0,0]=4 1515 B14R1.760 Cc1ccc(c(c1)OCCF)[N+](=O)[O-] 34a_100000195450_100011217306 [1,1,0,0,0,0|2,0,0]=4 1516 B14R1.760 Cc1ccc(c(c1)OCCF)[N+](=O)[O-] 7a_100000195450_100011217306 [1,1,0,0,0,0|2,0,0]=4 1517 B14R1.760 Cc1ccc(c(c1)OCCO)[N+](=O)[O-] 34a_100000195450_100000211926 [1,1,0,0,0,0|2,0,0]=4 1518 B14R1.760 Cc1ccc(c(c1)OCCO)[N+](=O)[O-] 7a_100000195450_100000211926 [1,1,0,0,0,0|2,0,0]=4 1519 B14R1.760 O=CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_200009817547 [1,1,0,0,0,0|1,0,1]=4 1520 B14R1.760 O=[N+]([O-])c1ccc(cc1COCF)Br 7a_100012361455_100015361967 [1,1,0,0,0,0|2,0,0]=4 1521 B14R1.760 O=[N+]([O-])c1ccc(cc1COCF)Cl 7a_100011216915_100015361967 [1,1,0,0,0,0|2,0,0]=4 1522 B14R1.760 O=[N+]([O-])c1ccc(cc1COCF)F 34a_100000746263_100015361967 [1,1,0,0,0,0|2,0,0]=4 1523 B14R1.760 O=[N+]([O-])c1ccc(cc1COCF)F 7a_100000746263_100015361967 [1,1,0,0,0,0|2,0,0]=4 1524 B14R1.760 O=[N+]([O-])c1ccc(cc1CSCF)Br 62a_100010245524_100015361967 [1,1,0,0,0,0|2,0,0]=4 1525 B14R1.760 O=[N+]([O-])c1ccc(cc1NCCF)F 34a_100000746377_100011217306 [1,1,0,0,0,0|1,0,0]=3 1526 B14R1.760 O=[N+]([O-])c1ccc(cc1NCCO)F 34a_100000746377_100000211926 [1,1,0,0,0,0|1,0,0]=3 1527 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)Br 7a_100011934350_100011217306 [1,1,0,0,0,0|2,0,0]=4 1528 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)Cl 34a_100000746067_100011217306 [1,1,0,0,0,0|2,0,0]=4 1529 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)Cl 7a_100000746067_100011217306 [1,1,0,0,0,0|2,0,0]=4 1530 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)F 34a_100000210785_100011217306 [1,1,0,0,0,0|2,0,0]=4 1531 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)F 7a_100000210785_100011217306 [1,1,0,0,0,0|2,0,0]=4 1532 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCF)I 7a_100000072657_100011217306 [1,1,0,0,0,0|2,0,0]=4 1533 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)Br 7a_100011934350_100000211926 [1,1,0,0,0,0|2,0,0]=4 1534 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)Cl 34a_100000746067_100000211926 [1,1,0,0,0,0|2,0,0]=4 1535 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)Cl 7a_100000746067_100000211926 [1,1,0,0,0,0|2,0,0]=4 1536 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)F 34a_100000210785_100000211926 [1,1,0,0,0,0|2,0,0]=4 1537 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)F 7a_100000210785_100000211926 [1,1,0,0,0,0|2,0,0]=4 1538 B14R1.760 O=[N+]([O-])c1ccc(cc1OCCO)I 7a_100000072657_100000211926 [1,1,0,0,0,0|2,0,0]=4 1539 B14R1.788 CCCNc1ccccc1P(=O)(C)C 2230a_100010749338_100000210303 [1,1,0,0,0,0|1,1,0]=4 1540 B14R1.788 CCCNc1ccccc1P(=O)(C)C 34a_100010749338_100000210303 [1,1,0,0,0,0|1,1,0]=4 1541 B14R1.788 CCCNc1ccccc1S(=O)(=O)C 34a_100000241000_100000210303 [1,1,0,0,0,0|1,0,1]=4 1542 B14R1.788 CCCNc1ccccc1S(=O)(=O)C 7a_100000241000_100000210303 [1,1,0,0,0,0|1,0,1]=4 1543 B14R1.788 CCCNc1ccccc1S(=O)(=O)N 34a_100011204920_100000210303 [1,1,0,0,0,0|1,0,1]=4 1544 B14R1.789 CCCNc1ccccc1C(=O)NC 34a_100000185696_100000210303 [1,1,0,0,0,0|2,0,0]=4 1545 B14R1.3302 CC(CO)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100012180447 [1,1,0,0,0,0|2,0,0]=4 1546 B14R1.3302 CC(CO)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100012180447 [1,1,0,0,0,0|2,0,0]=4 1547 B14R1.3302 CCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100000210202 [1,1,0,0,0,0|1,0,1]=4 1548 B14R1.3302 CCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000210414_100000181388 [1,1,0,0,0,0|1,0,1]=4 1549 B14R1.3302 CCC(C)Nc1ccccc1C(=O)N 34a_100000185089_100011215416 [1,1,0,0,0,0|2,0,0]=4 1550 B14R1.3302 CCC(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000758301 [1,1,0,0,0,0|2,0,0]=4 1551 B14R1.3302 CCC(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100011215416 [1,1,0,0,0,0|1,0,0]=3 1552 B14R1.3302 CCC(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000758301 [1,1,0,0,0,0|1,0,0]=3 1553 B14R1.3302 CCC(C)Oc1cccnc1[N+](=O)[O-] 7a_100000183951_100000758301 [1,1,0,0,0,0|2,0,0]=4 1554 B14R1.3302 CCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000225621_100000181388 [1,1,0,0,0,0|2,0,0]=4 1555 B14R1.3302 CCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000210202 [1,1,0,0,0,0|2,0,0]=4 1556 B14R1.3302 CCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000225621_100000181388 [1,1,0,0,0,0|2,0,0]=4 1557 B14R1.3302 CCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000204670 [1,1,0,0,0,0|2,0,0]=4 1558 B14R1.3302 CN(CF)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100015361967 [1,1,0,0,0,0|2,0,0]=4 1559 B14R1.3302 O=C(CF)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100015361967 [1,1,0,0,0,0|1,0,1]=4 1560 B14R1.3302 O=C(CO)Cc1ccccc1[N+](=O)[O-] 1458a_100000210174_100000181388 [1,1,0,0,0,0|1,0,1]=4 1561 B14R1.4432 C#CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000184674 [1,1,0,0,0,0|0,0,2]=4 1562 B14R1.4432 C#CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000184674 [1,1,0,0,0,0|0,0,2]=4 1563 B14R1.4432 C=CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100015514636 [1,1,0,0,0,0|0,0,2]=4 1564 B14R1.4432 C=CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100015514636 [1,1,0,0,0,0|0,0,2]=4 1565 B14R1.4432 CCCNc1cccc(c1C(=O)N)C 34a_100102558177_100000210303 [1,1,0,0,0,0|2,0,0]=4 1566 B14R1.4432 CCCNc1cccc(c1C(=O)N)C 7a_100102558177_100000210303 [1,1,0,0,0,0|2,0,0]=4 1567 B14R1.4432 CCCNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000210303 [1,1,0,0,0,0|2,0,0]=4 1568 B14R1.4432 CCCNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000210303 [1,1,0,0,0,0|2,0,0]=4 1569 B14R1.4432 CCCNc1cccc(c1C(=O)N)F 34a_100000036109_100000210303 [1,1,0,0,0,0|2,0,0]=4 1570 B14R1.4432 CCCNc1cccc(c1C(=O)N)F 7a_100000036109_100000210303 [1,1,0,0,0,0|2,0,0]=4 1571 B14R1.4432 CCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000210303 [1,1,0,0,0,0|0,0,0]=2 1572 B14R1.4432 CCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000210303 [1,1,0,0,0,0|0,0,0]=2 1573 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000210303 [1,1,0,0,0,0|1,0,0]=3 1574 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000210303 [1,1,0,0,0,0|1,0,0]=3 1575 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000210303 [1,1,0,0,0,0|1,0,0]=3 1576 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000210303 [1,1,0,0,0,0|1,0,0]=3 1577 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000210303 [1,1,0,0,0,0|1,0,0]=3 1578 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000210303 [1,1,0,0,0,0|1,0,0]=3 1579 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000210303 [1,1,0,0,0,0|1,0,0]=3 1580 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000210303 [1,1,0,0,0,0|1,0,0]=3 1581 B14R1.4432 CCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000210303 [1,1,0,0,0,0|1,0,0]=3 1582 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])Br 2230a_100015525214_100010145487 [1,1,0,0,0,0|2,0,0]=4 1583 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100015525214_100009996538 [1,1,0,0,0,0|2,0,0]=4 1584 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])C 207a_100015525214_100000050834 [1,1,0,0,0,0|2,0,0]=4 1585 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])C 2230a_100015525214_100010188692 [1,1,0,0,0,0|2,0,0]=4 1586 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])C 270004a_100015525214_100000050834 [1,1,0,0,0,0|2,0,0]=4 1587 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])Cl 2230a_100015525214_100009990124 [1,1,0,0,0,0|2,0,0]=4 1588 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100015525214_100000050954 [1,1,0,0,0,0|2,0,0]=4 1589 B14R1.4432 CCNCc1cccc(c1[N+](=O)[O-])F 270004a_100015525214_100000102507 [1,1,0,0,0,0|2,0,0]=4 1590 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])Br 34a_100121572206_100010145487 [1,1,0,0,0,0|2,0,0]=4 1591 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])Br 7a_100010147062_100000210202 [1,1,0,0,0,0|2,0,0]=4 1592 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])C 34a_100000032366_100000210202 [1,1,0,0,0,0|2,0,0]=4 1593 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])C 34a_100121572206_100010188692 [1,1,0,0,0,0|2,0,0]=4 1594 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])C 7a_100000032366_100000210202 [1,1,0,0,0,0|2,0,0]=4 1595 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100121572206_100009990124 [1,1,0,0,0,0|2,0,0]=4 1596 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])Cl 7a_100000067488_100000210202 [1,1,0,0,0,0|2,0,0]=4 1597 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])F 34a_100009840826_100000210202 [1,1,0,0,0,0|2,0,0]=4 1598 B14R1.4432 CCOCc1cccc(c1[N+](=O)[O-])F 7a_100009840826_100000210202 [1,1,0,0,0,0|2,0,0]=4 1599 B14R1.4432 CCSCc1cccc(c1[N+](=O)[O-])Br 62a_100010145487_100000210202 [1,1,0,0,0,0|2,0,0]=4 1600 B14R1.4432 CCSCc1cccc(c1[N+](=O)[O-])C 62a_100000210202_100010188692 [1,1,0,0,0,0|2,0,0]=4 1601 B14R1.4432 CSCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100011218213 [1,1,0,0,0,0|1,0,0]=3 1602 B14R1.4432 CSCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100011218213 [1,1,0,0,0,0|1,0,0]=3 1603 B14R1.4432 CSCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100011218213 [1,1,0,0,0,0|2,0,0]=4 1604 B14R1.4432 CSCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100011218213 [1,1,0,0,0,0|2,0,0]=4 1605 B14R1.4432 CSCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100011218213 [1,1,0,0,0,0|2,0,0]=4 1606 B14R1.4432 CSCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100011218213 [1,1,0,0,0,0|2,0,0]=4 1607 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])COCF 34a_100000032366_100015361967 [1,1,0,0,0,0|2,0,0]=4 1608 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])COCF 7a_100000032366_100015361967 [1,1,0,0,0,0|2,0,0]=4 1609 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])CSCF 62a_100015361967_100010188692 [1,1,0,0,0,0|2,0,0]=4 1610 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])NCC=O 34a_100011424894_200009817547 [1,1,0,0,0,0|1,0,1]=4 1611 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])NCCF 34a_100011424894_100011217306 [1,1,0,0,0,0|1,0,0]=3 1612 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])NCCO 34a_100011424894_100000211926 [1,1,0,0,0,0|1,0,0]=3 1613 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCCF 34a_100000740142_100011217306 [1,1,0,0,0,0|2,0,0]=4 1614 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCCF 7a_100000740142_100011217306 [1,1,0,0,0,0|2,0,0]=4 1615 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCCO 34a_100000740142_100000211926 [1,1,0,0,0,0|2,0,0]=4 1616 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCCO 7a_100000740142_100000211926 [1,1,0,0,0,0|2,0,0]=4 1617 B14R1.4432 O=CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_200009817547 [1,1,0,0,0,0|1,0,1]=4 1618 B14R1.4432 O=[N+]([O-])c1c(cccc1COCF)Br 7a_100010147062_100015361967 [1,1,0,0,0,0|2,0,0]=4 1619 B14R1.4432 O=[N+]([O-])c1c(cccc1COCF)Cl 7a_100000067488_100015361967 [1,1,0,0,0,0|2,0,0]=4 1620 B14R1.4432 O=[N+]([O-])c1c(cccc1COCF)F 34a_100009840826_100015361967 [1,1,0,0,0,0|2,0,0]=4 1621 B14R1.4432 O=[N+]([O-])c1c(cccc1COCF)F 7a_100009840826_100015361967 [1,1,0,0,0,0|2,0,0]=4 1622 B14R1.4432 O=[N+]([O-])c1c(cccc1CSCF)Br 62a_100010145487_100015361967 [1,1,0,0,0,0|2,0,0]=4 1623 B14R1.4432 O=[N+]([O-])c1c(cccc1NCCF)F 34a_100011219493_100011217306 [1,1,0,0,0,0|1,0,0]=3 1624 B14R1.4432 O=[N+]([O-])c1c(cccc1NCCO)F 34a_100011219493_100000211926 [1,1,0,0,0,0|1,0,0]=3 1625 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)Br 34a_100011934925_100011217306 [1,1,0,0,0,0|2,0,0]=4 1626 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)Br 7a_100011934925_100011217306 [1,1,0,0,0,0|2,0,0]=4 1627 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)Cl 34a_100011999376_100011217306 [1,1,0,0,0,0|2,0,0]=4 1628 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)Cl 7a_100011999376_100011217306 [1,1,0,0,0,0|2,0,0]=4 1629 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)F 34a_100011217962_100011217306 [1,1,0,0,0,0|2,0,0]=4 1630 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)F 7a_100011217962_100011217306 [1,1,0,0,0,0|2,0,0]=4 1631 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCF)I 7a_100010150324_100011217306 [1,1,0,0,0,0|2,0,0]=4 1632 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)Br 34a_100011934925_100000211926 [1,1,0,0,0,0|2,0,0]=4 1633 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)Br 7a_100011934925_100000211926 [1,1,0,0,0,0|2,0,0]=4 1634 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)Cl 34a_100011999376_100000211926 [1,1,0,0,0,0|2,0,0]=4 1635 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)Cl 7a_100011999376_100000211926 [1,1,0,0,0,0|2,0,0]=4 1636 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)F 34a_100011217962_100000211926 [1,1,0,0,0,0|2,0,0]=4 1637 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)F 7a_100011217962_100000211926 [1,1,0,0,0,0|2,0,0]=4 1638 B14R1.4432 O=[N+]([O-])c1c(cccc1OCCO)I 7a_100010150324_100000211926 [1,1,0,0,0,0|2,0,0]=4 1639 B14R1.4522 C=C(C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000748629 [1,1,0,0,0,0|1,0,1]=4 1640 B14R1.4522 C=C(C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000748629 [1,1,0,0,0,0|1,0,1]=4 1641 B14R1.4522 CC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000070787_200011934512 [1,1,0,0,0,0|1,0,1]=4 1642 B14R1.4522 CC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_200000210301 [1,1,0,0,0,0|1,0,1]=4 1643 B14R1.4522 CC(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_200000210301 [1,1,0,0,0,0|1,0,1]=4 1644 B14R1.4522 CC(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_200000210301 [1,1,0,0,0,0|1,0,1]=4 1645 B14R1.4522 CC(=O)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100000070787 [1,1,0,0,0,0|1,0,1]=4 1646 B14R1.4522 CC(C)CNc1ccccc1C(=O)N 34a_100000185089_100000210624 [1,1,0,0,0,0|2,0,0]=4 1647 B14R1.4522 CC(C)COc1ccccc1C(=O)[O-] 7a_100015234032_100000210760 [1,1,0,0,0,0|2,0,0]=4 1648 B14R1.4522 CC(C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210624 [1,1,0,0,0,0|1,0,0]=3 1649 B14R1.4522 CC(C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210760 [1,1,0,0,0,0|1,0,0]=3 1650 B14R1.4522 CC(C)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100000210760 [1,1,0,0,0,0|2,0,0]=4 1651 B14R1.4522 CC(C)NCc1ccccc1[N+](=O)[O-] 2230a_100138425928_100000181388 [1,1,0,0,0,0|2,0,0]=4 1652 B14R1.4522 CC(C)NCc1ccccc1[N+](=O)[O-] 34a_100138425928_100000181388 [1,1,0,0,0,0|2,0,0]=4 1653 B14R1.4522 CC(C)OCc1ccccc1[N+](=O)[O-] 34a_100000212225_100000181388 [1,1,0,0,0,0|2,0,0]=4 1654 B14R1.4522 CC(C)OCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210206 [1,1,0,0,0,0|2,0,0]=4 1655 B14R1.4522 CC(C)SCc1ccccc1[N+](=O)[O-] 62a_100000210206_100000181388 [1,1,0,0,0,0|2,0,0]=4 1656 B14R1.4522 CC(O)CNc1ccccc1C(=O)N 34a_100000185089_100011218427 [1,1,0,0,0,0|2,0,0]=4 1657 B14R1.4522 CC(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100011218427 [1,1,0,0,0,0|2,0,0]=4 1658 B14R1.4522 CC(O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011218427 [1,1,0,0,0,0|1,0,0]=3 1659 B14R1.4522 CC(O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011218427 [1,1,0,0,0,0|1,0,0]=3 1660 B14R1.4522 CC(O)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100011218427 [1,1,0,0,0,0|2,0,0]=4 1661 B14R1.4522 CN(C)CCc1ccccc1[N+](=O)[O-] 2230a_100102631434_200011934512 [1,1,0,0,0,0|2,0,0]=4 1662 B14R1.4522 CN(C)CCc1ccccc1[N+](=O)[O-] 269982a_100102631434_200011934512 [1,1,0,0,0,0|2,0,0]=4 1663 B14R1.4522 C[C@@H](O)CNc1ccccc1C(=O)N 34a_100000185089_100009817552 [1,1,0,0,0,0|2,0,0]=4 1664 B14R1.4522 C[C@@H](O)COc1ccccc1C(=O)[O-] 7a_100015234032_100009817552 [1,1,0,0,0,0|2,0,0]=4 1665 B14R1.4522 C[C@@H](O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100009817552 [1,1,0,0,0,0|1,0,0]=3 1666 B14R1.4522 C[C@@H](O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100009817552 [1,1,0,0,0,0|1,0,0]=3 1667 B14R1.4522 C[C@@H](O)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100009817552 [1,1,0,0,0,0|2,0,0]=4 1668 B14R1.4522 NC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000187820 [1,1,0,0,0,0|1,0,1]=4 1669 B14R1.4522 NC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000187820 [1,1,0,0,0,0|1,0,1]=4 1670 B14R1.4522 O=[N+]([O-])c1ccccc1OCC(F)F 34a_100000186319_100011934356 [1,1,0,0,0,0|2,0,0]=4 1671 B14R1.4522 O=[N+]([O-])c1ccccc1OCC(F)F 7a_100000186319_100011934356 [1,1,0,0,0,0|2,0,0]=4 1672 B14R1.4522 [13CH3]C(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_200025704644 [1,1,0,0,0,0|1,0,1]=4 1673 B14R1.4522 [13CH3]C(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_200025704644 [1,1,0,0,0,0|1,0,1]=4 1674 B14R1.4522 [13CH3]C(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_200025704644 [1,1,0,0,0,0|1,0,1]=4 1675 B14R1.7480 C#CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000184674 [1,1,0,0,0,0|0,0,2]=4 1676 B14R1.7480 C=CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100015514636 [1,1,0,0,0,0|0,0,2]=4 1677 B14R1.7480 CCCNc1c(cccc1C(=O)N)C 34a_100000223273_100000210303 [1,1,0,0,0,0|2,0,0]=4 1678 B14R1.7480 CCCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000210303 [1,1,0,0,0,0|2,0,0]=4 1679 B14R1.7480 CCCNc1c(cccc1C(=O)N)F 34a_100011722151_100000210303 [1,1,0,0,0,0|2,0,0]=4 1680 B14R1.7480 CCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000210303 [1,1,0,0,0,0|0,0,0]=2 1681 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000210303 [1,1,0,0,0,0|1,0,0]=3 1682 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000210303 [1,1,0,0,0,0|1,0,0]=3 1683 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000210303 [1,1,0,0,0,0|1,0,0]=3 1684 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000210303 [1,1,0,0,0,0|1,0,0]=3 1685 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000210303 [1,1,0,0,0,0|1,0,0]=3 1686 B14R1.7480 CCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000210303 [1,1,0,0,0,0|1,0,0]=3 1687 B14R1.7480 CCCOc1c(ccnc1C)[N+](=O)[O-] 34a_200000144590_100000210303 [1,1,0,0,0,0|2,0,0]=4 1688 B14R1.7480 CCCOc1c(ccnc1C)[N+](=O)[O-] 7a_200000144590_100000210303 [1,1,0,0,0,0|2,0,0]=4 1689 B14R1.7480 CCCOc1c(ccnc1Cl)[N+](=O)[O-] 34a_100009852515_100000210303 [1,1,0,0,0,0|2,0,0]=4 1690 B14R1.7480 CCCOc1c(ccnc1Cl)[N+](=O)[O-] 7a_100009852515_100000210303 [1,1,0,0,0,0|2,0,0]=4 1691 B14R1.7480 CCCOc1c(ccnc1[N+](=O)[O-])C 7a_100009875811_100000210303 [1,1,0,0,0,0|2,0,0]=4 1692 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])Br 2230a_100015525214_100011273477 [1,1,0,0,0,0|2,0,0]=4 1693 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100015525214_100000735576 [1,1,0,0,0,0|2,0,0]=4 1694 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])C 2230a_100015525214_100010254497 [1,1,0,0,0,0|2,0,0]=4 1695 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])Cl 2230a_100015525214_100000753779 [1,1,0,0,0,0|2,0,0]=4 1696 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100015525214_100011217401 [1,1,0,0,0,0|2,0,0]=4 1697 B14R1.7480 CCNCc1c(cccc1[N+](=O)[O-])F 2230a_100015525214_100000751461 [1,1,0,0,0,0|2,0,0]=4 1698 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])Br 34a_100121572206_100011273477 [1,1,0,0,0,0|2,0,0]=4 1699 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])C 34a_100009850887_100000210202 [1,1,0,0,0,0|2,0,0]=4 1700 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])C 34a_100121572206_100010254497 [1,1,0,0,0,0|2,0,0]=4 1701 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])C 7a_100009850887_100000210202 [1,1,0,0,0,0|2,0,0]=4 1702 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100121572206_100000753779 [1,1,0,0,0,0|2,0,0]=4 1703 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])Cl 7a_100011916443_100000210202 [1,1,0,0,0,0|2,0,0]=4 1704 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])F 34a_100000102360_100000210202 [1,1,0,0,0,0|2,0,0]=4 1705 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])F 34a_100121572206_100000751461 [1,1,0,0,0,0|2,0,0]=4 1706 B14R1.7480 CCOCc1c(cccc1[N+](=O)[O-])F 7a_100000102360_100000210202 [1,1,0,0,0,0|2,0,0]=4 1707 B14R1.7480 CCSCc1c(cccc1[N+](=O)[O-])Br 62a_100011273477_100000210202 [1,1,0,0,0,0|2,0,0]=4 1708 B14R1.7480 CSCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100011218213 [1,1,0,0,0,0|1,0,0]=3 1709 B14R1.7480 CSCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100011218213 [1,1,0,0,0,0|2,0,0]=4 1710 B14R1.7480 CSCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100011218213 [1,1,0,0,0,0|2,0,0]=4 1711 B14R1.7480 CSCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100011218213 [1,1,0,0,0,0|2,0,0]=4 1712 B14R1.7480 CSCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100011218213 [1,1,0,0,0,0|2,0,0]=4 1713 B14R1.7480 Cc1cccc(c1COCF)[N+](=O)[O-] 34a_100009850887_100015361967 [1,1,0,0,0,0|2,0,0]=4 1714 B14R1.7480 Cc1cccc(c1COCF)[N+](=O)[O-] 7a_100009850887_100015361967 [1,1,0,0,0,0|2,0,0]=4 1715 B14R1.7480 Cc1cccc(c1OCCF)[N+](=O)[O-] 34a_100000763257_100011217306 [1,1,0,0,0,0|2,0,0]=4 1716 B14R1.7480 Cc1cccc(c1OCCF)[N+](=O)[O-] 7a_100000763257_100011217306 [1,1,0,0,0,0|2,0,0]=4 1717 B14R1.7480 Cc1cccc(c1OCCO)[N+](=O)[O-] 34a_100000763257_100000211926 [1,1,0,0,0,0|2,0,0]=4 1718 B14R1.7480 Cc1cccc(c1OCCO)[N+](=O)[O-] 7a_100000763257_100000211926 [1,1,0,0,0,0|2,0,0]=4 1719 B14R1.7480 O=CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_200009817547 [1,1,0,0,0,0|1,0,1]=4 1720 B14R1.7480 O=[N+]([O-])c1cccc(c1COCF)Cl 7a_100011916443_100015361967 [1,1,0,0,0,0|2,0,0]=4 1721 B14R1.7480 O=[N+]([O-])c1cccc(c1COCF)F 34a_100000102360_100015361967 [1,1,0,0,0,0|2,0,0]=4 1722 B14R1.7480 O=[N+]([O-])c1cccc(c1COCF)F 7a_100000102360_100015361967 [1,1,0,0,0,0|2,0,0]=4 1723 B14R1.7480 O=[N+]([O-])c1cccc(c1CSCF)Br 62a_100011273477_100015361967 [1,1,0,0,0,0|2,0,0]=4 1724 B14R1.7480 O=[N+]([O-])c1cccc(c1NCCF)F 34a_100000687224_100011217306 [1,1,0,0,0,0|1,0,0]=3 1725 B14R1.7480 O=[N+]([O-])c1cccc(c1NCCO)F 34a_100000687224_100000211926 [1,1,0,0,0,0|1,0,0]=3 1726 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCF)Br 34a_100000689966_100011217306 [1,1,0,0,0,0|2,0,0]=4 1727 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCF)Cl 34a_100000686934_100011217306 [1,1,0,0,0,0|2,0,0]=4 1728 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCF)Cl 7a_100000686934_100011217306 [1,1,0,0,0,0|2,0,0]=4 1729 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCF)F 34a_100000690172_100011217306 [1,1,0,0,0,0|2,0,0]=4 1730 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCO)Br 34a_100000689966_100000211926 [1,1,0,0,0,0|2,0,0]=4 1731 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCO)Cl 34a_100000686934_100000211926 [1,1,0,0,0,0|2,0,0]=4 1732 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCO)Cl 7a_100000686934_100000211926 [1,1,0,0,0,0|2,0,0]=4 1733 B14R1.7480 O=[N+]([O-])c1cccc(c1OCCO)F 34a_100000690172_100000211926 [1,1,0,0,0,0|2,0,0]=4 1734 B16R1.241 C#CCCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000695029 [0,2,0,0,0,0|1,0,0]=3 1735 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100011215417 [0,2,0,0,0,0|2,0,0]=4 1736 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000695029 [0,2,0,0,0,0|2,0,0]=4 1737 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100011215417 [0,2,0,0,0,0|2,0,0]=4 1738 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000695029 [0,2,0,0,0,0|2,0,0]=4 1739 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100011215417 [0,2,0,0,0,0|2,0,0]=4 1740 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000695029 [0,2,0,0,0,0|2,0,0]=4 1741 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100011215417 [0,2,0,0,0,0|2,0,0]=4 1742 B16R1.241 C#CCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100011215417 [0,2,0,0,0,0|2,0,0]=4 1743 B16R1.241 C#CCCNCc1cc(ccc1[N+](=O)[O-])Br 34a_100000755551_100010245524 [0,2,0,0,0,0|1,0,1]=4 1744 B16R1.241 C#CCCNCc1cc(ccc1[N+](=O)[O-])C 34a_100000755551_200000039114 [0,2,0,0,0,0|1,0,1]=4 1745 B16R1.241 C#CCCNCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000755551_100000765840 [0,2,0,0,0,0|1,0,1]=4 1746 B16R1.241 C=CCCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000757094 [0,2,0,0,0,0|1,0,0]=3 1747 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000757094 [0,2,0,0,0,0|2,0,0]=4 1748 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000757094 [0,2,0,0,0,0|2,0,0]=4 1749 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000757094 [0,2,0,0,0,0|2,0,0]=4 1750 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000757094 [0,2,0,0,0,0|2,0,0]=4 1751 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000757094 [0,2,0,0,0,0|2,0,0]=4 1752 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000757094 [0,2,0,0,0,0|2,0,0]=4 1753 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000757094 [0,2,0,0,0,0|2,0,0]=4 1754 B16R1.241 C=CCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000757094 [0,2,0,0,0,0|2,0,0]=4 1755 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])Br 2230a_100015191253_100010245524 [0,2,0,0,0,0|1,0,1]=4 1756 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100015191253_100000692607 [0,2,0,0,0,0|1,0,1]=4 1757 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])C 207a_100015191253_100000050452 [0,2,0,0,0,0|1,0,1]=4 1758 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])C 2230a_100015191253_200000039114 [0,2,0,0,0,0|1,0,1]=4 1759 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100015191253_100000050452 [0,2,0,0,0,0|1,0,1]=4 1760 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])Cl 2230a_100015191253_100000765840 [0,2,0,0,0,0|1,0,1]=4 1761 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100015191253_100000758460 [0,2,0,0,0,0|1,0,1]=4 1762 B16R1.241 C=CCCNCc1cc(ccc1[N+](=O)[O-])F 2230a_100015191253_100000740372 [0,2,0,0,0,0|1,0,1]=4 1763 B16R1.241 C=COCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000039644 [0,2,0,0,0,0|1,0,1]=4 1764 B16R1.241 CC/C=C\CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100103147603 [0,2,0,0,0,0|1,0,1]=4 1765 B16R1.241 CCC#CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100009813939 [0,2,0,0,0,0|1,0,1]=4 1766 B16R1.241 CCCCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000718602 [0,2,0,0,0,0|1,0,0]=3 1767 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000210326 [0,2,0,0,0,0|2,0,0]=4 1768 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000718602 [0,2,0,0,0,0|2,0,0]=4 1769 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000210326 [0,2,0,0,0,0|2,0,0]=4 1770 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000718602 [0,2,0,0,0,0|2,0,0]=4 1771 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000210326 [0,2,0,0,0,0|2,0,0]=4 1772 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000718602 [0,2,0,0,0,0|2,0,0]=4 1773 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000210326 [0,2,0,0,0,0|2,0,0]=4 1774 B16R1.241 CCCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000210326 [0,2,0,0,0,0|2,0,0]=4 1775 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Br 2230a_100000102301_100010245524 [0,2,0,0,0,0|1,0,0]=3 1776 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100000102301_100000692607 [0,2,0,0,0,0|1,0,0]=3 1777 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Br 7a_106832991798_100010245524 [0,2,0,0,0,0|1,0,0]=3 1778 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])C 207a_100000102301_100000050452 [0,2,0,0,0,0|1,0,0]=3 1779 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])C 2230a_100000102301_200000039114 [0,2,0,0,0,0|1,0,0]=3 1780 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100000102301_100000050452 [0,2,0,0,0,0|1,0,0]=3 1781 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])C 7a_106832991798_200000039114 [0,2,0,0,0,0|1,0,0]=3 1782 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Cl 2230a_100000102301_100000765840 [0,2,0,0,0,0|1,0,0]=3 1783 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100000102301_100000758460 [0,2,0,0,0,0|1,0,0]=3 1784 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])Cl 7a_106832991798_100000765840 [0,2,0,0,0,0|1,0,0]=3 1785 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])F 2230a_100000102301_100000740372 [0,2,0,0,0,0|1,0,0]=3 1786 B16R1.241 CCCCNCc1cc(ccc1[N+](=O)[O-])F 7a_106832991798_100000740372 [0,2,0,0,0,0|1,0,0]=3 1787 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100000210227_100010245524 [0,2,0,0,0,0|2,0,0]=4 1788 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Br 7a_100000210227_100010245524 [0,2,0,0,0,0|2,0,0]=4 1789 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Br 7a_100012361455_100000210211 [0,2,0,0,0,0|2,0,0]=4 1790 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])C 34a_100000210227_200000039114 [0,2,0,0,0,0|2,0,0]=4 1791 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])C 7a_100000038506_100000210211 [0,2,0,0,0,0|2,0,0]=4 1792 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])C 7a_100000210227_200000039114 [0,2,0,0,0,0|2,0,0]=4 1793 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000210227_100000765840 [0,2,0,0,0,0|2,0,0]=4 1794 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Cl 7a_100000210227_100000765840 [0,2,0,0,0,0|2,0,0]=4 1795 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])Cl 7a_100011216915_100000210211 [0,2,0,0,0,0|2,0,0]=4 1796 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])F 34a_100000746263_100000210210 [0,2,0,0,0,0|2,0,0]=4 1797 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])F 7a_100000210227_100000740372 [0,2,0,0,0,0|2,0,0]=4 1798 B16R1.241 CCCCOCc1cc(ccc1[N+](=O)[O-])F 7a_100000746263_100000210211 [0,2,0,0,0,0|2,0,0]=4 1799 B16R1.241 CCCCSCc1cc(ccc1[N+](=O)[O-])Br 62a_100010245524_100000210210 [0,2,0,0,0,0|2,0,0]=4 1800 B16R1.241 CCOCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000210147 [0,2,0,0,0,0|1,0,0]=3 1801 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100011215890 [0,2,0,0,0,0|2,0,0]=4 1802 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000210147 [0,2,0,0,0,0|2,0,0]=4 1803 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100011215890 [0,2,0,0,0,0|2,0,0]=4 1804 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000210147 [0,2,0,0,0,0|2,0,0]=4 1805 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100011215890 [0,2,0,0,0,0|2,0,0]=4 1806 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000210147 [0,2,0,0,0,0|2,0,0]=4 1807 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100011215890 [0,2,0,0,0,0|2,0,0]=4 1808 B16R1.241 CCOCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100011215890 [0,2,0,0,0,0|2,0,0]=4 1809 B16R1.241 CCSCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000757381 [0,2,0,0,0,0|1,0,0]=3 1810 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000757381 [0,2,0,0,0,0|2,0,0]=4 1811 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000757381 [0,2,0,0,0,0|2,0,0]=4 1812 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000757381 [0,2,0,0,0,0|2,0,0]=4 1813 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000757381 [0,2,0,0,0,0|2,0,0]=4 1814 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000757381 [0,2,0,0,0,0|2,0,0]=4 1815 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000757381 [0,2,0,0,0,0|2,0,0]=4 1816 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000757381 [0,2,0,0,0,0|2,0,0]=4 1817 B16R1.241 CCSCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000757381 [0,2,0,0,0,0|2,0,0]=4 1818 B16R1.241 COCCCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000740836 [0,2,0,0,0,0|1,0,0]=3 1819 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000740836 [0,2,0,0,0,0|2,0,0]=4 1820 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000740836 [0,2,0,0,0,0|2,0,0]=4 1821 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000740836 [0,2,0,0,0,0|2,0,0]=4 1822 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000740836 [0,2,0,0,0,0|2,0,0]=4 1823 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000740836 [0,2,0,0,0,0|2,0,0]=4 1824 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000740836 [0,2,0,0,0,0|2,0,0]=4 1825 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000740836 [0,2,0,0,0,0|2,0,0]=4 1826 B16R1.241 COCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000740836 [0,2,0,0,0,0|2,0,0]=4 1827 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])Br 2230a_100000209980_100010245524 [0,2,0,0,0,0|2,0,0]=4 1828 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100000209980_100000692607 [0,2,0,0,0,0|2,0,0]=4 1829 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])C 207a_100000209980_100000050452 [0,2,0,0,0,0|2,0,0]=4 1830 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])C 2230a_100000209980_200000039114 [0,2,0,0,0,0|2,0,0]=4 1831 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100000209980_100000050452 [0,2,0,0,0,0|2,0,0]=4 1832 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])Cl 2230a_100000209980_100000765840 [0,2,0,0,0,0|2,0,0]=4 1833 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100000209980_100000758460 [0,2,0,0,0,0|2,0,0]=4 1834 B16R1.241 COCCNCc1cc(ccc1[N+](=O)[O-])F 2230a_100000209980_100000740372 [0,2,0,0,0,0|2,0,0]=4 1835 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])Br 2230a_100020590264_100010245524 [0,2,0,0,0,0|2,0,0]=4 1836 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100020590264_100000692607 [0,2,0,0,0,0|2,0,0]=4 1837 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])C 207a_100020590264_100000050452 [0,2,0,0,0,0|2,0,0]=4 1838 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])C 2230a_100020590264_200000039114 [0,2,0,0,0,0|2,0,0]=4 1839 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])C 270004a_100020590264_100000050452 [0,2,0,0,0,0|2,0,0]=4 1840 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])Cl 2230a_100020590264_100000765840 [0,2,0,0,0,0|2,0,0]=4 1841 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100020590264_100000758460 [0,2,0,0,0,0|2,0,0]=4 1842 B16R1.241 CSCCNCc1cc(ccc1[N+](=O)[O-])F 2230a_100020590264_100000740372 [0,2,0,0,0,0|2,0,0]=4 1843 B16R1.241 Cc1ccc(c(c1)CNCCC#N)[N+](=O)[O-] 270004a_100000720768_100000050452 [0,2,0,0,0,0|0,0,2]=4 1844 B16R1.241 Cc1ccc(c(c1)CNCCCF)[N+](=O)[O-] 207a_100015189416_100000050452 [0,2,0,0,0,0|1,0,0]=3 1845 B16R1.241 Cc1ccc(c(c1)CNCCCF)[N+](=O)[O-] 2230a_100015189416_200000039114 [0,2,0,0,0,0|1,0,0]=3 1846 B16R1.241 Cc1ccc(c(c1)CNCCCF)[N+](=O)[O-] 270004a_100015189416_100000050452 [0,2,0,0,0,0|1,0,0]=3 1847 B16R1.241 Cc1ccc(c(c1)CNCCCF)[N+](=O)[O-] 34a_100015189416_200000039114 [0,2,0,0,0,0|1,0,0]=3 1848 B16R1.241 Cc1ccc(c(c1)CNCCCO)[N+](=O)[O-] 207a_100000182051_100000050452 [0,2,0,0,0,0|1,0,0]=3 1849 B16R1.241 Cc1ccc(c(c1)CNCCCO)[N+](=O)[O-] 270004a_100000182051_100000050452 [0,2,0,0,0,0|1,0,0]=3 1850 B16R1.241 Cc1ccc(c(c1)COCCCBr)[N+](=O)[O-] 34a_100011217188_200000039114 [0,2,0,0,0,0|2,0,0]=4 1851 B16R1.241 Cc1ccc(c(c1)COCCCCl)[N+](=O)[O-] 34a_100000230001_200000039114 [0,2,0,0,0,0|2,0,0]=4 1852 B16R1.241 Cc1ccc(c(c1)COCCCF)[N+](=O)[O-] 34a_100000759539_200000039114 [0,2,0,0,0,0|2,0,0]=4 1853 B16R1.241 Cc1ccc(c(c1)COCCCF)[N+](=O)[O-] 7a_100000038506_100011934791 [0,2,0,0,0,0|2,0,0]=4 1854 B16R1.241 Cc1ccc(c(c1)COCCCN)[N+](=O)[O-] 34a_100000182051_200000039114 [0,2,0,0,0,0|1,0,0]=3 1855 B16R1.241 Cc1ccc(c(c1)COCCCO)[N+](=O)[O-] 7a_100000038506_100011215043 [0,2,0,0,0,0|2,0,0]=4 1856 B16R1.241 Cc1ccc(c(c1)COCCON)[N+](=O)[O-] 34a_100000700252_200000039114 [0,2,0,0,0,0|2,0,0]=4 1857 B16R1.241 Cc1ccc(c(c1)OCCCC#N)[N+](=O)[O-] 7a_100000195450_100000687738 [0,2,0,0,0,0|1,0,1]=4 1858 B16R1.241 Cc1ccc(c(c1)OCCCC=O)[N+](=O)[O-] 7a_100000195450_200011292268 [0,2,0,0,0,0|2,0,0]=4 1859 B16R1.241 Cc1ccc(c(c1)OCCCCF)[N+](=O)[O-] 34a_100000195450_100000729493 [0,2,0,0,0,0|2,0,0]=4 1860 B16R1.241 Cc1ccc(c(c1)OCCCCF)[N+](=O)[O-] 7a_100000195450_100000729493 [0,2,0,0,0,0|2,0,0]=4 1861 B16R1.241 Cc1ccc(c(c1)OCCCCO)[N+](=O)[O-] 34a_100000195450_100011216708 [0,2,0,0,0,0|2,0,0]=4 1862 B16R1.241 Cc1ccc(c(c1)OCCCCO)[N+](=O)[O-] 7a_100000195450_100000210776 [0,2,0,0,0,0|2,0,0]=4 1863 B16R1.241 N#CCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000687738 [0,2,0,0,0,0|1,0,1]=4 1864 B16R1.241 N#CCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000687738 [0,2,0,0,0,0|1,0,1]=4 1865 B16R1.241 N#CCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000687738 [0,2,0,0,0,0|1,0,1]=4 1866 B16R1.241 N#CCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000687738 [0,2,0,0,0,0|1,0,1]=4 1867 B16R1.241 N#CCCNCc1cc(ccc1[N+](=O)[O-])Br 270004a_100000720768_100000692607 [0,2,0,0,0,0|0,0,2]=4 1868 B16R1.241 N#CCCNCc1cc(ccc1[N+](=O)[O-])Cl 270004a_100000720768_100000758460 [0,2,0,0,0,0|0,0,2]=4 1869 B16R1.241 NCCCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100000182051_100010245524 [0,2,0,0,0,0|1,0,0]=3 1870 B16R1.241 NCCCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000182051_100000765840 [0,2,0,0,0,0|1,0,0]=3 1871 B16R1.241 NOCCOCc1cc(ccc1[N+](=O)[O-])Br 34a_100000700252_100010245524 [0,2,0,0,0,0|2,0,0]=4 1872 B16R1.241 NOCCOCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000700252_100000765840 [0,2,0,0,0,0|2,0,0]=4 1873 B16R1.241 O=CCCCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_200011292268 [0,2,0,0,0,0|2,0,0]=4 1874 B16R1.241 O=CCCCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_200011292268 [0,2,0,0,0,0|2,0,0]=4 1875 B16R1.241 O=CCCCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_200011292268 [0,2,0,0,0,0|2,0,0]=4 1876 B16R1.241 O=CCCCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_200011292268 [0,2,0,0,0,0|2,0,0]=4 1877 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Br 2230a_100015189416_100010245524 [0,2,0,0,0,0|1,0,0]=3 1878 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Br 270004a_100015189416_100000692607 [0,2,0,0,0,0|1,0,0]=3 1879 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Br 34a_100015189416_100010245524 [0,2,0,0,0,0|1,0,0]=3 1880 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Cl 2230a_100015189416_100000765840 [0,2,0,0,0,0|1,0,0]=3 1881 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Cl 270004a_100015189416_100000758460 [0,2,0,0,0,0|1,0,0]=3 1882 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)Cl 34a_100015189416_100000765840 [0,2,0,0,0,0|1,0,0]=3 1883 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCF)F 2230a_100015189416_100000740372 [0,2,0,0,0,0|1,0,0]=3 1884 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCO)Br 270004a_100000182051_100000692607 [0,2,0,0,0,0|1,0,0]=3 1885 B16R1.241 O=[N+]([O-])c1ccc(cc1CNCCCO)Cl 270004a_100000182051_100000758460 [0,2,0,0,0,0|1,0,0]=3 1886 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCBr)Br 34a_100011217188_100010245524 [0,2,0,0,0,0|2,0,0]=4 1887 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCBr)Cl 34a_100011217188_100000765840 [0,2,0,0,0,0|2,0,0]=4 1888 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCCl)Br 34a_100000230001_100010245524 [0,2,0,0,0,0|2,0,0]=4 1889 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCCl)Cl 34a_100000230001_100000765840 [0,2,0,0,0,0|2,0,0]=4 1890 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)Br 34a_100000759539_100010245524 [0,2,0,0,0,0|2,0,0]=4 1891 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)Br 7a_100012361455_100011934791 [0,2,0,0,0,0|2,0,0]=4 1892 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)Cl 34a_100000759539_100000765840 [0,2,0,0,0,0|2,0,0]=4 1893 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)Cl 7a_100011216915_100011934791 [0,2,0,0,0,0|2,0,0]=4 1894 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)F 34a_100000746263_100011934791 [0,2,0,0,0,0|2,0,0]=4 1895 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCF)F 7a_100000746263_100011934791 [0,2,0,0,0,0|2,0,0]=4 1896 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCO)Br 7a_100012361455_100011215043 [0,2,0,0,0,0|2,0,0]=4 1897 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCO)Cl 7a_100011216915_100011215043 [0,2,0,0,0,0|2,0,0]=4 1898 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCO)F 34a_100000746263_100000230001 [0,2,0,0,0,0|2,0,0]=4 1899 B16R1.241 O=[N+]([O-])c1ccc(cc1COCCCO)F 7a_100000746263_100011215043 [0,2,0,0,0,0|2,0,0]=4 1900 B16R1.241 O=[N+]([O-])c1ccc(cc1CSCCCF)Br 62a_100010245524_100011934791 [0,2,0,0,0,0|2,0,0]=4 1901 B16R1.241 O=[N+]([O-])c1ccc(cc1CSCCCO)Br 62a_100010245524_100011215043 [0,2,0,0,0,0|2,0,0]=4 1902 B16R1.241 O=[N+]([O-])c1ccc(cc1NCC#CCO)F 34a_100000746377_200000047223 [0,2,0,0,0,0|1,0,1]=4 1903 B16R1.241 O=[N+]([O-])c1ccc(cc1NCCCCF)F 34a_100000746377_100000729493 [0,2,0,0,0,0|1,0,0]=3 1904 B16R1.241 O=[N+]([O-])c1ccc(cc1NCCCCO)F 34a_100000746377_100011216708 [0,2,0,0,0,0|1,0,0]=3 1905 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)Br 7a_100011934350_100000729493 [0,2,0,0,0,0|2,0,0]=4 1906 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)Cl 34a_100000746067_100000729493 [0,2,0,0,0,0|2,0,0]=4 1907 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)Cl 7a_100000746067_100000729493 [0,2,0,0,0,0|2,0,0]=4 1908 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)F 34a_100000210785_100000729493 [0,2,0,0,0,0|2,0,0]=4 1909 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)F 7a_100000210785_100000729493 [0,2,0,0,0,0|2,0,0]=4 1910 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCF)I 7a_100000072657_100000729493 [0,2,0,0,0,0|2,0,0]=4 1911 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)Br 7a_100011934350_100000210776 [0,2,0,0,0,0|2,0,0]=4 1912 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)Cl 34a_100000746067_100011216708 [0,2,0,0,0,0|2,0,0]=4 1913 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)Cl 7a_100000746067_100000210776 [0,2,0,0,0,0|2,0,0]=4 1914 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)F 34a_100000210785_100011216708 [0,2,0,0,0,0|2,0,0]=4 1915 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)F 7a_100000210785_100000210776 [0,2,0,0,0,0|2,0,0]=4 1916 B16R1.241 O=[N+]([O-])c1ccc(cc1OCCCCO)I 7a_100000072657_100000210776 [0,2,0,0,0,0|2,0,0]=4 1917 B16R1.1225 C#CCCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000695029 [0,2,0,0,0,0|1,0,0]=3 1918 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000695029 [0,2,0,0,0,0|2,0,0]=4 1919 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100011215417 [0,2,0,0,0,0|2,0,0]=4 1920 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000695029 [0,2,0,0,0,0|2,0,0]=4 1921 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100011215417 [0,2,0,0,0,0|2,0,0]=4 1922 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000695029 [0,2,0,0,0,0|2,0,0]=4 1923 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100011215417 [0,2,0,0,0,0|2,0,0]=4 1924 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000695029 [0,2,0,0,0,0|2,0,0]=4 1925 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100011215417 [0,2,0,0,0,0|2,0,0]=4 1926 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100011215417 [0,2,0,0,0,0|2,0,0]=4 1927 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000695029 [0,2,0,0,0,0|2,0,0]=4 1928 B16R1.1225 C#CCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100011215417 [0,2,0,0,0,0|2,0,0]=4 1929 B16R1.1225 C#CCCNCc1ccc(cc1[N+](=O)[O-])Br 34a_100000755551_100012353686 [0,2,0,0,0,0|1,0,1]=4 1930 B16R1.1225 C#CCCNCc1ccc(cc1[N+](=O)[O-])C 34a_100000755551_200009879986 [0,2,0,0,0,0|1,0,1]=4 1931 B16R1.1225 C#CCCNCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000755551_100000748067 [0,2,0,0,0,0|1,0,1]=4 1932 B16R1.1225 C#CCCNCc1ccc(cc1[N+](=O)[O-])F 34a_100000755551_100012145688 [0,2,0,0,0,0|1,0,1]=4 1933 B16R1.1225 C#CCCNCc1ccc(cc1[N+](=O)[O-])I 34a_100000755551_200010171343 [0,2,0,0,0,0|1,0,1]=4 1934 B16R1.1225 C=CCCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000757094 [0,2,0,0,0,0|1,0,0]=3 1935 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000757094 [0,2,0,0,0,0|2,0,0]=4 1936 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000757094 [0,2,0,0,0,0|2,0,0]=4 1937 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000757094 [0,2,0,0,0,0|2,0,0]=4 1938 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000757094 [0,2,0,0,0,0|2,0,0]=4 1939 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000757094 [0,2,0,0,0,0|2,0,0]=4 1940 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000757094 [0,2,0,0,0,0|2,0,0]=4 1941 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000757094 [0,2,0,0,0,0|2,0,0]=4 1942 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000757094 [0,2,0,0,0,0|2,0,0]=4 1943 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000757094 [0,2,0,0,0,0|2,0,0]=4 1944 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000757094 [0,2,0,0,0,0|2,0,0]=4 1945 B16R1.1225 C=CCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000757094 [0,2,0,0,0,0|2,0,0]=4 1946 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])Br 2230a_100015191253_100012353686 [0,2,0,0,0,0|1,0,1]=4 1947 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])C 207a_100015191253_100000050315 [0,2,0,0,0,0|1,0,1]=4 1948 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])C 2230a_100015191253_200009879986 [0,2,0,0,0,0|1,0,1]=4 1949 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])Cl 2230a_100015191253_100000748067 [0,2,0,0,0,0|1,0,1]=4 1950 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])F 2230a_100015191253_100012145688 [0,2,0,0,0,0|1,0,1]=4 1951 B16R1.1225 C=CCCNCc1ccc(cc1[N+](=O)[O-])I 2230a_100015191253_200010171343 [0,2,0,0,0,0|1,0,1]=4 1952 B16R1.1225 C=COCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000039644 [0,2,0,0,0,0|1,0,1]=4 1953 B16R1.1225 CC/C=C\CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100103147603 [0,2,0,0,0,0|1,0,1]=4 1954 B16R1.1225 CCC#CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100009813939 [0,2,0,0,0,0|1,0,1]=4 1955 B16R1.1225 CCCC=NNc1ccc(cc1[N+](=O)[O-])Br 4a_100011218155_100000185831 [0,2,0,0,0,0|1,0,1]=4 1956 B16R1.1225 CCCCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000718602 [0,2,0,0,0,0|1,0,0]=3 1957 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000718602 [0,2,0,0,0,0|2,0,0]=4 1958 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000210326 [0,2,0,0,0,0|2,0,0]=4 1959 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000718602 [0,2,0,0,0,0|2,0,0]=4 1960 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000210326 [0,2,0,0,0,0|2,0,0]=4 1961 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000718602 [0,2,0,0,0,0|2,0,0]=4 1962 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000210326 [0,2,0,0,0,0|2,0,0]=4 1963 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000718602 [0,2,0,0,0,0|2,0,0]=4 1964 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000210326 [0,2,0,0,0,0|2,0,0]=4 1965 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000210326 [0,2,0,0,0,0|2,0,0]=4 1966 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000718602 [0,2,0,0,0,0|2,0,0]=4 1967 B16R1.1225 CCCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000210326 [0,2,0,0,0,0|2,0,0]=4 1968 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])Br 2230a_100000102301_100012353686 [0,2,0,0,0,0|1,0,0]=3 1969 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])Br 7a_106832991798_100012353686 [0,2,0,0,0,0|1,0,0]=3 1970 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])C 207a_100000102301_100000050315 [0,2,0,0,0,0|1,0,0]=3 1971 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])C 2230a_100000102301_200009879986 [0,2,0,0,0,0|1,0,0]=3 1972 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])C 7a_106832991798_200009879986 [0,2,0,0,0,0|1,0,0]=3 1973 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])Cl 2230a_100000102301_100000748067 [0,2,0,0,0,0|1,0,0]=3 1974 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])Cl 7a_106832991798_100000748067 [0,2,0,0,0,0|1,0,0]=3 1975 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])F 2230a_100000102301_100012145688 [0,2,0,0,0,0|1,0,0]=3 1976 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])F 7a_106832991798_100012145688 [0,2,0,0,0,0|1,0,0]=3 1977 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])I 2230a_100000102301_200010171343 [0,2,0,0,0,0|1,0,0]=3 1978 B16R1.1225 CCCCNCc1ccc(cc1[N+](=O)[O-])I 7a_106832991798_200010171343 [0,2,0,0,0,0|1,0,0]=3 1979 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100000210227_100012353686 [0,2,0,0,0,0|2,0,0]=4 1980 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Br 7a_100000210227_100012353686 [0,2,0,0,0,0|2,0,0]=4 1981 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Br 7a_100012353685_100000210211 [0,2,0,0,0,0|2,0,0]=4 1982 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])C 34a_100000210227_200009879986 [0,2,0,0,0,0|2,0,0]=4 1983 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])C 7a_100000087798_100000210211 [0,2,0,0,0,0|2,0,0]=4 1984 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])C 7a_100000210227_200009879986 [0,2,0,0,0,0|2,0,0]=4 1985 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000210227_100000748067 [0,2,0,0,0,0|2,0,0]=4 1986 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Cl 7a_100000210227_100000748067 [0,2,0,0,0,0|2,0,0]=4 1987 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])Cl 7a_100011219603_100000210211 [0,2,0,0,0,0|2,0,0]=4 1988 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000085351_100000210210 [0,2,0,0,0,0|2,0,0]=4 1989 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000210227_100012145688 [0,2,0,0,0,0|2,0,0]=4 1990 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])F 7a_100000085351_100000210211 [0,2,0,0,0,0|2,0,0]=4 1991 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])F 7a_100000210227_100012145688 [0,2,0,0,0,0|2,0,0]=4 1992 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])I 34a_100000210227_200010171343 [0,2,0,0,0,0|2,0,0]=4 1993 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])I 7a_100000210227_200010171343 [0,2,0,0,0,0|2,0,0]=4 1994 B16R1.1225 CCCCOCc1ccc(cc1[N+](=O)[O-])I 7a_200000049922_100000210211 [0,2,0,0,0,0|2,0,0]=4 1995 B16R1.1225 CCCCSCc1ccc(cc1[N+](=O)[O-])Br 62a_100012353686_100000210210 [0,2,0,0,0,0|2,0,0]=4 1996 B16R1.1225 CCCCSCc1ccc(cc1[N+](=O)[O-])F 62a_100012145688_100000210210 [0,2,0,0,0,0|2,0,0]=4 1997 B16R1.1225 CCCCSCc1ccc(cc1[N+](=O)[O-])I 62a_200010171343_100000210210 [0,2,0,0,0,0|2,0,0]=4 1998 B16R1.1225 CCOCCNc1ccc(cc1[N+](=O)[O-])Br 7a_200000176067_100000210202 [0,2,0,0,0,0|1,0,0]=3 1999 B16R1.1225 CCOCCNc1ccc(cc1[N+](=O)[O-])C 7a_200011273385_100000210202 [0,2,0,0,0,0|1,0,0]=3 2000 B16R1.1225 CCOCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000210147 [0,2,0,0,0,0|1,0,0]=3 2001 B16R1.1225 CCOCCNc1ncc(cc1[N+](=O)[O-])Br 7a_200011432938_100000210202 [0,2,0,0,0,0|2,0,0]=4 2002 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000210147 [0,2,0,0,0,0|2,0,0]=4 2003 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100011215890 [0,2,0,0,0,0|2,0,0]=4 2004 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000210147 [0,2,0,0,0,0|2,0,0]=4 2005 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100011215890 [0,2,0,0,0,0|2,0,0]=4 2006 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000210147 [0,2,0,0,0,0|2,0,0]=4 2007 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100011215890 [0,2,0,0,0,0|2,0,0]=4 2008 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000210147 [0,2,0,0,0,0|2,0,0]=4 2009 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100011215890 [0,2,0,0,0,0|2,0,0]=4 2010 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100011215890 [0,2,0,0,0,0|2,0,0]=4 2011 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000210147 [0,2,0,0,0,0|2,0,0]=4 2012 B16R1.1225 CCOCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100011215890 [0,2,0,0,0,0|2,0,0]=4 2013 B16R1.1225 CCSCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000757381 [0,2,0,0,0,0|1,0,0]=3 2014 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000757381 [0,2,0,0,0,0|2,0,0]=4 2015 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000757381 [0,2,0,0,0,0|2,0,0]=4 2016 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000757381 [0,2,0,0,0,0|2,0,0]=4 2017 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000757381 [0,2,0,0,0,0|2,0,0]=4 2018 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000757381 [0,2,0,0,0,0|2,0,0]=4 2019 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000757381 [0,2,0,0,0,0|2,0,0]=4 2020 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000757381 [0,2,0,0,0,0|2,0,0]=4 2021 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000757381 [0,2,0,0,0,0|2,0,0]=4 2022 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000757381 [0,2,0,0,0,0|2,0,0]=4 2023 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000757381 [0,2,0,0,0,0|2,0,0]=4 2024 B16R1.1225 CCSCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000757381 [0,2,0,0,0,0|2,0,0]=4 2025 B16R1.1225 COCCCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000740836 [0,2,0,0,0,0|1,0,0]=3 2026 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000740836 [0,2,0,0,0,0|2,0,0]=4 2027 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000740836 [0,2,0,0,0,0|2,0,0]=4 2028 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000740836 [0,2,0,0,0,0|2,0,0]=4 2029 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000740836 [0,2,0,0,0,0|2,0,0]=4 2030 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000740836 [0,2,0,0,0,0|2,0,0]=4 2031 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000740836 [0,2,0,0,0,0|2,0,0]=4 2032 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000740836 [0,2,0,0,0,0|2,0,0]=4 2033 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000740836 [0,2,0,0,0,0|2,0,0]=4 2034 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000740836 [0,2,0,0,0,0|2,0,0]=4 2035 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000740836 [0,2,0,0,0,0|2,0,0]=4 2036 B16R1.1225 COCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000740836 [0,2,0,0,0,0|2,0,0]=4 2037 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])Br 2230a_100000209980_100012353686 [0,2,0,0,0,0|2,0,0]=4 2038 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])C 207a_100000209980_100000050315 [0,2,0,0,0,0|2,0,0]=4 2039 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])C 2230a_100000209980_200009879986 [0,2,0,0,0,0|2,0,0]=4 2040 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])Cl 2230a_100000209980_100000748067 [0,2,0,0,0,0|2,0,0]=4 2041 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])F 2230a_100000209980_100012145688 [0,2,0,0,0,0|2,0,0]=4 2042 B16R1.1225 COCCNCc1ccc(cc1[N+](=O)[O-])I 2230a_100000209980_200010171343 [0,2,0,0,0,0|2,0,0]=4 2043 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])Br 2230a_100020590264_100012353686 [0,2,0,0,0,0|2,0,0]=4 2044 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])C 207a_100020590264_100000050315 [0,2,0,0,0,0|2,0,0]=4 2045 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])C 2230a_100020590264_200009879986 [0,2,0,0,0,0|2,0,0]=4 2046 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])Cl 2230a_100020590264_100000748067 [0,2,0,0,0,0|2,0,0]=4 2047 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])F 2230a_100020590264_100012145688 [0,2,0,0,0,0|2,0,0]=4 2048 B16R1.1225 CSCCNCc1ccc(cc1[N+](=O)[O-])I 2230a_100020590264_200010171343 [0,2,0,0,0,0|2,0,0]=4 2049 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])CNCCCF 207a_100015189416_100000050315 [0,2,0,0,0,0|1,0,0]=3 2050 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])CNCCCF 2230a_100015189416_200009879986 [0,2,0,0,0,0|1,0,0]=3 2051 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])CNCCCF 34a_100015189416_200009879986 [0,2,0,0,0,0|1,0,0]=3 2052 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])CNCCCO 207a_100000182051_100000050315 [0,2,0,0,0,0|1,0,0]=3 2053 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCBr 34a_100011217188_200009879986 [0,2,0,0,0,0|2,0,0]=4 2054 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCCl 34a_100000230001_200009879986 [0,2,0,0,0,0|2,0,0]=4 2055 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCF 34a_100000759539_200009879986 [0,2,0,0,0,0|2,0,0]=4 2056 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCF 7a_100000087798_100011934791 [0,2,0,0,0,0|2,0,0]=4 2057 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCN 34a_100000182051_200009879986 [0,2,0,0,0,0|1,0,0]=3 2058 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCCO 7a_100000087798_100011215043 [0,2,0,0,0,0|2,0,0]=4 2059 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])COCCON 34a_100000700252_200009879986 [0,2,0,0,0,0|2,0,0]=4 2060 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])NCCOCF 7a_200011273385_100015361967 [0,2,0,0,0,0|1,0,0]=3 2061 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCC#N 7a_100000195567_100000687738 [0,2,0,0,0,0|1,0,1]=4 2062 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCC=O 7a_100000195567_200011292268 [0,2,0,0,0,0|2,0,0]=4 2063 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCCF 34a_100000195567_100000729493 [0,2,0,0,0,0|2,0,0]=4 2064 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCCF 7a_100000195567_100000729493 [0,2,0,0,0,0|2,0,0]=4 2065 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCCO 34a_100000195567_100011216708 [0,2,0,0,0,0|2,0,0]=4 2066 B16R1.1225 Cc1ccc(c(c1)[N+](=O)[O-])OCCCCO 7a_100000195567_100000210776 [0,2,0,0,0,0|2,0,0]=4 2067 B16R1.1225 N#CCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000687738 [0,2,0,0,0,0|1,0,1]=4 2068 B16R1.1225 N#CCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000687738 [0,2,0,0,0,0|1,0,1]=4 2069 B16R1.1225 N#CCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000687738 [0,2,0,0,0,0|1,0,1]=4 2070 B16R1.1225 N#CCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000687738 [0,2,0,0,0,0|1,0,1]=4 2071 B16R1.1225 N#CCCCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000687738 [0,2,0,0,0,0|1,0,1]=4 2072 B16R1.1225 NCCCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100000182051_100012353686 [0,2,0,0,0,0|1,0,0]=3 2073 B16R1.1225 NCCCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000182051_100000748067 [0,2,0,0,0,0|1,0,0]=3 2074 B16R1.1225 NCCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000182051_100012145688 [0,2,0,0,0,0|1,0,0]=3 2075 B16R1.1225 NCCCOCc1ccc(cc1[N+](=O)[O-])I 34a_100000182051_200010171343 [0,2,0,0,0,0|1,0,0]=3 2076 B16R1.1225 NOCCOCc1ccc(cc1[N+](=O)[O-])Br 34a_100000700252_100012353686 [0,2,0,0,0,0|2,0,0]=4 2077 B16R1.1225 NOCCOCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000700252_100000748067 [0,2,0,0,0,0|2,0,0]=4 2078 B16R1.1225 NOCCOCc1ccc(cc1[N+](=O)[O-])F 34a_100000700252_100012145688 [0,2,0,0,0,0|2,0,0]=4 2079 B16R1.1225 NOCCOCc1ccc(cc1[N+](=O)[O-])I 34a_100000700252_200010171343 [0,2,0,0,0,0|2,0,0]=4 2080 B16R1.1225 Nc1ccc(c(c1)[N+](=O)[O-])OCCCC=O 7a_100000032192_200011292268 [0,2,0,0,0,0|2,0,0]=4 2081 B16R1.1225 Nc1ccc(c(c1)[N+](=O)[O-])OCCCCF 34a_100000032192_100000729493 [0,2,0,0,0,0|2,0,0]=4 2082 B16R1.1225 Nc1ccc(c(c1)[N+](=O)[O-])OCCCCF 7a_100000032192_100000729493 [0,2,0,0,0,0|2,0,0]=4 2083 B16R1.1225 Nc1ccc(c(c1)[N+](=O)[O-])OCCCCO 34a_100000032192_100011216708 [0,2,0,0,0,0|2,0,0]=4 2084 B16R1.1225 Nc1ccc(c(c1)[N+](=O)[O-])OCCCCO 7a_100000032192_100000210776 [0,2,0,0,0,0|2,0,0]=4 2085 B16R1.1225 O=CCCCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_200011292268 [0,2,0,0,0,0|2,0,0]=4 2086 B16R1.1225 O=CCCCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_200011292268 [0,2,0,0,0,0|2,0,0]=4 2087 B16R1.1225 O=CCCCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_200011292268 [0,2,0,0,0,0|2,0,0]=4 2088 B16R1.1225 O=CCCCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200011292268 [0,2,0,0,0,0|2,0,0]=4 2089 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)Br 2230a_100015189416_100012353686 [0,2,0,0,0,0|1,0,0]=3 2090 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)Br 34a_100015189416_100012353686 [0,2,0,0,0,0|1,0,0]=3 2091 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)Cl 2230a_100015189416_100000748067 [0,2,0,0,0,0|1,0,0]=3 2092 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)Cl 34a_100015189416_100000748067 [0,2,0,0,0,0|1,0,0]=3 2093 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)F 2230a_100015189416_100012145688 [0,2,0,0,0,0|1,0,0]=3 2094 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)F 34a_100015189416_100012145688 [0,2,0,0,0,0|1,0,0]=3 2095 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)I 2230a_100015189416_200010171343 [0,2,0,0,0,0|1,0,0]=3 2096 B16R1.1225 O=[N+]([O-])c1cc(ccc1CNCCCF)I 34a_100015189416_200010171343 [0,2,0,0,0,0|1,0,0]=3 2097 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCBr)Br 34a_100011217188_100012353686 [0,2,0,0,0,0|2,0,0]=4 2098 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCBr)Cl 34a_100011217188_100000748067 [0,2,0,0,0,0|2,0,0]=4 2099 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCBr)F 34a_100011217188_100012145688 [0,2,0,0,0,0|2,0,0]=4 2100 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCBr)I 34a_100011217188_200010171343 [0,2,0,0,0,0|2,0,0]=4 2101 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCCl)Br 34a_100000230001_100012353686 [0,2,0,0,0,0|2,0,0]=4 2102 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCCl)Cl 34a_100000230001_100000748067 [0,2,0,0,0,0|2,0,0]=4 2103 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCCl)F 34a_100000230001_100012145688 [0,2,0,0,0,0|2,0,0]=4 2104 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCCl)I 34a_100000230001_200010171343 [0,2,0,0,0,0|2,0,0]=4 2105 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)Br 34a_100000759539_100012353686 [0,2,0,0,0,0|2,0,0]=4 2106 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)Br 7a_100012353685_100011934791 [0,2,0,0,0,0|2,0,0]=4 2107 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)Cl 34a_100000759539_100000748067 [0,2,0,0,0,0|2,0,0]=4 2108 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)Cl 7a_100011219603_100011934791 [0,2,0,0,0,0|2,0,0]=4 2109 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)F 34a_100000085351_100011934791 [0,2,0,0,0,0|2,0,0]=4 2110 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)F 34a_100000759539_100012145688 [0,2,0,0,0,0|2,0,0]=4 2111 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)F 7a_100000085351_100011934791 [0,2,0,0,0,0|2,0,0]=4 2112 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)I 34a_100000759539_200010171343 [0,2,0,0,0,0|2,0,0]=4 2113 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCF)I 7a_200000049922_100011934791 [0,2,0,0,0,0|2,0,0]=4 2114 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCO)Br 7a_100012353685_100011215043 [0,2,0,0,0,0|2,0,0]=4 2115 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCO)Cl 7a_100011219603_100011215043 [0,2,0,0,0,0|2,0,0]=4 2116 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCO)F 34a_100000085351_100000230001 [0,2,0,0,0,0|2,0,0]=4 2117 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCO)F 7a_100000085351_100011215043 [0,2,0,0,0,0|2,0,0]=4 2118 B16R1.1225 O=[N+]([O-])c1cc(ccc1COCCCO)I 7a_200000049922_100011215043 [0,2,0,0,0,0|2,0,0]=4 2119 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCF)Br 62a_100012353686_100011934791 [0,2,0,0,0,0|2,0,0]=4 2120 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCF)F 62a_100012145688_100011934791 [0,2,0,0,0,0|2,0,0]=4 2121 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCF)I 62a_200010171343_100011934791 [0,2,0,0,0,0|2,0,0]=4 2122 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCO)Br 62a_100012353686_100011215043 [0,2,0,0,0,0|2,0,0]=4 2123 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCO)F 62a_100012145688_100011215043 [0,2,0,0,0,0|2,0,0]=4 2124 B16R1.1225 O=[N+]([O-])c1cc(ccc1CSCCCO)I 62a_200010171343_100011215043 [0,2,0,0,0,0|2,0,0]=4 2125 B16R1.1225 O=[N+]([O-])c1cc(ccc1NCC#CCO)F 34a_100000187532_200000047223 [0,2,0,0,0,0|1,0,1]=4 2126 B16R1.1225 O=[N+]([O-])c1cc(ccc1NCCCCF)F 34a_100000187532_100000729493 [0,2,0,0,0,0|1,0,0]=3 2127 B16R1.1225 O=[N+]([O-])c1cc(ccc1NCCCCO)F 34a_100000187532_100011216708 [0,2,0,0,0,0|1,0,0]=3 2128 B16R1.1225 O=[N+]([O-])c1cc(ccc1NCCOCF)Br 7a_200000176067_100015361967 [0,2,0,0,0,0|1,0,0]=3 2129 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)Br 34a_100000757407_100000729493 [0,2,0,0,0,0|2,0,0]=4 2130 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)Br 7a_100000757407_100000729493 [0,2,0,0,0,0|2,0,0]=4 2131 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)Cl 34a_100000212152_100000729493 [0,2,0,0,0,0|2,0,0]=4 2132 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)Cl 7a_100000212152_100000729493 [0,2,0,0,0,0|2,0,0]=4 2133 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)F 34a_100000748789_100000729493 [0,2,0,0,0,0|2,0,0]=4 2134 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)F 7a_100000748789_100000729493 [0,2,0,0,0,0|2,0,0]=4 2135 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCF)I 7a_100000698543_100000729493 [0,2,0,0,0,0|2,0,0]=4 2136 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)Br 34a_100000757407_100011216708 [0,2,0,0,0,0|2,0,0]=4 2137 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)Br 7a_100000757407_100000210776 [0,2,0,0,0,0|2,0,0]=4 2138 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)Cl 34a_100000212152_100011216708 [0,2,0,0,0,0|2,0,0]=4 2139 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)Cl 7a_100000212152_100000210776 [0,2,0,0,0,0|2,0,0]=4 2140 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)F 34a_100000748789_100011216708 [0,2,0,0,0,0|2,0,0]=4 2141 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)F 7a_100000748789_100000210776 [0,2,0,0,0,0|2,0,0]=4 2142 B16R1.1225 O=[N+]([O-])c1cc(ccc1OCCCCO)I 7a_100000698543_100000210776 [0,2,0,0,0,0|2,0,0]=4 2143 B16R1.1225 O=[N+]([O-])c1cc(cnc1NCCOCF)Br 7a_200011432938_100015361967 [0,2,0,0,0,0|2,0,0]=4 2144 B16R1.1730 C#CCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000731252 [0,2,0,0,0,0|2,0,0]=4 2145 B16R1.1730 C#CCCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000731252 [0,2,0,0,0,0|1,0,0]=3 2146 B16R1.1730 C#CCCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011215417 [0,2,0,0,0,0|1,0,0]=3 2147 B16R1.1730 C#CCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100000755551_100000188706 [0,2,0,0,0,0|1,0,1]=4 2148 B16R1.1730 C#CCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000755551_100000188706 [0,2,0,0,0,0|1,0,1]=4 2149 B16R1.1730 C#CCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000755551_100000188706 [0,2,0,0,0,0|1,0,1]=4 2150 B16R1.1730 C#CCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000755551_100000188706 [0,2,0,0,0,0|1,0,1]=4 2151 B16R1.1730 C#CCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000688953 [0,2,0,0,0,0|1,0,1]=4 2152 B16R1.1730 C=CCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000757094 [0,2,0,0,0,0|2,0,0]=4 2153 B16R1.1730 C=CCCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011713584 [0,2,0,0,0,0|1,0,0]=3 2154 B16R1.1730 C=CCCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000757094 [0,2,0,0,0,0|1,0,0]=3 2155 B16R1.1730 C=CCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100015191253_100000188706 [0,2,0,0,0,0|1,0,1]=4 2156 B16R1.1730 C=CCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100015191253_100000188706 [0,2,0,0,0,0|1,0,1]=4 2157 B16R1.1730 C=CCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100015191253_100000188706 [0,2,0,0,0,0|1,0,1]=4 2158 B16R1.1730 C=CCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100015191253_100000188706 [0,2,0,0,0,0|1,0,1]=4 2159 B16R1.1730 C=CCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000754431 [0,2,0,0,0,0|1,0,1]=4 2160 B16R1.1730 C=COCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000039644 [0,2,0,0,0,0|1,0,1]=4 2161 B16R1.1730 C=COCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000039644 [0,2,0,0,0,0|1,0,1]=4 2162 B16R1.1730 CC(OCCCF)c1ccccc1[N+](=O)[O-] 7a_100000246502_100011934791 [0,2,0,0,0,0|2,0,0]=4 2163 B16R1.1730 CC(OCCCO)c1ccccc1[N+](=O)[O-] 7a_100000246502_100011215043 [0,2,0,0,0,0|2,0,0]=4 2164 B16R1.1730 CC/C=C\CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100103147603 [0,2,0,0,0,0|1,0,1]=4 2165 B16R1.1730 CC/C=C\CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100103147603 [0,2,0,0,0,0|1,0,1]=4 2166 B16R1.1730 CCC#CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100009813939 [0,2,0,0,0,0|1,0,1]=4 2167 B16R1.1730 CCCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210326 [0,2,0,0,0,0|2,0,0]=4 2168 B16R1.1730 CCCCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210326 [0,2,0,0,0,0|1,0,0]=3 2169 B16R1.1730 CCCCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210215 [0,2,0,0,0,0|1,0,0]=3 2170 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100000102301_100000188706 [0,2,0,0,0,0|1,0,0]=3 2171 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000102301_100000188706 [0,2,0,0,0,0|1,0,0]=3 2172 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000102301_100000188706 [0,2,0,0,0,0|1,0,0]=3 2173 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000102301_100000188706 [0,2,0,0,0,0|1,0,0]=3 2174 B16R1.1730 CCCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000210211 [0,2,0,0,0,0|1,0,0]=3 2175 B16R1.1730 CCCCOC(C)c1ccccc1[N+](=O)[O-] 7a_100000246502_100000210211 [0,2,0,0,0,0|2,0,0]=4 2176 B16R1.1730 CCCNNC(=O)c1ccccc1[N+](=O)[O-] 22a_100000740057_100000188706 [0,2,0,0,0,0|2,0,0]=4 2177 B16R1.1730 CCCSCC(=O)c1ccccc1[N+](=O)[O-] 62a_100011219728_100000210303 [0,2,0,0,0,0|2,0,0]=4 2178 B16R1.1730 CCOCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011215890 [0,2,0,0,0,0|2,0,0]=4 2179 B16R1.1730 CCOCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011215890 [0,2,0,0,0,0|1,0,0]=3 2180 B16R1.1730 CCOCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011215890 [0,2,0,0,0,0|1,0,0]=3 2181 B16R1.1730 CCSCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000757381 [0,2,0,0,0,0|2,0,0]=4 2182 B16R1.1730 CCSCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000757381 [0,2,0,0,0,0|1,0,0]=3 2183 B16R1.1730 CCSCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000757381 [0,2,0,0,0,0|1,0,0]=3 2184 B16R1.1730 CN(CC#CCO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_200000047223 [0,2,0,0,0,0|1,0,1]=4 2185 B16R1.1730 CN(CCCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000687738 [0,2,0,0,0,0|0,0,1]=3 2186 B16R1.1730 CN(CCCC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000687738 [0,2,0,0,0,0|0,0,1]=3 2187 B16R1.1730 CN(CCCC=O)c1ccccc1[N+](=O)[O-] 2230a_100000156515_200011292268 [0,2,0,0,0,0|1,0,0]=3 2188 B16R1.1730 CN(CCCC=O)c1ccccc1[N+](=O)[O-] 269982a_100000156515_200011292268 [0,2,0,0,0,0|1,0,0]=3 2189 B16R1.1730 CN(CCCCF)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000729493 [0,2,0,0,0,0|1,0,0]=3 2190 B16R1.1730 CN(CCCCF)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000729493 [0,2,0,0,0,0|1,0,0]=3 2191 B16R1.1730 CN(CCCCO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210776 [0,2,0,0,0,0|1,0,0]=3 2192 B16R1.1730 CN(CCCCO)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210776 [0,2,0,0,0,0|1,0,0]=3 2193 B16R1.1730 CN(CCSC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000034367 [0,2,0,0,0,0|0,0,2]=4 2194 B16R1.1730 COCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000740836 [0,2,0,0,0,0|2,0,0]=4 2195 B16R1.1730 COCCCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000740836 [0,2,0,0,0,0|1,0,0]=3 2196 B16R1.1730 COCCCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000740836 [0,2,0,0,0,0|1,0,0]=3 2197 B16R1.1730 COCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000209980_100000188706 [0,2,0,0,0,0|2,0,0]=4 2198 B16R1.1730 COCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000209980_100000188706 [0,2,0,0,0,0|2,0,0]=4 2199 B16R1.1730 COCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000209980_100000188706 [0,2,0,0,0,0|2,0,0]=4 2200 B16R1.1730 COCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100011201679 [0,2,0,0,0,0|2,0,0]=4 2201 B16R1.1730 CSCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100020590264_100000188706 [0,2,0,0,0,0|2,0,0]=4 2202 B16R1.1730 CSCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100020590264_100000188706 [0,2,0,0,0,0|2,0,0]=4 2203 B16R1.1730 CSCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100020590264_100000188706 [0,2,0,0,0,0|2,0,0]=4 2204 B16R1.1730 CSCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100020590264_100000188706 [0,2,0,0,0,0|2,0,0]=4 2205 B16R1.1730 CSCCN[C@H](C)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000751147 [0,2,0,0,0,0|2,0,0]=4 2206 B16R1.1730 C[C@@H](NCCC#N)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100011215226 [0,2,0,0,0,0|0,0,2]=4 2207 B16R1.1730 C[C@@H](NCCCF)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100011934791 [0,2,0,0,0,0|1,0,0]=3 2208 B16R1.1730 C[C@@H](NCCCO)c1ccccc1[N+](=O)[O-] 2230a_100025717333_100000230001 [0,2,0,0,0,0|1,0,0]=3 2209 B16R1.1730 N#CCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000211468 [0,2,0,0,0,0|1,0,1]=4 2210 B16R1.1730 N#CCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100000720768_100000188706 [0,2,0,0,0,0|0,0,2]=4 2211 B16R1.1730 N#CCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000720768_100000188706 [0,2,0,0,0,0|0,0,2]=4 2212 B16R1.1730 N#CCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000720768_100000188706 [0,2,0,0,0,0|0,0,2]=4 2213 B16R1.1730 N#CCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000720768_100000188706 [0,2,0,0,0,0|0,0,2]=4 2214 B16R1.1730 O=C(CCCCF)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000729493 [0,2,0,0,0,0|2,0,0]=4 2215 B16R1.1730 O=C(CCCCO)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210776 [0,2,0,0,0,0|2,0,0]=4 2216 B16R1.1730 O=C(CNCCO)c1ccccc1[N+](=O)[O-] 2230a_100016997473_100011219728 [0,2,0,0,0,0|2,0,0]=4 2217 B16R1.1730 O=C(CSCCF)c1ccccc1[N+](=O)[O-] 62a_100011219728_100011217306 [0,2,0,0,0,0|2,0,0]=4 2218 B16R1.1730 O=C(CSCCO)c1ccccc1[N+](=O)[O-] 62a_100011219728_100000211926 [0,2,0,0,0,0|2,0,0]=4 2219 B16R1.1730 O=C(NCCCF)c1ccccc1[N+](=O)[O-] 11a_100015189416_100000188706 [0,2,0,0,0,0|1,0,0]=3 2220 B16R1.1730 O=C(NCCCF)c1ccccc1[N+](=O)[O-] 1626a_100015189416_100000188706 [0,2,0,0,0,0|1,0,0]=3 2221 B16R1.1730 O=C(NCCCF)c1ccccc1[N+](=O)[O-] 240690a_100015189416_100000188706 [0,2,0,0,0,0|1,0,0]=3 2222 B16R1.1730 O=C(NCCCF)c1ccccc1[N+](=O)[O-] 527a_100015189416_100000188706 [0,2,0,0,0,0|1,0,0]=3 2223 B16R1.1730 O=C(NCCCO)c1ccccc1[N+](=O)[O-] 240690a_100000182051_100000188706 [0,2,0,0,0,0|1,0,0]=3 2224 B16R1.1730 O=C(NCCCO)c1ccccc1[N+](=O)[O-] 527a_100000182051_100000188706 [0,2,0,0,0,0|1,0,0]=3 2225 B16R1.1730 O=C(NNCCO)c1ccccc1[N+](=O)[O-] 22a_100000210001_100000188706 [0,2,0,0,0,0|2,0,0]=4 2226 B16R1.3262 C=C[C@H](N)COCc1ccccc1[N+](=O)[O-] 34a_100016989147_100000181388 [0,2,0,0,0,0|2,0,0]=4 2227 B16R1.3262 CC(CF)OCCc1ccccc1[N+](=O)[O-] 34a_100016041109_200011934512 [0,2,0,0,0,0|2,0,0]=4 2228 B16R1.3262 CC(CF)OCCc1ccccc1[N+](=O)[O-] 7a_100016041109_200011934512 [0,2,0,0,0,0|2,0,0]=4 2229 B16R1.3262 CC(CN)COCc1ccccc1[N+](=O)[O-] 34a_100000744482_100000181388 [0,2,0,0,0,0|1,0,0]=3 2230 B16R1.3262 CC(CN)OCCc1ccccc1[N+](=O)[O-] 34a_100000210904_200011934512 [0,2,0,0,0,0|1,0,0]=3 2231 B16R1.3262 CC(CO)CNCc1ccccc1[N+](=O)[O-] 34a_100000744482_100000181388 [0,2,0,0,0,0|1,0,0]=3 2232 B16R1.3262 CC(CO)NCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100012180447 [0,2,0,0,0,0|2,0,0]=4 2233 B16R1.3262 CC(CO)OCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100012180447 [0,2,0,0,0,0|2,0,0]=4 2234 B16R1.3262 CC(CO)OCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100012180447 [0,2,0,0,0,0|2,0,0]=4 2235 B16R1.3262 CCC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000210414_100000741959 [0,2,0,0,0,0|2,0,0]=4 2236 B16R1.3262 CCC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_100000210202 [0,2,0,0,0,0|2,0,0]=4 2237 B16R1.3262 CCC(C)C=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000243153 [0,2,0,0,0,0|1,0,1]=4 2238 B16R1.3262 CCC(C)CNCc1ccccc1[N+](=O)[O-] 2230a_100020588543_100000181388 [0,2,0,0,0,0|1,0,0]=3 2239 B16R1.3262 CCC(C)CNCc1ccccc1[N+](=O)[O-] 270004a_100000740939_100000243153 [0,2,0,0,0,0|1,0,0]=3 2240 B16R1.3262 CCC(C)CNCc1ccccc1[N+](=O)[O-] 270004a_100020588543_100000186027 [0,2,0,0,0,0|1,0,0]=3 2241 B16R1.3262 CCC(C)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000748023 [0,2,0,0,0,0|2,0,0]=4 2242 B16R1.3262 CCC(C)CSCc1ccccc1[N+](=O)[O-] 62a_100000748023_100000181388 [0,2,0,0,0,0|2,0,0]=4 2243 B16R1.3262 CCC(C)NCCc1ccccc1[N+](=O)[O-] 2230a_100000209981_200011934512 [0,2,0,0,0,0|2,0,0]=4 2244 B16R1.3262 CCC(C)NCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000758301 [0,2,0,0,0,0|2,0,0]=4 2245 B16R1.3262 CCC(C)OCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100011215416 [0,2,0,0,0,0|2,0,0]=4 2246 B16R1.3262 CCC(C)OCCc1ccccc1[N+](=O)[O-] 7a_100000210228_200011934512 [0,2,0,0,0,0|2,0,0]=4 2247 B16R1.3262 CCC(C)OCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000758301 [0,2,0,0,0,0|2,0,0]=4 2248 B16R1.3262 CCC(O)CNCc1ccccc1[N+](=O)[O-] 2230a_100011218483_100000181388 [0,2,0,0,0,0|1,0,0]=3 2249 B16R1.3262 CCC(O)CNCc1ccccc1[N+](=O)[O-] 270004a_100011218483_100000186027 [0,2,0,0,0,0|1,0,0]=3 2250 B16R1.3262 CCC(O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100011218378 [0,2,0,0,0,0|2,0,0]=4 2251 B16R1.3262 CCC(O)CSCc1ccccc1[N+](=O)[O-] 62a_100011218378_100000181388 [0,2,0,0,0,0|2,0,0]=4 2252 B16R1.3262 CCN(C)CCOc1ccccc1[N+](=O)[O-] 2230a_100000225621_100000741959 [0,2,0,0,0,0|2,0,0]=4 2253 B16R1.3262 CCN(C)CCOc1ccccc1[N+](=O)[O-] 269982a_100000225621_100000741959 [0,2,0,0,0,0|2,0,0]=4 2254 B16R1.3262 CC[C@H](C)COCc1ccccc1[N+](=O)[O-] 7a_100009816381_100000181388 [0,2,0,0,0,0|2,0,0]=4 2255 B16R1.3262 CC[C@H](C)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100009816398 [0,2,0,0,0,0|2,0,0]=4 2256 B16R1.3262 CC[C@H](C)CSCc1ccccc1[N+](=O)[O-] 62a_100009816398_100000181388 [0,2,0,0,0,0|2,0,0]=4 2257 B16R1.3262 CNC(=O)CCOc1ccccc1[N+](=O)[O-] 1626a_100102657272_100000244353 [0,2,0,0,0,0|1,0,1]=4 2258 B16R1.3262 CNC(=O)CCOc1ccccc1[N+](=O)[O-] 240690a_100102657272_100000244353 [0,2,0,0,0,0|1,0,1]=4 2259 B16R1.3262 CNC(=O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100012179268 [0,2,0,0,0,0|1,0,1]=4 2260 B16R1.3262 CNC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000737683 [0,2,0,0,0,0|1,0,1]=4 2261 B16R1.3262 CO[C@H](C)CNCc1ccccc1[N+](=O)[O-] 2230a_100020591295_100000181388 [0,2,0,0,0,0|2,0,0]=4 2262 B16R1.3262 CO[C@H](C)CNCc1ccccc1[N+](=O)[O-] 270004a_100020591295_100000186027 [0,2,0,0,0,0|2,0,0]=4 2263 B16R1.3262 C[C@@H](CO)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000059175 [0,2,0,0,0,0|2,0,0]=4 2264 B16R1.3262 C[C@@H](CO)CSCc1ccccc1[N+](=O)[O-] 62a_100000059175_100000181388 [0,2,0,0,0,0|2,0,0]=4 2265 B16R1.3262 C[C@H](CO)NCCc1ccccc1[N+](=O)[O-] 2230a_100000737577_200011934512 [0,2,0,0,0,0|2,0,0]=4 2266 B16R1.3262 NC[C@@H](F)COCc1ccccc1[N+](=O)[O-] 34a_100015665980_100000181388 [0,2,0,0,0,0|1,0,0]=3 2267 B16R1.3262 O=C(CF)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_100015361967 [0,2,0,0,0,0|2,0,0]=4 2268 B16R1.3262 O=C(CO)CCOc1ccccc1[N+](=O)[O-] 1458a_100000210174_100000741959 [0,2,0,0,0,0|2,0,0]=4 2269 B16R1.3262 O=[N+]([O-])c1ccccc1CNC[C@@H](F)CO 270004a_100015665980_100000186027 [0,2,0,0,0,0|1,0,0]=3 2270 B16R1.3262 O=[N+]([O-])c1ccccc1CNC[C@@H](F)CO 34a_100015665980_100000181388 [0,2,0,0,0,0|1,0,0]=3 2271 B16R1.3262 O=[N+]([O-])c1ccccc1CNC[C@H](O)CO 2230a_100020644852_100000181388 [0,2,0,0,0,0|1,0,0]=3 2272 B16R1.3262 O=[N+]([O-])c1ccccc1COCC(Cl)CCl 34a_100000033668_100000181388 [0,2,0,0,0,0|2,0,0]=4 2273 B16R1.3262 O=[N+]([O-])c1ccccc1COCC(O)CO 7a_100011218404_100011219619 [0,2,0,0,0,0|2,0,0]=4 2274 B16R1.3262 O=[N+]([O-])c1ccccc1COC[C@@H](O)CF 7a_100011218404_100015614560 [0,2,0,0,0,0|2,0,0]=4 2275 B16R1.3262 O=[N+]([O-])c1ccccc1COC[C@@H](O)CO 7a_100011218404_100009815848 [0,2,0,0,0,0|2,0,0]=4 2276 B16R1.3262 O=[N+]([O-])c1ccccc1CSCC(O)CO 62a_100011219619_100000181388 [0,2,0,0,0,0|2,0,0]=4 2277 B16R1.3262 O=[N+]([O-])c1ccccc1CSC[C@@H](O)CF 62a_100015614560_100000181388 [0,2,0,0,0,0|2,0,0]=4 2278 B16R1.3262 O=[N+]([O-])c1ccccc1CSC[C@@H](O)CO 62a_100009815848_100000181388 [0,2,0,0,0,0|2,0,0]=4 2279 B16R1.3262 O=[N+]([O-])c1ccccc1NN=CC(O)CO 4a_100000737275_100000033539 [0,2,0,0,0,0|1,0,1]=4 2280 B16R1.3900 C#CCCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100011713443 [0,2,0,0,0,0|1,0,1]=4 2281 B16R1.3900 C#CCCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100010269958 [0,2,0,0,0,0|2,0,0]=4 2282 B16R1.3900 C#CCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100010269958 [0,2,0,0,0,0|2,0,0]=4 2283 B16R1.3900 C#CCCCNCc1ccccc1[N+](=O)[O-] 270004a_100000718082_100000186027 [0,2,0,0,0,0|1,0,0]=3 2284 B16R1.3900 C#CCCCNCc1ccccc1[N+](=O)[O-] 34a_100000718082_100000181388 [0,2,0,0,0,0|1,0,0]=3 2285 B16R1.3900 C#CCCCOCc1ccccc1[N+](=O)[O-] 34a_100000215630_100000181388 [0,2,0,0,0,0|2,0,0]=4 2286 B16R1.3900 C#CCCCOCc1ccccc1[N+](=O)[O-] 7a_100000215630_100000181388 [0,2,0,0,0,0|2,0,0]=4 2287 B16R1.3900 C#CCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100011215417 [0,2,0,0,0,0|2,0,0]=4 2288 B16R1.3900 C#CCCCSCc1ccccc1[N+](=O)[O-] 62a_100011215417_100000181388 [0,2,0,0,0,0|2,0,0]=4 2289 B16R1.3900 C#CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000688953 [0,2,0,0,0,0|1,0,1]=4 2290 B16R1.3900 C#CCCNCCc1ccccc1[N+](=O)[O-] 34a_100000755551_200011934512 [0,2,0,0,0,0|1,0,1]=4 2291 B16R1.3900 C#CCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000688953 [0,2,0,0,0,0|2,0,0]=4 2292 B16R1.3900 C#CCCOCCc1ccccc1[N+](=O)[O-] 34a_100011215631_200011934512 [0,2,0,0,0,0|2,0,0]=4 2293 B16R1.3900 C#CCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000688953 [0,2,0,0,0,0|2,0,0]=4 2294 B16R1.3900 C#CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000038162 [0,2,0,0,0,0|2,0,0]=4 2295 B16R1.3900 C#CCNCCOc1ccccc1[N+](=O)[O-] 34a_100000212058_100000741959 [0,2,0,0,0,0|2,0,0]=4 2296 B16R1.3900 C#CCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100000184674 [0,2,0,0,0,0|2,0,0]=4 2297 B16R1.3900 C#CCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100000038162 [0,2,0,0,0,0|2,0,0]=4 2298 B16R1.3900 C#CCOCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100010402529 [0,2,0,0,0,0|2,0,0]=4 2299 B16R1.3900 C#CCOCCOc1ccccc1[N+](=O)[O-] 34a_100000210247_100000741959 [0,2,0,0,0,0|2,0,0]=4 2300 B16R1.3900 C#CCOCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100010402529 [0,2,0,0,0,0|2,0,0]=4 2301 B16R1.3900 C=CCCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100011216789 [0,2,0,0,0,0|1,0,1]=4 2302 B16R1.3900 C=CCCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011215482 [0,2,0,0,0,0|2,0,0]=4 2303 B16R1.3900 C=CCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215482 [0,2,0,0,0,0|2,0,0]=4 2304 B16R1.3900 C=CCCCNCc1ccccc1[N+](=O)[O-] 2230a_100000700776_100000181388 [0,2,0,0,0,0|1,0,0]=3 2305 B16R1.3900 C=CCCCNCc1ccccc1[N+](=O)[O-] 270004a_100000700776_100000186027 [0,2,0,0,0,0|1,0,0]=3 2306 B16R1.3900 C=CCCCNCc1ccccc1[N+](=O)[O-] 34a_100000700776_100000181388 [0,2,0,0,0,0|1,0,0]=3 2307 B16R1.3900 C=CCCCOCc1ccccc1[N+](=O)[O-] 34a_100000758997_100000181388 [0,2,0,0,0,0|2,0,0]=4 2308 B16R1.3900 C=CCCCOCc1ccccc1[N+](=O)[O-] 7a_100000758997_100000181388 [0,2,0,0,0,0|2,0,0]=4 2309 B16R1.3900 C=CCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000757094 [0,2,0,0,0,0|2,0,0]=4 2310 B16R1.3900 C=CCCCSCc1ccccc1[N+](=O)[O-] 62a_100011713584_100000181388 [0,2,0,0,0,0|2,0,0]=4 2311 B16R1.3900 C=CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000754431 [0,2,0,0,0,0|1,0,1]=4 2312 B16R1.3900 C=CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100015191253_200011934512 [0,2,0,0,0,0|1,0,1]=4 2313 B16R1.3900 C=CCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000754431 [0,2,0,0,0,0|2,0,0]=4 2314 B16R1.3900 C=CCCOCCc1ccccc1[N+](=O)[O-] 34a_100011205117_200011934512 [0,2,0,0,0,0|2,0,0]=4 2315 B16R1.3900 C=CCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000754431 [0,2,0,0,0,0|2,0,0]=4 2316 B16R1.3900 C=CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000210623 [0,2,0,0,0,0|2,0,0]=4 2317 B16R1.3900 C=CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586998_100000741959 [0,2,0,0,0,0|2,0,0]=4 2318 B16R1.3900 C=CCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100015514636 [0,2,0,0,0,0|2,0,0]=4 2319 B16R1.3900 C=CCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100015514636 [0,2,0,0,0,0|2,0,0]=4 2320 B16R1.3900 C=CCOCCOc1ccccc1[N+](=O)[O-] 34a_200000210373_100000741959 [0,2,0,0,0,0|2,0,0]=4 2321 B16R1.3900 CC/C=C\CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100015370543 [0,2,0,0,0,0|2,0,0]=4 2322 B16R1.3900 CC/C=C\CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100015370543 [0,2,0,0,0,0|2,0,0]=4 2323 B16R1.3900 CCCCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000210104 [0,2,0,0,0,0|1,0,0]=3 2324 B16R1.3900 CCCCC=NNc1ncccc1[N+](=O)[O-] 4a_100000687566_100000210104 [0,2,0,0,0,0|2,0,0]=4 2325 B16R1.3900 CCCCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000210314 [0,2,0,0,0,0|2,0,0]=4 2326 B16R1.3900 CCCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000210314 [0,2,0,0,0,0|2,0,0]=4 2327 B16R1.3900 CCCCCNCc1ccccc1[N+](=O)[O-] 2230a_100000209983_100000181388 [0,2,0,0,0,0|1,0,0]=3 2328 B16R1.3900 CCCCCNCc1ccccc1[N+](=O)[O-] 270004a_100000209983_100000186027 [0,2,0,0,0,0|1,0,0]=3 2329 B16R1.3900 CCCCCOCc1ccccc1[N+](=O)[O-] 34a_100000210253_100000181388 [0,2,0,0,0,0|2,0,0]=4 2330 B16R1.3900 CCCCCOCc1ccccc1[N+](=O)[O-] 7a_100000210253_100000181388 [0,2,0,0,0,0|2,0,0]=4 2331 B16R1.3900 CCCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210326 [0,2,0,0,0,0|2,0,0]=4 2332 B16R1.3900 CCCCCSCc1ccccc1[N+](=O)[O-] 62a_100000210326_100000181388 [0,2,0,0,0,0|2,0,0]=4 2333 B16R1.3900 CCCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000102301_200011934512 [0,2,0,0,0,0|1,0,0]=3 2334 B16R1.3900 CCCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210211 [0,2,0,0,0,0|1,0,0]=3 2335 B16R1.3900 CCCCNCCc1ccccc1[N+](=O)[O-] 7a_106832991798_200011934512 [0,2,0,0,0,0|1,0,0]=3 2336 B16R1.3900 CCCCNN=Cc1ccccc1[N+](=O)[O-] 4a_100025702795_100000186027 [0,2,0,0,0,0|1,0,0]=3 2337 B16R1.3900 CCCCNN=Cc1ccncc1[N+](=O)[O-] 4a_100025702795_100000731466 [0,2,0,0,0,0|2,0,0]=4 2338 B16R1.3900 CCCCNN=Cc1ncccc1[N+](=O)[O-] 4a_100025702795_100000099571 [0,2,0,0,0,0|2,0,0]=4 2339 B16R1.3900 CCCCOCCc1ccccc1[N+](=O)[O-] 34a_100000210227_200011934512 [0,2,0,0,0,0|2,0,0]=4 2340 B16R1.3900 CCCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000210210 [0,2,0,0,0,0|2,0,0]=4 2341 B16R1.3900 CCCCOCCc1ccccc1[N+](=O)[O-] 7a_100000210227_200011934512 [0,2,0,0,0,0|2,0,0]=4 2342 B16R1.3900 CCCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000210211 [0,2,0,0,0,0|2,0,0]=4 2343 B16R1.3900 CCCCOCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011995733 [0,2,0,0,0,0|2,0,0]=4 2344 B16R1.3900 CCCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000210303 [0,2,0,0,0,0|2,0,0]=4 2345 B16R1.3900 CCCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100000210303 [0,2,0,0,0,0|2,0,0]=4 2346 B16R1.3900 CCCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100000210303 [0,2,0,0,0,0|2,0,0]=4 2347 B16R1.3900 CCCOCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011215938 [0,2,0,0,0,0|2,0,0]=4 2348 B16R1.3900 CCCOCCOc1ccccc1[N+](=O)[O-] 34a_100000210258_100000741959 [0,2,0,0,0,0|2,0,0]=4 2349 B16R1.3900 CCCOCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215938 [0,2,0,0,0,0|2,0,0]=4 2350 B16R1.3900 CCNCCCOc1ccccc1[N+](=O)[O-] 2230a_106726388176_100000210202 [0,2,0,0,0,0|1,0,0]=3 2351 B16R1.3900 CCOCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100012232248 [0,2,0,0,0,0|2,0,0]=4 2352 B16R1.3900 CCOCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100012232248 [0,2,0,0,0,0|2,0,0]=4 2353 B16R1.3900 CCOCCNCc1ccccc1[N+](=O)[O-] 2230a_102516460346_100000181388 [0,2,0,0,0,0|1,0,0]=3 2354 B16R1.3900 CCOCCNCc1ccccc1[N+](=O)[O-] 270004a_102516460346_100000186027 [0,2,0,0,0,0|1,0,0]=3 2355 B16R1.3900 CCOCCNCc1ccccc1[N+](=O)[O-] 34a_102516460346_100000181388 [0,2,0,0,0,0|1,0,0]=3 2356 B16R1.3900 CCOCCOCc1ccccc1[N+](=O)[O-] 34a_100000210136_100000181388 [0,2,0,0,0,0|2,0,0]=4 2357 B16R1.3900 CCOCCOCc1ccccc1[N+](=O)[O-] 7a_100000210136_100000181388 [0,2,0,0,0,0|2,0,0]=4 2358 B16R1.3900 CCOCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100011215890 [0,2,0,0,0,0|2,0,0]=4 2359 B16R1.3900 CCOCCSCc1ccccc1[N+](=O)[O-] 62a_100000210147_100000181388 [0,2,0,0,0,0|2,0,0]=4 2360 B16R1.3900 CCSCCNCc1ccccc1[N+](=O)[O-] 2230a_100000106463_100000181388 [0,2,0,0,0,0|1,0,0]=3 2361 B16R1.3900 CCSCCNCc1ccccc1[N+](=O)[O-] 270004a_100000106463_100000186027 [0,2,0,0,0,0|1,0,0]=3 2362 B16R1.3900 CCSCCOCc1ccccc1[N+](=O)[O-] 34a_100000212035_100000181388 [0,2,0,0,0,0|2,0,0]=4 2363 B16R1.3900 CCSCCOCc1ccccc1[N+](=O)[O-] 7a_100000212035_100000181388 [0,2,0,0,0,0|2,0,0]=4 2364 B16R1.3900 CCSCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000757381 [0,2,0,0,0,0|2,0,0]=4 2365 B16R1.3900 CCSCCSCc1ccccc1[N+](=O)[O-] 62a_100000757381_100000181388 [0,2,0,0,0,0|2,0,0]=4 2366 B16R1.3900 CNCCCOCc1ccccc1[N+](=O)[O-] 34a_100000213112_100000181388 [0,2,0,0,0,0|1,0,0]=3 2367 B16R1.3900 COCCCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000755781 [0,2,0,0,0,0|2,0,0]=4 2368 B16R1.3900 COCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000730899 [0,2,0,0,0,0|2,0,0]=4 2369 B16R1.3900 COCCCNCc1ccccc1[N+](=O)[O-] 270004a_100150723488_100000186027 [0,2,0,0,0,0|1,0,0]=3 2370 B16R1.3900 COCCCNCc1ccccc1[N+](=O)[O-] 34a_100150723488_100000181388 [0,2,0,0,0,0|1,0,0]=3 2371 B16R1.3900 COCCCOCc1ccccc1[N+](=O)[O-] 34a_100000740835_100000181388 [0,2,0,0,0,0|2,0,0]=4 2372 B16R1.3900 COCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000740836 [0,2,0,0,0,0|2,0,0]=4 2373 B16R1.3900 COCCCSCc1ccccc1[N+](=O)[O-] 62a_100000709357_100000181388 [0,2,0,0,0,0|2,0,0]=4 2374 B16R1.3900 COCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000209980_200011934512 [0,2,0,0,0,0|2,0,0]=4 2375 B16R1.3900 COCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100011201679 [0,2,0,0,0,0|2,0,0]=4 2376 B16R1.3900 COCCOCCc1ccccc1[N+](=O)[O-] 34a_100000210237_200011934512 [0,2,0,0,0,0|2,0,0]=4 2377 B16R1.3900 COCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100011201679 [0,2,0,0,0,0|2,0,0]=4 2378 B16R1.3900 COCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000233755 [0,2,0,0,0,0|2,0,0]=4 2379 B16R1.3900 COCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000766300 [0,2,0,0,0,0|2,0,0]=4 2380 B16R1.3900 CSCCC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000210997 [0,2,0,0,0,0|1,0,1]=4 2381 B16R1.3900 CSCCCNCc1ccccc1[N+](=O)[O-] 2230a_100000749238_100000181388 [0,2,0,0,0,0|1,0,0]=3 2382 B16R1.3900 CSCCCNCc1ccccc1[N+](=O)[O-] 270004a_100000749238_100000186027 [0,2,0,0,0,0|1,0,0]=3 2383 B16R1.3900 CSCCCOCc1ccccc1[N+](=O)[O-] 34a_100000690336_100000181388 [0,2,0,0,0,0|2,0,0]=4 2384 B16R1.3900 CSCCCOCc1ccccc1[N+](=O)[O-] 7a_100000690336_100000181388 [0,2,0,0,0,0|2,0,0]=4 2385 B16R1.3900 CSCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000751147 [0,2,0,0,0,0|2,0,0]=4 2386 B16R1.3900 CSCCNCCc1ccccc1[N+](=O)[O-] 2230a_100020590264_200011934512 [0,2,0,0,0,0|2,0,0]=4 2387 B16R1.3900 CSCCOCCc1ccccc1[N+](=O)[O-] 34a_100000230434_200011934512 [0,2,0,0,0,0|2,0,0]=4 2388 B16R1.3900 CSCCOCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000212216 [0,2,0,0,0,0|2,0,0]=4 2389 B16R1.3900 CSCCOCCc1ccccc1[N+](=O)[O-] 7a_100000230434_200011934512 [0,2,0,0,0,0|2,0,0]=4 2390 B16R1.3900 CSCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000212216 [0,2,0,0,0,0|2,0,0]=4 2391 B16R1.3900 CSCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100011218213 [0,2,0,0,0,0|2,0,0]=4 2392 B16R1.3900 CSCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100011218213 [0,2,0,0,0,0|2,0,0]=4 2393 B16R1.3900 N#CCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000211819 [0,2,0,0,0,0|1,0,1]=4 2394 B16R1.3900 N#CCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000687738 [0,2,0,0,0,0|1,0,1]=4 2395 B16R1.3900 N#CCCCSCc1ccccc1[N+](=O)[O-] 62a_100000687738_100000181388 [0,2,0,0,0,0|1,0,1]=4 2396 B16R1.3900 N#CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100011215226 [0,2,0,0,0,0|0,0,2]=4 2397 B16R1.3900 N#CCCNN=Cc1ccccc1[N+](=O)[O-] 4a_100000229987_100000186027 [0,2,0,0,0,0|0,0,2]=4 2398 B16R1.3900 N#CCCOCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000184422 [0,2,0,0,0,0|1,0,1]=4 2399 B16R1.3900 N#CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100011215382 [0,2,0,0,0,0|1,0,1]=4 2400 B16R1.3900 N#CCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100011215382 [0,2,0,0,0,0|1,0,1]=4 2401 B16R1.3900 N#CCOCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200000047693 [0,2,0,0,0,0|1,0,1]=4 2402 B16R1.3900 NCCCCOCc1ccccc1[N+](=O)[O-] 34a_100000750430_100000181388 [0,2,0,0,0,0|1,0,0]=3 2403 B16R1.3900 NCCCOCCc1ccccc1[N+](=O)[O-] 34a_100000182051_200011934512 [0,2,0,0,0,0|1,0,0]=3 2404 B16R1.3900 NCCOCCOc1ccccc1[N+](=O)[O-] 34a_100000210304_100000741959 [0,2,0,0,0,0|1,0,0]=3 2405 B16R1.3900 NOCCOCCc1ccccc1[N+](=O)[O-] 34a_100000700252_200011934512 [0,2,0,0,0,0|1,0,0]=3 2406 B16R1.3900 O=CCCCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000139335 [0,2,0,0,0,0|2,0,0]=4 2407 B16R1.3900 O=CCCCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_200011292268 [0,2,0,0,0,0|2,0,0]=4 2408 B16R1.3900 O=CCCCSCc1ccccc1[N+](=O)[O-] 62a_200011292268_100000181388 [0,2,0,0,0,0|2,0,0]=4 2409 B16R1.3900 O=CCNCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_200015260668 [0,2,0,0,0,0|2,0,0]=4 2410 B16R1.3900 O=CCOCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_200009817547 [0,2,0,0,0,0|2,0,0]=4 2411 B16R1.3900 O=CCOCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_200015260668 [0,2,0,0,0,0|2,0,0]=4 2412 B16R1.3900 O=[N+]([O-])c1ccccc1CCCOCCF 34a_100000090589_100011217306 [0,2,0,0,0,0|2,0,0]=4 2413 B16R1.3900 O=[N+]([O-])c1ccccc1CCCOCCF 7a_100000090589_100011217306 [0,2,0,0,0,0|2,0,0]=4 2414 B16R1.3900 O=[N+]([O-])c1ccccc1CCCOCCO 34a_100000090589_100000211926 [0,2,0,0,0,0|2,0,0]=4 2415 B16R1.3900 O=[N+]([O-])c1ccccc1CCCOCCO 7a_100000090589_100000211926 [0,2,0,0,0,0|2,0,0]=4 2416 B16R1.3900 O=[N+]([O-])c1ccccc1CCNCCCF 2230a_100000723993_100011934791 [0,2,0,0,0,0|1,0,0]=3 2417 B16R1.3900 O=[N+]([O-])c1ccccc1CCNCCCF 2230a_100015189416_200011934512 [0,2,0,0,0,0|1,0,0]=3 2418 B16R1.3900 O=[N+]([O-])c1ccccc1CCNCCCF 34a_100015189416_200011934512 [0,2,0,0,0,0|1,0,0]=3 2419 B16R1.3900 O=[N+]([O-])c1ccccc1CCNCCCO 2230a_100000723993_100000230001 [0,2,0,0,0,0|1,0,0]=3 2420 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCBr 34a_100011217188_200011934512 [0,2,0,0,0,0|2,0,0]=4 2421 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCCl 34a_100000230001_200011934512 [0,2,0,0,0,0|2,0,0]=4 2422 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCF 34a_100000749287_100011934791 [0,2,0,0,0,0|2,0,0]=4 2423 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCF 34a_100000759539_200011934512 [0,2,0,0,0,0|2,0,0]=4 2424 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCF 7a_100000749287_100011934791 [0,2,0,0,0,0|2,0,0]=4 2425 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCO 34a_100000749287_100000230001 [0,2,0,0,0,0|2,0,0]=4 2426 B16R1.3900 O=[N+]([O-])c1ccccc1CCOCCCO 7a_100000749287_100011215043 [0,2,0,0,0,0|2,0,0]=4 2427 B16R1.3900 O=[N+]([O-])c1ccccc1CNCCCCO 2230a_100000750430_100000181388 [0,2,0,0,0,0|1,0,0]=3 2428 B16R1.3900 O=[N+]([O-])c1ccccc1CNCCCCO 270004a_100000750430_100000186027 [0,2,0,0,0,0|1,0,0]=3 2429 B16R1.3900 O=[N+]([O-])c1ccccc1CNCCCCO 34a_100000750430_100000181388 [0,2,0,0,0,0|1,0,0]=3 2430 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCBr 34a_100011216708_100000181388 [0,2,0,0,0,0|2,0,0]=4 2431 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCCl 34a_100000210776_100000181388 [0,2,0,0,0,0|2,0,0]=4 2432 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCCl 7a_100000210776_100000181388 [0,2,0,0,0,0|2,0,0]=4 2433 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCF 34a_100011995726_100000181388 [0,2,0,0,0,0|2,0,0]=4 2434 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCF 7a_100011218404_100000729493 [0,2,0,0,0,0|2,0,0]=4 2435 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCF 7a_100011995726_100000181388 [0,2,0,0,0,0|2,0,0]=4 2436 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCI 34a_200012148704_100000181388 [0,2,0,0,0,0|2,0,0]=4 2437 B16R1.3900 O=[N+]([O-])c1ccccc1COCCCCO 7a_100011218404_100000210776 [0,2,0,0,0,0|2,0,0]=4 2438 B16R1.3900 O=[N+]([O-])c1ccccc1CSCCCCF 62a_100000729493_100000181388 [0,2,0,0,0,0|2,0,0]=4 2439 B16R1.3900 O=[N+]([O-])c1ccccc1CSCCCCO 62a_100000210776_100000181388 [0,2,0,0,0,0|2,0,0]=4 2440 B16R1.3900 O=[N+]([O-])c1ccccc1OCCCCCF 34a_100000186319_100000729378 [0,2,0,0,0,0|2,0,0]=4 2441 B16R1.3900 O=[N+]([O-])c1ccccc1OCCCCCF 7a_100000186319_100000729378 [0,2,0,0,0,0|2,0,0]=4 2442 B16R1.3900 O=[N+]([O-])c1ccccc1OCCCCCO 34a_100000186319_100000746330 [0,2,0,0,0,0|2,0,0]=4 2443 B16R1.3900 O=[N+]([O-])c1ccccc1OCCCCCO 7a_100000186319_100000746330 [0,2,0,0,0,0|2,0,0]=4 2444 B16R1.3900 O=[N+]([O-])c1ccccc1OCCNCCF 2230a_100020586980_100011217306 [0,2,0,0,0,0|2,0,0]=4 2445 B16R1.3900 O=[N+]([O-])c1ccccc1OCCNCCF 34a_100000724931_100000741959 [0,2,0,0,0,0|2,0,0]=4 2446 B16R1.3900 O=[N+]([O-])c1ccccc1OCCNCCO 2230a_100016997473_100000741959 [0,2,0,0,0,0|2,0,0]=4 2447 B16R1.3900 O=[N+]([O-])c1ccccc1OCCNCCO 2230a_100020586980_100000211926 [0,2,0,0,0,0|2,0,0]=4 2448 B16R1.3900 O=[N+]([O-])c1ccccc1OCCNCCO 34a_100016990907_100000741959 [0,2,0,0,0,0|2,0,0]=4 2449 B16R1.3900 O=[N+]([O-])c1ccccc1OCCOCCBr 34a_100000211926_100000741959 [0,2,0,0,0,0|2,0,0]=4 2450 B16R1.3900 O=[N+]([O-])c1ccccc1OCCOCCO 34a_100000186319_100000692535 [0,2,0,0,0,0|2,0,0]=4 2451 B16R1.3900 O=[N+]([O-])c1ccccc1OCCOCCO 7a_100000186319_100011215305 [0,2,0,0,0,0|2,0,0]=4 2452 B16R1.4440 CC(CCBr)OCc1ccccc1[N+](=O)[O-] 34a_100012276601_100000181388 [0,2,0,0,0,0|2,0,0]=4 2453 B16R1.4440 CC(CCO)OCc1ccccc1[N+](=O)[O-] 7a_100011218404_100009893172 [0,2,0,0,0,0|2,0,0]=4 2454 B16R1.4440 CC(CCO)SCc1ccccc1[N+](=O)[O-] 62a_100009893172_100000181388 [0,2,0,0,0,0|2,0,0]=4 2455 B16R1.4440 CCCC(=NNc1ccccc1[N+](=O)[O-])C 4a_100000737275_100000211909 [0,2,0,0,0,0|1,0,1]=4 2456 B16R1.4440 CCCC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000211992_200011934512 [0,2,0,0,0,0|2,0,0]=4 2457 B16R1.4440 CCCC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_100000210303 [0,2,0,0,0,0|2,0,0]=4 2458 B16R1.4440 CCCC(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100000210303 [0,2,0,0,0,0|2,0,0]=4 2459 B16R1.4440 CCCC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000747444 [0,2,0,0,0,0|2,0,0]=4 2460 B16R1.4440 CCCC(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_100000210303 [0,2,0,0,0,0|2,0,0]=4 2461 B16R1.4440 CCCC(=O)NCc1ccccc1[N+](=O)[O-] 11a_100000740939_100000211992 [0,2,0,0,0,0|1,0,1]=4 2462 B16R1.4440 CCCC(=O)NCc1ccccc1[N+](=O)[O-] 240690a_100000740939_100000211992 [0,2,0,0,0,0|1,0,1]=4 2463 B16R1.4440 CCCC(=O)NCc1ccccc1[N+](=O)[O-] 527a_100000740939_100000211992 [0,2,0,0,0,0|1,0,1]=4 2464 B16R1.4440 CCCC(=O)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100000211992 [0,2,0,0,0,0|1,0,1]=4 2465 B16R1.4440 CCCC(C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011216630 [0,2,0,0,0,0|2,0,0]=4 2466 B16R1.4440 CCCC(C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011216630 [0,2,0,0,0,0|2,0,0]=4 2467 B16R1.4440 CCCC(C)NCc1ccccc1[N+](=O)[O-] 2230a_100000741246_100000181388 [0,2,0,0,0,0|1,0,0]=3 2468 B16R1.4440 CCCC(C)NCc1ccccc1[N+](=O)[O-] 270004a_100000740939_100000211909 [0,2,0,0,0,0|1,0,0]=3 2469 B16R1.4440 CCCC(C)NCc1ccccc1[N+](=O)[O-] 270004a_100000741246_100000186027 [0,2,0,0,0,0|1,0,0]=3 2470 B16R1.4440 CCCC(C)OCc1ccccc1[N+](=O)[O-] 34a_100000764384_100000181388 [0,2,0,0,0,0|2,0,0]=4 2471 B16R1.4440 CCCC(C)OCc1ccccc1[N+](=O)[O-] 7a_100000764384_100000181388 [0,2,0,0,0,0|2,0,0]=4 2472 B16R1.4440 CCCC(C)OCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000766640 [0,2,0,0,0,0|2,0,0]=4 2473 B16R1.4440 CCCC(C)SCc1ccccc1[N+](=O)[O-] 62a_100000766640_100000181388 [0,2,0,0,0,0|2,0,0]=4 2474 B16R1.4440 CCCN(C)CCc1ccccc1[N+](=O)[O-] 2230a_100000747261_200011934512 [0,2,0,0,0,0|2,0,0]=4 2475 B16R1.4440 CCCN(C)CCc1ccccc1[N+](=O)[O-] 269982a_100000747261_200011934512 [0,2,0,0,0,0|2,0,0]=4 2476 B16R1.4440 CCNC(C)CCc1ccccc1[N+](=O)[O-] 270004a_100015525214_200000760465 [0,2,0,0,0,0|2,0,0]=4 2477 B16R1.4440 CCNC(C)COc1ccccc1[N+](=O)[O-] 270004a_100015525214_100000150660 [0,2,0,0,0,0|2,0,0]=4 2478 B16R1.4440 CN(CCO)CCc1ccccc1[N+](=O)[O-] 2230a_100000210263_200011934512 [0,2,0,0,0,0|2,0,0]=4 2479 B16R1.4440 CN(CCO)CCc1ccccc1[N+](=O)[O-] 269982a_100000210263_200011934512 [0,2,0,0,0,0|2,0,0]=4 2480 B16R1.4440 COCC(C)NCc1ccccc1[N+](=O)[O-] 270004a_100000740939_100000749346 [0,2,0,0,0,0|2,0,0]=4 2481 B16R1.4440 COCC(O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011215053 [0,2,0,0,0,0|2,0,0]=4 2482 B16R1.4440 COCC(O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215053 [0,2,0,0,0,0|2,0,0]=4 2483 B16R1.4440 COC[C@@H](C)NCc1ccccc1[N+](=O)[O-] 2230a_100000764878_100000181388 [0,2,0,0,0,0|2,0,0]=4 2484 B16R1.4440 COC[C@@H](C)NCc1ccccc1[N+](=O)[O-] 270004a_100000764878_100000186027 [0,2,0,0,0,0|2,0,0]=4 2485 B16R1.4440 CSCC(C)NCc1ccccc1[N+](=O)[O-] 270004a_100000740939_100011216314 [0,2,0,0,0,0|2,0,0]=4 2486 B16R1.4440 C[C@@H](CC#N)NCc1ccccc1[N+](=O)[O-] 2230a_100016994482_100000181388 [0,2,0,0,0,0|0,0,2]=4 2487 B16R1.4440 C[C@H](CCO)NCc1ccccc1[N+](=O)[O-] 2230a_100000706166_100000181388 [0,2,0,0,0,0|1,0,0]=3 2488 B16R1.4440 C[C@H](CCO)NCc1ccccc1[N+](=O)[O-] 270004a_100000706166_100000186027 [0,2,0,0,0,0|1,0,0]=3 2489 B16R1.4440 C[C@H](CCO)NCc1ccccc1[N+](=O)[O-] 34a_100000706166_100000181388 [0,2,0,0,0,0|1,0,0]=3 2490 B16R1.4440 N#CC[C@H](O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000001066 [0,2,0,0,0,0|1,0,1]=4 2491 B16R1.4440 O=C(CCF)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_100011217306 [0,2,0,0,0,0|2,0,0]=4 2492 B16R1.4440 O=C(CCF)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100011217306 [0,2,0,0,0,0|2,0,0]=4 2493 B16R1.4440 O=C(CCF)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_100011217306 [0,2,0,0,0,0|2,0,0]=4 2494 B16R1.4440 O=C(CCO)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_100000211926 [0,2,0,0,0,0|2,0,0]=4 2495 B16R1.4440 O=C(CCO)CCc1ccccc1[N+](=O)[O-] 1458a_100011216618_200011934512 [0,2,0,0,0,0|2,0,0]=4 2496 B16R1.4440 O=C(CCO)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100000211926 [0,2,0,0,0,0|2,0,0]=4 2497 B16R1.4440 O=C(CCO)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_100000211926 [0,2,0,0,0,0|2,0,0]=4 2498 B16R1.4440 O=C(CCO)NCc1ccccc1[N+](=O)[O-] 240690a_100000740939_100011216618 [0,2,0,0,0,0|1,0,1]=4 2499 B16R1.4440 O=C(CCO)NNc1ccccc1[N+](=O)[O-] 22a_100000737275_100011216618 [0,2,0,0,0,0|1,0,1]=4 2500 B16R1.4493 C#CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000688953 [0,2,0,0,0,0|1,0,1]=4 2501 B16R1.4493 C#CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000730999 [0,2,0,0,0,0|1,0,1]=4 2502 B16R1.4493 C=CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000754431 [0,2,0,0,0,0|1,0,1]=4 2503 B16R1.4493 C=CCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100020639649_100000181388 [0,2,0,0,0,0|1,0,1]=4 2504 B16R1.4493 C=CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000754431 [0,2,0,0,0,0|1,0,1]=4 2505 B16R1.4493 C=CCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100020639649_100000181388 [0,2,0,0,0,0|1,0,1]=4 2506 B16R1.4493 C=CCCN(C)Cc1ccccc1[N+](=O)[O-] 270004a_100020639649_100000186027 [0,2,0,0,0,0|1,0,1]=4 2507 B16R1.4493 CCCCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100000210211 [0,2,0,0,0,0|2,0,0]=4 2508 B16R1.4493 CCCCC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000210183_100000181388 [0,2,0,0,0,0|2,0,0]=4 2509 B16R1.4493 CCCCC(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_200011215066 [0,2,0,0,0,0|2,0,0]=4 2510 B16R1.4493 CCCCC(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_200011215066 [0,2,0,0,0,0|2,0,0]=4 2511 B16R1.4493 CCCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000207549_100000181388 [0,2,0,0,0,0|1,0,0]=3 2512 B16R1.4493 CCCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000210211 [0,2,0,0,0,0|1,0,0]=3 2513 B16R1.4493 CCCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000207549_100000181388 [0,2,0,0,0,0|1,0,0]=3 2514 B16R1.4493 CCCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000210211 [0,2,0,0,0,0|1,0,0]=3 2515 B16R1.4493 CCCCN(C)Cc1ccccc1[N+](=O)[O-] 270004a_100000207549_100000186027 [0,2,0,0,0,0|1,0,0]=3 2516 B16R1.4493 CCNCC(=O)Nc1ccccc1[N+](=O)[O-] 2230a_100015525214_100000182460 [0,2,0,0,0,0|1,0,1]=4 2517 B16R1.4493 CCOCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000739092 [0,2,0,0,0,0|2,0,0]=4 2518 B16R1.4493 CN(CCC#N)Cc1ccccc1[N+](=O)[O-] 2230a_100000184479_100000181388 [0,2,0,0,0,0|0,0,2]=4 2519 B16R1.4493 CN(CCC#N)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100011215226 [0,2,0,0,0,0|0,0,2]=4 2520 B16R1.4493 CN(CCC#N)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100011215226 [0,2,0,0,0,0|0,0,2]=4 2521 B16R1.4493 CN(CCC#N)Cc1ccccc1[N+](=O)[O-] 270004a_100000184479_100000186027 [0,2,0,0,0,0|0,0,2]=4 2522 B16R1.4493 CN(CCCF)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100011934791 [0,2,0,0,0,0|1,0,0]=3 2523 B16R1.4493 CN(CCCF)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100011934791 [0,2,0,0,0,0|1,0,0]=3 2524 B16R1.4493 CN(CCCO)Cc1ccccc1[N+](=O)[O-] 2230a_100000213112_100000181388 [0,2,0,0,0,0|1,0,0]=3 2525 B16R1.4493 CN(CCCO)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000230001 [0,2,0,0,0,0|1,0,0]=3 2526 B16R1.4493 CN(CCCO)Cc1ccccc1[N+](=O)[O-] 269982a_100000213112_100000181388 [0,2,0,0,0,0|1,0,0]=3 2527 B16R1.4493 CN(CCCO)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100011215043 [0,2,0,0,0,0|1,0,0]=3 2528 B16R1.4493 CN(CCCO)Cc1ccccc1[N+](=O)[O-] 270004a_100000213112_100000186027 [0,2,0,0,0,0|1,0,0]=3 2529 B16R1.4493 CNCCC(=O)Nc1ccccc1[N+](=O)[O-] 2230a_106832991635_100000735757 [0,2,0,0,0,0|0,0,1]=3 2530 B16R1.4493 CNCCC(=O)Nc1ccccc1[N+](=O)[O-] 7a_106832991635_100000735757 [0,2,0,0,0,0|0,0,1]=3 2531 B16R1.4493 COCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100011201679 [0,2,0,0,0,0|2,0,0]=4 2532 B16R1.4493 COCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000743101_100000181388 [0,2,0,0,0,0|2,0,0]=4 2533 B16R1.4493 COCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000233755 [0,2,0,0,0,0|2,0,0]=4 2534 B16R1.4493 COCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000743101_100000181388 [0,2,0,0,0,0|2,0,0]=4 2535 B16R1.4493 COCCN(C)Cc1ccccc1[N+](=O)[O-] 270004a_100000743101_100000186027 [0,2,0,0,0,0|2,0,0]=4 2536 B16R1.4493 CSCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000686725_100000181388 [0,2,0,0,0,0|2,0,0]=4 2537 B16R1.4493 CSCCN(C)Cc1ccccc1[N+](=O)[O-] 2230a_100000737654_100000751147 [0,2,0,0,0,0|2,0,0]=4 2538 B16R1.4493 CSCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000686725_100000181388 [0,2,0,0,0,0|2,0,0]=4 2539 B16R1.4493 CSCCN(C)Cc1ccccc1[N+](=O)[O-] 269982a_100000737654_100000212216 [0,2,0,0,0,0|2,0,0]=4 2540 B16R1.4493 CSCCN(C)Cc1ccccc1[N+](=O)[O-] 270004a_100000686725_100000186027 [0,2,0,0,0,0|2,0,0]=4 2541 B16R1.4493 O=C(CCCF)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100011934791 [0,2,0,0,0,0|2,0,0]=4 2542 B16R1.4493 O=C(CCCO)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_100011215043 [0,2,0,0,0,0|2,0,0]=4 2543 B16R1.12322 CC(=O)CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000685027 [0,2,0,0,0,0|2,0,0]=4 2544 B16R1.12322 CC(=O)CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215641 [0,2,0,0,0,0|2,0,0]=4 2545 B16R1.12322 CC(Br)CCOCc1ccccc1[N+](=O)[O-] 34a_100009893172_100000181388 [0,2,0,0,0,0|2,0,0]=4 2546 B16R1.12322 CC(Br)COCCc1ccccc1[N+](=O)[O-] 34a_100012180447_200011934512 [0,2,0,0,0,0|2,0,0]=4 2547 B16R1.12322 CC(C)CC=NNc1ccccc1[N+](=O)[O-] 4a_100000737275_100000185833 [0,2,0,0,0,0|1,0,1]=4 2548 B16R1.12322 CC(C)CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100011214892 [0,2,0,0,0,0|2,0,0]=4 2549 B16R1.12322 CC(C)CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100011214892 [0,2,0,0,0,0|2,0,0]=4 2550 B16R1.12322 CC(C)CCNCc1ccccc1[N+](=O)[O-] 269862a_100000740939_100000185833 [0,2,0,0,0,0|1,0,0]=3 2551 B16R1.12322 CC(C)CCNCc1ccccc1[N+](=O)[O-] 270004a_100000210545_100000186027 [0,2,0,0,0,0|1,0,0]=3 2552 B16R1.12322 CC(C)CCOCc1ccccc1[N+](=O)[O-] 34a_100000210254_100000181388 [0,2,0,0,0,0|2,0,0]=4 2553 B16R1.12322 CC(C)CCOCc1ccccc1[N+](=O)[O-] 7a_100000210254_100000181388 [0,2,0,0,0,0|2,0,0]=4 2554 B16R1.12322 CC(C)CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000210626 [0,2,0,0,0,0|2,0,0]=4 2555 B16R1.12322 CC(C)CCSCc1ccccc1[N+](=O)[O-] 62a_100000210312_100000181388 [0,2,0,0,0,0|2,0,0]=4 2556 B16R1.12322 CC(C)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000210953_200011934512 [0,2,0,0,0,0|2,0,0]=4 2557 B16R1.12322 CC(C)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210760 [0,2,0,0,0,0|2,0,0]=4 2558 B16R1.12322 CC(C)CNCCc1ccccc1[N+](=O)[O-] 270004a_100000723993_100000210432 [0,2,0,0,0,0|2,0,0]=4 2559 B16R1.12322 CC(C)CNCCc1ccccc1[N+](=O)[O-] 34a_100000210953_200011934512 [0,2,0,0,0,0|2,0,0]=4 2560 B16R1.12322 CC(C)COCCc1ccccc1[N+](=O)[O-] 34a_100000210257_200011934512 [0,2,0,0,0,0|2,0,0]=4 2561 B16R1.12322 CC(C)COCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000210624 [0,2,0,0,0,0|2,0,0]=4 2562 B16R1.12322 CC(C)COCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000210760 [0,2,0,0,0,0|2,0,0]=4 2563 B16R1.12322 CC(C)NCCOc1ccccc1[N+](=O)[O-] 2230a_100020586980_100000210206 [0,2,0,0,0,0|2,0,0]=4 2564 B16R1.12322 CC(C)NCCOc1ccccc1[N+](=O)[O-] 2230a_100138425928_100000741959 [0,2,0,0,0,0|2,0,0]=4 2565 B16R1.12322 CC(C)NCCOc1ccccc1[N+](=O)[O-] 34a_100138425928_100000741959 [0,2,0,0,0,0|2,0,0]=4 2566 B16R1.12322 CC(C)OCCCc1ccccc1[N+](=O)[O-] 34a_100000090589_100000210206 [0,2,0,0,0,0|2,0,0]=4 2567 B16R1.12322 CC(C)OCCCc1ccccc1[N+](=O)[O-] 7a_100000090589_100000210206 [0,2,0,0,0,0|2,0,0]=4 2568 B16R1.12322 CC(C)OCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000211751 [0,2,0,0,0,0|2,0,0]=4 2569 B16R1.12322 CC(C)OCCOc1ccccc1[N+](=O)[O-] 34a_100000212225_100000741959 [0,2,0,0,0,0|2,0,0]=4 2570 B16R1.12322 CC(C)OCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000211751 [0,2,0,0,0,0|2,0,0]=4 2571 B16R1.12322 CC(C)SCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000730970 [0,2,0,0,0,0|2,0,0]=4 2572 B16R1.12322 CC(C)SCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000730970 [0,2,0,0,0,0|2,0,0]=4 2573 B16R1.12322 CC(F)COCCc1ccccc1[N+](=O)[O-] 34a_100015925927_200011934512 [0,2,0,0,0,0|2,0,0]=4 2574 B16R1.12322 CC(O)CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_200000718107 [0,2,0,0,0,0|2,0,0]=4 2575 B16R1.12322 CC(O)CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200000718107 [0,2,0,0,0,0|2,0,0]=4 2576 B16R1.12322 CC(O)CCNCc1ccccc1[N+](=O)[O-] 2230a_200000755665_100000181388 [0,2,0,0,0,0|1,0,0]=3 2577 B16R1.12322 CC(O)CCNCc1ccccc1[N+](=O)[O-] 270004a_200000755665_100000186027 [0,2,0,0,0,0|1,0,0]=3 2578 B16R1.12322 CC(O)CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100012276601 [0,2,0,0,0,0|2,0,0]=4 2579 B16R1.12322 CC(O)CCSCc1ccccc1[N+](=O)[O-] 62a_100012276601_100000181388 [0,2,0,0,0,0|2,0,0]=4 2580 B16R1.12322 CC(O)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000210904_200011934512 [0,2,0,0,0,0|2,0,0]=4 2581 B16R1.12322 CC(O)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100011218427 [0,2,0,0,0,0|2,0,0]=4 2582 B16R1.12322 CC(O)CNCCc1ccccc1[N+](=O)[O-] 34a_100000210904_200011934512 [0,2,0,0,0,0|2,0,0]=4 2583 B16R1.12322 CC(O)COCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100011218427 [0,2,0,0,0,0|2,0,0]=4 2584 B16R1.12322 CC(O)COCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100011218427 [0,2,0,0,0,0|2,0,0]=4 2585 B16R1.12322 CN(C)CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000757444 [0,2,0,0,0,0|2,0,0]=4 2586 B16R1.12322 CN(C)CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000757444 [0,2,0,0,0,0|1,0,0]=3 2587 B16R1.12322 CN(C)CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100000757444 [0,2,0,0,0,0|2,0,0]=4 2588 B16R1.12322 CN(C)CCNCc1ccccc1[N+](=O)[O-] 270004a_100000210585_100000186027 [0,2,0,0,0,0|2,0,0]=4 2589 B16R1.12322 CN(C)CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000755713 [0,2,0,0,0,0|2,0,0]=4 2590 B16R1.12322 C[C@@H](Cl)COCCc1ccccc1[N+](=O)[O-] 34a_100016084084_200011934512 [0,2,0,0,0,0|2,0,0]=4 2591 B16R1.12322 C[C@@H](N)CCOCc1ccccc1[N+](=O)[O-] 34a_100000706166_100000181388 [0,2,0,0,0,0|1,0,0]=3 2592 B16R1.12322 C[C@@H](N)COCCc1ccccc1[N+](=O)[O-] 34a_100000737577_200011934512 [0,2,0,0,0,0|1,0,0]=3 2593 B16R1.12322 C[C@@H](O)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100009817552 [0,2,0,0,0,0|2,0,0]=4 2594 B16R1.12322 C[C@@H](O)COCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100009817552 [0,2,0,0,0,0|2,0,0]=4 2595 B16R1.12322 C[C@@H](O)COCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100009817552 [0,2,0,0,0,0|2,0,0]=4 2596 B16R1.12322 NC(=O)CCCNc1ccccc1C(=O)N 34a_100000185089_100102525003 [0,2,0,0,0,0|2,0,0]=4 2597 B16R1.12322 NC(=O)CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100102525003 [0,2,0,0,0,0|2,0,0]=4 2598 B16R1.12322 NC(=O)CCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100102525003 [0,2,0,0,0,0|1,0,0]=3 2599 B16R1.12322 NC(=O)CCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100102525003 [0,2,0,0,0,0|1,0,0]=3 2600 B16R1.12322 NC(=O)CCCOc1cccnc1[N+](=O)[O-] 7a_100000183951_100102525003 [0,2,0,0,0,0|2,0,0]=4 2601 B16R1.12322 NC(=O)CCOCc1ccccc1[N+](=O)[O-] 34a_100000757172_100000181388 [0,2,0,0,0,0|1,0,1]=4 2602 B16R1.12322 NC(=O)CCOCc1ccccc1[N+](=O)[O-] 7a_100000757172_100000181388 [0,2,0,0,0,0|1,0,1]=4 2603 B16R1.12322 NC(=O)CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000744528 [0,2,0,0,0,0|1,0,1]=4 2604 B16R1.12322 NC(=O)CCSCc1ccccc1[N+](=O)[O-] 62a_100000744528_100000181388 [0,2,0,0,0,0|1,0,1]=4 2605 B16R1.12322 NC(=O)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000711301_200011934512 [0,2,0,0,0,0|1,0,1]=4 2606 B16R1.12322 NC(=O)CNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000747473 [0,2,0,0,0,0|1,0,1]=4 2607 B16R1.12322 NC(=O)COCCc1ccccc1[N+](=O)[O-] 34a_100000749287_100000187820 [0,2,0,0,0,0|1,0,1]=4 2608 B16R1.12322 NC(=O)COCCc1ccccc1[N+](=O)[O-] 7a_100000749287_100000187820 [0,2,0,0,0,0|1,0,1]=4 2609 B16R1.12322 NC(=O)NCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200000034859 [0,2,0,0,0,0|1,0,1]=4 2610 B16R1.12322 NC(=O)OCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_200011214921 [0,2,0,0,0,0|1,0,1]=4 2611 B16R1.12322 NC(=O)OCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200011214921 [0,2,0,0,0,0|1,0,1]=4 2612 B16R1.12322 O=[N+]([O-])c1ccccc1CCNCC(F)F 2230a_100000723993_100011934356 [0,2,0,0,0,0|2,0,0]=4 2613 B16R1.12322 O=[N+]([O-])c1ccccc1CCNCC(F)F 34a_100000765723_200011934512 [0,2,0,0,0,0|2,0,0]=4 2614 B16R1.12322 O=[N+]([O-])c1ccccc1CCOCC(F)F 34a_100000743014_200011934512 [0,2,0,0,0,0|2,0,0]=4 2615 B16R1.12322 O=[N+]([O-])c1ccccc1CCOCC(F)F 34a_100000749287_100011934356 [0,2,0,0,0,0|2,0,0]=4 2616 B16R1.12322 O=[N+]([O-])c1ccccc1CCOCC(F)F 7a_100000749287_100011934356 [0,2,0,0,0,0|2,0,0]=4 2617 B16R1.12322 O=[N+]([O-])c1ccccc1COCCC(F)F 34a_100103093639_100000181388 [0,2,0,0,0,0|2,0,0]=4 2618 B16R1.12677 C#CCCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000695029 [0,2,0,0,0,0|1,0,0]=3 2619 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000695029 [0,2,0,0,0,0|2,0,0]=4 2620 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000695029 [0,2,0,0,0,0|2,0,0]=4 2621 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100011215417 [0,2,0,0,0,0|2,0,0]=4 2622 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000695029 [0,2,0,0,0,0|2,0,0]=4 2623 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100011215417 [0,2,0,0,0,0|2,0,0]=4 2624 B16R1.12677 C#CCCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000695029 [0,2,0,0,0,0|2,0,0]=4 2625 B16R1.12677 C#CCCNCc1c(cccc1[N+](=O)[O-])Br 34a_100000755551_100011273477 [0,2,0,0,0,0|1,0,1]=4 2626 B16R1.12677 C#CCCNCc1c(cccc1[N+](=O)[O-])C 34a_100000755551_100010254497 [0,2,0,0,0,0|1,0,1]=4 2627 B16R1.12677 C#CCCNCc1c(cccc1[N+](=O)[O-])Cl 34a_100000755551_100000753779 [0,2,0,0,0,0|1,0,1]=4 2628 B16R1.12677 C#CCCNCc1c(cccc1[N+](=O)[O-])F 34a_100000755551_100000751461 [0,2,0,0,0,0|1,0,1]=4 2629 B16R1.12677 C=CCCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000757094 [0,2,0,0,0,0|1,0,0]=3 2630 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000757094 [0,2,0,0,0,0|2,0,0]=4 2631 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000757094 [0,2,0,0,0,0|2,0,0]=4 2632 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000757094 [0,2,0,0,0,0|2,0,0]=4 2633 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000757094 [0,2,0,0,0,0|2,0,0]=4 2634 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000757094 [0,2,0,0,0,0|2,0,0]=4 2635 B16R1.12677 C=CCCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000757094 [0,2,0,0,0,0|2,0,0]=4 2636 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])Br 2230a_100015191253_100011273477 [0,2,0,0,0,0|1,0,1]=4 2637 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100015191253_100000735576 [0,2,0,0,0,0|1,0,1]=4 2638 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])C 2230a_100015191253_100010254497 [0,2,0,0,0,0|1,0,1]=4 2639 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])Cl 2230a_100015191253_100000753779 [0,2,0,0,0,0|1,0,1]=4 2640 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100015191253_100011217401 [0,2,0,0,0,0|1,0,1]=4 2641 B16R1.12677 C=CCCNCc1c(cccc1[N+](=O)[O-])F 2230a_100015191253_100000751461 [0,2,0,0,0,0|1,0,1]=4 2642 B16R1.12677 C=COCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000039644 [0,2,0,0,0,0|1,0,1]=4 2643 B16R1.12677 CC/C=C\CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100103147603 [0,2,0,0,0,0|1,0,1]=4 2644 B16R1.12677 CCC#CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100009813939 [0,2,0,0,0,0|1,0,1]=4 2645 B16R1.12677 CCCCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000718602 [0,2,0,0,0,0|1,0,0]=3 2646 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000718602 [0,2,0,0,0,0|2,0,0]=4 2647 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000718602 [0,2,0,0,0,0|2,0,0]=4 2648 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000210326 [0,2,0,0,0,0|2,0,0]=4 2649 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000718602 [0,2,0,0,0,0|2,0,0]=4 2650 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000210326 [0,2,0,0,0,0|2,0,0]=4 2651 B16R1.12677 CCCCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000718602 [0,2,0,0,0,0|2,0,0]=4 2652 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Br 2230a_100000102301_100011273477 [0,2,0,0,0,0|1,0,0]=3 2653 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100000102301_100000735576 [0,2,0,0,0,0|1,0,0]=3 2654 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Br 7a_106832991798_100011273477 [0,2,0,0,0,0|1,0,0]=3 2655 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])C 2230a_100000102301_100010254497 [0,2,0,0,0,0|1,0,0]=3 2656 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])C 7a_106832991798_100010254497 [0,2,0,0,0,0|1,0,0]=3 2657 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Cl 2230a_100000102301_100000753779 [0,2,0,0,0,0|1,0,0]=3 2658 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100000102301_100011217401 [0,2,0,0,0,0|1,0,0]=3 2659 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])Cl 7a_106832991798_100000753779 [0,2,0,0,0,0|1,0,0]=3 2660 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])F 2230a_100000102301_100000751461 [0,2,0,0,0,0|1,0,0]=3 2661 B16R1.12677 CCCCNCc1c(cccc1[N+](=O)[O-])F 7a_106832991798_100000751461 [0,2,0,0,0,0|1,0,0]=3 2662 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])Br 34a_100000210227_100011273477 [0,2,0,0,0,0|2,0,0]=4 2663 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])Br 7a_100000210227_100011273477 [0,2,0,0,0,0|2,0,0]=4 2664 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])C 34a_100000210227_100010254497 [0,2,0,0,0,0|2,0,0]=4 2665 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])C 34a_100009850887_100000210210 [0,2,0,0,0,0|2,0,0]=4 2666 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])C 7a_100000210227_100010254497 [0,2,0,0,0,0|2,0,0]=4 2667 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])C 7a_100009850887_100000210211 [0,2,0,0,0,0|2,0,0]=4 2668 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100000210227_100000753779 [0,2,0,0,0,0|2,0,0]=4 2669 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])Cl 7a_100000210227_100000753779 [0,2,0,0,0,0|2,0,0]=4 2670 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])Cl 7a_100011916443_100000210211 [0,2,0,0,0,0|2,0,0]=4 2671 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000102360_100000210210 [0,2,0,0,0,0|2,0,0]=4 2672 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000210227_100000751461 [0,2,0,0,0,0|2,0,0]=4 2673 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])F 7a_100000102360_100000210211 [0,2,0,0,0,0|2,0,0]=4 2674 B16R1.12677 CCCCOCc1c(cccc1[N+](=O)[O-])F 7a_100000210227_100000751461 [0,2,0,0,0,0|2,0,0]=4 2675 B16R1.12677 CCCCSCc1c(cccc1[N+](=O)[O-])Br 62a_100011273477_100000210210 [0,2,0,0,0,0|2,0,0]=4 2676 B16R1.12677 CCOCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000210147 [0,2,0,0,0,0|1,0,0]=3 2677 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000210147 [0,2,0,0,0,0|2,0,0]=4 2678 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000210147 [0,2,0,0,0,0|2,0,0]=4 2679 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100011215890 [0,2,0,0,0,0|2,0,0]=4 2680 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000210147 [0,2,0,0,0,0|2,0,0]=4 2681 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100011215890 [0,2,0,0,0,0|2,0,0]=4 2682 B16R1.12677 CCOCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000210147 [0,2,0,0,0,0|2,0,0]=4 2683 B16R1.12677 CCSCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000757381 [0,2,0,0,0,0|1,0,0]=3 2684 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000757381 [0,2,0,0,0,0|2,0,0]=4 2685 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000757381 [0,2,0,0,0,0|2,0,0]=4 2686 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000757381 [0,2,0,0,0,0|2,0,0]=4 2687 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000757381 [0,2,0,0,0,0|2,0,0]=4 2688 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000757381 [0,2,0,0,0,0|2,0,0]=4 2689 B16R1.12677 CCSCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000757381 [0,2,0,0,0,0|2,0,0]=4 2690 B16R1.12677 COCCCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000740836 [0,2,0,0,0,0|1,0,0]=3 2691 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000740836 [0,2,0,0,0,0|2,0,0]=4 2692 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000740836 [0,2,0,0,0,0|2,0,0]=4 2693 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000740836 [0,2,0,0,0,0|2,0,0]=4 2694 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000740836 [0,2,0,0,0,0|2,0,0]=4 2695 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000740836 [0,2,0,0,0,0|2,0,0]=4 2696 B16R1.12677 COCCCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000740836 [0,2,0,0,0,0|2,0,0]=4 2697 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])Br 2230a_100000209980_100011273477 [0,2,0,0,0,0|2,0,0]=4 2698 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100000209980_100000735576 [0,2,0,0,0,0|2,0,0]=4 2699 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])C 2230a_100000209980_100010254497 [0,2,0,0,0,0|2,0,0]=4 2700 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])Cl 2230a_100000209980_100000753779 [0,2,0,0,0,0|2,0,0]=4 2701 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100000209980_100011217401 [0,2,0,0,0,0|2,0,0]=4 2702 B16R1.12677 COCCNCc1c(cccc1[N+](=O)[O-])F 2230a_100000209980_100000751461 [0,2,0,0,0,0|2,0,0]=4 2703 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])Br 2230a_100020590264_100011273477 [0,2,0,0,0,0|2,0,0]=4 2704 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100020590264_100000735576 [0,2,0,0,0,0|2,0,0]=4 2705 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])C 2230a_100020590264_100010254497 [0,2,0,0,0,0|2,0,0]=4 2706 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])Cl 2230a_100020590264_100000753779 [0,2,0,0,0,0|2,0,0]=4 2707 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100020590264_100011217401 [0,2,0,0,0,0|2,0,0]=4 2708 B16R1.12677 CSCCNCc1c(cccc1[N+](=O)[O-])F 2230a_100020590264_100000751461 [0,2,0,0,0,0|2,0,0]=4 2709 B16R1.12677 Cc1cccc(c1CNCCCF)[N+](=O)[O-] 2230a_100015189416_100010254497 [0,2,0,0,0,0|1,0,0]=3 2710 B16R1.12677 Cc1cccc(c1CNCCCF)[N+](=O)[O-] 34a_100015189416_100010254497 [0,2,0,0,0,0|1,0,0]=3 2711 B16R1.12677 Cc1cccc(c1COCCCBr)[N+](=O)[O-] 34a_100011217188_100010254497 [0,2,0,0,0,0|2,0,0]=4 2712 B16R1.12677 Cc1cccc(c1COCCCCl)[N+](=O)[O-] 34a_100000230001_100010254497 [0,2,0,0,0,0|2,0,0]=4 2713 B16R1.12677 Cc1cccc(c1COCCCF)[N+](=O)[O-] 34a_100000759539_100010254497 [0,2,0,0,0,0|2,0,0]=4 2714 B16R1.12677 Cc1cccc(c1COCCCF)[N+](=O)[O-] 34a_100009850887_100011934791 [0,2,0,0,0,0|2,0,0]=4 2715 B16R1.12677 Cc1cccc(c1COCCCF)[N+](=O)[O-] 7a_100009850887_100011934791 [0,2,0,0,0,0|2,0,0]=4 2716 B16R1.12677 Cc1cccc(c1COCCCN)[N+](=O)[O-] 34a_100000182051_100010254497 [0,2,0,0,0,0|1,0,0]=3 2717 B16R1.12677 Cc1cccc(c1COCCCO)[N+](=O)[O-] 34a_100009850887_100000230001 [0,2,0,0,0,0|2,0,0]=4 2718 B16R1.12677 Cc1cccc(c1COCCCO)[N+](=O)[O-] 7a_100009850887_100011215043 [0,2,0,0,0,0|2,0,0]=4 2719 B16R1.12677 Cc1cccc(c1COCCON)[N+](=O)[O-] 34a_100000700252_100010254497 [0,2,0,0,0,0|2,0,0]=4 2720 B16R1.12677 Cc1cccc(c1OCCCC#N)[N+](=O)[O-] 7a_100000763257_100000687738 [0,2,0,0,0,0|1,0,1]=4 2721 B16R1.12677 Cc1cccc(c1OCCCC=O)[N+](=O)[O-] 7a_100000763257_200011292268 [0,2,0,0,0,0|2,0,0]=4 2722 B16R1.12677 Cc1cccc(c1OCCCCF)[N+](=O)[O-] 34a_100000763257_100000729493 [0,2,0,0,0,0|2,0,0]=4 2723 B16R1.12677 Cc1cccc(c1OCCCCF)[N+](=O)[O-] 7a_100000763257_100000729493 [0,2,0,0,0,0|2,0,0]=4 2724 B16R1.12677 Cc1cccc(c1OCCCCO)[N+](=O)[O-] 34a_100000763257_100011216708 [0,2,0,0,0,0|2,0,0]=4 2725 B16R1.12677 Cc1cccc(c1OCCCCO)[N+](=O)[O-] 7a_100000763257_100000210776 [0,2,0,0,0,0|2,0,0]=4 2726 B16R1.12677 N#CCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000687738 [0,2,0,0,0,0|1,0,1]=4 2727 B16R1.12677 N#CCCNCc1c(cccc1[N+](=O)[O-])Br 270004a_100000720768_100000735576 [0,2,0,0,0,0|0,0,2]=4 2728 B16R1.12677 N#CCCNCc1c(cccc1[N+](=O)[O-])Cl 270004a_100000720768_100011217401 [0,2,0,0,0,0|0,0,2]=4 2729 B16R1.12677 NCCCOCc1c(cccc1[N+](=O)[O-])Br 34a_100000182051_100011273477 [0,2,0,0,0,0|1,0,0]=3 2730 B16R1.12677 NCCCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100000182051_100000753779 [0,2,0,0,0,0|1,0,0]=3 2731 B16R1.12677 NCCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000182051_100000751461 [0,2,0,0,0,0|1,0,0]=3 2732 B16R1.12677 NOCCOCc1c(cccc1[N+](=O)[O-])Br 34a_100000700252_100011273477 [0,2,0,0,0,0|2,0,0]=4 2733 B16R1.12677 NOCCOCc1c(cccc1[N+](=O)[O-])Cl 34a_100000700252_100000753779 [0,2,0,0,0,0|2,0,0]=4 2734 B16R1.12677 NOCCOCc1c(cccc1[N+](=O)[O-])F 34a_100000700252_100000751461 [0,2,0,0,0,0|2,0,0]=4 2735 B16R1.12677 O=CCCCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_200011292268 [0,2,0,0,0,0|2,0,0]=4 2736 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Br 2230a_100015189416_100011273477 [0,2,0,0,0,0|1,0,0]=3 2737 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Br 270004a_100015189416_100000735576 [0,2,0,0,0,0|1,0,0]=3 2738 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Br 34a_100015189416_100011273477 [0,2,0,0,0,0|1,0,0]=3 2739 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Cl 2230a_100015189416_100000753779 [0,2,0,0,0,0|1,0,0]=3 2740 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Cl 270004a_100015189416_100011217401 [0,2,0,0,0,0|1,0,0]=3 2741 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)Cl 34a_100015189416_100000753779 [0,2,0,0,0,0|1,0,0]=3 2742 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)F 2230a_100015189416_100000751461 [0,2,0,0,0,0|1,0,0]=3 2743 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCF)F 34a_100015189416_100000751461 [0,2,0,0,0,0|1,0,0]=3 2744 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCO)Br 270004a_100000182051_100000735576 [0,2,0,0,0,0|1,0,0]=3 2745 B16R1.12677 O=[N+]([O-])c1cccc(c1CNCCCO)Cl 270004a_100000182051_100011217401 [0,2,0,0,0,0|1,0,0]=3 2746 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCBr)Br 34a_100011217188_100011273477 [0,2,0,0,0,0|2,0,0]=4 2747 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCBr)Cl 34a_100011217188_100000753779 [0,2,0,0,0,0|2,0,0]=4 2748 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCBr)F 34a_100011217188_100000751461 [0,2,0,0,0,0|2,0,0]=4 2749 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCCl)Br 34a_100000230001_100011273477 [0,2,0,0,0,0|2,0,0]=4 2750 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCCl)Cl 34a_100000230001_100000753779 [0,2,0,0,0,0|2,0,0]=4 2751 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCCl)F 34a_100000230001_100000751461 [0,2,0,0,0,0|2,0,0]=4 2752 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)Br 34a_100000759539_100011273477 [0,2,0,0,0,0|2,0,0]=4 2753 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)Cl 34a_100000759539_100000753779 [0,2,0,0,0,0|2,0,0]=4 2754 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)Cl 7a_100011916443_100011934791 [0,2,0,0,0,0|2,0,0]=4 2755 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)F 34a_100000102360_100011934791 [0,2,0,0,0,0|2,0,0]=4 2756 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)F 34a_100000759539_100000751461 [0,2,0,0,0,0|2,0,0]=4 2757 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCF)F 7a_100000102360_100011934791 [0,2,0,0,0,0|2,0,0]=4 2758 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCO)Cl 7a_100011916443_100011215043 [0,2,0,0,0,0|2,0,0]=4 2759 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCO)F 34a_100000102360_100000230001 [0,2,0,0,0,0|2,0,0]=4 2760 B16R1.12677 O=[N+]([O-])c1cccc(c1COCCCO)F 7a_100000102360_100011215043 [0,2,0,0,0,0|2,0,0]=4 2761 B16R1.12677 O=[N+]([O-])c1cccc(c1CSCCCF)Br 62a_100011273477_100011934791 [0,2,0,0,0,0|2,0,0]=4 2762 B16R1.12677 O=[N+]([O-])c1cccc(c1CSCCCO)Br 62a_100011273477_100011215043 [0,2,0,0,0,0|2,0,0]=4 2763 B16R1.12677 O=[N+]([O-])c1cccc(c1NCC#CCO)F 34a_100000687224_200000047223 [0,2,0,0,0,0|1,0,1]=4 2764 B16R1.12677 O=[N+]([O-])c1cccc(c1NCCCCF)F 34a_100000687224_100000729493 [0,2,0,0,0,0|1,0,0]=3 2765 B16R1.12677 O=[N+]([O-])c1cccc(c1NCCCCO)F 34a_100000687224_100011216708 [0,2,0,0,0,0|1,0,0]=3 2766 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCF)Br 34a_100000689966_100000729493 [0,2,0,0,0,0|2,0,0]=4 2767 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCF)Cl 34a_100000686934_100000729493 [0,2,0,0,0,0|2,0,0]=4 2768 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCF)Cl 7a_100000686934_100000729493 [0,2,0,0,0,0|2,0,0]=4 2769 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCF)F 34a_100000690172_100000729493 [0,2,0,0,0,0|2,0,0]=4 2770 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCO)Br 34a_100000689966_100011216708 [0,2,0,0,0,0|2,0,0]=4 2771 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCO)Cl 34a_100000686934_100011216708 [0,2,0,0,0,0|2,0,0]=4 2772 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCO)Cl 7a_100000686934_100000210776 [0,2,0,0,0,0|2,0,0]=4 2773 B16R1.12677 O=[N+]([O-])c1cccc(c1OCCCCO)F 34a_100000690172_100011216708 [0,2,0,0,0,0|2,0,0]=4 2774 B16R1.13275 C#CCCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000695029 [0,2,0,0,0,0|1,0,0]=3 2775 B16R1.13275 C#CCCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000695029 [0,2,0,0,0,0|1,0,0]=3 2776 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000695029 [0,2,0,0,0,0|2,0,0]=4 2777 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100011215417 [0,2,0,0,0,0|2,0,0]=4 2778 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000695029 [0,2,0,0,0,0|2,0,0]=4 2779 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100011215417 [0,2,0,0,0,0|2,0,0]=4 2780 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000695029 [0,2,0,0,0,0|2,0,0]=4 2781 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100011215417 [0,2,0,0,0,0|2,0,0]=4 2782 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000695029 [0,2,0,0,0,0|2,0,0]=4 2783 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100011215417 [0,2,0,0,0,0|2,0,0]=4 2784 B16R1.13275 C#CCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100011215417 [0,2,0,0,0,0|2,0,0]=4 2785 B16R1.13275 C#CCCNCc1cccc(c1[N+](=O)[O-])Br 34a_100000755551_100010145487 [0,2,0,0,0,0|1,0,1]=4 2786 B16R1.13275 C#CCCNCc1cccc(c1[N+](=O)[O-])C 34a_100000755551_100010188692 [0,2,0,0,0,0|1,0,1]=4 2787 B16R1.13275 C#CCCNCc1cccc(c1[N+](=O)[O-])Cl 34a_100000755551_100009990124 [0,2,0,0,0,0|1,0,1]=4 2788 B16R1.13275 C=CCCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000757094 [0,2,0,0,0,0|1,0,0]=3 2789 B16R1.13275 C=CCCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000757094 [0,2,0,0,0,0|1,0,0]=3 2790 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000757094 [0,2,0,0,0,0|2,0,0]=4 2791 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000757094 [0,2,0,0,0,0|2,0,0]=4 2792 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000757094 [0,2,0,0,0,0|2,0,0]=4 2793 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000757094 [0,2,0,0,0,0|2,0,0]=4 2794 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000757094 [0,2,0,0,0,0|2,0,0]=4 2795 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000757094 [0,2,0,0,0,0|2,0,0]=4 2796 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000757094 [0,2,0,0,0,0|2,0,0]=4 2797 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000757094 [0,2,0,0,0,0|2,0,0]=4 2798 B16R1.13275 C=CCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000757094 [0,2,0,0,0,0|2,0,0]=4 2799 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])Br 2230a_100015191253_100010145487 [0,2,0,0,0,0|1,0,1]=4 2800 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100015191253_100009996538 [0,2,0,0,0,0|1,0,1]=4 2801 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])C 207a_100015191253_100000050834 [0,2,0,0,0,0|1,0,1]=4 2802 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])C 2230a_100015191253_100010188692 [0,2,0,0,0,0|1,0,1]=4 2803 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])C 270004a_100015191253_100000050834 [0,2,0,0,0,0|1,0,1]=4 2804 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])Cl 2230a_100015191253_100009990124 [0,2,0,0,0,0|1,0,1]=4 2805 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100015191253_100000050954 [0,2,0,0,0,0|1,0,1]=4 2806 B16R1.13275 C=CCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100015191253_100000102507 [0,2,0,0,0,0|1,0,1]=4 2807 B16R1.13275 C=COCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000039644 [0,2,0,0,0,0|1,0,1]=4 2808 B16R1.13275 C=COCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000039644 [0,2,0,0,0,0|1,0,1]=4 2809 B16R1.13275 CC/C=C\CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100103147603 [0,2,0,0,0,0|1,0,1]=4 2810 B16R1.13275 CC/C=C\CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100103147603 [0,2,0,0,0,0|1,0,1]=4 2811 B16R1.13275 CCC#CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100009813939 [0,2,0,0,0,0|1,0,1]=4 2812 B16R1.13275 CCC#CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100009813939 [0,2,0,0,0,0|1,0,1]=4 2813 B16R1.13275 CCCCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000718602 [0,2,0,0,0,0|1,0,0]=3 2814 B16R1.13275 CCCCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000718602 [0,2,0,0,0,0|1,0,0]=3 2815 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000718602 [0,2,0,0,0,0|2,0,0]=4 2816 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000210326 [0,2,0,0,0,0|2,0,0]=4 2817 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000718602 [0,2,0,0,0,0|2,0,0]=4 2818 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000210326 [0,2,0,0,0,0|2,0,0]=4 2819 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000718602 [0,2,0,0,0,0|2,0,0]=4 2820 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000210326 [0,2,0,0,0,0|2,0,0]=4 2821 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000718602 [0,2,0,0,0,0|2,0,0]=4 2822 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000210326 [0,2,0,0,0,0|2,0,0]=4 2823 B16R1.13275 CCCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000210326 [0,2,0,0,0,0|2,0,0]=4 2824 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Br 2230a_100000102301_100010145487 [0,2,0,0,0,0|1,0,0]=3 2825 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100000102301_100009996538 [0,2,0,0,0,0|1,0,0]=3 2826 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Br 7a_106832991798_100010145487 [0,2,0,0,0,0|1,0,0]=3 2827 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])C 207a_100000102301_100000050834 [0,2,0,0,0,0|1,0,0]=3 2828 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])C 2230a_100000102301_100010188692 [0,2,0,0,0,0|1,0,0]=3 2829 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])C 270004a_100000102301_100000050834 [0,2,0,0,0,0|1,0,0]=3 2830 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])C 7a_106832991798_100010188692 [0,2,0,0,0,0|1,0,0]=3 2831 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Cl 2230a_100000102301_100009990124 [0,2,0,0,0,0|1,0,0]=3 2832 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100000102301_100000050954 [0,2,0,0,0,0|1,0,0]=3 2833 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])Cl 7a_106832991798_100009990124 [0,2,0,0,0,0|1,0,0]=3 2834 B16R1.13275 CCCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100000102301_100000102507 [0,2,0,0,0,0|1,0,0]=3 2835 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Br 34a_100000210227_100010145487 [0,2,0,0,0,0|2,0,0]=4 2836 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Br 7a_100000210227_100010145487 [0,2,0,0,0,0|2,0,0]=4 2837 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Br 7a_100010147062_100000210211 [0,2,0,0,0,0|2,0,0]=4 2838 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])C 34a_100000032366_100000210210 [0,2,0,0,0,0|2,0,0]=4 2839 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])C 34a_100000210227_100010188692 [0,2,0,0,0,0|2,0,0]=4 2840 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])C 7a_100000032366_100000210211 [0,2,0,0,0,0|2,0,0]=4 2841 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])C 7a_100000210227_100010188692 [0,2,0,0,0,0|2,0,0]=4 2842 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100000210227_100009990124 [0,2,0,0,0,0|2,0,0]=4 2843 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Cl 7a_100000067488_100000210211 [0,2,0,0,0,0|2,0,0]=4 2844 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])Cl 7a_100000210227_100009990124 [0,2,0,0,0,0|2,0,0]=4 2845 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])F 34a_100009840826_100000210210 [0,2,0,0,0,0|2,0,0]=4 2846 B16R1.13275 CCCCOCc1cccc(c1[N+](=O)[O-])F 7a_100009840826_100000210211 [0,2,0,0,0,0|2,0,0]=4 2847 B16R1.13275 CCCCSCc1cccc(c1[N+](=O)[O-])Br 62a_100010145487_100000210210 [0,2,0,0,0,0|2,0,0]=4 2848 B16R1.13275 CCCCSCc1cccc(c1[N+](=O)[O-])C 62a_100000210211_100010188692 [0,2,0,0,0,0|2,0,0]=4 2849 B16R1.13275 CCOCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000210147 [0,2,0,0,0,0|1,0,0]=3 2850 B16R1.13275 CCOCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000210147 [0,2,0,0,0,0|1,0,0]=3 2851 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000210147 [0,2,0,0,0,0|2,0,0]=4 2852 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100011215890 [0,2,0,0,0,0|2,0,0]=4 2853 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000210147 [0,2,0,0,0,0|2,0,0]=4 2854 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100011215890 [0,2,0,0,0,0|2,0,0]=4 2855 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000210147 [0,2,0,0,0,0|2,0,0]=4 2856 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100011215890 [0,2,0,0,0,0|2,0,0]=4 2857 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000210147 [0,2,0,0,0,0|2,0,0]=4 2858 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100011215890 [0,2,0,0,0,0|2,0,0]=4 2859 B16R1.13275 CCOCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100011215890 [0,2,0,0,0,0|2,0,0]=4 2860 B16R1.13275 CCSCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000757381 [0,2,0,0,0,0|1,0,0]=3 2861 B16R1.13275 CCSCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000757381 [0,2,0,0,0,0|1,0,0]=3 2862 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000757381 [0,2,0,0,0,0|2,0,0]=4 2863 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000757381 [0,2,0,0,0,0|2,0,0]=4 2864 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000757381 [0,2,0,0,0,0|2,0,0]=4 2865 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000757381 [0,2,0,0,0,0|2,0,0]=4 2866 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000757381 [0,2,0,0,0,0|2,0,0]=4 2867 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000757381 [0,2,0,0,0,0|2,0,0]=4 2868 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000757381 [0,2,0,0,0,0|2,0,0]=4 2869 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000757381 [0,2,0,0,0,0|2,0,0]=4 2870 B16R1.13275 CCSCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000757381 [0,2,0,0,0,0|2,0,0]=4 2871 B16R1.13275 COCCCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000740836 [0,2,0,0,0,0|1,0,0]=3 2872 B16R1.13275 COCCCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000740836 [0,2,0,0,0,0|1,0,0]=3 2873 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000740836 [0,2,0,0,0,0|2,0,0]=4 2874 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000740836 [0,2,0,0,0,0|2,0,0]=4 2875 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000740836 [0,2,0,0,0,0|2,0,0]=4 2876 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000740836 [0,2,0,0,0,0|2,0,0]=4 2877 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000740836 [0,2,0,0,0,0|2,0,0]=4 2878 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000740836 [0,2,0,0,0,0|2,0,0]=4 2879 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000740836 [0,2,0,0,0,0|2,0,0]=4 2880 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000740836 [0,2,0,0,0,0|2,0,0]=4 2881 B16R1.13275 COCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000740836 [0,2,0,0,0,0|2,0,0]=4 2882 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])Br 2230a_100000209980_100010145487 [0,2,0,0,0,0|2,0,0]=4 2883 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100000209980_100009996538 [0,2,0,0,0,0|2,0,0]=4 2884 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])C 207a_100000209980_100000050834 [0,2,0,0,0,0|2,0,0]=4 2885 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])C 2230a_100000209980_100010188692 [0,2,0,0,0,0|2,0,0]=4 2886 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])C 270004a_100000209980_100000050834 [0,2,0,0,0,0|2,0,0]=4 2887 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])Cl 2230a_100000209980_100009990124 [0,2,0,0,0,0|2,0,0]=4 2888 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100000209980_100000050954 [0,2,0,0,0,0|2,0,0]=4 2889 B16R1.13275 COCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100000209980_100000102507 [0,2,0,0,0,0|2,0,0]=4 2890 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])Br 2230a_100020590264_100010145487 [0,2,0,0,0,0|2,0,0]=4 2891 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100020590264_100009996538 [0,2,0,0,0,0|2,0,0]=4 2892 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])C 207a_100020590264_100000050834 [0,2,0,0,0,0|2,0,0]=4 2893 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])C 2230a_100020590264_100010188692 [0,2,0,0,0,0|2,0,0]=4 2894 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])C 270004a_100020590264_100000050834 [0,2,0,0,0,0|2,0,0]=4 2895 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])Cl 2230a_100020590264_100009990124 [0,2,0,0,0,0|2,0,0]=4 2896 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100020590264_100000050954 [0,2,0,0,0,0|2,0,0]=4 2897 B16R1.13275 CSCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100020590264_100000102507 [0,2,0,0,0,0|2,0,0]=4 2898 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCC#N 270004a_100000720768_100000050834 [0,2,0,0,0,0|0,0,2]=4 2899 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCF 207a_100015189416_100000050834 [0,2,0,0,0,0|1,0,0]=3 2900 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCF 2230a_100015189416_100010188692 [0,2,0,0,0,0|1,0,0]=3 2901 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCF 270004a_100015189416_100000050834 [0,2,0,0,0,0|1,0,0]=3 2902 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCF 34a_100015189416_100010188692 [0,2,0,0,0,0|1,0,0]=3 2903 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCO 207a_100000182051_100000050834 [0,2,0,0,0,0|1,0,0]=3 2904 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CNCCCO 270004a_100000182051_100000050834 [0,2,0,0,0,0|1,0,0]=3 2905 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCBr 34a_100011217188_100010188692 [0,2,0,0,0,0|2,0,0]=4 2906 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCCl 34a_100000230001_100010188692 [0,2,0,0,0,0|2,0,0]=4 2907 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCF 34a_100000032366_100011934791 [0,2,0,0,0,0|2,0,0]=4 2908 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCF 34a_100000759539_100010188692 [0,2,0,0,0,0|2,0,0]=4 2909 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCF 7a_100000032366_100011934791 [0,2,0,0,0,0|2,0,0]=4 2910 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCN 34a_100000182051_100010188692 [0,2,0,0,0,0|1,0,0]=3 2911 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCO 34a_100000032366_100000230001 [0,2,0,0,0,0|2,0,0]=4 2912 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCCO 7a_100000032366_100011215043 [0,2,0,0,0,0|2,0,0]=4 2913 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])COCCON 34a_100000700252_100010188692 [0,2,0,0,0,0|2,0,0]=4 2914 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CSCCCF 62a_100011934791_100010188692 [0,2,0,0,0,0|2,0,0]=4 2915 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])CSCCCO 62a_100011215043_100010188692 [0,2,0,0,0,0|2,0,0]=4 2916 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])NCC#CCO 34a_100011424894_200000047223 [0,2,0,0,0,0|1,0,1]=4 2917 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])NCCCCF 34a_100011424894_100000729493 [0,2,0,0,0,0|1,0,0]=3 2918 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])NCCCCO 34a_100011424894_100011216708 [0,2,0,0,0,0|1,0,0]=3 2919 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCC#N 7a_100000740142_100000687738 [0,2,0,0,0,0|1,0,1]=4 2920 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCC=O 7a_100000740142_200011292268 [0,2,0,0,0,0|2,0,0]=4 2921 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCCF 34a_100000740142_100000729493 [0,2,0,0,0,0|2,0,0]=4 2922 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCCF 7a_100000740142_100000729493 [0,2,0,0,0,0|2,0,0]=4 2923 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCCO 34a_100000740142_100011216708 [0,2,0,0,0,0|2,0,0]=4 2924 B16R1.13275 Cc1cccc(c1[N+](=O)[O-])OCCCCO 7a_100000740142_100000210776 [0,2,0,0,0,0|2,0,0]=4 2925 B16R1.13275 N#CCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000687738 [0,2,0,0,0,0|1,0,1]=4 2926 B16R1.13275 N#CCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000687738 [0,2,0,0,0,0|1,0,1]=4 2927 B16R1.13275 N#CCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000687738 [0,2,0,0,0,0|1,0,1]=4 2928 B16R1.13275 N#CCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000687738 [0,2,0,0,0,0|1,0,1]=4 2929 B16R1.13275 N#CCCNCc1cccc(c1[N+](=O)[O-])Br 270004a_100000720768_100009996538 [0,2,0,0,0,0|0,0,2]=4 2930 B16R1.13275 N#CCCNCc1cccc(c1[N+](=O)[O-])Cl 270004a_100000720768_100000050954 [0,2,0,0,0,0|0,0,2]=4 2931 B16R1.13275 N#CCCNCc1cccc(c1[N+](=O)[O-])F 270004a_100000720768_100000102507 [0,2,0,0,0,0|0,0,2]=4 2932 B16R1.13275 NCCCOCc1cccc(c1[N+](=O)[O-])Br 34a_100000182051_100010145487 [0,2,0,0,0,0|1,0,0]=3 2933 B16R1.13275 NCCCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100000182051_100009990124 [0,2,0,0,0,0|1,0,0]=3 2934 B16R1.13275 NOCCOCc1cccc(c1[N+](=O)[O-])Br 34a_100000700252_100010145487 [0,2,0,0,0,0|2,0,0]=4 2935 B16R1.13275 NOCCOCc1cccc(c1[N+](=O)[O-])Cl 34a_100000700252_100009990124 [0,2,0,0,0,0|2,0,0]=4 2936 B16R1.13275 O=CCCCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_200011292268 [0,2,0,0,0,0|2,0,0]=4 2937 B16R1.13275 O=CCCCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_200011292268 [0,2,0,0,0,0|2,0,0]=4 2938 B16R1.13275 O=CCCCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_200011292268 [0,2,0,0,0,0|2,0,0]=4 2939 B16R1.13275 O=CCCCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_200011292268 [0,2,0,0,0,0|2,0,0]=4 2940 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Br 2230a_100015189416_100010145487 [0,2,0,0,0,0|1,0,0]=3 2941 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Br 270004a_100015189416_100009996538 [0,2,0,0,0,0|1,0,0]=3 2942 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Br 34a_100015189416_100010145487 [0,2,0,0,0,0|1,0,0]=3 2943 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Cl 2230a_100015189416_100009990124 [0,2,0,0,0,0|1,0,0]=3 2944 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Cl 270004a_100015189416_100000050954 [0,2,0,0,0,0|1,0,0]=3 2945 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)Cl 34a_100015189416_100009990124 [0,2,0,0,0,0|1,0,0]=3 2946 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCF)F 270004a_100015189416_100000102507 [0,2,0,0,0,0|1,0,0]=3 2947 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCO)Br 270004a_100000182051_100009996538 [0,2,0,0,0,0|1,0,0]=3 2948 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCO)Cl 270004a_100000182051_100000050954 [0,2,0,0,0,0|1,0,0]=3 2949 B16R1.13275 O=[N+]([O-])c1c(cccc1CNCCCO)F 270004a_100000182051_100000102507 [0,2,0,0,0,0|1,0,0]=3 2950 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCBr)Br 34a_100011217188_100010145487 [0,2,0,0,0,0|2,0,0]=4 2951 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCBr)Cl 34a_100011217188_100009990124 [0,2,0,0,0,0|2,0,0]=4 2952 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCCl)Br 34a_100000230001_100010145487 [0,2,0,0,0,0|2,0,0]=4 2953 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCCl)Cl 34a_100000230001_100009990124 [0,2,0,0,0,0|2,0,0]=4 2954 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)Br 34a_100000759539_100010145487 [0,2,0,0,0,0|2,0,0]=4 2955 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)Br 7a_100010147062_100011934791 [0,2,0,0,0,0|2,0,0]=4 2956 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)Cl 34a_100000759539_100009990124 [0,2,0,0,0,0|2,0,0]=4 2957 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)Cl 7a_100000067488_100011934791 [0,2,0,0,0,0|2,0,0]=4 2958 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)F 34a_100009840826_100011934791 [0,2,0,0,0,0|2,0,0]=4 2959 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCF)F 7a_100009840826_100011934791 [0,2,0,0,0,0|2,0,0]=4 2960 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCO)Br 7a_100010147062_100011215043 [0,2,0,0,0,0|2,0,0]=4 2961 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCO)Cl 7a_100000067488_100011215043 [0,2,0,0,0,0|2,0,0]=4 2962 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCO)F 34a_100009840826_100000230001 [0,2,0,0,0,0|2,0,0]=4 2963 B16R1.13275 O=[N+]([O-])c1c(cccc1COCCCO)F 7a_100009840826_100011215043 [0,2,0,0,0,0|2,0,0]=4 2964 B16R1.13275 O=[N+]([O-])c1c(cccc1CSCCCF)Br 62a_100010145487_100011934791 [0,2,0,0,0,0|2,0,0]=4 2965 B16R1.13275 O=[N+]([O-])c1c(cccc1CSCCCO)Br 62a_100010145487_100011215043 [0,2,0,0,0,0|2,0,0]=4 2966 B16R1.13275 O=[N+]([O-])c1c(cccc1NCC#CCO)F 34a_100011219493_200000047223 [0,2,0,0,0,0|1,0,1]=4 2967 B16R1.13275 O=[N+]([O-])c1c(cccc1NCCCCF)F 34a_100011219493_100000729493 [0,2,0,0,0,0|1,0,0]=3 2968 B16R1.13275 O=[N+]([O-])c1c(cccc1NCCCCO)F 34a_100011219493_100011216708 [0,2,0,0,0,0|1,0,0]=3 2969 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)Br 34a_100011934925_100000729493 [0,2,0,0,0,0|2,0,0]=4 2970 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)Br 7a_100011934925_100000729493 [0,2,0,0,0,0|2,0,0]=4 2971 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)Cl 34a_100011999376_100000729493 [0,2,0,0,0,0|2,0,0]=4 2972 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)Cl 7a_100011999376_100000729493 [0,2,0,0,0,0|2,0,0]=4 2973 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)F 34a_100011217962_100000729493 [0,2,0,0,0,0|2,0,0]=4 2974 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)F 7a_100011217962_100000729493 [0,2,0,0,0,0|2,0,0]=4 2975 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCF)I 7a_100010150324_100000729493 [0,2,0,0,0,0|2,0,0]=4 2976 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)Br 34a_100011934925_100011216708 [0,2,0,0,0,0|2,0,0]=4 2977 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)Br 7a_100011934925_100000210776 [0,2,0,0,0,0|2,0,0]=4 2978 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)Cl 34a_100011999376_100011216708 [0,2,0,0,0,0|2,0,0]=4 2979 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)Cl 7a_100011999376_100000210776 [0,2,0,0,0,0|2,0,0]=4 2980 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)F 34a_100011217962_100011216708 [0,2,0,0,0,0|2,0,0]=4 2981 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)F 7a_100011217962_100000210776 [0,2,0,0,0,0|2,0,0]=4 2982 B16R1.13275 O=[N+]([O-])c1c(cccc1OCCCCO)I 7a_100010150324_100000210776 [0,2,0,0,0,0|2,0,0]=4 2983 B16R1.1138 C=CC(O)CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000730141 [0,2,0,0,0,0|1,0,1]=4 2984 B16R1.1138 CC(CN)OCc1ccc(cc1[N+](=O)[O-])Br 34a_100000210904_100012353686 [0,2,0,0,0,0|2,0,0]=4 2985 B16R1.1138 CC(CN)OCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000210904_100000748067 [0,2,0,0,0,0|2,0,0]=4 2986 B16R1.1138 CC(CN)OCc1ccc(cc1[N+](=O)[O-])F 34a_100000210904_100012145688 [0,2,0,0,0,0|2,0,0]=4 2987 B16R1.1138 CC(CN)OCc1ccc(cc1[N+](=O)[O-])I 34a_100000210904_200010171343 [0,2,0,0,0,0|2,0,0]=4 2988 B16R1.1138 CCC(C)CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000748023 [0,2,0,0,0,0|1,0,0]=3 2989 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000748023 [0,2,0,0,0,0|2,0,0]=4 2990 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000748023 [0,2,0,0,0,0|2,0,0]=4 2991 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000748023 [0,2,0,0,0,0|2,0,0]=4 2992 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000748023 [0,2,0,0,0,0|2,0,0]=4 2993 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000748023 [0,2,0,0,0,0|2,0,0]=4 2994 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000748023 [0,2,0,0,0,0|2,0,0]=4 2995 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000748023 [0,2,0,0,0,0|2,0,0]=4 2996 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000748023 [0,2,0,0,0,0|2,0,0]=4 2997 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000748023 [0,2,0,0,0,0|2,0,0]=4 2998 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000748023 [0,2,0,0,0,0|2,0,0]=4 2999 B16R1.1138 CCC(C)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000748023 [0,2,0,0,0,0|2,0,0]=4 3000 B16R1.1138 CCC(O)CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100011218378 [0,2,0,0,0,0|1,0,0]=3 3001 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100011218378 [0,2,0,0,0,0|2,0,0]=4 3002 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100011218378 [0,2,0,0,0,0|2,0,0]=4 3003 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100011218378 [0,2,0,0,0,0|2,0,0]=4 3004 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100011218378 [0,2,0,0,0,0|2,0,0]=4 3005 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100011218378 [0,2,0,0,0,0|2,0,0]=4 3006 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100011218378 [0,2,0,0,0,0|2,0,0]=4 3007 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100011218378 [0,2,0,0,0,0|2,0,0]=4 3008 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100011218378 [0,2,0,0,0,0|2,0,0]=4 3009 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100011218378 [0,2,0,0,0,0|2,0,0]=4 3010 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100011218378 [0,2,0,0,0,0|2,0,0]=4 3011 B16R1.1138 CCC(O)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100011218378 [0,2,0,0,0,0|2,0,0]=4 3012 B16R1.1138 CC[C@H](C)CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100009816398 [0,2,0,0,0,0|1,0,0]=3 3013 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100009816398 [0,2,0,0,0,0|2,0,0]=4 3014 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100009816398 [0,2,0,0,0,0|2,0,0]=4 3015 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100009816398 [0,2,0,0,0,0|2,0,0]=4 3016 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100009816398 [0,2,0,0,0,0|2,0,0]=4 3017 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100009816398 [0,2,0,0,0,0|2,0,0]=4 3018 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100009816398 [0,2,0,0,0,0|2,0,0]=4 3019 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100009816398 [0,2,0,0,0,0|2,0,0]=4 3020 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100009816398 [0,2,0,0,0,0|2,0,0]=4 3021 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100009816398 [0,2,0,0,0,0|2,0,0]=4 3022 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100009816398 [0,2,0,0,0,0|2,0,0]=4 3023 B16R1.1138 CC[C@H](C)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100009816398 [0,2,0,0,0,0|2,0,0]=4 3024 B16R1.1138 C[C@@H](CO)CNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000059175 [0,2,0,0,0,0|1,0,0]=3 3025 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000059175 [0,2,0,0,0,0|2,0,0]=4 3026 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000059175 [0,2,0,0,0,0|2,0,0]=4 3027 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000059175 [0,2,0,0,0,0|2,0,0]=4 3028 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000059175 [0,2,0,0,0,0|2,0,0]=4 3029 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000059175 [0,2,0,0,0,0|2,0,0]=4 3030 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000059175 [0,2,0,0,0,0|2,0,0]=4 3031 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000059175 [0,2,0,0,0,0|2,0,0]=4 3032 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000059175 [0,2,0,0,0,0|2,0,0]=4 3033 B16R1.1138 C[C@@H](CO)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000059175 [0,2,0,0,0,0|2,0,0]=4 3034 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])COC(C)CN 34a_100000210904_200009879986 [0,2,0,0,0,0|2,0,0]=4 3035 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OCC(O)CO 34a_100000195567_100011219619 [0,2,0,0,0,0|2,0,0]=4 3036 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OCC(O)CO 7a_100000195567_100011219619 [0,2,0,0,0,0|2,0,0]=4 3037 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](C)CO 34a_100000195567_100000059175 [0,2,0,0,0,0|2,0,0]=4 3038 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](C)CO 7a_100000195567_100000059175 [0,2,0,0,0,0|2,0,0]=4 3039 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CF 34a_100000195567_100015614560 [0,2,0,0,0,0|2,0,0]=4 3040 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CF 7a_100000195567_100015614560 [0,2,0,0,0,0|2,0,0]=4 3041 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CO 34a_100000195567_100009815848 [0,2,0,0,0,0|2,0,0]=4 3042 B16R1.1138 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CO 7a_100000195567_100009815848 [0,2,0,0,0,0|2,0,0]=4 3043 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OCC(O)CO 34a_100000032192_100011219619 [0,2,0,0,0,0|2,0,0]=4 3044 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OCC(O)CO 7a_100000032192_100011219619 [0,2,0,0,0,0|2,0,0]=4 3045 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CF 34a_100000032192_100015614560 [0,2,0,0,0,0|2,0,0]=4 3046 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CF 7a_100000032192_100015614560 [0,2,0,0,0,0|2,0,0]=4 3047 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CO 34a_100000032192_100009815848 [0,2,0,0,0,0|2,0,0]=4 3048 B16R1.1138 Nc1ccc(c(c1)[N+](=O)[O-])OC[C@@H](O)CO 7a_100000032192_100009815848 [0,2,0,0,0,0|2,0,0]=4 3049 B16R1.1138 O=[N+]([O-])c1cc(ccc1NCC(O)CO)F 34a_100000187532_100011219619 [0,2,0,0,0,0|1,0,0]=3 3050 B16R1.1138 O=[N+]([O-])c1cc(ccc1NC[C@@H](O)CF)F 34a_100000187532_100015614560 [0,2,0,0,0,0|1,0,0]=3 3051 B16R1.1138 O=[N+]([O-])c1cc(ccc1NC[C@@H](O)CO)F 34a_100000187532_100009815848 [0,2,0,0,0,0|1,0,0]=3 3052 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)Br 34a_100000757407_100011219619 [0,2,0,0,0,0|2,0,0]=4 3053 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)Br 7a_100000757407_100011219619 [0,2,0,0,0,0|2,0,0]=4 3054 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)Cl 34a_100000212152_100011219619 [0,2,0,0,0,0|2,0,0]=4 3055 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)Cl 7a_100000212152_100011219619 [0,2,0,0,0,0|2,0,0]=4 3056 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)F 34a_100000748789_100011219619 [0,2,0,0,0,0|2,0,0]=4 3057 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)F 7a_100000748789_100011219619 [0,2,0,0,0,0|2,0,0]=4 3058 B16R1.1138 O=[N+]([O-])c1cc(ccc1OCC(O)CO)I 7a_100000698543_100011219619 [0,2,0,0,0,0|2,0,0]=4 3059 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)Br 34a_100000757407_100015614560 [0,2,0,0,0,0|2,0,0]=4 3060 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)Br 7a_100000757407_100015614560 [0,2,0,0,0,0|2,0,0]=4 3061 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)Cl 34a_100000212152_100015614560 [0,2,0,0,0,0|2,0,0]=4 3062 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)Cl 7a_100000212152_100015614560 [0,2,0,0,0,0|2,0,0]=4 3063 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)F 34a_100000748789_100015614560 [0,2,0,0,0,0|2,0,0]=4 3064 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)F 7a_100000748789_100015614560 [0,2,0,0,0,0|2,0,0]=4 3065 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CF)I 7a_100000698543_100015614560 [0,2,0,0,0,0|2,0,0]=4 3066 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)Br 34a_100000757407_100009815848 [0,2,0,0,0,0|2,0,0]=4 3067 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)Br 7a_100000757407_100009815848 [0,2,0,0,0,0|2,0,0]=4 3068 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)Cl 34a_100000212152_100009815848 [0,2,0,0,0,0|2,0,0]=4 3069 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)Cl 7a_100000212152_100009815848 [0,2,0,0,0,0|2,0,0]=4 3070 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)F 34a_100000748789_100009815848 [0,2,0,0,0,0|2,0,0]=4 3071 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)F 7a_100000748789_100009815848 [0,2,0,0,0,0|2,0,0]=4 3072 B16R1.1138 O=[N+]([O-])c1cc(ccc1OC[C@@H](O)CO)I 7a_100000698543_100009815848 [0,2,0,0,0,0|2,0,0]=4 3073 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100000688953 [0,2,0,0,0,0|1,0,1]=4 3074 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000730999 [0,2,0,0,0,0|1,0,1]=4 3075 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100000688953 [0,2,0,0,0,0|1,0,1]=4 3076 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000730999 [0,2,0,0,0,0|1,0,1]=4 3077 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100000688953 [0,2,0,0,0,0|1,0,1]=4 3078 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000730999 [0,2,0,0,0,0|1,0,1]=4 3079 B16R1.1829 C#CCCN(C)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100000688953 [0,2,0,0,0,0|1,0,1]=4 3080 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100000754431 [0,2,0,0,0,0|1,0,1]=4 3081 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000754431 [0,2,0,0,0,0|1,0,1]=4 3082 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100000754431 [0,2,0,0,0,0|1,0,1]=4 3083 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000754431 [0,2,0,0,0,0|1,0,1]=4 3084 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100000754431 [0,2,0,0,0,0|1,0,1]=4 3085 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000754431 [0,2,0,0,0,0|1,0,1]=4 3086 B16R1.1829 C=CCCN(C)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100000754431 [0,2,0,0,0,0|1,0,1]=4 3087 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])Br 1458a_100000767047_100000210211 [0,2,0,0,0,0|2,0,0]=4 3088 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])C 1458a_100011827699_100000210211 [0,2,0,0,0,0|2,0,0]=4 3089 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])Cl 1458a_100000210460_100000210211 [0,2,0,0,0,0|2,0,0]=4 3090 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])F 1458a_100000686224_100000210211 [0,2,0,0,0,0|2,0,0]=4 3091 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])I 1458a_100000718686_100000210211 [0,2,0,0,0,0|2,0,0]=4 3092 B16R1.1829 CCCCC(=O)c1ccc(cc1[N+](=O)[O-])O 1458a_100000701580_100000210211 [0,2,0,0,0,0|2,0,0]=4 3093 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000176069_200000210301 [0,2,0,0,0,0|1,0,0]=3 3094 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100000210211 [0,2,0,0,0,0|1,0,0]=3 3095 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000176069_200000210301 [0,2,0,0,0,0|1,0,0]=3 3096 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000210211 [0,2,0,0,0,0|1,0,0]=3 3097 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Br 7a_100000176069_200000210301 [0,2,0,0,0,0|1,0,0]=3 3098 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100000210211 [0,2,0,0,0,0|1,0,0]=3 3099 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000210211 [0,2,0,0,0,0|1,0,0]=3 3100 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100000210211 [0,2,0,0,0,0|1,0,0]=3 3101 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000210211 [0,2,0,0,0,0|1,0,0]=3 3102 B16R1.1829 CCCCN(C)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100000210210 [0,2,0,0,0,0|1,0,0]=3 3103 B16R1.1829 CCCCN([13CH3])c1ccc(cc1[N+](=O)[O-])Br 2230a_100000176069_200025704644 [0,2,0,0,0,0|1,0,0]=3 3104 B16R1.1829 CCCCN([13CH3])c1ccc(cc1[N+](=O)[O-])Br 269982a_100000176069_200025704644 [0,2,0,0,0,0|1,0,0]=3 3105 B16R1.1829 CCCCN([13CH3])c1ccc(cc1[N+](=O)[O-])Br 7a_100000176069_200025704644 [0,2,0,0,0,0|1,0,0]=3 3106 B16R1.1829 CCOCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000739092 [0,2,0,0,0,0|2,0,0]=4 3107 B16R1.1829 CCOCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000739092 [0,2,0,0,0,0|2,0,0]=4 3108 B16R1.1829 CCOCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000739092 [0,2,0,0,0,0|2,0,0]=4 3109 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100011215226 [0,2,0,0,0,0|0,0,2]=4 3110 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100011215226 [0,2,0,0,0,0|0,0,2]=4 3111 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100011215226 [0,2,0,0,0,0|0,0,2]=4 3112 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100011215226 [0,2,0,0,0,0|0,0,2]=4 3113 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100011215226 [0,2,0,0,0,0|0,0,2]=4 3114 B16R1.1829 CN(CCC#N)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100011215226 [0,2,0,0,0,0|0,0,2]=4 3115 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100011934791 [0,2,0,0,0,0|1,0,0]=3 3116 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100011934791 [0,2,0,0,0,0|1,0,0]=3 3117 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100011934791 [0,2,0,0,0,0|1,0,0]=3 3118 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100011934791 [0,2,0,0,0,0|1,0,0]=3 3119 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100011934791 [0,2,0,0,0,0|1,0,0]=3 3120 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100011934791 [0,2,0,0,0,0|1,0,0]=3 3121 B16R1.1829 CN(CCCF)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100011934791 [0,2,0,0,0,0|1,0,0]=3 3122 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100000230001 [0,2,0,0,0,0|1,0,0]=3 3123 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100011215043 [0,2,0,0,0,0|1,0,0]=3 3124 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100000230001 [0,2,0,0,0,0|1,0,0]=3 3125 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100011215043 [0,2,0,0,0,0|1,0,0]=3 3126 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100000230001 [0,2,0,0,0,0|1,0,0]=3 3127 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100011215043 [0,2,0,0,0,0|1,0,0]=3 3128 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100000230001 [0,2,0,0,0,0|1,0,0]=3 3129 B16R1.1829 CN(CCCO)c1ccc(cc1[N+](=O)[O-])O 269982a_100010177836_200000210301 [0,2,0,0,0,0|1,0,0]=3 3130 B16R1.1829 CN(CCO[13CH3])c1ccc(cc1[N+](=O)[O-])Br 7a_200000204761_200025704644 [0,2,0,0,0,0|2,0,0]=4 3131 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100011201679 [0,2,0,0,0,0|2,0,0]=4 3132 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000233755 [0,2,0,0,0,0|2,0,0]=4 3133 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])Br 7a_200000204761_200000210301 [0,2,0,0,0,0|2,0,0]=4 3134 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100011201679 [0,2,0,0,0,0|2,0,0]=4 3135 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000233755 [0,2,0,0,0,0|2,0,0]=4 3136 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100011201679 [0,2,0,0,0,0|2,0,0]=4 3137 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000233755 [0,2,0,0,0,0|2,0,0]=4 3138 B16R1.1829 COCCN(C)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100011201679 [0,2,0,0,0,0|2,0,0]=4 3139 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])Br 2230a_100000752019_100000751147 [0,2,0,0,0,0|2,0,0]=4 3140 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])Br 269982a_100000752019_100000212216 [0,2,0,0,0,0|2,0,0]=4 3141 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 2230a_100000156513_100000751147 [0,2,0,0,0,0|2,0,0]=4 3142 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])Cl 269982a_100000156513_100000212216 [0,2,0,0,0,0|2,0,0]=4 3143 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])F 2230a_100000197360_100000751147 [0,2,0,0,0,0|2,0,0]=4 3144 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])F 269982a_100000197360_100000212216 [0,2,0,0,0,0|2,0,0]=4 3145 B16R1.1829 CSCCN(C)c1ccc(cc1[N+](=O)[O-])F 34a_100000197360_100000212216 [0,2,0,0,0,0|2,0,0]=4 3146 B16R1.1829 Cc1ccc(c(c1)[N+](=O)[O-])C(=O)CCCF 1458a_100011827699_100011934791 [0,2,0,0,0,0|2,0,0]=4 3147 B16R1.1829 Cc1ccc(c(c1)[N+](=O)[O-])C(=O)CCCO 1458a_100011827699_100011215043 [0,2,0,0,0,0|2,0,0]=4 3148 B16R1.1829 O=C(CCCF)c1ccc(cc1[N+](=O)[O-])Br 1458a_100000767047_100011934791 [0,2,0,0,0,0|2,0,0]=4 3149 B16R1.1829 O=C(CCCF)c1ccc(cc1[N+](=O)[O-])Cl 1458a_100000210460_100011934791 [0,2,0,0,0,0|2,0,0]=4 3150 B16R1.1829 O=C(CCCF)c1ccc(cc1[N+](=O)[O-])F 1458a_100000686224_100011934791 [0,2,0,0,0,0|2,0,0]=4 3151 B16R1.1829 O=C(CCCF)c1ccc(cc1[N+](=O)[O-])I 1458a_100000718686_100011934791 [0,2,0,0,0,0|2,0,0]=4 3152 B16R1.1829 O=C(CCCF)c1ccc(cc1[N+](=O)[O-])O 1458a_100000701580_100011934791 [0,2,0,0,0,0|2,0,0]=4 3153 B16R1.1829 O=C(CCCO)c1ccc(cc1[N+](=O)[O-])Br 1458a_100000767047_100011215043 [0,2,0,0,0,0|2,0,0]=4 3154 B16R1.1829 O=C(CCCO)c1ccc(cc1[N+](=O)[O-])Cl 1458a_100000210460_100011215043 [0,2,0,0,0,0|2,0,0]=4 3155 B16R1.1829 O=C(CCCO)c1ccc(cc1[N+](=O)[O-])F 1458a_100000686224_100011215043 [0,2,0,0,0,0|2,0,0]=4 3156 B16R1.1829 O=C(CCCO)c1ccc(cc1[N+](=O)[O-])I 1458a_100000718686_100011215043 [0,2,0,0,0,0|2,0,0]=4 3157 B16R1.1829 O=C(CCCO)c1ccc(cc1[N+](=O)[O-])O 1458a_100000701580_100011215043 [0,2,0,0,0,0|2,0,0]=4 3158 B16R1.1829 [13CH3]N(CCCO)c1ccc(cc1[N+](=O)[O-])O 269982a_100010177836_200025704644 [0,2,0,0,0,0|1,0,0]=3 3159 B16R1.11454 C=C(C)CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000730704 [0,2,0,0,0,0|1,0,1]=4 3160 B16R1.11454 CC(C)CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000210312 [0,2,0,0,0,0|1,0,0]=3 3161 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000210312 [0,2,0,0,0,0|2,0,0]=4 3162 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000210626 [0,2,0,0,0,0|2,0,0]=4 3163 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000210312 [0,2,0,0,0,0|2,0,0]=4 3164 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000210626 [0,2,0,0,0,0|2,0,0]=4 3165 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000210312 [0,2,0,0,0,0|2,0,0]=4 3166 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000210626 [0,2,0,0,0,0|2,0,0]=4 3167 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000210626 [0,2,0,0,0,0|2,0,0]=4 3168 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000210312 [0,2,0,0,0,0|2,0,0]=4 3169 B16R1.11454 CC(C)CCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000210626 [0,2,0,0,0,0|2,0,0]=4 3170 B16R1.11454 CC(C)OCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000709892 [0,2,0,0,0,0|2,0,0]=4 3171 B16R1.11454 CC(O)CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100012276601 [0,2,0,0,0,0|1,0,0]=3 3172 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100012276601 [0,2,0,0,0,0|2,0,0]=4 3173 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100012276601 [0,2,0,0,0,0|2,0,0]=4 3174 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100012276601 [0,2,0,0,0,0|2,0,0]=4 3175 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100012276601 [0,2,0,0,0,0|2,0,0]=4 3176 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100012276601 [0,2,0,0,0,0|2,0,0]=4 3177 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100012276601 [0,2,0,0,0,0|2,0,0]=4 3178 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100012276601 [0,2,0,0,0,0|2,0,0]=4 3179 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100012276601 [0,2,0,0,0,0|2,0,0]=4 3180 B16R1.11454 CC(O)CCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100012276601 [0,2,0,0,0,0|2,0,0]=4 3181 B16R1.11454 C[C@@H](N)COCc1ccc(cc1[N+](=O)[O-])Br 34a_100000737577_100012353686 [0,2,0,0,0,0|2,0,0]=4 3182 B16R1.11454 C[C@@H](N)COCc1ccc(cc1[N+](=O)[O-])Cl 34a_100000737577_100000748067 [0,2,0,0,0,0|2,0,0]=4 3183 B16R1.11454 C[C@@H](N)COCc1ccc(cc1[N+](=O)[O-])F 34a_100000737577_100012145688 [0,2,0,0,0,0|2,0,0]=4 3184 B16R1.11454 C[C@@H](N)COCc1ccc(cc1[N+](=O)[O-])I 34a_100000737577_200010171343 [0,2,0,0,0,0|2,0,0]=4 3185 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])COC[C@@H](C)N 34a_100000737577_200009879986 [0,2,0,0,0,0|2,0,0]=4 3186 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(=O)N 34a_100000195567_100000731001 [0,2,0,0,0,0|1,0,1]=4 3187 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(=O)N 7a_100000195567_100000744528 [0,2,0,0,0,0|1,0,1]=4 3188 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(C)C 34a_100000195567_100000210312 [0,2,0,0,0,0|2,0,0]=4 3189 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(C)C 7a_100000195567_100000210626 [0,2,0,0,0,0|2,0,0]=4 3190 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(C)O 34a_100000195567_100012276601 [0,2,0,0,0,0|2,0,0]=4 3191 B16R1.11454 Cc1ccc(c(c1)[N+](=O)[O-])OCCC(C)O 7a_100000195567_100012276601 [0,2,0,0,0,0|2,0,0]=4 3192 B16R1.11454 NC(=O)CCNc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000731001 [0,2,0,0,0,0|0,0,1]=3 3193 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000731001 [0,2,0,0,0,0|1,0,1]=4 3194 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000744528 [0,2,0,0,0,0|1,0,1]=4 3195 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000731001 [0,2,0,0,0,0|1,0,1]=4 3196 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000744528 [0,2,0,0,0,0|1,0,1]=4 3197 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000731001 [0,2,0,0,0,0|1,0,1]=4 3198 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000744528 [0,2,0,0,0,0|1,0,1]=4 3199 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000744528 [0,2,0,0,0,0|1,0,1]=4 3200 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000731001 [0,2,0,0,0,0|1,0,1]=4 3201 B16R1.11454 NC(=O)CCOc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000744528 [0,2,0,0,0,0|1,0,1]=4 3202 B16R1.13013 C#CCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000688953 [0,2,0,0,0,0|1,0,1]=4 3203 B16R1.13013 C#CCCNc1ccc(cc1[N+](=O)[O-])CC 2230a_100012180705_100000688953 [0,2,0,0,0,0|1,0,1]=4 3204 B16R1.13013 C=CCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000754431 [0,2,0,0,0,0|1,0,1]=4 3205 B16R1.13013 C=CCCNc1ccc(cc1[N+](=O)[O-])CC 2230a_100012180705_100000754431 [0,2,0,0,0,0|1,0,1]=4 3206 B16R1.13013 CCCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000210211 [0,2,0,0,0,0|1,0,0]=3 3207 B16R1.13013 CCCCNc1ccc(cc1[N+](=O)[O-])CC 2230a_100012180705_100000210211 [0,2,0,0,0,0|1,0,0]=3 3208 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])C#N 34a_100000188248_100000210210 [0,2,0,0,0,0|2,0,0]=4 3209 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])C#N 7a_100000188248_100000210211 [0,2,0,0,0,0|2,0,0]=4 3210 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CBr 34a_100010149780_100000210210 [0,2,0,0,0,0|2,0,0]=4 3211 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CBr 7a_100010149780_100000210211 [0,2,0,0,0,0|2,0,0]=4 3212 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CC 34a_100000756517_100000210210 [0,2,0,0,0,0|2,0,0]=4 3213 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CC 7a_100000756517_100000210211 [0,2,0,0,0,0|2,0,0]=4 3214 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CCl 34a_200000683477_100000210210 [0,2,0,0,0,0|2,0,0]=4 3215 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CCl 7a_200000683477_100000210211 [0,2,0,0,0,0|2,0,0]=4 3216 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CO 34a_100011216038_100000210210 [0,2,0,0,0,0|2,0,0]=4 3217 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])CO 7a_100011216038_100000210211 [0,2,0,0,0,0|2,0,0]=4 3218 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])OC 34a_100000211607_100000210210 [0,2,0,0,0,0|2,0,0]=4 3219 B16R1.13013 CCCCOc1ccc(cc1[N+](=O)[O-])OC 7a_100000211607_100000210211 [0,2,0,0,0,0|2,0,0]=4 3220 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])NCCC#N 2230a_100012180705_100011215226 [0,2,0,0,0,0|0,0,2]=4 3221 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])NCCCF 2230a_100012180705_100011934791 [0,2,0,0,0,0|1,0,0]=3 3222 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])NCCCO 2230a_100012180705_100000230001 [0,2,0,0,0,0|1,0,0]=3 3223 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])NCCOC 2230a_100012180705_100011201679 [0,2,0,0,0,0|2,0,0]=4 3224 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])NCCSC 2230a_100012180705_100000751147 [0,2,0,0,0,0|2,0,0]=4 3225 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])OCCCF 34a_100000756517_100011934791 [0,2,0,0,0,0|2,0,0]=4 3226 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])OCCCF 7a_100000756517_100011934791 [0,2,0,0,0,0|2,0,0]=4 3227 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])OCCCO 34a_100000756517_100000230001 [0,2,0,0,0,0|2,0,0]=4 3228 B16R1.13013 CCc1ccc(c(c1)[N+](=O)[O-])OCCCO 7a_100000756517_100011215043 [0,2,0,0,0,0|2,0,0]=4 3229 B16R1.13013 COCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000233755 [0,2,0,0,0,0|2,0,0]=4 3230 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])COCCN 34a_100000210304_200010157536 [0,2,0,0,0,0|2,0,0]=4 3231 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])NCCCO 34a_100010177836_200000210301 [0,2,0,0,0,0|1,0,0]=3 3232 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])NCCCO 7a_100010177836_200000210301 [0,2,0,0,0,0|1,0,0]=3 3233 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])OCCCF 34a_100000211607_100011934791 [0,2,0,0,0,0|2,0,0]=4 3234 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])OCCCF 7a_100000211607_100011934791 [0,2,0,0,0,0|2,0,0]=4 3235 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])OCCCO 34a_100000211607_100000230001 [0,2,0,0,0,0|2,0,0]=4 3236 B16R1.13013 COc1ccc(c(c1)[N+](=O)[O-])OCCCO 7a_100000211607_100011215043 [0,2,0,0,0,0|2,0,0]=4 3237 B16R1.13013 CSCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000212216 [0,2,0,0,0,0|2,0,0]=4 3238 B16R1.13013 N#CCCNc1ccc(cc1[N+](=O)[O-])C#N 7a_100000210007_100000184422 [0,2,0,0,0,0|0,0,2]=4 3239 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])NCCCF 7a_100000210007_100011934791 [0,2,0,0,0,0|1,0,0]=3 3240 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])NCCCO 7a_100000210007_100011215043 [0,2,0,0,0,0|1,0,0]=3 3241 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])OCCCF 34a_100000188248_100011934791 [0,2,0,0,0,0|2,0,0]=4 3242 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])OCCCF 7a_100000188248_100011934791 [0,2,0,0,0,0|2,0,0]=4 3243 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])OCCCO 34a_100000188248_100000230001 [0,2,0,0,0,0|2,0,0]=4 3244 B16R1.13013 N#Cc1ccc(c(c1)[N+](=O)[O-])OCCCO 7a_100000188248_100011215043 [0,2,0,0,0,0|2,0,0]=4 3245 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CBr 34a_100010149780_100011934791 [0,2,0,0,0,0|2,0,0]=4 3246 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CBr 7a_100010149780_100011934791 [0,2,0,0,0,0|2,0,0]=4 3247 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CCl 34a_200000683477_100011934791 [0,2,0,0,0,0|2,0,0]=4 3248 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CCl 7a_200000683477_100011934791 [0,2,0,0,0,0|2,0,0]=4 3249 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CO 34a_100011216038_100011934791 [0,2,0,0,0,0|2,0,0]=4 3250 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCF)CO 7a_100011216038_100011934791 [0,2,0,0,0,0|2,0,0]=4 3251 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CBr 34a_100010149780_100000230001 [0,2,0,0,0,0|2,0,0]=4 3252 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CBr 7a_100010149780_100011215043 [0,2,0,0,0,0|2,0,0]=4 3253 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CCl 34a_200000683477_100000230001 [0,2,0,0,0,0|2,0,0]=4 3254 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CCl 7a_200000683477_100011215043 [0,2,0,0,0,0|2,0,0]=4 3255 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CO 34a_100011216038_100000230001 [0,2,0,0,0,0|2,0,0]=4 3256 B16R1.13013 O=[N+]([O-])c1cc(ccc1OCCCO)CO 7a_100011216038_100011215043 [0,2,0,0,0,0|2,0,0]=4 3257 B16R1.13013 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])NCCCO 34a_100010177836_200025704644 [0,2,0,0,0,0|1,0,0]=3 3258 B16R1.13013 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])NCCCO 7a_100010177836_200025704644 [0,2,0,0,0,0|1,0,0]=3 3259 B16R1.13671 CC(CCO)Nc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100009893172 [0,2,0,0,0,0|1,0,0]=3 3260 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100009893172 [0,2,0,0,0,0|2,0,0]=4 3261 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100009893172 [0,2,0,0,0,0|2,0,0]=4 3262 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100009893172 [0,2,0,0,0,0|2,0,0]=4 3263 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100009893172 [0,2,0,0,0,0|2,0,0]=4 3264 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100009893172 [0,2,0,0,0,0|2,0,0]=4 3265 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100009893172 [0,2,0,0,0,0|2,0,0]=4 3266 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100009893172 [0,2,0,0,0,0|2,0,0]=4 3267 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100009893172 [0,2,0,0,0,0|2,0,0]=4 3268 B16R1.13671 CC(CCO)Oc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100009893172 [0,2,0,0,0,0|2,0,0]=4 3269 B16R1.13671 CCCC(=O)Nc1ccc(cc1[N+](=O)[O-])Cl 1626a_100000210029_100000211992 [0,2,0,0,0,0|1,0,1]=4 3270 B16R1.13671 CCCC(=O)Nc1ccc(cc1[N+](=O)[O-])F 11a_100000187532_100000211992 [0,2,0,0,0,0|1,0,1]=4 3271 B16R1.13671 CCCC(=O)Nc1ccc(cc1[N+](=O)[O-])F 1626a_100000187532_100000211992 [0,2,0,0,0,0|1,0,1]=4 3272 B16R1.13671 CCCC(=O)Nc1ccc(cc1[N+](=O)[O-])O 527a_100000740891_100000211992 [0,2,0,0,0,0|1,0,1]=4 3273 B16R1.13671 CCCC(C)Nc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000766640 [0,2,0,0,0,0|1,0,0]=3 3274 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000766640 [0,2,0,0,0,0|2,0,0]=4 3275 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000766640 [0,2,0,0,0,0|2,0,0]=4 3276 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000766640 [0,2,0,0,0,0|2,0,0]=4 3277 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000766640 [0,2,0,0,0,0|2,0,0]=4 3278 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000766640 [0,2,0,0,0,0|2,0,0]=4 3279 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000766640 [0,2,0,0,0,0|2,0,0]=4 3280 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000766640 [0,2,0,0,0,0|2,0,0]=4 3281 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000766640 [0,2,0,0,0,0|2,0,0]=4 3282 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000766640 [0,2,0,0,0,0|2,0,0]=4 3283 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000766640 [0,2,0,0,0,0|2,0,0]=4 3284 B16R1.13671 CCCC(C)Oc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000766640 [0,2,0,0,0,0|2,0,0]=4 3285 B16R1.13671 COCC(C)Nc1ccc(cc1[N+](=O)[O-])F 34a_100000187532_100000765312 [0,2,0,0,0,0|2,0,0]=4 3286 B16R1.13671 Cc1ccc(c(c1)[N+](=O)[O-])OC(C)CCO 34a_100000195567_100009893172 [0,2,0,0,0,0|2,0,0]=4 3287 B16R1.13671 Cc1ccc(c(c1)[N+](=O)[O-])OC(C)CCO 7a_100000195567_100009893172 [0,2,0,0,0,0|2,0,0]=4 3288 B16R1.26945 C#CCCNc1c(cc(cc1[N+](=O)[O-])F)F 34a_100000685770_100000688953 [0,2,0,0,0,0|1,0,1]=4 3289 B16R1.26945 C=CCCNc1c(cc(cc1[N+](=O)[O-])F)F 34a_100000685770_100000754431 [0,2,0,0,0,0|1,0,1]=4 3290 B16R1.26945 CCCCNc1c(cc(cc1[N+](=O)[O-])F)F 34a_100000685770_100000210210 [0,2,0,0,0,0|1,0,0]=3 3291 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])Br)C 34a_100000684574_100000210210 [0,2,0,0,0,0|2,0,0]=4 3292 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])Br)C 7a_100000684574_100000210211 [0,2,0,0,0,0|2,0,0]=4 3293 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])Br)Cl 7a_100000717539_100000210211 [0,2,0,0,0,0|2,0,0]=4 3294 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])Br)F 34a_100011218681_100000210210 [0,2,0,0,0,0|2,0,0]=4 3295 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])Br)F 7a_100011218681_100000210211 [0,2,0,0,0,0|2,0,0]=4 3296 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])C)C 7a_100000195569_100000210211 [0,2,0,0,0,0|2,0,0]=4 3297 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])F)Br 34a_100000244768_100000210210 [0,2,0,0,0,0|2,0,0]=4 3298 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])F)C 34a_100010988975_100000210210 [0,2,0,0,0,0|2,0,0]=4 3299 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])F)C 7a_100010988975_100000210211 [0,2,0,0,0,0|2,0,0]=4 3300 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])F)F 34a_100011217088_100000210210 [0,2,0,0,0,0|2,0,0]=4 3301 B16R1.26945 CCCCOc1c(cc(cc1[N+](=O)[O-])F)F 7a_100011217088_100000210211 [0,2,0,0,0,0|2,0,0]=4 3302 B16R1.26945 COCCNc1c(cc(cc1[N+](=O)[O-])F)F 34a_100000685770_100011201679 [0,2,0,0,0,0|2,0,0]=4 3303 B16R1.26945 CSCCNc1c(cc(cc1[N+](=O)[O-])F)F 34a_100000685770_100000212216 [0,2,0,0,0,0|2,0,0]=4 3304 B16R1.26945 Cc1cc(c(c(c1)[N+](=O)[O-])OCCCF)C 7a_100000195569_100011934791 [0,2,0,0,0,0|2,0,0]=4 3305 B16R1.26945 Cc1cc(c(c(c1)[N+](=O)[O-])OCCCO)C 7a_100000195569_100011215043 [0,2,0,0,0,0|2,0,0]=4 3306 B16R1.26945 Cc1cc(cc(c1OCCCF)[N+](=O)[O-])Br 34a_100000684574_100011934791 [0,2,0,0,0,0|2,0,0]=4 3307 B16R1.26945 Cc1cc(cc(c1OCCCF)[N+](=O)[O-])Br 7a_100000684574_100011934791 [0,2,0,0,0,0|2,0,0]=4 3308 B16R1.26945 Cc1cc(cc(c1OCCCF)[N+](=O)[O-])F 34a_100010988975_100011934791 [0,2,0,0,0,0|2,0,0]=4 3309 B16R1.26945 Cc1cc(cc(c1OCCCF)[N+](=O)[O-])F 7a_100010988975_100011934791 [0,2,0,0,0,0|2,0,0]=4 3310 B16R1.26945 Cc1cc(cc(c1OCCCO)[N+](=O)[O-])Br 34a_100000684574_100000230001 [0,2,0,0,0,0|2,0,0]=4 3311 B16R1.26945 Cc1cc(cc(c1OCCCO)[N+](=O)[O-])Br 7a_100000684574_100011215043 [0,2,0,0,0,0|2,0,0]=4 3312 B16R1.26945 Cc1cc(cc(c1OCCCO)[N+](=O)[O-])F 34a_100010988975_100000230001 [0,2,0,0,0,0|2,0,0]=4 3313 B16R1.26945 Cc1cc(cc(c1OCCCO)[N+](=O)[O-])F 7a_100010988975_100011215043 [0,2,0,0,0,0|2,0,0]=4 3314 B16R1.26945 O=[N+]([O-])c1cc(cc(c1NCCCF)F)F 34a_100000685770_100011934791 [0,2,0,0,0,0|1,0,0]=3 3315 B16R1.26945 O=[N+]([O-])c1cc(cc(c1NCCCO)F)F 34a_100000685770_100000230001 [0,2,0,0,0,0|1,0,0]=3 3316 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)Br)F 34a_100000244768_100011934791 [0,2,0,0,0,0|2,0,0]=4 3317 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)Cl)Br 7a_100000717539_100011934791 [0,2,0,0,0,0|2,0,0]=4 3318 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)F)Br 34a_100011218681_100011934791 [0,2,0,0,0,0|2,0,0]=4 3319 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)F)Br 7a_100011218681_100011934791 [0,2,0,0,0,0|2,0,0]=4 3320 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)F)F 34a_100011217088_100011934791 [0,2,0,0,0,0|2,0,0]=4 3321 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCF)F)F 7a_100011217088_100011934791 [0,2,0,0,0,0|2,0,0]=4 3322 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)Br)F 34a_100000244768_100000230001 [0,2,0,0,0,0|2,0,0]=4 3323 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)Cl)Br 7a_100000717539_100011215043 [0,2,0,0,0,0|2,0,0]=4 3324 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)F)Br 34a_100011218681_100000230001 [0,2,0,0,0,0|2,0,0]=4 3325 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)F)Br 7a_100011218681_100011215043 [0,2,0,0,0,0|2,0,0]=4 3326 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)F)F 34a_100011217088_100000230001 [0,2,0,0,0,0|2,0,0]=4 3327 B16R1.26945 O=[N+]([O-])c1cc(cc(c1OCCCO)F)F 7a_100011217088_100011215043 [0,2,0,0,0,0|2,0,0]=4 3328 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)C 2230a_100010071459_100000688953 [0,2,0,0,0,0|1,0,1]=4 3329 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100010071459_100000688953 [0,2,0,0,0,0|1,0,1]=4 3330 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100000688953 [0,2,0,0,0,0|1,0,1]=4 3331 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000688953 [0,2,0,0,0,0|1,0,1]=4 3332 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100000688953 [0,2,0,0,0,0|1,0,1]=4 3333 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000688953 [0,2,0,0,0,0|1,0,1]=4 3334 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)Br 2230a_100009993796_100000688953 [0,2,0,0,0,0|1,0,1]=4 3335 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)Br 7a_100009993796_100000688953 [0,2,0,0,0,0|1,0,1]=4 3336 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)C 2230a_100000211049_100000688953 [0,2,0,0,0,0|1,0,1]=4 3337 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)C 7a_100000211049_100000688953 [0,2,0,0,0,0|1,0,1]=4 3338 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 2230a_100011219555_100000688953 [0,2,0,0,0,0|1,0,1]=4 3339 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_100011219555_100000688953 [0,2,0,0,0,0|1,0,1]=4 3340 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000688953 [0,2,0,0,0,0|1,0,1]=4 3341 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100000688953 [0,2,0,0,0,0|1,0,1]=4 3342 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100012180780_100000688953 [0,2,0,0,0,0|1,0,1]=4 3343 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000688953 [0,2,0,0,0,0|1,0,1]=4 3344 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100000688953 [0,2,0,0,0,0|1,0,1]=4 3345 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000688953 [0,2,0,0,0,0|1,0,1]=4 3346 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100000688953 [0,2,0,0,0,0|1,0,1]=4 3347 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000688953 [0,2,0,0,0,0|1,0,1]=4 3348 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100000688953 [0,2,0,0,0,0|1,0,1]=4 3349 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000735901_100000688953 [0,2,0,0,0,0|1,0,1]=4 3350 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000688953 [0,2,0,0,0,0|1,0,1]=4 3351 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000688953 [0,2,0,0,0,0|1,0,1]=4 3352 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])I)C 7a_100011003967_100000688953 [0,2,0,0,0,0|1,0,1]=4 3353 B16R1.29972 C#CCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000688953 [0,2,0,0,0,0|1,0,1]=4 3354 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)C 2230a_100010071459_100000754431 [0,2,0,0,0,0|1,0,1]=4 3355 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100010071459_100000754431 [0,2,0,0,0,0|1,0,1]=4 3356 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100000754431 [0,2,0,0,0,0|1,0,1]=4 3357 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000754431 [0,2,0,0,0,0|1,0,1]=4 3358 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100000754431 [0,2,0,0,0,0|1,0,1]=4 3359 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000754431 [0,2,0,0,0,0|1,0,1]=4 3360 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)Br 2230a_100009993796_100000754431 [0,2,0,0,0,0|1,0,1]=4 3361 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)Br 7a_100009993796_100000754431 [0,2,0,0,0,0|1,0,1]=4 3362 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)C 2230a_100000211049_100000754431 [0,2,0,0,0,0|1,0,1]=4 3363 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)C 7a_100000211049_100000754431 [0,2,0,0,0,0|1,0,1]=4 3364 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 2230a_100011219555_100000754431 [0,2,0,0,0,0|1,0,1]=4 3365 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_100011219555_100000754431 [0,2,0,0,0,0|1,0,1]=4 3366 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000754431 [0,2,0,0,0,0|1,0,1]=4 3367 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100000754431 [0,2,0,0,0,0|1,0,1]=4 3368 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100012180780_100000754431 [0,2,0,0,0,0|1,0,1]=4 3369 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000754431 [0,2,0,0,0,0|1,0,1]=4 3370 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100000754431 [0,2,0,0,0,0|1,0,1]=4 3371 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000754431 [0,2,0,0,0,0|1,0,1]=4 3372 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100000754431 [0,2,0,0,0,0|1,0,1]=4 3373 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000754431 [0,2,0,0,0,0|1,0,1]=4 3374 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100000754431 [0,2,0,0,0,0|1,0,1]=4 3375 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000735901_100000754431 [0,2,0,0,0,0|1,0,1]=4 3376 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000754431 [0,2,0,0,0,0|1,0,1]=4 3377 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000754431 [0,2,0,0,0,0|1,0,1]=4 3378 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])I)C 7a_100011003967_100000754431 [0,2,0,0,0,0|1,0,1]=4 3379 B16R1.29972 C=CCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000754431 [0,2,0,0,0,0|1,0,1]=4 3380 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)C 2230a_100010071459_100000210211 [0,2,0,0,0,0|1,0,0]=3 3381 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100010071459_100000210211 [0,2,0,0,0,0|1,0,0]=3 3382 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100000210211 [0,2,0,0,0,0|1,0,0]=3 3383 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000210211 [0,2,0,0,0,0|1,0,0]=3 3384 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100000210211 [0,2,0,0,0,0|1,0,0]=3 3385 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000210211 [0,2,0,0,0,0|1,0,0]=3 3386 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)Br 2230a_100009993796_100000210211 [0,2,0,0,0,0|1,0,0]=3 3387 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)Br 7a_100009993796_100000210211 [0,2,0,0,0,0|1,0,0]=3 3388 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)C 2230a_100000211049_100000210211 [0,2,0,0,0,0|1,0,0]=3 3389 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)C 7a_100000211049_100000210211 [0,2,0,0,0,0|1,0,0]=3 3390 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 2230a_100011219555_100000210211 [0,2,0,0,0,0|1,0,0]=3 3391 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_100011219555_100000210211 [0,2,0,0,0,0|1,0,0]=3 3392 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000210211 [0,2,0,0,0,0|1,0,0]=3 3393 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100000210211 [0,2,0,0,0,0|1,0,0]=3 3394 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100012180780_100000210210 [0,2,0,0,0,0|1,0,0]=3 3395 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000210211 [0,2,0,0,0,0|1,0,0]=3 3396 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100000210211 [0,2,0,0,0,0|1,0,0]=3 3397 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000210211 [0,2,0,0,0,0|1,0,0]=3 3398 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100000210211 [0,2,0,0,0,0|1,0,0]=3 3399 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000210211 [0,2,0,0,0,0|1,0,0]=3 3400 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100000210211 [0,2,0,0,0,0|1,0,0]=3 3401 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000735901_100000210210 [0,2,0,0,0,0|1,0,0]=3 3402 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000210211 [0,2,0,0,0,0|1,0,0]=3 3403 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000210211 [0,2,0,0,0,0|1,0,0]=3 3404 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])I)C 7a_100011003967_100000210211 [0,2,0,0,0,0|1,0,0]=3 3405 B16R1.29972 CCCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000210211 [0,2,0,0,0,0|1,0,0]=3 3406 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Br)C 34a_100012351188_100000210210 [0,2,0,0,0,0|2,0,0]=4 3407 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100012351188_100000210211 [0,2,0,0,0,0|2,0,0]=4 3408 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100014909177_100000210211 [0,2,0,0,0,0|2,0,0]=4 3409 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Br)F 34a_100000718853_100000210210 [0,2,0,0,0,0|2,0,0]=4 3410 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000718853_100000210211 [0,2,0,0,0,0|2,0,0]=4 3411 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])C)Cl 34a_200009838783_100000210210 [0,2,0,0,0,0|2,0,0]=4 3412 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_200009838783_100000210211 [0,2,0,0,0,0|2,0,0]=4 3413 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])C)F 34a_100012182840_100000210210 [0,2,0,0,0,0|2,0,0]=4 3414 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])C)F 7a_100012182840_100000210211 [0,2,0,0,0,0|2,0,0]=4 3415 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)Br 7a_100010381898_100000210211 [0,2,0,0,0,0|2,0,0]=4 3416 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)C 34a_100011215964_100000210210 [0,2,0,0,0,0|2,0,0]=4 3417 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)C 7a_100011215964_100000210211 [0,2,0,0,0,0|2,0,0]=4 3418 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)Cl 34a_100000717957_100000210210 [0,2,0,0,0,0|2,0,0]=4 3419 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100000717957_100000210211 [0,2,0,0,0,0|2,0,0]=4 3420 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100000724970_100000210210 [0,2,0,0,0,0|2,0,0]=4 3421 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100000724970_100000210211 [0,2,0,0,0,0|2,0,0]=4 3422 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)Br 34a_100013631521_100000210210 [0,2,0,0,0,0|2,0,0]=4 3423 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100013631521_100000210211 [0,2,0,0,0,0|2,0,0]=4 3424 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)C 34a_100012175661_100000210210 [0,2,0,0,0,0|2,0,0]=4 3425 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)C 7a_100012175661_100000210211 [0,2,0,0,0,0|2,0,0]=4 3426 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)Cl 34a_100012183888_100000210210 [0,2,0,0,0,0|2,0,0]=4 3427 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100012183888_100000210211 [0,2,0,0,0,0|2,0,0]=4 3428 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000688940_100000210210 [0,2,0,0,0,0|2,0,0]=4 3429 B16R1.29972 CCCCOc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000688940_100000210211 [0,2,0,0,0,0|2,0,0]=4 3430 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)C 2230a_100010071459_100011201679 [0,2,0,0,0,0|2,0,0]=4 3431 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100010071459_100000233755 [0,2,0,0,0,0|2,0,0]=4 3432 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100011201679 [0,2,0,0,0,0|2,0,0]=4 3433 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000233755 [0,2,0,0,0,0|2,0,0]=4 3434 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100011201679 [0,2,0,0,0,0|2,0,0]=4 3435 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000233755 [0,2,0,0,0,0|2,0,0]=4 3436 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)Br 2230a_100009993796_100011201679 [0,2,0,0,0,0|2,0,0]=4 3437 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)Br 7a_100009993796_100000233755 [0,2,0,0,0,0|2,0,0]=4 3438 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)C 2230a_100000211049_100011201679 [0,2,0,0,0,0|2,0,0]=4 3439 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)C 7a_100000211049_100000233755 [0,2,0,0,0,0|2,0,0]=4 3440 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 2230a_100011219555_100011201679 [0,2,0,0,0,0|2,0,0]=4 3441 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_100011219555_100000233755 [0,2,0,0,0,0|2,0,0]=4 3442 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000233755 [0,2,0,0,0,0|2,0,0]=4 3443 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100011201679 [0,2,0,0,0,0|2,0,0]=4 3444 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100012180780_100011201679 [0,2,0,0,0,0|2,0,0]=4 3445 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000233755 [0,2,0,0,0,0|2,0,0]=4 3446 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100011201679 [0,2,0,0,0,0|2,0,0]=4 3447 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000233755 [0,2,0,0,0,0|2,0,0]=4 3448 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100011201679 [0,2,0,0,0,0|2,0,0]=4 3449 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000233755 [0,2,0,0,0,0|2,0,0]=4 3450 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100011201679 [0,2,0,0,0,0|2,0,0]=4 3451 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000735901_100011201679 [0,2,0,0,0,0|2,0,0]=4 3452 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000233755 [0,2,0,0,0,0|2,0,0]=4 3453 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000233755 [0,2,0,0,0,0|2,0,0]=4 3454 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])I)C 7a_100011003967_100000233755 [0,2,0,0,0,0|2,0,0]=4 3455 B16R1.29972 COCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000233755 [0,2,0,0,0,0|2,0,0]=4 3456 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)C 2230a_100010071459_100000751147 [0,2,0,0,0,0|2,0,0]=4 3457 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)C 7a_100010071459_100000212216 [0,2,0,0,0,0|2,0,0]=4 3458 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100000751147 [0,2,0,0,0,0|2,0,0]=4 3459 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000212216 [0,2,0,0,0,0|2,0,0]=4 3460 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100000751147 [0,2,0,0,0,0|2,0,0]=4 3461 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000212216 [0,2,0,0,0,0|2,0,0]=4 3462 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)Br 2230a_100009993796_100000751147 [0,2,0,0,0,0|2,0,0]=4 3463 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)Br 7a_100009993796_100000212216 [0,2,0,0,0,0|2,0,0]=4 3464 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)C 2230a_100000211049_100000751147 [0,2,0,0,0,0|2,0,0]=4 3465 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)C 7a_100000211049_100000212216 [0,2,0,0,0,0|2,0,0]=4 3466 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 2230a_100011219555_100000751147 [0,2,0,0,0,0|2,0,0]=4 3467 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_100011219555_100000212216 [0,2,0,0,0,0|2,0,0]=4 3468 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000212216 [0,2,0,0,0,0|2,0,0]=4 3469 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100000751147 [0,2,0,0,0,0|2,0,0]=4 3470 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 34a_100012180780_100000212216 [0,2,0,0,0,0|2,0,0]=4 3471 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000212216 [0,2,0,0,0,0|2,0,0]=4 3472 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100000751147 [0,2,0,0,0,0|2,0,0]=4 3473 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000212216 [0,2,0,0,0,0|2,0,0]=4 3474 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100000751147 [0,2,0,0,0,0|2,0,0]=4 3475 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000212216 [0,2,0,0,0,0|2,0,0]=4 3476 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100000751147 [0,2,0,0,0,0|2,0,0]=4 3477 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)F 34a_100000735901_100000212216 [0,2,0,0,0,0|2,0,0]=4 3478 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000212216 [0,2,0,0,0,0|2,0,0]=4 3479 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000212216 [0,2,0,0,0,0|2,0,0]=4 3480 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])I)C 7a_100011003967_100000212216 [0,2,0,0,0,0|2,0,0]=4 3481 B16R1.29972 CSCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000212216 [0,2,0,0,0,0|2,0,0]=4 3482 B16R1.29972 Cc1cc(c(cc1Br)NCCC#N)[N+](=O)[O-] 2230a_100009993796_100011215226 [0,2,0,0,0,0|0,0,2]=4 3483 B16R1.29972 Cc1cc(c(cc1Br)NCCC#N)[N+](=O)[O-] 7a_100009993796_100000184422 [0,2,0,0,0,0|0,0,2]=4 3484 B16R1.29972 Cc1cc(c(cc1Br)NCCCF)[N+](=O)[O-] 2230a_100009993796_100011934791 [0,2,0,0,0,0|1,0,0]=3 3485 B16R1.29972 Cc1cc(c(cc1Br)NCCCF)[N+](=O)[O-] 7a_100009993796_100011934791 [0,2,0,0,0,0|1,0,0]=3 3486 B16R1.29972 Cc1cc(c(cc1Br)NCCCO)[N+](=O)[O-] 2230a_100009993796_100000230001 [0,2,0,0,0,0|1,0,0]=3 3487 B16R1.29972 Cc1cc(c(cc1Br)NCCCO)[N+](=O)[O-] 7a_100009993796_100011215043 [0,2,0,0,0,0|1,0,0]=3 3488 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCC#N 2230a_100010071459_100011215226 [0,2,0,0,0,0|0,0,2]=4 3489 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCC#N 7a_100010071459_100000184422 [0,2,0,0,0,0|0,0,2]=4 3490 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCCF 2230a_100010071459_100011934791 [0,2,0,0,0,0|1,0,0]=3 3491 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCCF 7a_100010071459_100011934791 [0,2,0,0,0,0|1,0,0]=3 3492 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCCO 2230a_100010071459_100000230001 [0,2,0,0,0,0|1,0,0]=3 3493 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])NCCCO 7a_100010071459_100011215043 [0,2,0,0,0,0|1,0,0]=3 3494 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])OCCCF 34a_100012351188_100011934791 [0,2,0,0,0,0|2,0,0]=4 3495 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])OCCCF 7a_100012351188_100011934791 [0,2,0,0,0,0|2,0,0]=4 3496 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])OCCCO 34a_100012351188_100000230001 [0,2,0,0,0,0|2,0,0]=4 3497 B16R1.29972 Cc1cc(c(cc1Br)[N+](=O)[O-])OCCCO 7a_100012351188_100011215043 [0,2,0,0,0,0|2,0,0]=4 3498 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCC#N 2230a_100000211049_100011215226 [0,2,0,0,0,0|0,0,2]=4 3499 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCC#N 7a_100000211049_100000184422 [0,2,0,0,0,0|0,0,2]=4 3500 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCCF 2230a_100000211049_100011934791 [0,2,0,0,0,0|1,0,0]=3 3501 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCCF 7a_100000211049_100011934791 [0,2,0,0,0,0|1,0,0]=3 3502 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCCO 2230a_100000211049_100000230001 [0,2,0,0,0,0|1,0,0]=3 3503 B16R1.29972 Cc1cc(c(cc1C)[N+](=O)[O-])NCCCO 7a_100000211049_100011215043 [0,2,0,0,0,0|1,0,0]=3 3504 B16R1.29972 Cc1cc(c(cc1Cl)NCCC#N)[N+](=O)[O-] 2230a_100011219555_100011215226 [0,2,0,0,0,0|0,0,2]=4 3505 B16R1.29972 Cc1cc(c(cc1Cl)NCCC#N)[N+](=O)[O-] 7a_100011219555_100000184422 [0,2,0,0,0,0|0,0,2]=4 3506 B16R1.29972 Cc1cc(c(cc1Cl)NCCCF)[N+](=O)[O-] 2230a_100011219555_100011934791 [0,2,0,0,0,0|1,0,0]=3 3507 B16R1.29972 Cc1cc(c(cc1Cl)NCCCF)[N+](=O)[O-] 7a_100011219555_100011934791 [0,2,0,0,0,0|1,0,0]=3 3508 B16R1.29972 Cc1cc(c(cc1Cl)NCCCO)[N+](=O)[O-] 2230a_100011219555_100000230001 [0,2,0,0,0,0|1,0,0]=3 3509 B16R1.29972 Cc1cc(c(cc1Cl)NCCCO)[N+](=O)[O-] 7a_100011219555_100011215043 [0,2,0,0,0,0|1,0,0]=3 3510 B16R1.29972 Cc1cc(c(cc1Cl)OCCCF)[N+](=O)[O-] 34a_200009838783_100011934791 [0,2,0,0,0,0|2,0,0]=4 3511 B16R1.29972 Cc1cc(c(cc1Cl)OCCCF)[N+](=O)[O-] 7a_200009838783_100011934791 [0,2,0,0,0,0|2,0,0]=4 3512 B16R1.29972 Cc1cc(c(cc1Cl)OCCCO)[N+](=O)[O-] 34a_200009838783_100000230001 [0,2,0,0,0,0|2,0,0]=4 3513 B16R1.29972 Cc1cc(c(cc1Cl)OCCCO)[N+](=O)[O-] 7a_200009838783_100011215043 [0,2,0,0,0,0|2,0,0]=4 3514 B16R1.29972 Cc1cc(c(cc1Cl)[N+](=O)[O-])OCCCF 34a_100011215964_100011934791 [0,2,0,0,0,0|2,0,0]=4 3515 B16R1.29972 Cc1cc(c(cc1Cl)[N+](=O)[O-])OCCCF 7a_100011215964_100011934791 [0,2,0,0,0,0|2,0,0]=4 3516 B16R1.29972 Cc1cc(c(cc1Cl)[N+](=O)[O-])OCCCO 34a_100011215964_100000230001 [0,2,0,0,0,0|2,0,0]=4 3517 B16R1.29972 Cc1cc(c(cc1Cl)[N+](=O)[O-])OCCCO 7a_100011215964_100011215043 [0,2,0,0,0,0|2,0,0]=4 3518 B16R1.29972 Cc1cc(c(cc1F)OCCCF)[N+](=O)[O-] 34a_100012182840_100011934791 [0,2,0,0,0,0|2,0,0]=4 3519 B16R1.29972 Cc1cc(c(cc1F)OCCCF)[N+](=O)[O-] 7a_100012182840_100011934791 [0,2,0,0,0,0|2,0,0]=4 3520 B16R1.29972 Cc1cc(c(cc1F)OCCCO)[N+](=O)[O-] 34a_100012182840_100000230001 [0,2,0,0,0,0|2,0,0]=4 3521 B16R1.29972 Cc1cc(c(cc1F)OCCCO)[N+](=O)[O-] 7a_100012182840_100011215043 [0,2,0,0,0,0|2,0,0]=4 3522 B16R1.29972 Cc1cc(c(cc1F)[N+](=O)[O-])OCCCF 34a_100012175661_100011934791 [0,2,0,0,0,0|2,0,0]=4 3523 B16R1.29972 Cc1cc(c(cc1F)[N+](=O)[O-])OCCCF 7a_100012175661_100011934791 [0,2,0,0,0,0|2,0,0]=4 3524 B16R1.29972 Cc1cc(c(cc1F)[N+](=O)[O-])OCCCO 34a_100012175661_100000230001 [0,2,0,0,0,0|2,0,0]=4 3525 B16R1.29972 Cc1cc(c(cc1F)[N+](=O)[O-])OCCCO 7a_100012175661_100011215043 [0,2,0,0,0,0|2,0,0]=4 3526 B16R1.29972 Cc1cc(c(cc1I)[N+](=O)[O-])NCCC#N 7a_100011003967_100000184422 [0,2,0,0,0,0|0,0,2]=4 3527 B16R1.29972 Cc1cc(c(cc1I)[N+](=O)[O-])NCCCF 7a_100011003967_100011934791 [0,2,0,0,0,0|1,0,0]=3 3528 B16R1.29972 Cc1cc(c(cc1I)[N+](=O)[O-])NCCCO 7a_100011003967_100011215043 [0,2,0,0,0,0|1,0,0]=3 3529 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 2230a_100000717972_100011215226 [0,2,0,0,0,0|0,0,2]=4 3530 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Br)Cl 7a_100000717972_100000184422 [0,2,0,0,0,0|0,0,2]=4 3531 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 2230a_100000766068_100011215226 [0,2,0,0,0,0|0,0,2]=4 3532 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Br)F 7a_100000766068_100000184422 [0,2,0,0,0,0|0,0,2]=4 3533 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)Cl 7a_100011215035_100000184422 [0,2,0,0,0,0|0,0,2]=4 3534 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 2230a_100012180780_100011215226 [0,2,0,0,0,0|0,0,2]=4 3535 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])Cl)F 7a_100012180780_100000184422 [0,2,0,0,0,0|0,0,2]=4 3536 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 2230a_100012662953_100011215226 [0,2,0,0,0,0|0,0,2]=4 3537 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)Br 7a_100012662953_100000184422 [0,2,0,0,0,0|0,0,2]=4 3538 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 2230a_100011216510_100011215226 [0,2,0,0,0,0|0,0,2]=4 3539 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)Cl 7a_100011216510_100000184422 [0,2,0,0,0,0|0,0,2]=4 3540 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)F 2230a_100000735901_100011215226 [0,2,0,0,0,0|0,0,2]=4 3541 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])F)F 7a_100000735901_100000184422 [0,2,0,0,0,0|0,0,2]=4 3542 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])I)Br 7a_200021141667_100000184422 [0,2,0,0,0,0|0,0,2]=4 3543 B16R1.29972 N#CCCNc1cc(c(cc1[N+](=O)[O-])I)Cl 7a_100010191617_100000184422 [0,2,0,0,0,0|0,0,2]=4 3544 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Br)F 2230a_100012662953_100011934791 [0,2,0,0,0,0|1,0,0]=3 3545 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Br)F 7a_100012662953_100011934791 [0,2,0,0,0,0|1,0,0]=3 3546 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Br)I 7a_200021141667_100011934791 [0,2,0,0,0,0|1,0,0]=3 3547 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)Br 2230a_100000717972_100011934791 [0,2,0,0,0,0|1,0,0]=3 3548 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)Br 7a_100000717972_100011934791 [0,2,0,0,0,0|1,0,0]=3 3549 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)Cl 7a_100011215035_100011934791 [0,2,0,0,0,0|1,0,0]=3 3550 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)F 2230a_100011216510_100011934791 [0,2,0,0,0,0|1,0,0]=3 3551 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)F 7a_100011216510_100011934791 [0,2,0,0,0,0|1,0,0]=3 3552 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)Cl)I 7a_100010191617_100011934791 [0,2,0,0,0,0|1,0,0]=3 3553 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)Br 2230a_100000766068_100011934791 [0,2,0,0,0,0|1,0,0]=3 3554 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)Br 7a_100000766068_100011934791 [0,2,0,0,0,0|1,0,0]=3 3555 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)Cl 2230a_100012180780_100011934791 [0,2,0,0,0,0|1,0,0]=3 3556 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)Cl 34a_100012180780_100011934791 [0,2,0,0,0,0|1,0,0]=3 3557 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)Cl 7a_100012180780_100011934791 [0,2,0,0,0,0|1,0,0]=3 3558 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)F 2230a_100000735901_100011934791 [0,2,0,0,0,0|1,0,0]=3 3559 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)F 34a_100000735901_100011934791 [0,2,0,0,0,0|1,0,0]=3 3560 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCF)F)F 7a_100000735901_100011934791 [0,2,0,0,0,0|1,0,0]=3 3561 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Br)F 2230a_100012662953_100000230001 [0,2,0,0,0,0|1,0,0]=3 3562 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Br)F 7a_100012662953_100011215043 [0,2,0,0,0,0|1,0,0]=3 3563 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Br)I 7a_200021141667_100011215043 [0,2,0,0,0,0|1,0,0]=3 3564 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)Br 2230a_100000717972_100000230001 [0,2,0,0,0,0|1,0,0]=3 3565 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)Br 7a_100000717972_100011215043 [0,2,0,0,0,0|1,0,0]=3 3566 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)Cl 7a_100011215035_100011215043 [0,2,0,0,0,0|1,0,0]=3 3567 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)F 2230a_100011216510_100000230001 [0,2,0,0,0,0|1,0,0]=3 3568 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)F 7a_100011216510_100011215043 [0,2,0,0,0,0|1,0,0]=3 3569 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)Cl)I 7a_100010191617_100011215043 [0,2,0,0,0,0|1,0,0]=3 3570 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)Br 2230a_100000766068_100000230001 [0,2,0,0,0,0|1,0,0]=3 3571 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)Br 7a_100000766068_100011215043 [0,2,0,0,0,0|1,0,0]=3 3572 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)Cl 2230a_100012180780_100000230001 [0,2,0,0,0,0|1,0,0]=3 3573 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)Cl 34a_100012180780_100000230001 [0,2,0,0,0,0|1,0,0]=3 3574 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)Cl 7a_100012180780_100011215043 [0,2,0,0,0,0|1,0,0]=3 3575 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)F 2230a_100000735901_100000230001 [0,2,0,0,0,0|1,0,0]=3 3576 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)F 34a_100000735901_100000230001 [0,2,0,0,0,0|1,0,0]=3 3577 B16R1.29972 O=[N+]([O-])c1cc(c(cc1NCCCO)F)F 7a_100000735901_100011215043 [0,2,0,0,0,0|1,0,0]=3 3578 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Br)Cl 7a_100010381898_100011934791 [0,2,0,0,0,0|2,0,0]=4 3579 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Br)F 34a_100013631521_100011934791 [0,2,0,0,0,0|2,0,0]=4 3580 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Br)F 7a_100013631521_100011934791 [0,2,0,0,0,0|2,0,0]=4 3581 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Cl)Br 7a_100014909177_100011934791 [0,2,0,0,0,0|2,0,0]=4 3582 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Cl)Cl 34a_100000717957_100011934791 [0,2,0,0,0,0|2,0,0]=4 3583 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Cl)Cl 7a_100000717957_100011934791 [0,2,0,0,0,0|2,0,0]=4 3584 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Cl)F 34a_100012183888_100011934791 [0,2,0,0,0,0|2,0,0]=4 3585 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)Cl)F 7a_100012183888_100011934791 [0,2,0,0,0,0|2,0,0]=4 3586 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)Br 34a_100000718853_100011934791 [0,2,0,0,0,0|2,0,0]=4 3587 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)Br 7a_100000718853_100011934791 [0,2,0,0,0,0|2,0,0]=4 3588 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)Cl 34a_100000724970_100011934791 [0,2,0,0,0,0|2,0,0]=4 3589 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)Cl 7a_100000724970_100011934791 [0,2,0,0,0,0|2,0,0]=4 3590 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)F 34a_100000688940_100011934791 [0,2,0,0,0,0|2,0,0]=4 3591 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCF)F)F 7a_100000688940_100011934791 [0,2,0,0,0,0|2,0,0]=4 3592 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Br)Cl 7a_100010381898_100011215043 [0,2,0,0,0,0|2,0,0]=4 3593 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Br)F 34a_100013631521_100000230001 [0,2,0,0,0,0|2,0,0]=4 3594 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Br)F 7a_100013631521_100011215043 [0,2,0,0,0,0|2,0,0]=4 3595 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Cl)Br 7a_100014909177_100011215043 [0,2,0,0,0,0|2,0,0]=4 3596 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Cl)Cl 34a_100000717957_100000230001 [0,2,0,0,0,0|2,0,0]=4 3597 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Cl)Cl 7a_100000717957_100011215043 [0,2,0,0,0,0|2,0,0]=4 3598 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Cl)F 34a_100012183888_100000230001 [0,2,0,0,0,0|2,0,0]=4 3599 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)Cl)F 7a_100012183888_100011215043 [0,2,0,0,0,0|2,0,0]=4 3600 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)Br 34a_100000718853_100000230001 [0,2,0,0,0,0|2,0,0]=4 3601 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)Br 7a_100000718853_100011215043 [0,2,0,0,0,0|2,0,0]=4 3602 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)Cl 34a_100000724970_100000230001 [0,2,0,0,0,0|2,0,0]=4 3603 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)Cl 7a_100000724970_100011215043 [0,2,0,0,0,0|2,0,0]=4 3604 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)F 34a_100000688940_100000230001 [0,2,0,0,0,0|2,0,0]=4 3605 B16R1.29972 O=[N+]([O-])c1cc(c(cc1OCCCO)F)F 7a_100000688940_100011215043 [0,2,0,0,0,0|2,0,0]=4 3606 B16R1.88777 C#CCCNc1ccc(c(c1[N+](=O)[O-])C)Br 2230a_100010749425_100000688953 [0,2,0,0,0,0|1,0,1]=4 3607 B16R1.88777 C#CCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 2230a_200016036588_100000688953 [0,2,0,0,0,0|1,0,1]=4 3608 B16R1.88777 C#CCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 34a_200016036588_100000688953 [0,2,0,0,0,0|1,0,1]=4 3609 B16R1.88777 C#CCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100000688953 [0,2,0,0,0,0|1,0,1]=4 3610 B16R1.88777 C=CCCNc1ccc(c(c1[N+](=O)[O-])C)Br 2230a_100010749425_100000754431 [0,2,0,0,0,0|1,0,1]=4 3611 B16R1.88777 C=CCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 2230a_200016036588_100000754431 [0,2,0,0,0,0|1,0,1]=4 3612 B16R1.88777 C=CCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 34a_200016036588_100000754431 [0,2,0,0,0,0|1,0,1]=4 3613 B16R1.88777 C=CCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100000754431 [0,2,0,0,0,0|1,0,1]=4 3614 B16R1.88777 CCCCNc1ccc(c(c1[N+](=O)[O-])C)Br 2230a_100010749425_100000210211 [0,2,0,0,0,0|1,0,0]=3 3615 B16R1.88777 CCCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 2230a_200016036588_100000210211 [0,2,0,0,0,0|1,0,0]=3 3616 B16R1.88777 CCCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 34a_200016036588_100000210210 [0,2,0,0,0,0|1,0,0]=3 3617 B16R1.88777 CCCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100000210211 [0,2,0,0,0,0|1,0,0]=3 3618 B16R1.88777 CCCCOc1ccc(c(c1[N+](=O)[O-])C)Br 34a_100010090815_100000210210 [0,2,0,0,0,0|2,0,0]=4 3619 B16R1.88777 CCCCOc1ccc(c(c1[N+](=O)[O-])C)Br 7a_100010090815_100000210211 [0,2,0,0,0,0|2,0,0]=4 3620 B16R1.88777 COCCNc1ccc(c(c1[N+](=O)[O-])C)Br 2230a_100010749425_100011201679 [0,2,0,0,0,0|2,0,0]=4 3621 B16R1.88777 COCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 2230a_200016036588_100011201679 [0,2,0,0,0,0|2,0,0]=4 3622 B16R1.88777 COCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 34a_200016036588_100011201679 [0,2,0,0,0,0|2,0,0]=4 3623 B16R1.88777 COCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100011201679 [0,2,0,0,0,0|2,0,0]=4 3624 B16R1.88777 CSCCNc1ccc(c(c1[N+](=O)[O-])C)Br 2230a_100010749425_100000751147 [0,2,0,0,0,0|2,0,0]=4 3625 B16R1.88777 CSCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 2230a_200016036588_100000751147 [0,2,0,0,0,0|2,0,0]=4 3626 B16R1.88777 CSCCNc1ccc(c(c1[N+](=O)[O-])C)Cl 34a_200016036588_100000212216 [0,2,0,0,0,0|2,0,0]=4 3627 B16R1.88777 CSCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100000751147 [0,2,0,0,0,0|2,0,0]=4 3628 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCC#N)Br 2230a_100010749425_100011215226 [0,2,0,0,0,0|0,0,2]=4 3629 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCC#N)Cl 2230a_200016036588_100011215226 [0,2,0,0,0,0|0,0,2]=4 3630 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCF)Br 2230a_100010749425_100011934791 [0,2,0,0,0,0|1,0,0]=3 3631 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCF)Cl 2230a_200016036588_100011934791 [0,2,0,0,0,0|1,0,0]=3 3632 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCF)Cl 34a_200016036588_100011934791 [0,2,0,0,0,0|1,0,0]=3 3633 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCO)Br 2230a_100010749425_100000230001 [0,2,0,0,0,0|1,0,0]=3 3634 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCO)Cl 2230a_200016036588_100000230001 [0,2,0,0,0,0|1,0,0]=3 3635 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])NCCCO)Cl 34a_200016036588_100000230001 [0,2,0,0,0,0|1,0,0]=3 3636 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])OCCCF)Br 34a_100010090815_100011934791 [0,2,0,0,0,0|2,0,0]=4 3637 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])OCCCF)Br 7a_100010090815_100011934791 [0,2,0,0,0,0|2,0,0]=4 3638 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])OCCCO)Br 34a_100010090815_100000230001 [0,2,0,0,0,0|2,0,0]=4 3639 B16R1.88777 Cc1c(ccc(c1[N+](=O)[O-])OCCCO)Br 7a_100010090815_100011215043 [0,2,0,0,0,0|2,0,0]=4 3640 B16R1.88777 N#CCCNc1ccc(c(c1[N+](=O)[O-])F)Br 2230a_100009814303_100011215226 [0,2,0,0,0,0|0,0,2]=4 3641 B16R1.88777 O=[N+]([O-])c1c(ccc(c1F)Br)NCCCF 2230a_100009814303_100011934791 [0,2,0,0,0,0|1,0,0]=3 3642 B16R1.88777 O=[N+]([O-])c1c(ccc(c1F)Br)NCCCO 2230a_100009814303_100000230001 [0,2,0,0,0,0|1,0,0]=3 3643 B16R1.874 C=CC(O)CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000730141 [0,2,0,0,0,0|1,0,1]=4 3644 B16R1.874 CCC(=O)CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000747405 [0,2,0,0,0,0|1,0,1]=4 3645 B16R1.874 CCC(C)CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000748023 [0,2,0,0,0,0|2,0,0]=4 3646 B16R1.874 CCC(C)CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000748023 [0,2,0,0,0,0|1,0,0]=3 3647 B16R1.874 CCC(C)CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000748023 [0,2,0,0,0,0|1,0,0]=3 3648 B16R1.874 CCC(O)CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100011218378 [0,2,0,0,0,0|2,0,0]=4 3649 B16R1.874 CCC(O)CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011218378 [0,2,0,0,0,0|1,0,0]=3 3650 B16R1.874 CCC(O)CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100011218378 [0,2,0,0,0,0|1,0,0]=3 3651 B16R1.874 CC[C@H](C)CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100009816398 [0,2,0,0,0,0|2,0,0]=4 3652 B16R1.874 CC[C@H](C)CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100009816398 [0,2,0,0,0,0|1,0,0]=3 3653 B16R1.874 CC[C@H](C)CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100009816398 [0,2,0,0,0,0|1,0,0]=3 3654 B16R1.874 CN(CC(O)CO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100011219619 [0,2,0,0,0,0|1,0,0]=3 3655 B16R1.874 CN(C[C@@H](O)CF)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100015614560 [0,2,0,0,0,0|1,0,0]=3 3656 B16R1.874 CN(C[C@@H](O)CO)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100009815848 [0,2,0,0,0,0|1,0,0]=3 3657 B16R1.874 C[C@@H](CO)CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000059175 [0,2,0,0,0,0|2,0,0]=4 3658 B16R1.874 C[C@@H](CO)CN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000059175 [0,2,0,0,0,0|1,0,0]=3 3659 B16R1.874 C[C@@H](CO)CN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000059175 [0,2,0,0,0,0|1,0,0]=3 3660 B16R1.1302 C=CC(O)CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000730141 [0,2,0,0,0,0|1,0,1]=4 3661 B16R1.1302 CC(CN)OCc1cc(ccc1[N+](=O)[O-])Br 34a_100000210904_100010245524 [0,2,0,0,0,0|2,0,0]=4 3662 B16R1.1302 CC(CN)OCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000210904_100000765840 [0,2,0,0,0,0|2,0,0]=4 3663 B16R1.1302 CCC(C)CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000748023 [0,2,0,0,0,0|1,0,0]=3 3664 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000748023 [0,2,0,0,0,0|2,0,0]=4 3665 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000748023 [0,2,0,0,0,0|2,0,0]=4 3666 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000748023 [0,2,0,0,0,0|2,0,0]=4 3667 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000748023 [0,2,0,0,0,0|2,0,0]=4 3668 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000748023 [0,2,0,0,0,0|2,0,0]=4 3669 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000748023 [0,2,0,0,0,0|2,0,0]=4 3670 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000748023 [0,2,0,0,0,0|2,0,0]=4 3671 B16R1.1302 CCC(C)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000748023 [0,2,0,0,0,0|2,0,0]=4 3672 B16R1.1302 CCC(O)CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100011218378 [0,2,0,0,0,0|1,0,0]=3 3673 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100011218378 [0,2,0,0,0,0|2,0,0]=4 3674 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100011218378 [0,2,0,0,0,0|2,0,0]=4 3675 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100011218378 [0,2,0,0,0,0|2,0,0]=4 3676 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100011218378 [0,2,0,0,0,0|2,0,0]=4 3677 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100011218378 [0,2,0,0,0,0|2,0,0]=4 3678 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100011218378 [0,2,0,0,0,0|2,0,0]=4 3679 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100011218378 [0,2,0,0,0,0|2,0,0]=4 3680 B16R1.1302 CCC(O)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100011218378 [0,2,0,0,0,0|2,0,0]=4 3681 B16R1.1302 CC[C@H](C)CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100009816398 [0,2,0,0,0,0|1,0,0]=3 3682 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100009816398 [0,2,0,0,0,0|2,0,0]=4 3683 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100009816398 [0,2,0,0,0,0|2,0,0]=4 3684 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100009816398 [0,2,0,0,0,0|2,0,0]=4 3685 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100009816398 [0,2,0,0,0,0|2,0,0]=4 3686 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100009816398 [0,2,0,0,0,0|2,0,0]=4 3687 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100009816398 [0,2,0,0,0,0|2,0,0]=4 3688 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100009816398 [0,2,0,0,0,0|2,0,0]=4 3689 B16R1.1302 CC[C@H](C)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100009816398 [0,2,0,0,0,0|2,0,0]=4 3690 B16R1.1302 C[C@@H](CO)CNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000059175 [0,2,0,0,0,0|1,0,0]=3 3691 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000059175 [0,2,0,0,0,0|2,0,0]=4 3692 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000059175 [0,2,0,0,0,0|2,0,0]=4 3693 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000059175 [0,2,0,0,0,0|2,0,0]=4 3694 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000059175 [0,2,0,0,0,0|2,0,0]=4 3695 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000059175 [0,2,0,0,0,0|2,0,0]=4 3696 B16R1.1302 C[C@@H](CO)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000059175 [0,2,0,0,0,0|2,0,0]=4 3697 B16R1.1302 Cc1ccc(c(c1)COC(C)CN)[N+](=O)[O-] 34a_100000210904_200000039114 [0,2,0,0,0,0|2,0,0]=4 3698 B16R1.1302 Cc1ccc(c(c1)OCC(O)CO)[N+](=O)[O-] 34a_100000195450_100011219619 [0,2,0,0,0,0|2,0,0]=4 3699 B16R1.1302 Cc1ccc(c(c1)OCC(O)CO)[N+](=O)[O-] 7a_100000195450_100011219619 [0,2,0,0,0,0|2,0,0]=4 3700 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](C)CO)[N+](=O)[O-] 34a_100000195450_100000059175 [0,2,0,0,0,0|2,0,0]=4 3701 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](C)CO)[N+](=O)[O-] 7a_100000195450_100000059175 [0,2,0,0,0,0|2,0,0]=4 3702 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CF)[N+](=O)[O-] 34a_100000195450_100015614560 [0,2,0,0,0,0|2,0,0]=4 3703 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CF)[N+](=O)[O-] 7a_100000195450_100015614560 [0,2,0,0,0,0|2,0,0]=4 3704 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CO)[N+](=O)[O-] 34a_100000195450_100009815848 [0,2,0,0,0,0|2,0,0]=4 3705 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CO)[N+](=O)[O-] 7a_100000195450_100009815848 [0,2,0,0,0,0|2,0,0]=4 3706 B16R1.1302 O=[N+]([O-])c1ccc(cc1NCC(O)CO)F 34a_100000746377_100011219619 [0,2,0,0,0,0|1,0,0]=3 3707 B16R1.1302 O=[N+]([O-])c1ccc(cc1NC[C@@H](O)CF)F 34a_100000746377_100015614560 [0,2,0,0,0,0|1,0,0]=3 3708 B16R1.1302 O=[N+]([O-])c1ccc(cc1NC[C@@H](O)CO)F 34a_100000746377_100009815848 [0,2,0,0,0,0|1,0,0]=3 3709 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)Br 7a_100011934350_100011219619 [0,2,0,0,0,0|2,0,0]=4 3710 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)Cl 34a_100000746067_100011219619 [0,2,0,0,0,0|2,0,0]=4 3711 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)Cl 7a_100000746067_100011219619 [0,2,0,0,0,0|2,0,0]=4 3712 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)F 34a_100000210785_100011219619 [0,2,0,0,0,0|2,0,0]=4 3713 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)F 7a_100000210785_100011219619 [0,2,0,0,0,0|2,0,0]=4 3714 B16R1.1302 O=[N+]([O-])c1ccc(cc1OCC(O)CO)I 7a_100000072657_100011219619 [0,2,0,0,0,0|2,0,0]=4 3715 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)Br 7a_100011934350_100015614560 [0,2,0,0,0,0|2,0,0]=4 3716 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)Cl 34a_100000746067_100015614560 [0,2,0,0,0,0|2,0,0]=4 3717 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)Cl 7a_100000746067_100015614560 [0,2,0,0,0,0|2,0,0]=4 3718 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)F 34a_100000210785_100015614560 [0,2,0,0,0,0|2,0,0]=4 3719 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)F 7a_100000210785_100015614560 [0,2,0,0,0,0|2,0,0]=4 3720 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CF)I 7a_100000072657_100015614560 [0,2,0,0,0,0|2,0,0]=4 3721 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)Br 7a_100011934350_100009815848 [0,2,0,0,0,0|2,0,0]=4 3722 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)Cl 34a_100000746067_100009815848 [0,2,0,0,0,0|2,0,0]=4 3723 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)Cl 7a_100000746067_100009815848 [0,2,0,0,0,0|2,0,0]=4 3724 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)F 34a_100000210785_100009815848 [0,2,0,0,0,0|2,0,0]=4 3725 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)F 7a_100000210785_100009815848 [0,2,0,0,0,0|2,0,0]=4 3726 B16R1.1302 O=[N+]([O-])c1ccc(cc1OC[C@@H](O)CO)I 7a_100000072657_100009815848 [0,2,0,0,0,0|2,0,0]=4 3727 B16R1.10380 CC(C)(CO)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100009813988 [0,2,0,0,0,0|2,0,0]=4 3728 B16R1.10380 CC(C)(CO)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100009813988 [0,2,0,0,0,0|2,0,0]=4 3729 B16R1.14339 CCC(CC)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011215472 [0,2,0,0,0,0|2,0,0]=4 3730 B16R1.14339 CCC(CC)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011215472 [0,2,0,0,0,0|2,0,0]=4 3731 B16R1.14339 NCC(CN)OCc1ccccc1[N+](=O)[O-] 34a_100000031598_100000181388 [0,2,0,0,0,0|2,0,0]=4 3732 B16R1.16824 C=CC(O)CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000730141 [0,2,0,0,0,0|1,0,1]=4 3733 B16R1.16824 C=CC(O)CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000730141 [0,2,0,0,0,0|1,0,1]=4 3734 B16R1.16824 CC(CN)OCc1cccc(c1[N+](=O)[O-])Br 34a_100000210904_100010145487 [0,2,0,0,0,0|2,0,0]=4 3735 B16R1.16824 CC(CN)OCc1cccc(c1[N+](=O)[O-])Cl 34a_100000210904_100009990124 [0,2,0,0,0,0|2,0,0]=4 3736 B16R1.16824 CCC(C)CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000748023 [0,2,0,0,0,0|1,0,0]=3 3737 B16R1.16824 CCC(C)CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000748023 [0,2,0,0,0,0|1,0,0]=3 3738 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000748023 [0,2,0,0,0,0|2,0,0]=4 3739 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000748023 [0,2,0,0,0,0|2,0,0]=4 3740 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000748023 [0,2,0,0,0,0|2,0,0]=4 3741 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000748023 [0,2,0,0,0,0|2,0,0]=4 3742 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000748023 [0,2,0,0,0,0|2,0,0]=4 3743 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000748023 [0,2,0,0,0,0|2,0,0]=4 3744 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000748023 [0,2,0,0,0,0|2,0,0]=4 3745 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000748023 [0,2,0,0,0,0|2,0,0]=4 3746 B16R1.16824 CCC(C)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000748023 [0,2,0,0,0,0|2,0,0]=4 3747 B16R1.16824 CCC(O)CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100011218378 [0,2,0,0,0,0|1,0,0]=3 3748 B16R1.16824 CCC(O)CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100011218378 [0,2,0,0,0,0|1,0,0]=3 3749 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100011218378 [0,2,0,0,0,0|2,0,0]=4 3750 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100011218378 [0,2,0,0,0,0|2,0,0]=4 3751 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100011218378 [0,2,0,0,0,0|2,0,0]=4 3752 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100011218378 [0,2,0,0,0,0|2,0,0]=4 3753 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100011218378 [0,2,0,0,0,0|2,0,0]=4 3754 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100011218378 [0,2,0,0,0,0|2,0,0]=4 3755 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100011218378 [0,2,0,0,0,0|2,0,0]=4 3756 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100011218378 [0,2,0,0,0,0|2,0,0]=4 3757 B16R1.16824 CCC(O)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100011218378 [0,2,0,0,0,0|2,0,0]=4 3758 B16R1.16824 CC[C@H](C)CNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100009816398 [0,2,0,0,0,0|1,0,0]=3 3759 B16R1.16824 CC[C@H](C)CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100009816398 [0,2,0,0,0,0|1,0,0]=3 3760 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100009816398 [0,2,0,0,0,0|2,0,0]=4 3761 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100009816398 [0,2,0,0,0,0|2,0,0]=4 3762 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100009816398 [0,2,0,0,0,0|2,0,0]=4 3763 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100009816398 [0,2,0,0,0,0|2,0,0]=4 3764 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100009816398 [0,2,0,0,0,0|2,0,0]=4 3765 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100009816398 [0,2,0,0,0,0|2,0,0]=4 3766 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100009816398 [0,2,0,0,0,0|2,0,0]=4 3767 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100009816398 [0,2,0,0,0,0|2,0,0]=4 3768 B16R1.16824 CC[C@H](C)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100009816398 [0,2,0,0,0,0|2,0,0]=4 3769 B16R1.16824 C[C@@H](CO)CNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000059175 [0,2,0,0,0,0|1,0,0]=3 3770 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000059175 [0,2,0,0,0,0|2,0,0]=4 3771 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000059175 [0,2,0,0,0,0|2,0,0]=4 3772 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000059175 [0,2,0,0,0,0|2,0,0]=4 3773 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000059175 [0,2,0,0,0,0|2,0,0]=4 3774 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000059175 [0,2,0,0,0,0|2,0,0]=4 3775 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000059175 [0,2,0,0,0,0|2,0,0]=4 3776 B16R1.16824 C[C@@H](CO)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000059175 [0,2,0,0,0,0|2,0,0]=4 3777 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])COC(C)CN 34a_100000210904_100010188692 [0,2,0,0,0,0|2,0,0]=4 3778 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])NCC(O)CO 34a_100011424894_100011219619 [0,2,0,0,0,0|1,0,0]=3 3779 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])NC[C@@H](C)CO 34a_100011424894_100000059175 [0,2,0,0,0,0|1,0,0]=3 3780 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])NC[C@@H](O)CF 34a_100011424894_100015614560 [0,2,0,0,0,0|1,0,0]=3 3781 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])NC[C@@H](O)CO 34a_100011424894_100009815848 [0,2,0,0,0,0|1,0,0]=3 3782 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OCC(O)CO 34a_100000740142_100011219619 [0,2,0,0,0,0|2,0,0]=4 3783 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OCC(O)CO 7a_100000740142_100011219619 [0,2,0,0,0,0|2,0,0]=4 3784 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](C)CO 34a_100000740142_100000059175 [0,2,0,0,0,0|2,0,0]=4 3785 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](C)CO 7a_100000740142_100000059175 [0,2,0,0,0,0|2,0,0]=4 3786 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](O)CF 34a_100000740142_100015614560 [0,2,0,0,0,0|2,0,0]=4 3787 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](O)CF 7a_100000740142_100015614560 [0,2,0,0,0,0|2,0,0]=4 3788 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](O)CO 34a_100000740142_100009815848 [0,2,0,0,0,0|2,0,0]=4 3789 B16R1.16824 Cc1cccc(c1[N+](=O)[O-])OC[C@@H](O)CO 7a_100000740142_100009815848 [0,2,0,0,0,0|2,0,0]=4 3790 B16R1.16824 O=[N+]([O-])c1c(cccc1NCC(O)CO)F 34a_100011219493_100011219619 [0,2,0,0,0,0|1,0,0]=3 3791 B16R1.16824 O=[N+]([O-])c1c(cccc1NC[C@@H](O)CF)F 34a_100011219493_100015614560 [0,2,0,0,0,0|1,0,0]=3 3792 B16R1.16824 O=[N+]([O-])c1c(cccc1NC[C@@H](O)CO)F 34a_100011219493_100009815848 [0,2,0,0,0,0|1,0,0]=3 3793 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)Br 34a_100011934925_100011219619 [0,2,0,0,0,0|2,0,0]=4 3794 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)Br 7a_100011934925_100011219619 [0,2,0,0,0,0|2,0,0]=4 3795 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)Cl 34a_100011999376_100011219619 [0,2,0,0,0,0|2,0,0]=4 3796 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)Cl 7a_100011999376_100011219619 [0,2,0,0,0,0|2,0,0]=4 3797 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)F 34a_100011217962_100011219619 [0,2,0,0,0,0|2,0,0]=4 3798 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)F 7a_100011217962_100011219619 [0,2,0,0,0,0|2,0,0]=4 3799 B16R1.16824 O=[N+]([O-])c1c(cccc1OCC(O)CO)I 7a_100010150324_100011219619 [0,2,0,0,0,0|2,0,0]=4 3800 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)Br 34a_100011934925_100015614560 [0,2,0,0,0,0|2,0,0]=4 3801 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)Br 7a_100011934925_100015614560 [0,2,0,0,0,0|2,0,0]=4 3802 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)Cl 34a_100011999376_100015614560 [0,2,0,0,0,0|2,0,0]=4 3803 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)Cl 7a_100011999376_100015614560 [0,2,0,0,0,0|2,0,0]=4 3804 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)F 34a_100011217962_100015614560 [0,2,0,0,0,0|2,0,0]=4 3805 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)F 7a_100011217962_100015614560 [0,2,0,0,0,0|2,0,0]=4 3806 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CF)I 7a_100010150324_100015614560 [0,2,0,0,0,0|2,0,0]=4 3807 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)Br 34a_100011934925_100009815848 [0,2,0,0,0,0|2,0,0]=4 3808 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)Br 7a_100011934925_100009815848 [0,2,0,0,0,0|2,0,0]=4 3809 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)Cl 34a_100011999376_100009815848 [0,2,0,0,0,0|2,0,0]=4 3810 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)Cl 7a_100011999376_100009815848 [0,2,0,0,0,0|2,0,0]=4 3811 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)F 34a_100011217962_100009815848 [0,2,0,0,0,0|2,0,0]=4 3812 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)F 7a_100011217962_100009815848 [0,2,0,0,0,0|2,0,0]=4 3813 B16R1.16824 O=[N+]([O-])c1c(cccc1OC[C@@H](O)CO)I 7a_100010150324_100009815848 [0,2,0,0,0,0|2,0,0]=4 3814 B16R1.18406 C=CC(O)CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000730141 [0,2,0,0,0,0|1,0,1]=4 3815 B16R1.18406 CC(CN)OCc1c(cccc1[N+](=O)[O-])Br 34a_100000210904_100011273477 [0,2,0,0,0,0|2,0,0]=4 3816 B16R1.18406 CC(CN)OCc1c(cccc1[N+](=O)[O-])Cl 34a_100000210904_100000753779 [0,2,0,0,0,0|2,0,0]=4 3817 B16R1.18406 CC(CN)OCc1c(cccc1[N+](=O)[O-])F 34a_100000210904_100000751461 [0,2,0,0,0,0|2,0,0]=4 3818 B16R1.18406 CCC(C)CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000748023 [0,2,0,0,0,0|1,0,0]=3 3819 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000748023 [0,2,0,0,0,0|2,0,0]=4 3820 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000748023 [0,2,0,0,0,0|2,0,0]=4 3821 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000748023 [0,2,0,0,0,0|2,0,0]=4 3822 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000748023 [0,2,0,0,0,0|2,0,0]=4 3823 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000748023 [0,2,0,0,0,0|2,0,0]=4 3824 B16R1.18406 CCC(C)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000748023 [0,2,0,0,0,0|2,0,0]=4 3825 B16R1.18406 CCC(O)CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100011218378 [0,2,0,0,0,0|1,0,0]=3 3826 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100011218378 [0,2,0,0,0,0|2,0,0]=4 3827 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100011218378 [0,2,0,0,0,0|2,0,0]=4 3828 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100011218378 [0,2,0,0,0,0|2,0,0]=4 3829 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100011218378 [0,2,0,0,0,0|2,0,0]=4 3830 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100011218378 [0,2,0,0,0,0|2,0,0]=4 3831 B16R1.18406 CCC(O)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100011218378 [0,2,0,0,0,0|2,0,0]=4 3832 B16R1.18406 CC[C@H](C)CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100009816398 [0,2,0,0,0,0|1,0,0]=3 3833 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100009816398 [0,2,0,0,0,0|2,0,0]=4 3834 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100009816398 [0,2,0,0,0,0|2,0,0]=4 3835 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100009816398 [0,2,0,0,0,0|2,0,0]=4 3836 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100009816398 [0,2,0,0,0,0|2,0,0]=4 3837 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100009816398 [0,2,0,0,0,0|2,0,0]=4 3838 B16R1.18406 CC[C@H](C)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100009816398 [0,2,0,0,0,0|2,0,0]=4 3839 B16R1.18406 C[C@@H](CO)CNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000059175 [0,2,0,0,0,0|1,0,0]=3 3840 B16R1.18406 C[C@@H](CO)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000059175 [0,2,0,0,0,0|2,0,0]=4 3841 B16R1.18406 C[C@@H](CO)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000059175 [0,2,0,0,0,0|2,0,0]=4 3842 B16R1.18406 C[C@@H](CO)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000059175 [0,2,0,0,0,0|2,0,0]=4 3843 B16R1.18406 C[C@@H](CO)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000059175 [0,2,0,0,0,0|2,0,0]=4 3844 B16R1.18406 Cc1cccc(c1COC(C)CN)[N+](=O)[O-] 34a_100000210904_100010254497 [0,2,0,0,0,0|2,0,0]=4 3845 B16R1.18406 Cc1cccc(c1OCC(O)CO)[N+](=O)[O-] 34a_100000763257_100011219619 [0,2,0,0,0,0|2,0,0]=4 3846 B16R1.18406 Cc1cccc(c1OCC(O)CO)[N+](=O)[O-] 7a_100000763257_100011219619 [0,2,0,0,0,0|2,0,0]=4 3847 B16R1.18406 Cc1cccc(c1OC[C@@H](C)CO)[N+](=O)[O-] 34a_100000763257_100000059175 [0,2,0,0,0,0|2,0,0]=4 3848 B16R1.18406 Cc1cccc(c1OC[C@@H](C)CO)[N+](=O)[O-] 7a_100000763257_100000059175 [0,2,0,0,0,0|2,0,0]=4 3849 B16R1.18406 Cc1cccc(c1OC[C@@H](O)CF)[N+](=O)[O-] 34a_100000763257_100015614560 [0,2,0,0,0,0|2,0,0]=4 3850 B16R1.18406 Cc1cccc(c1OC[C@@H](O)CF)[N+](=O)[O-] 7a_100000763257_100015614560 [0,2,0,0,0,0|2,0,0]=4 3851 B16R1.18406 Cc1cccc(c1OC[C@@H](O)CO)[N+](=O)[O-] 34a_100000763257_100009815848 [0,2,0,0,0,0|2,0,0]=4 3852 B16R1.18406 Cc1cccc(c1OC[C@@H](O)CO)[N+](=O)[O-] 7a_100000763257_100009815848 [0,2,0,0,0,0|2,0,0]=4 3853 B16R1.18406 O=[N+]([O-])c1cccc(c1NCC(O)CO)F 34a_100000687224_100011219619 [0,2,0,0,0,0|1,0,0]=3 3854 B16R1.18406 O=[N+]([O-])c1cccc(c1NC[C@@H](O)CF)F 34a_100000687224_100015614560 [0,2,0,0,0,0|1,0,0]=3 3855 B16R1.18406 O=[N+]([O-])c1cccc(c1NC[C@@H](O)CO)F 34a_100000687224_100009815848 [0,2,0,0,0,0|1,0,0]=3 3856 B16R1.18406 O=[N+]([O-])c1cccc(c1OCC(O)CO)Br 34a_100000689966_100011219619 [0,2,0,0,0,0|2,0,0]=4 3857 B16R1.18406 O=[N+]([O-])c1cccc(c1OCC(O)CO)Cl 34a_100000686934_100011219619 [0,2,0,0,0,0|2,0,0]=4 3858 B16R1.18406 O=[N+]([O-])c1cccc(c1OCC(O)CO)Cl 7a_100000686934_100011219619 [0,2,0,0,0,0|2,0,0]=4 3859 B16R1.18406 O=[N+]([O-])c1cccc(c1OCC(O)CO)F 34a_100000690172_100011219619 [0,2,0,0,0,0|2,0,0]=4 3860 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CF)Br 34a_100000689966_100015614560 [0,2,0,0,0,0|2,0,0]=4 3861 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CF)Cl 34a_100000686934_100015614560 [0,2,0,0,0,0|2,0,0]=4 3862 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CF)Cl 7a_100000686934_100015614560 [0,2,0,0,0,0|2,0,0]=4 3863 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CF)F 34a_100000690172_100015614560 [0,2,0,0,0,0|2,0,0]=4 3864 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CO)Br 34a_100000689966_100009815848 [0,2,0,0,0,0|2,0,0]=4 3865 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CO)Cl 34a_100000686934_100009815848 [0,2,0,0,0,0|2,0,0]=4 3866 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CO)Cl 7a_100000686934_100009815848 [0,2,0,0,0,0|2,0,0]=4 3867 B16R1.18406 O=[N+]([O-])c1cccc(c1OC[C@@H](O)CO)F 34a_100000690172_100009815848 [0,2,0,0,0,0|2,0,0]=4 3868 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100000688953 [0,2,0,0,0,0|1,0,1]=4 3869 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000730999 [0,2,0,0,0,0|1,0,1]=4 3870 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])C 2230a_100012179672_100000688953 [0,2,0,0,0,0|1,0,1]=4 3871 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000730999 [0,2,0,0,0,0|1,0,1]=4 3872 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100000688953 [0,2,0,0,0,0|1,0,1]=4 3873 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000730999 [0,2,0,0,0,0|1,0,1]=4 3874 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100000688953 [0,2,0,0,0,0|1,0,1]=4 3875 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000730999 [0,2,0,0,0,0|1,0,1]=4 3876 B16R1.1449 C#CCCN(C)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100000688953 [0,2,0,0,0,0|1,0,1]=4 3877 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100000754431 [0,2,0,0,0,0|1,0,1]=4 3878 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000754431 [0,2,0,0,0,0|1,0,1]=4 3879 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])C 2230a_100012179672_100000754431 [0,2,0,0,0,0|1,0,1]=4 3880 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000754431 [0,2,0,0,0,0|1,0,1]=4 3881 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100000754431 [0,2,0,0,0,0|1,0,1]=4 3882 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000754431 [0,2,0,0,0,0|1,0,1]=4 3883 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100000754431 [0,2,0,0,0,0|1,0,1]=4 3884 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000754431 [0,2,0,0,0,0|1,0,1]=4 3885 B16R1.1449 C=CCCN(C)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100000754431 [0,2,0,0,0,0|1,0,1]=4 3886 B16R1.1449 CCCCC(=O)c1cc(ccc1[N+](=O)[O-])Br 1458a_100009992657_100000210211 [0,2,0,0,0,0|2,0,0]=4 3887 B16R1.1449 CCCCC(=O)c1cc(ccc1[N+](=O)[O-])C 1458a_100000763269_100000210211 [0,2,0,0,0,0|2,0,0]=4 3888 B16R1.1449 CCCCC(=O)c1cc(ccc1[N+](=O)[O-])Cl 1458a_100000210914_100000210211 [0,2,0,0,0,0|2,0,0]=4 3889 B16R1.1449 CCCCC(=O)c1cc(ccc1[N+](=O)[O-])I 1458a_100010186413_100000210211 [0,2,0,0,0,0|2,0,0]=4 3890 B16R1.1449 CCCCC(=O)c1cc(ccc1[N+](=O)[O-])O 1458a_100000692585_100000210211 [0,2,0,0,0,0|2,0,0]=4 3891 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100000210211 [0,2,0,0,0,0|1,0,0]=3 3892 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000210211 [0,2,0,0,0,0|1,0,0]=3 3893 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])C 2230a_100012179672_100000210211 [0,2,0,0,0,0|1,0,0]=3 3894 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000210211 [0,2,0,0,0,0|1,0,0]=3 3895 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100000210211 [0,2,0,0,0,0|1,0,0]=3 3896 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000210211 [0,2,0,0,0,0|1,0,0]=3 3897 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100000210211 [0,2,0,0,0,0|1,0,0]=3 3898 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000210211 [0,2,0,0,0,0|1,0,0]=3 3899 B16R1.1449 CCCCN(C)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100000210210 [0,2,0,0,0,0|1,0,0]=3 3900 B16R1.1449 CCOCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000739092 [0,2,0,0,0,0|2,0,0]=4 3901 B16R1.1449 CCOCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000739092 [0,2,0,0,0,0|2,0,0]=4 3902 B16R1.1449 CCOCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000739092 [0,2,0,0,0,0|2,0,0]=4 3903 B16R1.1449 CCOCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000739092 [0,2,0,0,0,0|2,0,0]=4 3904 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100011215226 [0,2,0,0,0,0|0,0,2]=4 3905 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100011215226 [0,2,0,0,0,0|0,0,2]=4 3906 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100011215226 [0,2,0,0,0,0|0,0,2]=4 3907 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100011215226 [0,2,0,0,0,0|0,0,2]=4 3908 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100011215226 [0,2,0,0,0,0|0,0,2]=4 3909 B16R1.1449 CN(CCC#N)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100011215226 [0,2,0,0,0,0|0,0,2]=4 3910 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100011934791 [0,2,0,0,0,0|1,0,0]=3 3911 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100011934791 [0,2,0,0,0,0|1,0,0]=3 3912 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100011934791 [0,2,0,0,0,0|1,0,0]=3 3913 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100011934791 [0,2,0,0,0,0|1,0,0]=3 3914 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100011934791 [0,2,0,0,0,0|1,0,0]=3 3915 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100011934791 [0,2,0,0,0,0|1,0,0]=3 3916 B16R1.1449 CN(CCCF)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100011934791 [0,2,0,0,0,0|1,0,0]=3 3917 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100000230001 [0,2,0,0,0,0|1,0,0]=3 3918 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100011215043 [0,2,0,0,0,0|1,0,0]=3 3919 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100000230001 [0,2,0,0,0,0|1,0,0]=3 3920 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100011215043 [0,2,0,0,0,0|1,0,0]=3 3921 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100000230001 [0,2,0,0,0,0|1,0,0]=3 3922 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100011215043 [0,2,0,0,0,0|1,0,0]=3 3923 B16R1.1449 CN(CCCO)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100000230001 [0,2,0,0,0,0|1,0,0]=3 3924 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100011201679 [0,2,0,0,0,0|2,0,0]=4 3925 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000233755 [0,2,0,0,0,0|2,0,0]=4 3926 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])C 2230a_100012179672_100011201679 [0,2,0,0,0,0|2,0,0]=4 3927 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000233755 [0,2,0,0,0,0|2,0,0]=4 3928 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100011201679 [0,2,0,0,0,0|2,0,0]=4 3929 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000233755 [0,2,0,0,0,0|2,0,0]=4 3930 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100011201679 [0,2,0,0,0,0|2,0,0]=4 3931 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000233755 [0,2,0,0,0,0|2,0,0]=4 3932 B16R1.1449 COCCN(C)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100011201679 [0,2,0,0,0,0|2,0,0]=4 3933 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])Br 2230a_100000702581_100000751147 [0,2,0,0,0,0|2,0,0]=4 3934 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])Br 269982a_100000702581_100000212216 [0,2,0,0,0,0|2,0,0]=4 3935 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])C 2230a_100012179672_100000751147 [0,2,0,0,0,0|2,0,0]=4 3936 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])C 269982a_100012179672_100000212216 [0,2,0,0,0,0|2,0,0]=4 3937 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 2230a_100000188764_100000751147 [0,2,0,0,0,0|2,0,0]=4 3938 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])Cl 269982a_100000188764_100000212216 [0,2,0,0,0,0|2,0,0]=4 3939 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])F 2230a_100000765406_100000751147 [0,2,0,0,0,0|2,0,0]=4 3940 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])F 269982a_100000765406_100000212216 [0,2,0,0,0,0|2,0,0]=4 3941 B16R1.1449 CSCCN(C)c1cc(ccc1[N+](=O)[O-])F 34a_100000765406_100000212216 [0,2,0,0,0,0|2,0,0]=4 3942 B16R1.1449 Cc1ccc(c(c1)C(=O)CCCF)[N+](=O)[O-] 1458a_100000763269_100011934791 [0,2,0,0,0,0|2,0,0]=4 3943 B16R1.1449 Cc1ccc(c(c1)C(=O)CCCO)[N+](=O)[O-] 1458a_100000763269_100011215043 [0,2,0,0,0,0|2,0,0]=4 3944 B16R1.1449 Cc1ccc(c(c1)N(C)CCC#N)[N+](=O)[O-] 2230a_100012179672_100011215226 [0,2,0,0,0,0|0,0,2]=4 3945 B16R1.1449 Cc1ccc(c(c1)N(C)CCC#N)[N+](=O)[O-] 269982a_100012179672_100011215226 [0,2,0,0,0,0|0,0,2]=4 3946 B16R1.1449 Cc1ccc(c(c1)N(C)CCCF)[N+](=O)[O-] 2230a_100012179672_100011934791 [0,2,0,0,0,0|1,0,0]=3 3947 B16R1.1449 Cc1ccc(c(c1)N(C)CCCF)[N+](=O)[O-] 269982a_100012179672_100011934791 [0,2,0,0,0,0|1,0,0]=3 3948 B16R1.1449 Cc1ccc(c(c1)N(C)CCCO)[N+](=O)[O-] 2230a_100012179672_100000230001 [0,2,0,0,0,0|1,0,0]=3 3949 B16R1.1449 Cc1ccc(c(c1)N(C)CCCO)[N+](=O)[O-] 269982a_100012179672_100011215043 [0,2,0,0,0,0|1,0,0]=3 3950 B16R1.1449 O=C(CCCF)c1cc(ccc1[N+](=O)[O-])Br 1458a_100009992657_100011934791 [0,2,0,0,0,0|2,0,0]=4 3951 B16R1.1449 O=C(CCCF)c1cc(ccc1[N+](=O)[O-])Cl 1458a_100000210914_100011934791 [0,2,0,0,0,0|2,0,0]=4 3952 B16R1.1449 O=C(CCCF)c1cc(ccc1[N+](=O)[O-])I 1458a_100010186413_100011934791 [0,2,0,0,0,0|2,0,0]=4 3953 B16R1.1449 O=C(CCCF)c1cc(ccc1[N+](=O)[O-])O 1458a_100000692585_100011934791 [0,2,0,0,0,0|2,0,0]=4 3954 B16R1.1449 O=C(CCCO)c1cc(ccc1[N+](=O)[O-])Br 1458a_100009992657_100011215043 [0,2,0,0,0,0|2,0,0]=4 3955 B16R1.1449 O=C(CCCO)c1cc(ccc1[N+](=O)[O-])Cl 1458a_100000210914_100011215043 [0,2,0,0,0,0|2,0,0]=4 3956 B16R1.1449 O=C(CCCO)c1cc(ccc1[N+](=O)[O-])I 1458a_100010186413_100011215043 [0,2,0,0,0,0|2,0,0]=4 3957 B16R1.1449 O=C(CCCO)c1cc(ccc1[N+](=O)[O-])O 1458a_100000692585_100011215043 [0,2,0,0,0,0|2,0,0]=4 3958 B16R1.1519 CC(CCO)Nc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100009893172 [0,2,0,0,0,0|1,0,0]=3 3959 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100009893172 [0,2,0,0,0,0|2,0,0]=4 3960 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100009893172 [0,2,0,0,0,0|2,0,0]=4 3961 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100009893172 [0,2,0,0,0,0|2,0,0]=4 3962 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100009893172 [0,2,0,0,0,0|2,0,0]=4 3963 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100009893172 [0,2,0,0,0,0|2,0,0]=4 3964 B16R1.1519 CC(CCO)Oc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100009893172 [0,2,0,0,0,0|2,0,0]=4 3965 B16R1.1519 CCCC(C)Nc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000766640 [0,2,0,0,0,0|1,0,0]=3 3966 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000766640 [0,2,0,0,0,0|2,0,0]=4 3967 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000766640 [0,2,0,0,0,0|2,0,0]=4 3968 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000766640 [0,2,0,0,0,0|2,0,0]=4 3969 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000766640 [0,2,0,0,0,0|2,0,0]=4 3970 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000766640 [0,2,0,0,0,0|2,0,0]=4 3971 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000766640 [0,2,0,0,0,0|2,0,0]=4 3972 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000766640 [0,2,0,0,0,0|2,0,0]=4 3973 B16R1.1519 CCCC(C)Oc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000766640 [0,2,0,0,0,0|2,0,0]=4 3974 B16R1.1519 COCC(C)Nc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000765312 [0,2,0,0,0,0|2,0,0]=4 3975 B16R1.1519 Cc1ccc(c(c1)OC(C)CCO)[N+](=O)[O-] 34a_100000195450_100009893172 [0,2,0,0,0,0|2,0,0]=4 3976 B16R1.1519 Cc1ccc(c(c1)OC(C)CCO)[N+](=O)[O-] 7a_100000195450_100009893172 [0,2,0,0,0,0|2,0,0]=4 3977 B16R1.4846 C#CCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000688953 [0,2,0,0,0,0|1,0,1]=4 3978 B16R1.4846 C#CCCNc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011217433_100000688953 [0,2,0,0,0,0|1,0,1]=4 3979 B16R1.4846 C#CCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000688953 [0,2,0,0,0,0|1,0,1]=4 3980 B16R1.4846 C=CCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000754431 [0,2,0,0,0,0|1,0,1]=4 3981 B16R1.4846 C=CCCNc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011217433_100000754431 [0,2,0,0,0,0|1,0,1]=4 3982 B16R1.4846 C=CCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000754431 [0,2,0,0,0,0|1,0,1]=4 3983 B16R1.4846 CCCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000210211 [0,2,0,0,0,0|1,0,0]=3 3984 B16R1.4846 CCCCNc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011217433_100000210210 [0,2,0,0,0,0|1,0,0]=3 3985 B16R1.4846 CCCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000210211 [0,2,0,0,0,0|1,0,0]=3 3986 B16R1.4846 CCCCOc1cc(cc(c1[N+](=O)[O-])Br)F 34a_100015254745_100000210210 [0,2,0,0,0,0|2,0,0]=4 3987 B16R1.4846 CCCCOc1cc(cc(c1[N+](=O)[O-])Br)F 7a_100015254745_100000210211 [0,2,0,0,0,0|2,0,0]=4 3988 B16R1.4846 CCCCOc1cc(cc(c1[N+](=O)[O-])F)Br 7a_100015472981_100000210211 [0,2,0,0,0,0|2,0,0]=4 3989 B16R1.4846 CCCCOc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011934965_100000210210 [0,2,0,0,0,0|2,0,0]=4 3990 B16R1.4846 CCCCOc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011934965_100000210211 [0,2,0,0,0,0|2,0,0]=4 3991 B16R1.4846 COCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000233755 [0,2,0,0,0,0|2,0,0]=4 3992 B16R1.4846 COCCNc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011217433_100011201679 [0,2,0,0,0,0|2,0,0]=4 3993 B16R1.4846 COCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000233755 [0,2,0,0,0,0|2,0,0]=4 3994 B16R1.4846 CSCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000212216 [0,2,0,0,0,0|2,0,0]=4 3995 B16R1.4846 CSCCNc1cc(cc(c1[N+](=O)[O-])F)F 34a_100011217433_100000212216 [0,2,0,0,0,0|2,0,0]=4 3996 B16R1.4846 CSCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000212216 [0,2,0,0,0,0|2,0,0]=4 3997 B16R1.4846 N#CCCNc1cc(cc(c1[N+](=O)[O-])F)Cl 7a_100021568055_100000184422 [0,2,0,0,0,0|0,0,2]=4 3998 B16R1.4846 N#CCCNc1cc(cc(c1[N+](=O)[O-])F)F 7a_100011217433_100000184422 [0,2,0,0,0,0|0,0,2]=4 3999 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCF)Cl)F 7a_100021568055_100011934791 [0,2,0,0,0,0|1,0,0]=3 4000 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCF)F)F 34a_100011217433_100011934791 [0,2,0,0,0,0|1,0,0]=3 4001 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCF)F)F 7a_100011217433_100011934791 [0,2,0,0,0,0|1,0,0]=3 4002 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCO)Cl)F 7a_100021568055_100011215043 [0,2,0,0,0,0|1,0,0]=3 4003 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCO)F)F 34a_100011217433_100000230001 [0,2,0,0,0,0|1,0,0]=3 4004 B16R1.4846 O=[N+]([O-])c1c(cc(cc1NCCCO)F)F 7a_100011217433_100011215043 [0,2,0,0,0,0|1,0,0]=3 4005 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCF)Br)F 7a_100015472981_100011934791 [0,2,0,0,0,0|2,0,0]=4 4006 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCF)F)Br 34a_100015254745_100011934791 [0,2,0,0,0,0|2,0,0]=4 4007 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCF)F)Br 7a_100015254745_100011934791 [0,2,0,0,0,0|2,0,0]=4 4008 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCF)F)F 34a_100011934965_100011934791 [0,2,0,0,0,0|2,0,0]=4 4009 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCF)F)F 7a_100011934965_100011934791 [0,2,0,0,0,0|2,0,0]=4 4010 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCO)Br)F 7a_100015472981_100011215043 [0,2,0,0,0,0|2,0,0]=4 4011 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCO)F)Br 34a_100015254745_100000230001 [0,2,0,0,0,0|2,0,0]=4 4012 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCO)F)Br 7a_100015254745_100011215043 [0,2,0,0,0,0|2,0,0]=4 4013 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCO)F)F 34a_100011934965_100000230001 [0,2,0,0,0,0|2,0,0]=4 4014 B16R1.4846 O=[N+]([O-])c1c(cc(cc1OCCCO)F)F 7a_100011934965_100011215043 [0,2,0,0,0,0|2,0,0]=4 4015 B16R1.11451 C=C(C)CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000730704 [0,2,0,0,0,0|1,0,1]=4 4016 B16R1.11451 CC(C)CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000210312 [0,2,0,0,0,0|1,0,0]=3 4017 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000210626 [0,2,0,0,0,0|2,0,0]=4 4018 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000210312 [0,2,0,0,0,0|2,0,0]=4 4019 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000210626 [0,2,0,0,0,0|2,0,0]=4 4020 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000210312 [0,2,0,0,0,0|2,0,0]=4 4021 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000210626 [0,2,0,0,0,0|2,0,0]=4 4022 B16R1.11451 CC(C)CCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000210626 [0,2,0,0,0,0|2,0,0]=4 4023 B16R1.11451 CC(C)OCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000709892 [0,2,0,0,0,0|2,0,0]=4 4024 B16R1.11451 CC(O)CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100012276601 [0,2,0,0,0,0|1,0,0]=3 4025 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100012276601 [0,2,0,0,0,0|2,0,0]=4 4026 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100012276601 [0,2,0,0,0,0|2,0,0]=4 4027 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100012276601 [0,2,0,0,0,0|2,0,0]=4 4028 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100012276601 [0,2,0,0,0,0|2,0,0]=4 4029 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100012276601 [0,2,0,0,0,0|2,0,0]=4 4030 B16R1.11451 CC(O)CCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100012276601 [0,2,0,0,0,0|2,0,0]=4 4031 B16R1.11451 C[C@@H](N)COCc1cc(ccc1[N+](=O)[O-])Br 34a_100000737577_100010245524 [0,2,0,0,0,0|2,0,0]=4 4032 B16R1.11451 C[C@@H](N)COCc1cc(ccc1[N+](=O)[O-])Cl 34a_100000737577_100000765840 [0,2,0,0,0,0|2,0,0]=4 4033 B16R1.11451 Cc1ccc(c(c1)COC[C@@H](C)N)[N+](=O)[O-] 34a_100000737577_200000039114 [0,2,0,0,0,0|2,0,0]=4 4034 B16R1.11451 Cc1ccc(c(c1)OCCC(=O)N)[N+](=O)[O-] 34a_100000195450_100000731001 [0,2,0,0,0,0|1,0,1]=4 4035 B16R1.11451 Cc1ccc(c(c1)OCCC(=O)N)[N+](=O)[O-] 7a_100000195450_100000744528 [0,2,0,0,0,0|1,0,1]=4 4036 B16R1.11451 Cc1ccc(c(c1)OCCC(C)C)[N+](=O)[O-] 34a_100000195450_100000210312 [0,2,0,0,0,0|2,0,0]=4 4037 B16R1.11451 Cc1ccc(c(c1)OCCC(C)C)[N+](=O)[O-] 7a_100000195450_100000210626 [0,2,0,0,0,0|2,0,0]=4 4038 B16R1.11451 Cc1ccc(c(c1)OCCC(C)O)[N+](=O)[O-] 34a_100000195450_100012276601 [0,2,0,0,0,0|2,0,0]=4 4039 B16R1.11451 Cc1ccc(c(c1)OCCC(C)O)[N+](=O)[O-] 7a_100000195450_100012276601 [0,2,0,0,0,0|2,0,0]=4 4040 B16R1.11451 NC(=O)CCNc1cc(ccc1[N+](=O)[O-])F 34a_100000746377_100000731001 [0,2,0,0,0,0|0,0,1]=3 4041 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000744528 [0,2,0,0,0,0|1,0,1]=4 4042 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000731001 [0,2,0,0,0,0|1,0,1]=4 4043 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000744528 [0,2,0,0,0,0|1,0,1]=4 4044 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000731001 [0,2,0,0,0,0|1,0,1]=4 4045 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000744528 [0,2,0,0,0,0|1,0,1]=4 4046 B16R1.11451 NC(=O)CCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000744528 [0,2,0,0,0,0|1,0,1]=4 4047 B16R1.20307 C#CCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000688953 [0,2,0,0,0,0|1,0,1]=4 4048 B16R1.20307 C#CCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100000688953 [0,2,0,0,0,0|1,0,1]=4 4049 B16R1.20307 C=CCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000754431 [0,2,0,0,0,0|1,0,1]=4 4050 B16R1.20307 C=CCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100000754431 [0,2,0,0,0,0|1,0,1]=4 4051 B16R1.20307 CCCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000210211 [0,2,0,0,0,0|1,0,0]=3 4052 B16R1.20307 CCCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100000210211 [0,2,0,0,0,0|1,0,0]=3 4053 B16R1.20307 CCCCOc1cc(ccc1[N+](=O)[O-])C#N 7a_100011997734_100000210211 [0,2,0,0,0,0|2,0,0]=4 4054 B16R1.20307 CCCCOc1cc(ccc1[N+](=O)[O-])CO 7a_100000723458_100000210211 [0,2,0,0,0,0|2,0,0]=4 4055 B16R1.20307 CCCCOc1cc(ccc1[N+](=O)[O-])OC 34a_100011219805_100000210210 [0,2,0,0,0,0|2,0,0]=4 4056 B16R1.20307 CCCCOc1cc(ccc1[N+](=O)[O-])OC 7a_100011219805_100000210211 [0,2,0,0,0,0|2,0,0]=4 4057 B16R1.20307 COCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000233755 [0,2,0,0,0,0|2,0,0]=4 4058 B16R1.20307 COCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100011201679 [0,2,0,0,0,0|2,0,0]=4 4059 B16R1.20307 COc1ccc(c(c1)OCCCF)[N+](=O)[O-] 34a_100011219805_100011934791 [0,2,0,0,0,0|2,0,0]=4 4060 B16R1.20307 COc1ccc(c(c1)OCCCF)[N+](=O)[O-] 7a_100011219805_100011934791 [0,2,0,0,0,0|2,0,0]=4 4061 B16R1.20307 COc1ccc(c(c1)OCCCO)[N+](=O)[O-] 34a_100011219805_100000230001 [0,2,0,0,0,0|2,0,0]=4 4062 B16R1.20307 COc1ccc(c(c1)OCCCO)[N+](=O)[O-] 7a_100011219805_100011215043 [0,2,0,0,0,0|2,0,0]=4 4063 B16R1.20307 CSCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000212216 [0,2,0,0,0,0|2,0,0]=4 4064 B16R1.20307 CSCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100000751147 [0,2,0,0,0,0|2,0,0]=4 4065 B16R1.20307 N#CCCNc1cc(ccc1[N+](=O)[O-])C#N 7a_200012185224_100000184422 [0,2,0,0,0,0|0,0,2]=4 4066 B16R1.20307 N#CCCNc1cc(ccc1[N+](=O)[O-])CO 2230a_100012186632_100011215226 [0,2,0,0,0,0|0,0,2]=4 4067 B16R1.20307 N#Cc1ccc(c(c1)NCCCF)[N+](=O)[O-] 7a_200012185224_100011934791 [0,2,0,0,0,0|1,0,0]=3 4068 B16R1.20307 N#Cc1ccc(c(c1)NCCCO)[N+](=O)[O-] 7a_200012185224_100011215043 [0,2,0,0,0,0|1,0,0]=3 4069 B16R1.20307 N#Cc1ccc(c(c1)OCCCF)[N+](=O)[O-] 7a_100011997734_100011934791 [0,2,0,0,0,0|2,0,0]=4 4070 B16R1.20307 N#Cc1ccc(c(c1)OCCCO)[N+](=O)[O-] 7a_100011997734_100011215043 [0,2,0,0,0,0|2,0,0]=4 4071 B16R1.20307 O=[N+]([O-])c1ccc(cc1NCCCF)CO 2230a_100012186632_100011934791 [0,2,0,0,0,0|1,0,0]=3 4072 B16R1.20307 O=[N+]([O-])c1ccc(cc1NCCCO)CO 2230a_100012186632_100000230001 [0,2,0,0,0,0|1,0,0]=3 4073 B16R1.20307 O=[N+]([O-])c1ccc(cc1OCCCF)CO 7a_100000723458_100011934791 [0,2,0,0,0,0|2,0,0]=4 4074 B16R1.20307 O=[N+]([O-])c1ccc(cc1OCCCO)CO 7a_100000723458_100011215043 [0,2,0,0,0,0|2,0,0]=4 4075 B16R1.26789 C#CCCNc1c(ccc(c1C)C)[N+](=O)[O-] 34a_100000181302_100000688953 [0,2,0,0,0,0|1,0,1]=4 4076 B16R1.26789 C#CCCNc1c(ccc(c1C)F)[N+](=O)[O-] 34a_100000080702_100000688953 [0,2,0,0,0,0|1,0,1]=4 4077 B16R1.26789 C#CCCNc1c(ccc(c1Cl)F)[N+](=O)[O-] 34a_100000093548_100000688953 [0,2,0,0,0,0|1,0,1]=4 4078 B16R1.26789 C#CCCNc1c(ccc(c1F)C)[N+](=O)[O-] 34a_100009871327_100000688953 [0,2,0,0,0,0|1,0,1]=4 4079 B16R1.26789 C#CCCNc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100000759828_100000688953 [0,2,0,0,0,0|1,0,1]=4 4080 B16R1.26789 C=CCCNc1c(ccc(c1C)C)[N+](=O)[O-] 34a_100000181302_100000754431 [0,2,0,0,0,0|1,0,1]=4 4081 B16R1.26789 C=CCCNc1c(ccc(c1C)F)[N+](=O)[O-] 34a_100000080702_100000754431 [0,2,0,0,0,0|1,0,1]=4 4082 B16R1.26789 C=CCCNc1c(ccc(c1Cl)F)[N+](=O)[O-] 34a_100000093548_100000754431 [0,2,0,0,0,0|1,0,1]=4 4083 B16R1.26789 C=CCCNc1c(ccc(c1F)C)[N+](=O)[O-] 34a_100009871327_100000754431 [0,2,0,0,0,0|1,0,1]=4 4084 B16R1.26789 C=CCCNc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100000759828_100000754431 [0,2,0,0,0,0|1,0,1]=4 4085 B16R1.26789 CCCCNc1c(ccc(c1C)C)[N+](=O)[O-] 34a_100000181302_100000210210 [0,2,0,0,0,0|1,0,0]=3 4086 B16R1.26789 CCCCNc1c(ccc(c1C)F)[N+](=O)[O-] 34a_100000080702_100000210210 [0,2,0,0,0,0|1,0,0]=3 4087 B16R1.26789 CCCCNc1c(ccc(c1Cl)F)[N+](=O)[O-] 34a_100000093548_100000210210 [0,2,0,0,0,0|1,0,0]=3 4088 B16R1.26789 CCCCNc1c(ccc(c1F)C)[N+](=O)[O-] 34a_100009871327_100000210210 [0,2,0,0,0,0|1,0,0]=3 4089 B16R1.26789 CCCCNc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100000759828_100000210210 [0,2,0,0,0,0|1,0,0]=3 4090 B16R1.26789 CCCCOc1c(ccc(c1Br)F)[N+](=O)[O-] 34a_100010128262_100000210210 [0,2,0,0,0,0|2,0,0]=4 4091 B16R1.26789 CCCCOc1c(ccc(c1Cl)Cl)[N+](=O)[O-] 34a_100010195890_100000210210 [0,2,0,0,0,0|2,0,0]=4 4092 B16R1.26789 CCCCOc1c(ccc(c1Cl)Cl)[N+](=O)[O-] 7a_100010195890_100000210211 [0,2,0,0,0,0|2,0,0]=4 4093 B16R1.26789 CCCCOc1c(ccc(c1F)Cl)[N+](=O)[O-] 34a_200015649888_100000210210 [0,2,0,0,0,0|2,0,0]=4 4094 B16R1.26789 CCCCOc1c(ccc(c1F)Cl)[N+](=O)[O-] 7a_200015649888_100000210211 [0,2,0,0,0,0|2,0,0]=4 4095 B16R1.26789 CCCCOc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100011215612_100000210210 [0,2,0,0,0,0|2,0,0]=4 4096 B16R1.26789 CCCCOc1c(ccc(c1F)F)[N+](=O)[O-] 7a_100011215612_100000210211 [0,2,0,0,0,0|2,0,0]=4 4097 B16R1.26789 COCCNc1c(ccc(c1C)C)[N+](=O)[O-] 34a_100000181302_100011201679 [0,2,0,0,0,0|2,0,0]=4 4098 B16R1.26789 COCCNc1c(ccc(c1C)F)[N+](=O)[O-] 34a_100000080702_100011201679 [0,2,0,0,0,0|2,0,0]=4 4099 B16R1.26789 COCCNc1c(ccc(c1Cl)F)[N+](=O)[O-] 34a_100000093548_100011201679 [0,2,0,0,0,0|2,0,0]=4 4100 B16R1.26789 COCCNc1c(ccc(c1F)C)[N+](=O)[O-] 34a_100009871327_100011201679 [0,2,0,0,0,0|2,0,0]=4 4101 B16R1.26789 COCCNc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100000759828_100011201679 [0,2,0,0,0,0|2,0,0]=4 4102 B16R1.26789 CSCCNc1c(ccc(c1C)C)[N+](=O)[O-] 34a_100000181302_100000212216 [0,2,0,0,0,0|2,0,0]=4 4103 B16R1.26789 CSCCNc1c(ccc(c1C)F)[N+](=O)[O-] 34a_100000080702_100000212216 [0,2,0,0,0,0|2,0,0]=4 4104 B16R1.26789 CSCCNc1c(ccc(c1Cl)F)[N+](=O)[O-] 34a_100000093548_100000212216 [0,2,0,0,0,0|2,0,0]=4 4105 B16R1.26789 CSCCNc1c(ccc(c1F)C)[N+](=O)[O-] 34a_100009871327_100000212216 [0,2,0,0,0,0|2,0,0]=4 4106 B16R1.26789 CSCCNc1c(ccc(c1F)F)[N+](=O)[O-] 34a_100000759828_100000212216 [0,2,0,0,0,0|2,0,0]=4 4107 B16R1.26789 Cc1c(ccc(c1NCCCF)[N+](=O)[O-])F 34a_100000080702_100011934791 [0,2,0,0,0,0|1,0,0]=3 4108 B16R1.26789 Cc1c(ccc(c1NCCCO)[N+](=O)[O-])F 34a_100000080702_100000230001 [0,2,0,0,0,0|1,0,0]=3 4109 B16R1.26789 Cc1ccc(c(c1C)NCCCF)[N+](=O)[O-] 34a_100000181302_100011934791 [0,2,0,0,0,0|1,0,0]=3 4110 B16R1.26789 Cc1ccc(c(c1C)NCCCO)[N+](=O)[O-] 34a_100000181302_100000230001 [0,2,0,0,0,0|1,0,0]=3 4111 B16R1.26789 Cc1ccc(c(c1F)NCCCF)[N+](=O)[O-] 34a_100009871327_100011934791 [0,2,0,0,0,0|1,0,0]=3 4112 B16R1.26789 Cc1ccc(c(c1F)NCCCO)[N+](=O)[O-] 34a_100009871327_100000230001 [0,2,0,0,0,0|1,0,0]=3 4113 B16R1.26789 O=[N+]([O-])c1ccc(c(c1NCCCF)Cl)F 34a_100000093548_100011934791 [0,2,0,0,0,0|1,0,0]=3 4114 B16R1.26789 O=[N+]([O-])c1ccc(c(c1NCCCF)F)F 34a_100000759828_100011934791 [0,2,0,0,0,0|1,0,0]=3 4115 B16R1.26789 O=[N+]([O-])c1ccc(c(c1NCCCO)Cl)F 34a_100000093548_100000230001 [0,2,0,0,0,0|1,0,0]=3 4116 B16R1.26789 O=[N+]([O-])c1ccc(c(c1NCCCO)F)F 34a_100000759828_100000230001 [0,2,0,0,0,0|1,0,0]=3 4117 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)Br)F 34a_100010128262_100011934791 [0,2,0,0,0,0|2,0,0]=4 4118 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)Cl)Cl 34a_100010195890_100011934791 [0,2,0,0,0,0|2,0,0]=4 4119 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)Cl)Cl 7a_100010195890_100011934791 [0,2,0,0,0,0|2,0,0]=4 4120 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)F)Cl 34a_200015649888_100011934791 [0,2,0,0,0,0|2,0,0]=4 4121 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)F)Cl 7a_200015649888_100011934791 [0,2,0,0,0,0|2,0,0]=4 4122 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)F)F 34a_100011215612_100011934791 [0,2,0,0,0,0|2,0,0]=4 4123 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCF)F)F 7a_100011215612_100011934791 [0,2,0,0,0,0|2,0,0]=4 4124 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)Br)F 34a_100010128262_100000230001 [0,2,0,0,0,0|2,0,0]=4 4125 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)Cl)Cl 34a_100010195890_100000230001 [0,2,0,0,0,0|2,0,0]=4 4126 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)Cl)Cl 7a_100010195890_100011215043 [0,2,0,0,0,0|2,0,0]=4 4127 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)F)Cl 34a_200015649888_100000230001 [0,2,0,0,0,0|2,0,0]=4 4128 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)F)Cl 7a_200015649888_100011215043 [0,2,0,0,0,0|2,0,0]=4 4129 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)F)F 34a_100011215612_100000230001 [0,2,0,0,0,0|2,0,0]=4 4130 B16R1.26789 O=[N+]([O-])c1ccc(c(c1OCCCO)F)F 7a_100011215612_100011215043 [0,2,0,0,0,0|2,0,0]=4 4131 B16R1.1863 C#CCCN(C)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100000688953 [0,2,0,0,0,0|1,0,1]=4 4132 B16R1.1863 C#CCCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000730999 [0,2,0,0,0,0|1,0,1]=4 4133 B16R1.1863 C=CCCN(C)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100000754431 [0,2,0,0,0,0|1,0,1]=4 4134 B16R1.1863 C=CCCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000754431 [0,2,0,0,0,0|1,0,1]=4 4135 B16R1.1863 CCCCC(=O)c1cccc(c1[N+](=O)[O-])Br 1458a_100010232116_100000210211 [0,2,0,0,0,0|2,0,0]=4 4136 B16R1.1863 CCCCC(=O)c1cccc(c1[N+](=O)[O-])C 1458a_100000211462_100000210211 [0,2,0,0,0,0|2,0,0]=4 4137 B16R1.1863 CCCCC(=O)c1cccc(c1[N+](=O)[O-])Cl 1458a_100000766603_100000210211 [0,2,0,0,0,0|2,0,0]=4 4138 B16R1.1863 CCCCC(=O)c1cccc(c1[N+](=O)[O-])F 1458a_100000068878_100000210211 [0,2,0,0,0,0|2,0,0]=4 4139 B16R1.1863 CCCCC(=O)c1cccc(c1[N+](=O)[O-])O 1458a_100000688640_100000210211 [0,2,0,0,0,0|2,0,0]=4 4140 B16R1.1863 CCCCN(C)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100000210211 [0,2,0,0,0,0|1,0,0]=3 4141 B16R1.1863 CCCCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000210211 [0,2,0,0,0,0|1,0,0]=3 4142 B16R1.1863 CCOCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000739092 [0,2,0,0,0,0|2,0,0]=4 4143 B16R1.1863 CN(CCC#N)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100011215226 [0,2,0,0,0,0|0,0,2]=4 4144 B16R1.1863 CN(CCC#N)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100011215226 [0,2,0,0,0,0|0,0,2]=4 4145 B16R1.1863 CN(CCCF)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100011934791 [0,2,0,0,0,0|1,0,0]=3 4146 B16R1.1863 CN(CCCF)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100011934791 [0,2,0,0,0,0|1,0,0]=3 4147 B16R1.1863 CN(CCCO)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100000230001 [0,2,0,0,0,0|1,0,0]=3 4148 B16R1.1863 CN(CCCO)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100011215043 [0,2,0,0,0,0|1,0,0]=3 4149 B16R1.1863 COCCN(C)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100011201679 [0,2,0,0,0,0|2,0,0]=4 4150 B16R1.1863 COCCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000233755 [0,2,0,0,0,0|2,0,0]=4 4151 B16R1.1863 CSCCN(C)c1cccc(c1[N+](=O)[O-])Br 2230a_100012362474_100000751147 [0,2,0,0,0,0|2,0,0]=4 4152 B16R1.1863 CSCCN(C)c1cccc(c1[N+](=O)[O-])Br 269982a_100012362474_100000212216 [0,2,0,0,0,0|2,0,0]=4 4153 B16R1.1863 Cc1cccc(c1[N+](=O)[O-])C(=O)CCCF 1458a_100000211462_100011934791 [0,2,0,0,0,0|2,0,0]=4 4154 B16R1.1863 Cc1cccc(c1[N+](=O)[O-])C(=O)CCCO 1458a_100000211462_100011215043 [0,2,0,0,0,0|2,0,0]=4 4155 B16R1.1863 O=C(CCCF)c1cccc(c1[N+](=O)[O-])Br 1458a_100010232116_100011934791 [0,2,0,0,0,0|2,0,0]=4 4156 B16R1.1863 O=C(CCCF)c1cccc(c1[N+](=O)[O-])Cl 1458a_100000766603_100011934791 [0,2,0,0,0,0|2,0,0]=4 4157 B16R1.1863 O=C(CCCF)c1cccc(c1[N+](=O)[O-])F 1458a_100000068878_100011934791 [0,2,0,0,0,0|2,0,0]=4 4158 B16R1.1863 O=C(CCCF)c1cccc(c1[N+](=O)[O-])O 1458a_100000688640_100011934791 [0,2,0,0,0,0|2,0,0]=4 4159 B16R1.1863 O=C(CCCO)c1cccc(c1[N+](=O)[O-])Br 1458a_100010232116_100011215043 [0,2,0,0,0,0|2,0,0]=4 4160 B16R1.1863 O=C(CCCO)c1cccc(c1[N+](=O)[O-])Cl 1458a_100000766603_100011215043 [0,2,0,0,0,0|2,0,0]=4 4161 B16R1.1863 O=C(CCCO)c1cccc(c1[N+](=O)[O-])F 1458a_100000068878_100011215043 [0,2,0,0,0,0|2,0,0]=4 4162 B16R1.1863 O=C(CCCO)c1cccc(c1[N+](=O)[O-])O 1458a_100000688640_100011215043 [0,2,0,0,0,0|2,0,0]=4 4163 B16R1.1877 C#CCCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000730999 [0,2,0,0,0,0|1,0,1]=4 4164 B16R1.1877 C#CCCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000730999 [0,2,0,0,0,0|1,0,1]=4 4165 B16R1.1877 C#CCCN(C)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100000688953 [0,2,0,0,0,0|1,0,1]=4 4166 B16R1.1877 C#CCCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000730999 [0,2,0,0,0,0|1,0,1]=4 4167 B16R1.1877 C#CCCN(C)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100000688953 [0,2,0,0,0,0|1,0,1]=4 4168 B16R1.1877 C=CCCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000754431 [0,2,0,0,0,0|1,0,1]=4 4169 B16R1.1877 C=CCCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000754431 [0,2,0,0,0,0|1,0,1]=4 4170 B16R1.1877 C=CCCN(C)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100000754431 [0,2,0,0,0,0|1,0,1]=4 4171 B16R1.1877 C=CCCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000754431 [0,2,0,0,0,0|1,0,1]=4 4172 B16R1.1877 C=CCCN(C)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100000754431 [0,2,0,0,0,0|1,0,1]=4 4173 B16R1.1877 CCCCC(=O)c1c(cccc1[N+](=O)[O-])Br 1458a_100000690006_100000210211 [0,2,0,0,0,0|2,0,0]=4 4174 B16R1.1877 CCCCC(=O)c1c(cccc1[N+](=O)[O-])C 1458a_100000234352_100000210211 [0,2,0,0,0,0|2,0,0]=4 4175 B16R1.1877 CCCCC(=O)c1c(cccc1[N+](=O)[O-])Cl 1458a_100000752432_100000210211 [0,2,0,0,0,0|2,0,0]=4 4176 B16R1.1877 CCCCC(=O)c1c(cccc1[N+](=O)[O-])F 1458a_100011219868_100000210211 [0,2,0,0,0,0|2,0,0]=4 4177 B16R1.1877 CCCCC(=O)c1c(cccc1[N+](=O)[O-])O 1458a_100012186653_100000210211 [0,2,0,0,0,0|2,0,0]=4 4178 B16R1.1877 CCCCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000210211 [0,2,0,0,0,0|1,0,0]=3 4179 B16R1.1877 CCCCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000210211 [0,2,0,0,0,0|1,0,0]=3 4180 B16R1.1877 CCCCN(C)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100000210211 [0,2,0,0,0,0|1,0,0]=3 4181 B16R1.1877 CCCCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000210211 [0,2,0,0,0,0|1,0,0]=3 4182 B16R1.1877 CCCCN(C)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100000210210 [0,2,0,0,0,0|1,0,0]=3 4183 B16R1.1877 CCOCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000739092 [0,2,0,0,0,0|2,0,0]=4 4184 B16R1.1877 CCOCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000739092 [0,2,0,0,0,0|2,0,0]=4 4185 B16R1.1877 CCOCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000739092 [0,2,0,0,0,0|2,0,0]=4 4186 B16R1.1877 CN(CCC#N)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100011215226 [0,2,0,0,0,0|0,0,2]=4 4187 B16R1.1877 CN(CCC#N)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100011215226 [0,2,0,0,0,0|0,0,2]=4 4188 B16R1.1877 CN(CCC#N)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100011215226 [0,2,0,0,0,0|0,0,2]=4 4189 B16R1.1877 CN(CCC#N)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100011215226 [0,2,0,0,0,0|0,0,2]=4 4190 B16R1.1877 CN(CCCF)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100011934791 [0,2,0,0,0,0|1,0,0]=3 4191 B16R1.1877 CN(CCCF)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100011934791 [0,2,0,0,0,0|1,0,0]=3 4192 B16R1.1877 CN(CCCF)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100011934791 [0,2,0,0,0,0|1,0,0]=3 4193 B16R1.1877 CN(CCCF)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100011934791 [0,2,0,0,0,0|1,0,0]=3 4194 B16R1.1877 CN(CCCF)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100011934791 [0,2,0,0,0,0|1,0,0]=3 4195 B16R1.1877 CN(CCCO)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100011215043 [0,2,0,0,0,0|1,0,0]=3 4196 B16R1.1877 CN(CCCO)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100011215043 [0,2,0,0,0,0|1,0,0]=3 4197 B16R1.1877 CN(CCCO)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100000230001 [0,2,0,0,0,0|1,0,0]=3 4198 B16R1.1877 CN(CCCO)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100011215043 [0,2,0,0,0,0|1,0,0]=3 4199 B16R1.1877 CN(CCCO)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100000230001 [0,2,0,0,0,0|1,0,0]=3 4200 B16R1.1877 COCCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000233755 [0,2,0,0,0,0|2,0,0]=4 4201 B16R1.1877 COCCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000233755 [0,2,0,0,0,0|2,0,0]=4 4202 B16R1.1877 COCCN(C)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100011201679 [0,2,0,0,0,0|2,0,0]=4 4203 B16R1.1877 COCCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000233755 [0,2,0,0,0,0|2,0,0]=4 4204 B16R1.1877 COCCN(C)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100011201679 [0,2,0,0,0,0|2,0,0]=4 4205 B16R1.1877 CSCCN(C)c1c(cccc1[N+](=O)[O-])Br 269982a_100011093391_100000212216 [0,2,0,0,0,0|2,0,0]=4 4206 B16R1.1877 CSCCN(C)c1c(cccc1[N+](=O)[O-])Cl 269982a_200011606563_100000212216 [0,2,0,0,0,0|2,0,0]=4 4207 B16R1.1877 CSCCN(C)c1c(cccc1[N+](=O)[O-])F 2230a_200012281166_100000751147 [0,2,0,0,0,0|2,0,0]=4 4208 B16R1.1877 CSCCN(C)c1c(cccc1[N+](=O)[O-])F 269982a_200012281166_100000212216 [0,2,0,0,0,0|2,0,0]=4 4209 B16R1.1877 CSCCN(C)c1c(cccc1[N+](=O)[O-])F 34a_200012281166_100000212216 [0,2,0,0,0,0|2,0,0]=4 4210 B16R1.1877 Cc1cccc(c1C(=O)CCCF)[N+](=O)[O-] 1458a_100000234352_100011934791 [0,2,0,0,0,0|2,0,0]=4 4211 B16R1.1877 Cc1cccc(c1C(=O)CCCO)[N+](=O)[O-] 1458a_100000234352_100011215043 [0,2,0,0,0,0|2,0,0]=4 4212 B16R1.1877 O=C(CCCF)c1c(cccc1[N+](=O)[O-])Br 1458a_100000690006_100011934791 [0,2,0,0,0,0|2,0,0]=4 4213 B16R1.1877 O=C(CCCF)c1c(cccc1[N+](=O)[O-])Cl 1458a_100000752432_100011934791 [0,2,0,0,0,0|2,0,0]=4 4214 B16R1.1877 O=C(CCCF)c1c(cccc1[N+](=O)[O-])F 1458a_100011219868_100011934791 [0,2,0,0,0,0|2,0,0]=4 4215 B16R1.1877 O=C(CCCF)c1c(cccc1[N+](=O)[O-])O 1458a_100012186653_100011934791 [0,2,0,0,0,0|2,0,0]=4 4216 B16R1.1877 O=C(CCCO)c1c(cccc1[N+](=O)[O-])Br 1458a_100000690006_100011215043 [0,2,0,0,0,0|2,0,0]=4 4217 B16R1.1877 O=C(CCCO)c1c(cccc1[N+](=O)[O-])Cl 1458a_100000752432_100011215043 [0,2,0,0,0,0|2,0,0]=4 4218 B16R1.1877 O=C(CCCO)c1c(cccc1[N+](=O)[O-])F 1458a_100011219868_100011215043 [0,2,0,0,0,0|2,0,0]=4 4219 B16R1.1877 O=C(CCCO)c1c(cccc1[N+](=O)[O-])O 1458a_100012186653_100011215043 [0,2,0,0,0,0|2,0,0]=4 4220 B16R1.3864 C#CCCN(CC)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100000688953 [0,2,0,0,0,0|1,0,1]=4 4221 B16R1.3864 C#CCCN(CC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000730999 [0,2,0,0,0,0|1,0,1]=4 4222 B16R1.3864 C=CCCN(CC)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100000754431 [0,2,0,0,0,0|1,0,1]=4 4223 B16R1.3864 C=CCCN(CC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000754431 [0,2,0,0,0,0|1,0,1]=4 4224 B16R1.3864 CCCCN(CC)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100000210211 [0,2,0,0,0,0|1,0,0]=3 4225 B16R1.3864 CCCCN(CC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000210211 [0,2,0,0,0,0|1,0,0]=3 4226 B16R1.3864 CCN(CCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000002493_100000210202 [0,2,0,0,0,0|0,0,2]=4 4227 B16R1.3864 CCN(CCC#N)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100011215226 [0,2,0,0,0,0|0,0,2]=4 4228 B16R1.3864 CCN(CCC#N)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100011215226 [0,2,0,0,0,0|0,0,2]=4 4229 B16R1.3864 CCN(CCCF)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100011934791 [0,2,0,0,0,0|1,0,0]=3 4230 B16R1.3864 CCN(CCCF)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100011934791 [0,2,0,0,0,0|1,0,0]=3 4231 B16R1.3864 CCN(CCCO)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100000230001 [0,2,0,0,0,0|1,0,0]=3 4232 B16R1.3864 CCN(CCCO)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100011215043 [0,2,0,0,0,0|1,0,0]=3 4233 B16R1.3864 CCN(CCOC)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100011201679 [0,2,0,0,0,0|2,0,0]=4 4234 B16R1.3864 CCN(CCOC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000233755 [0,2,0,0,0,0|2,0,0]=4 4235 B16R1.3864 CCN(CCSC)c1ccccc1[N+](=O)[O-] 2230a_100000156562_100000751147 [0,2,0,0,0,0|2,0,0]=4 4236 B16R1.3864 CCN(CCSC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000212216 [0,2,0,0,0,0|2,0,0]=4 4237 B16R1.3864 CCOCN(CC)c1ccccc1[N+](=O)[O-] 269982a_100000156562_100000739092 [0,2,0,0,0,0|2,0,0]=4 4238 B16R1.4547 C=C(C)CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000730704 [0,2,0,0,0,0|1,0,1]=4 4239 B16R1.4547 C=C(C)CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000730704 [0,2,0,0,0,0|1,0,1]=4 4240 B16R1.4547 CC(=O)CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000053229 [0,2,0,0,0,0|1,0,1]=4 4241 B16R1.4547 CC(C)CCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210312 [0,2,0,0,0,0|2,0,0]=4 4242 B16R1.4547 CC(C)CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000210312 [0,2,0,0,0,0|1,0,0]=3 4243 B16R1.4547 CC(C)CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000210312 [0,2,0,0,0,0|1,0,0]=3 4244 B16R1.4547 CC(C)OCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000709892 [0,2,0,0,0,0|2,0,0]=4 4245 B16R1.4547 CC(C)OCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000709892 [0,2,0,0,0,0|2,0,0]=4 4246 B16R1.4547 CC(O)CCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100012276601 [0,2,0,0,0,0|2,0,0]=4 4247 B16R1.4547 CC(O)CCN(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100012276601 [0,2,0,0,0,0|1,0,0]=3 4248 B16R1.4547 CC(O)CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100012276601 [0,2,0,0,0,0|1,0,0]=3 4249 B16R1.4547 CN(C)CCN(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000755713 [0,2,0,0,0,0|2,0,0]=4 4250 B16R1.4547 CN(CCC(=O)N)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000744528 [0,2,0,0,0,0|0,0,1]=3 4251 B16R1.4547 CN(CCC(=O)N)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000744528 [0,2,0,0,0,0|0,0,1]=3 4252 B16R1.4578 CC(CC#N)N(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100009813641 [0,2,0,0,0,0|0,0,2]=4 4253 B16R1.4578 CC(CC#N)N(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100009813641 [0,2,0,0,0,0|0,0,2]=4 4254 B16R1.4578 CC(CCO)C(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100009893172 [0,2,0,0,0,0|2,0,0]=4 4255 B16R1.4578 CC(CCO)N(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100009893172 [0,2,0,0,0,0|1,0,0]=3 4256 B16R1.4578 CC(CCO)N(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100009893172 [0,2,0,0,0,0|1,0,0]=3 4257 B16R1.4578 CCCC(C)C(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000766640 [0,2,0,0,0,0|2,0,0]=4 4258 B16R1.4578 CCCC(C)N(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000766640 [0,2,0,0,0,0|1,0,0]=3 4259 B16R1.4578 CCCC(C)N(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000766640 [0,2,0,0,0,0|1,0,0]=3 4260 B16R1.4578 COCC(C)N(C)c1ccccc1[N+](=O)[O-] 2230a_100000156515_100000765312 [0,2,0,0,0,0|2,0,0]=4 4261 B16R1.4578 COCC(C)N(C)c1ccccc1[N+](=O)[O-] 269982a_100000156515_100000765312 [0,2,0,0,0,0|2,0,0]=4 4262 B16R1.2220 CC(CCO)Nc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100009893172 [0,2,0,0,0,0|1,0,0]=3 4263 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100009893172 [0,2,0,0,0,0|2,0,0]=4 4264 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100009893172 [0,2,0,0,0,0|2,0,0]=4 4265 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100009893172 [0,2,0,0,0,0|2,0,0]=4 4266 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100009893172 [0,2,0,0,0,0|2,0,0]=4 4267 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100009893172 [0,2,0,0,0,0|2,0,0]=4 4268 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100009893172 [0,2,0,0,0,0|2,0,0]=4 4269 B16R1.2220 CC(CCO)Oc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100009893172 [0,2,0,0,0,0|2,0,0]=4 4270 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])C 11a_100011424894_100000211992 [0,2,0,0,0,0|1,0,1]=4 4271 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])Cl 11a_100011934165_100000211992 [0,2,0,0,0,0|1,0,1]=4 4272 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])Cl 1626a_100011934165_100000211992 [0,2,0,0,0,0|1,0,1]=4 4273 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])F 11a_100011219493_100000211992 [0,2,0,0,0,0|1,0,1]=4 4274 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])F 1626a_100011219493_100000211992 [0,2,0,0,0,0|1,0,1]=4 4275 B16R1.2220 CCCC(=O)Nc1cccc(c1[N+](=O)[O-])I 1626a_100010150234_100000211992 [0,2,0,0,0,0|1,0,1]=4 4276 B16R1.2220 CCCC(C)Nc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000766640 [0,2,0,0,0,0|1,0,0]=3 4277 B16R1.2220 CCCC(C)Nc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000766640 [0,2,0,0,0,0|1,0,0]=3 4278 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000766640 [0,2,0,0,0,0|2,0,0]=4 4279 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000766640 [0,2,0,0,0,0|2,0,0]=4 4280 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000766640 [0,2,0,0,0,0|2,0,0]=4 4281 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000766640 [0,2,0,0,0,0|2,0,0]=4 4282 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000766640 [0,2,0,0,0,0|2,0,0]=4 4283 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000766640 [0,2,0,0,0,0|2,0,0]=4 4284 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000766640 [0,2,0,0,0,0|2,0,0]=4 4285 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000766640 [0,2,0,0,0,0|2,0,0]=4 4286 B16R1.2220 CCCC(C)Oc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000766640 [0,2,0,0,0,0|2,0,0]=4 4287 B16R1.2220 COCC(C)Nc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000765312 [0,2,0,0,0,0|2,0,0]=4 4288 B16R1.2220 COCC(C)Nc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000765312 [0,2,0,0,0,0|2,0,0]=4 4289 B16R1.2220 Cc1cccc(c1[N+](=O)[O-])NC(C)CCO 34a_100011424894_100009893172 [0,2,0,0,0,0|1,0,0]=3 4290 B16R1.2220 Cc1cccc(c1[N+](=O)[O-])OC(C)CCO 34a_100000740142_100009893172 [0,2,0,0,0,0|2,0,0]=4 4291 B16R1.2220 Cc1cccc(c1[N+](=O)[O-])OC(C)CCO 7a_100000740142_100009893172 [0,2,0,0,0,0|2,0,0]=4 4292 B16R1.2227 CC(CCO)Nc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100009893172 [0,2,0,0,0,0|1,0,0]=3 4293 B16R1.2227 CC(CCO)Oc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100009893172 [0,2,0,0,0,0|2,0,0]=4 4294 B16R1.2227 CC(CCO)Oc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100009893172 [0,2,0,0,0,0|2,0,0]=4 4295 B16R1.2227 CC(CCO)Oc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100009893172 [0,2,0,0,0,0|2,0,0]=4 4296 B16R1.2227 CC(CCO)Oc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100009893172 [0,2,0,0,0,0|2,0,0]=4 4297 B16R1.2227 CCCC(C)Nc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000766640 [0,2,0,0,0,0|1,0,0]=3 4298 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000766640 [0,2,0,0,0,0|2,0,0]=4 4299 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000766640 [0,2,0,0,0,0|2,0,0]=4 4300 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000766640 [0,2,0,0,0,0|2,0,0]=4 4301 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000766640 [0,2,0,0,0,0|2,0,0]=4 4302 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000766640 [0,2,0,0,0,0|2,0,0]=4 4303 B16R1.2227 CCCC(C)Oc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000766640 [0,2,0,0,0,0|2,0,0]=4 4304 B16R1.2227 COCC(C)Nc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000765312 [0,2,0,0,0,0|2,0,0]=4 4305 B16R1.2227 Cc1cccc(c1OC(C)CCO)[N+](=O)[O-] 34a_100000763257_100009893172 [0,2,0,0,0,0|2,0,0]=4 4306 B16R1.2227 Cc1cccc(c1OC(C)CCO)[N+](=O)[O-] 7a_100000763257_100009893172 [0,2,0,0,0,0|2,0,0]=4 4307 B16R1.5362 CCCC(CC)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100011219200 [0,2,0,0,0,0|2,0,0]=4 4308 B16R1.12463 CC(C)CC(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100000731052 [0,2,0,0,0,0|2,0,0]=4 4309 B16R1.12463 CC(C)CC(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000731052 [0,2,0,0,0,0|2,0,0]=4 4310 B16R1.4653 COc1cccc(c1COCCN)[N+](=O)[O-] 34a_100000210304_100010109836 [0,2,0,0,0,0|2,0,0]=4 4311 B16R1.8797 C=C(C)CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000730704 [0,2,0,0,0,0|1,0,1]=4 4312 B16R1.8797 CC(C)CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000210312 [0,2,0,0,0,0|1,0,0]=3 4313 B16R1.8797 CC(C)CCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000210312 [0,2,0,0,0,0|2,0,0]=4 4314 B16R1.8797 CC(C)CCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000210312 [0,2,0,0,0,0|2,0,0]=4 4315 B16R1.8797 CC(C)CCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000210626 [0,2,0,0,0,0|2,0,0]=4 4316 B16R1.8797 CC(C)CCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000210312 [0,2,0,0,0,0|2,0,0]=4 4317 B16R1.8797 CC(C)OCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000709892 [0,2,0,0,0,0|2,0,0]=4 4318 B16R1.8797 CC(O)CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100012276601 [0,2,0,0,0,0|1,0,0]=3 4319 B16R1.8797 CC(O)CCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100012276601 [0,2,0,0,0,0|2,0,0]=4 4320 B16R1.8797 CC(O)CCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100012276601 [0,2,0,0,0,0|2,0,0]=4 4321 B16R1.8797 CC(O)CCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100012276601 [0,2,0,0,0,0|2,0,0]=4 4322 B16R1.8797 CC(O)CCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100012276601 [0,2,0,0,0,0|2,0,0]=4 4323 B16R1.8797 C[C@@H](N)COCc1c(cccc1[N+](=O)[O-])Br 34a_100000737577_100011273477 [0,2,0,0,0,0|2,0,0]=4 4324 B16R1.8797 C[C@@H](N)COCc1c(cccc1[N+](=O)[O-])Cl 34a_100000737577_100000753779 [0,2,0,0,0,0|2,0,0]=4 4325 B16R1.8797 C[C@@H](N)COCc1c(cccc1[N+](=O)[O-])F 34a_100000737577_100000751461 [0,2,0,0,0,0|2,0,0]=4 4326 B16R1.8797 Cc1cccc(c1COC[C@@H](C)N)[N+](=O)[O-] 34a_100000737577_100010254497 [0,2,0,0,0,0|2,0,0]=4 4327 B16R1.8797 Cc1cccc(c1OCCC(=O)N)[N+](=O)[O-] 34a_100000763257_100000731001 [0,2,0,0,0,0|1,0,1]=4 4328 B16R1.8797 Cc1cccc(c1OCCC(=O)N)[N+](=O)[O-] 7a_100000763257_100000744528 [0,2,0,0,0,0|1,0,1]=4 4329 B16R1.8797 Cc1cccc(c1OCCC(C)C)[N+](=O)[O-] 34a_100000763257_100000210312 [0,2,0,0,0,0|2,0,0]=4 4330 B16R1.8797 Cc1cccc(c1OCCC(C)C)[N+](=O)[O-] 7a_100000763257_100000210626 [0,2,0,0,0,0|2,0,0]=4 4331 B16R1.8797 Cc1cccc(c1OCCC(C)O)[N+](=O)[O-] 34a_100000763257_100012276601 [0,2,0,0,0,0|2,0,0]=4 4332 B16R1.8797 Cc1cccc(c1OCCC(C)O)[N+](=O)[O-] 7a_100000763257_100012276601 [0,2,0,0,0,0|2,0,0]=4 4333 B16R1.8797 NC(=O)CCNc1c(cccc1[N+](=O)[O-])F 34a_100000687224_100000731001 [0,2,0,0,0,0|0,0,1]=3 4334 B16R1.8797 NC(=O)CCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000731001 [0,2,0,0,0,0|1,0,1]=4 4335 B16R1.8797 NC(=O)CCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000731001 [0,2,0,0,0,0|1,0,1]=4 4336 B16R1.8797 NC(=O)CCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000744528 [0,2,0,0,0,0|1,0,1]=4 4337 B16R1.8797 NC(=O)CCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000731001 [0,2,0,0,0,0|1,0,1]=4 4338 B16R1.24844 CCCCOc1c(ccc(c1[N+](=O)[O-])C)C 34a_200009857858_100000210210 [0,2,0,0,0,0|2,0,0]=4 4339 B16R1.24844 CCCCOc1c(ccc(c1[N+](=O)[O-])C)C 7a_200009857858_100000210211 [0,2,0,0,0,0|2,0,0]=4 4340 B16R1.24844 CCCCOc1c(ccc(c1[N+](=O)[O-])F)F 34a_200010339200_100000210210 [0,2,0,0,0,0|2,0,0]=4 4341 B16R1.24844 Cc1ccc(c(c1OCCCF)[N+](=O)[O-])C 34a_200009857858_100011934791 [0,2,0,0,0,0|2,0,0]=4 4342 B16R1.24844 Cc1ccc(c(c1OCCCF)[N+](=O)[O-])C 7a_200009857858_100011934791 [0,2,0,0,0,0|2,0,0]=4 4343 B16R1.24844 Cc1ccc(c(c1OCCCO)[N+](=O)[O-])C 34a_200009857858_100000230001 [0,2,0,0,0,0|2,0,0]=4 4344 B16R1.24844 Cc1ccc(c(c1OCCCO)[N+](=O)[O-])C 7a_200009857858_100011215043 [0,2,0,0,0,0|2,0,0]=4 4345 B16R1.24844 O=[N+]([O-])c1c(ccc(c1OCCCF)F)F 34a_200010339200_100011934791 [0,2,0,0,0,0|2,0,0]=4 4346 B16R1.24844 O=[N+]([O-])c1c(ccc(c1OCCCO)F)F 34a_200010339200_100000230001 [0,2,0,0,0,0|2,0,0]=4 4347 B16R1.11222 C=C(C)CCNc1cccc(c1[N+](=O)[O-])C 34a_100011424894_100000730704 [0,2,0,0,0,0|1,0,1]=4 4348 B16R1.11222 C=C(C)CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000730704 [0,2,0,0,0,0|1,0,1]=4 4349 B16R1.11222 CC(C)CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000210312 [0,2,0,0,0,0|1,0,0]=3 4350 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000210312 [0,2,0,0,0,0|2,0,0]=4 4351 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000210626 [0,2,0,0,0,0|2,0,0]=4 4352 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000210312 [0,2,0,0,0,0|2,0,0]=4 4353 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000210626 [0,2,0,0,0,0|2,0,0]=4 4354 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000210312 [0,2,0,0,0,0|2,0,0]=4 4355 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000210626 [0,2,0,0,0,0|2,0,0]=4 4356 B16R1.11222 CC(C)CCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000210626 [0,2,0,0,0,0|2,0,0]=4 4357 B16R1.11222 CC(C)OCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000709892 [0,2,0,0,0,0|2,0,0]=4 4358 B16R1.11222 CC(O)CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100012276601 [0,2,0,0,0,0|1,0,0]=3 4359 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100012276601 [0,2,0,0,0,0|2,0,0]=4 4360 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100012276601 [0,2,0,0,0,0|2,0,0]=4 4361 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100012276601 [0,2,0,0,0,0|2,0,0]=4 4362 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100012276601 [0,2,0,0,0,0|2,0,0]=4 4363 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100012276601 [0,2,0,0,0,0|2,0,0]=4 4364 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100012276601 [0,2,0,0,0,0|2,0,0]=4 4365 B16R1.11222 CC(O)CCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100012276601 [0,2,0,0,0,0|2,0,0]=4 4366 B16R1.11222 C[C@@H](N)COCc1cccc(c1[N+](=O)[O-])Br 34a_100000737577_100010145487 [0,2,0,0,0,0|2,0,0]=4 4367 B16R1.11222 C[C@@H](N)COCc1cccc(c1[N+](=O)[O-])Cl 34a_100000737577_100009990124 [0,2,0,0,0,0|2,0,0]=4 4368 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])COC[C@@H](C)N 34a_100000737577_100010188692 [0,2,0,0,0,0|2,0,0]=4 4369 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])NCCC(=O)N 34a_100011424894_100000731001 [0,2,0,0,0,0|0,0,1]=3 4370 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])NCCC(C)C 34a_100011424894_100000210312 [0,2,0,0,0,0|1,0,0]=3 4371 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])NCCC(C)O 34a_100011424894_100012276601 [0,2,0,0,0,0|1,0,0]=3 4372 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])NCOC(C)C 34a_100011424894_100000709892 [0,2,0,0,0,0|2,0,0]=4 4373 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(=O)N 34a_100000740142_100000731001 [0,2,0,0,0,0|1,0,1]=4 4374 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(=O)N 7a_100000740142_100000744528 [0,2,0,0,0,0|1,0,1]=4 4375 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(C)C 34a_100000740142_100000210312 [0,2,0,0,0,0|2,0,0]=4 4376 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(C)C 7a_100000740142_100000210626 [0,2,0,0,0,0|2,0,0]=4 4377 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(C)O 34a_100000740142_100012276601 [0,2,0,0,0,0|2,0,0]=4 4378 B16R1.11222 Cc1cccc(c1[N+](=O)[O-])OCCC(C)O 7a_100000740142_100012276601 [0,2,0,0,0,0|2,0,0]=4 4379 B16R1.11222 NC(=O)CCNc1cccc(c1[N+](=O)[O-])F 34a_100011219493_100000731001 [0,2,0,0,0,0|0,0,1]=3 4380 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000731001 [0,2,0,0,0,0|1,0,1]=4 4381 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000744528 [0,2,0,0,0,0|1,0,1]=4 4382 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000731001 [0,2,0,0,0,0|1,0,1]=4 4383 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000744528 [0,2,0,0,0,0|1,0,1]=4 4384 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000731001 [0,2,0,0,0,0|1,0,1]=4 4385 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000744528 [0,2,0,0,0,0|1,0,1]=4 4386 B16R1.11222 NC(=O)CCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000744528 [0,2,0,0,0,0|1,0,1]=4 4387 B16R1.60098 CCCCOc1cccc(c1[N+](=O)[O-])C#N 7a_100012000399_100000210211 [0,2,0,0,0,0|2,0,0]=4 4388 B16R1.60098 CCCCOc1cccc(c1[N+](=O)[O-])CO 7a_100000099161_100000210211 [0,2,0,0,0,0|2,0,0]=4 4389 B16R1.60098 CCCCOc1cccc(c1[N+](=O)[O-])OC 34a_200012185171_100000210210 [0,2,0,0,0,0|2,0,0]=4 4390 B16R1.60098 CCCCOc1cccc(c1[N+](=O)[O-])OC 7a_200012185171_100000210211 [0,2,0,0,0,0|2,0,0]=4 4391 B16R1.60098 COc1cccc(c1[N+](=O)[O-])OCCCF 34a_200012185171_100011934791 [0,2,0,0,0,0|2,0,0]=4 4392 B16R1.60098 COc1cccc(c1[N+](=O)[O-])OCCCF 7a_200012185171_100011934791 [0,2,0,0,0,0|2,0,0]=4 4393 B16R1.60098 COc1cccc(c1[N+](=O)[O-])OCCCO 34a_200012185171_100000230001 [0,2,0,0,0,0|2,0,0]=4 4394 B16R1.60098 COc1cccc(c1[N+](=O)[O-])OCCCO 7a_200012185171_100011215043 [0,2,0,0,0,0|2,0,0]=4 4395 B16R1.60098 N#Cc1cccc(c1[N+](=O)[O-])OCCCF 7a_100012000399_100011934791 [0,2,0,0,0,0|2,0,0]=4 4396 B16R1.60098 N#Cc1cccc(c1[N+](=O)[O-])OCCCO 7a_100012000399_100011215043 [0,2,0,0,0,0|2,0,0]=4 4397 B16R1.60098 O=[N+]([O-])c1c(cccc1OCCCF)CO 7a_100000099161_100011934791 [0,2,0,0,0,0|2,0,0]=4 4398 B16R1.60098 O=[N+]([O-])c1c(cccc1OCCCO)CO 7a_100000099161_100011215043 [0,2,0,0,0,0|2,0,0]=4 4399 B16R1.12214 CC(C)(C)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000755188 [0,2,0,0,0,0|2,0,0]=4 4400 B16R1.12214 CC(C)(C)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000755188 [0,2,0,0,0,0|2,0,0]=4 4401 B16R1.12214 CC(C)(O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000702414 [0,2,0,0,0,0|2,0,0]=4 4402 B16R1.12214 CC(C)(O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000702414 [0,2,0,0,0,0|2,0,0]=4 4403 B16R1.12214 O=[N+]([O-])c1ccccc1OCCC(F)(F)F 34a_100000186319_100011219754 [0,2,0,0,0,0|2,0,0]=4 4404 B16R1.12214 O=[N+]([O-])c1ccccc1OCCC(F)(F)F 7a_100000186319_100011219754 [0,2,0,0,0,0|2,0,0]=4 4405 B14R2.9513 NC(=O)c1ccccc1NC2CC2 34a_100000185089_100000211595 [1,0,0,1,0,0|2,0,0]=4 4406 B14R2.9513 O=[N+]([O-])c1ccccc1OC2CC2 34a_100000186319_100000211595 [1,0,0,1,0,0|1,0,0]=3 4407 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCCC2 2230a_100000188435_100000181388 [0,1,0,1,0,0|1,0,0]=3 4408 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCCC2 269982a_100000188435_100000181388 [0,1,0,1,0,0|1,0,0]=3 4409 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCCC2 270004a_100000188435_100000186027 [0,1,0,1,0,0|1,0,0]=3 4410 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCSC2 2230a_100011215254_100000181388 [0,1,0,1,0,0|2,0,0]=4 4411 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCSC2 269982a_100011215254_100000181388 [0,1,0,1,0,0|2,0,0]=4 4412 B16R2.498 O=[N+]([O-])c1ccccc1CN2CCSC2 270004a_100011215254_100000186027 [0,1,0,1,0,0|2,0,0]=4 4413 B16R2.498 O=[N+]([O-])c1ccccc1OC2CCCC2 34a_100000186319_100000179811 [0,1,0,1,0,0|2,0,0]=4 4414 B16R2.498 O=[N+]([O-])c1ccccc1OC2CCCC2 7a_100000186319_100000179811 [0,1,0,1,0,0|2,0,0]=4 4415 B16R2.498 O=[N+]([O-])c1ccccc1OC2CCOC2 34a_100000186319_100000690089 [0,1,0,1,0,0|2,0,0]=4 4416 B16R2.498 O=[N+]([O-])c1ccccc1OC2CCOC2 7a_100000186319_100000731011 [0,1,0,1,0,0|2,0,0]=4 4417 B16R2.3244 O=[N+]([O-])c1ccccc1CN[C@@H]2C[C@@H]2F 2230a_100015190264_100000181388 [0,1,0,1,0,0|1,0,0]=3 4418 B16R2.3244 O=[N+]([O-])c1ccccc1CN[C@@H]2C[C@H]2F 2230a_100025746932_100000181388 [0,1,0,1,0,0|1,0,0]=3 4419 B16R2.3244 O=[N+]([O-])c1ccccc1CN[C@@H]2C[C@H]2F 34a_100025746932_100000181388 [0,1,0,1,0,0|1,0,0]=3 4420 B16R2.3924 CC1CCN1Cc2ccccc2[N+](=O)[O-] 269982a_100000755817_100000181388 [0,1,0,1,0,0|1,0,0]=3 4421 B16R2.3924 CC1CCN1Cc2ccccc2[N+](=O)[O-] 34a_100000755817_100000181388 [0,1,0,1,0,0|1,0,0]=3 4422 B16R2.3924 O=C1CCC1Oc2ccccc2[N+](=O)[O-] 34a_100000186319_100009892977 [0,1,0,1,0,0|2,0,0]=4 4423 B16R2.3924 O=C1CCC1Oc2ccccc2[N+](=O)[O-] 7a_100000186319_100009892977 [0,1,0,1,0,0|2,0,0]=4 4424 B16R2.27522 O=[N+]([O-])c1ccccc1CCNC2CC2 34a_100000212008_200011934512 [0,1,0,1,0,0|2,0,0]=4 4425 B16R2.27522 O=[N+]([O-])c1ccccc1CCOC2CC2 34a_100000749287_100000211595 [0,1,0,1,0,0|2,0,0]=4 4426 B16R2.27522 O=[N+]([O-])c1ccccc1CNCC2CC2 2230a_100000735609_100000181388 [0,1,0,1,0,0|1,0,0]=3 4427 B16R2.27522 O=[N+]([O-])c1ccccc1CNCC2CC2 269862a_100000740939_100000741477 [0,1,0,1,0,0|1,0,0]=3 4428 B16R2.27522 O=[N+]([O-])c1ccccc1CNCC2CC2 270004a_100000735609_100000186027 [0,1,0,1,0,0|1,0,0]=3 4429 B16R2.27522 O=[N+]([O-])c1ccccc1CNCC2CC2 34a_100000735609_100000181388 [0,1,0,1,0,0|1,0,0]=3 4430 B16R2.27522 O=[N+]([O-])c1ccccc1COCC2CC2 34a_100000211283_100000181388 [0,1,0,1,0,0|2,0,0]=4 4431 B16R2.27522 O=[N+]([O-])c1ccccc1COCC2CC2 7a_100011218404_100000742324 [0,1,0,1,0,0|2,0,0]=4 4432 B16R2.27522 O=[N+]([O-])c1ccccc1COCC2CO2 7a_100011218404_102125554688 [0,1,0,1,0,0|2,0,0]=4 4433 B16R2.27522 O=[N+]([O-])c1ccccc1COCC2CS2 7a_100011218404_100000031435 [0,1,0,1,0,0|2,0,0]=4 4434 B16R2.27522 O=[N+]([O-])c1ccccc1COC[C@@H]2CO2 34a_100000757423_100000181388 [0,1,0,1,0,0|2,0,0]=4 4435 B16R2.27522 O=[N+]([O-])c1ccccc1COC[C@@H]2CO2 7a_100011218404_100000745022 [0,1,0,1,0,0|2,0,0]=4 4436 B16R2.27522 O=[N+]([O-])c1ccccc1CSCC2CC2 62a_100000756562_100000181388 [0,1,0,1,0,0|2,0,0]=4 4437 B16R2.27522 O=[N+]([O-])c1ccccc1CSCC2CO2 62a_102125554688_100000181388 [0,1,0,1,0,0|2,0,0]=4 4438 B16R2.27522 O=[N+]([O-])c1ccccc1CSCC2CS2 62a_100000031435_100000181388 [0,1,0,1,0,0|2,0,0]=4 4439 B16R2.27522 O=[N+]([O-])c1ccccc1CSC[C@@H]2CO2 62a_100000745022_100000181388 [0,1,0,1,0,0|2,0,0]=4 4440 B16R2.27522 O=[N+]([O-])c1ccccc1NN=CC2CC2 4a_100000737275_100000741477 [0,1,0,1,0,0|1,0,1]=4 4441 B16R2.27522 O=[N+]([O-])c1ccccc1OCCC2CC2 34a_100000186319_100000694398 [0,1,0,1,0,0|2,0,0]=4 4442 B16R2.27522 O=[N+]([O-])c1ccccc1OCCC2CC2 7a_100000186319_100000764125 [0,1,0,1,0,0|2,0,0]=4 4443 B16R2.27522 O=[N+]([O-])c1ccccc1OCCC2CO2 34a_100000186319_100000732470 [0,1,0,1,0,0|2,0,0]=4 4444 B16R2.27522 O=[N+]([O-])c1ccccc1OCCC2CO2 7a_100000186319_100000732470 [0,1,0,1,0,0|2,0,0]=4 4445 B16R2.27531 O=[N+]([O-])c1ccccc1CCN2CCC2 269982a_100000754969_200011934512 [0,1,0,1,0,0|2,0,0]=4 4446 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2CCC2 2230a_100000749019_100000181388 [0,1,0,1,0,0|1,0,0]=3 4447 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2CCC2 270004a_100000740939_100000241760 [0,1,0,1,0,0|1,0,0]=3 4448 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2CCC2 34a_100000749019_100000181388 [0,1,0,1,0,0|1,0,0]=3 4449 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2COC2 2230a_100016991112_100000181388 [0,1,0,1,0,0|2,0,0]=4 4450 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2COC2 270004a_100016991112_100000186027 [0,1,0,1,0,0|2,0,0]=4 4451 B16R2.27531 O=[N+]([O-])c1ccccc1CNC2CSC2 270004a_100016994217_100000186027 [0,1,0,1,0,0|2,0,0]=4 4452 B16R2.27531 O=[N+]([O-])c1ccccc1COC2CCC2 34a_100000748187_100000181388 [0,1,0,1,0,0|2,0,0]=4 4453 B16R2.27531 O=[N+]([O-])c1ccccc1NN=C2CCC2 4a_100000737275_100000241760 [0,1,0,1,0,0|1,0,1]=4 4454 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2CCC2 34a_100000186319_100000763275 [0,1,0,1,0,0|2,0,0]=4 4455 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2CCC2 7a_100000186319_100000763275 [0,1,0,1,0,0|2,0,0]=4 4456 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2CCO2 34a_100000186319_100000103362 [0,1,0,1,0,0|2,0,0]=4 4457 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2CCO2 7a_100000186319_100000103362 [0,1,0,1,0,0|2,0,0]=4 4458 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2COC2 34a_100000186319_100010264016 [0,1,0,1,0,0|2,0,0]=4 4459 B16R2.27531 O=[N+]([O-])c1ccccc1OCC2COC2 7a_100000186319_100010264016 [0,1,0,1,0,0|2,0,0]=4 4460 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CC2 34a_100000195567_100000742324 [0,1,0,1,0,0|2,0,0]=4 4461 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CC2 7a_100000195567_100000742324 [0,1,0,1,0,0|2,0,0]=4 4462 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CO2 34a_100000195567_102125554688 [0,1,0,1,0,0|2,0,0]=4 4463 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CO2 7a_100000195567_102125554688 [0,1,0,1,0,0|2,0,0]=4 4464 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CS2 7a_100000195567_100000031435 [0,1,0,1,0,0|2,0,0]=4 4465 B16R2.138130 Cc1ccc(c(c1)[N+](=O)[O-])OC[C@@H]2CO2 7a_100000195567_100000745022 [0,1,0,1,0,0|2,0,0]=4 4466 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CC2 34a_100000032192_100000742324 [0,1,0,1,0,0|2,0,0]=4 4467 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CC2 7a_100000032192_100000742324 [0,1,0,1,0,0|2,0,0]=4 4468 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CO2 34a_100000032192_102125554688 [0,1,0,1,0,0|2,0,0]=4 4469 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CO2 7a_100000032192_102125554688 [0,1,0,1,0,0|2,0,0]=4 4470 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CS2 7a_100000032192_100000031435 [0,1,0,1,0,0|2,0,0]=4 4471 B16R2.138130 Nc1ccc(c(c1)[N+](=O)[O-])OC[C@@H]2CO2 7a_100000032192_100000745022 [0,1,0,1,0,0|2,0,0]=4 4472 B16R2.138130 O=[N+]([O-])c1cc(ccc1NCC2CC2)F 34a_100000187532_100000742324 [0,1,0,1,0,0|1,0,0]=3 4473 B16R2.138130 O=[N+]([O-])c1cc(ccc1NCC2CO2)F 34a_100000187532_102125554688 [0,1,0,1,0,0|1,0,0]=3 4474 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)Br 34a_100000757407_100000742324 [0,1,0,1,0,0|2,0,0]=4 4475 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)Br 7a_100000757407_100000742324 [0,1,0,1,0,0|2,0,0]=4 4476 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)Cl 34a_100000212152_100000742324 [0,1,0,1,0,0|2,0,0]=4 4477 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)Cl 7a_100000212152_100000742324 [0,1,0,1,0,0|2,0,0]=4 4478 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)F 34a_100000748789_100000742324 [0,1,0,1,0,0|2,0,0]=4 4479 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)F 7a_100000748789_100000742324 [0,1,0,1,0,0|2,0,0]=4 4480 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CC2)I 7a_100000698543_100000742324 [0,1,0,1,0,0|2,0,0]=4 4481 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)Br 34a_100000757407_102125554688 [0,1,0,1,0,0|2,0,0]=4 4482 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)Br 7a_100000757407_102125554688 [0,1,0,1,0,0|2,0,0]=4 4483 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)Cl 34a_100000212152_102125554688 [0,1,0,1,0,0|2,0,0]=4 4484 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)Cl 7a_100000212152_102125554688 [0,1,0,1,0,0|2,0,0]=4 4485 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)F 34a_100000748789_102125554688 [0,1,0,1,0,0|2,0,0]=4 4486 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)F 7a_100000748789_102125554688 [0,1,0,1,0,0|2,0,0]=4 4487 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CO2)I 7a_100000698543_102125554688 [0,1,0,1,0,0|2,0,0]=4 4488 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CS2)Br 7a_100000757407_100000031435 [0,1,0,1,0,0|2,0,0]=4 4489 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CS2)Cl 7a_100000212152_100000031435 [0,1,0,1,0,0|2,0,0]=4 4490 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CS2)F 7a_100000748789_100000031435 [0,1,0,1,0,0|2,0,0]=4 4491 B16R2.138130 O=[N+]([O-])c1cc(ccc1OCC2CS2)I 7a_100000698543_100000031435 [0,1,0,1,0,0|2,0,0]=4 4492 B16R2.138130 O=[N+]([O-])c1cc(ccc1OC[C@@H]2CO2)Br 7a_100000757407_100000745022 [0,1,0,1,0,0|2,0,0]=4 4493 B16R2.138130 O=[N+]([O-])c1cc(ccc1OC[C@@H]2CO2)Cl 7a_100000212152_100000745022 [0,1,0,1,0,0|2,0,0]=4 4494 B16R2.138130 O=[N+]([O-])c1cc(ccc1OC[C@@H]2CO2)F 7a_100000748789_100000745022 [0,1,0,1,0,0|2,0,0]=4 4495 B16R2.138130 O=[N+]([O-])c1cc(ccc1OC[C@@H]2CO2)I 7a_100000698543_100000745022 [0,1,0,1,0,0|2,0,0]=4 4496 B16R2.138301 Cc1ccc(c(c1)[N+](=O)[O-])OC2CCC2 34a_100000195567_100000749161 [0,1,0,1,0,0|2,0,0]=4 4497 B16R2.138301 Nc1ccc(c(c1)[N+](=O)[O-])OC2CCC2 34a_100000032192_100000749161 [0,1,0,1,0,0|2,0,0]=4 4498 B16R2.138301 O=[N+]([O-])c1cc(ccc1NC2CCC2)F 34a_100000187532_100000749161 [0,1,0,1,0,0|1,0,0]=3 4499 B16R2.138301 O=[N+]([O-])c1cc(ccc1NC2COC2)F 34a_100000187532_100009818527 [0,1,0,1,0,0|2,0,0]=4 4500 B16R2.138301 O=[N+]([O-])c1cc(ccc1OC2CCC2)Br 34a_100000757407_100000749161 [0,1,0,1,0,0|2,0,0]=4 4501 B16R2.138301 O=[N+]([O-])c1cc(ccc1OC2CCC2)Cl 34a_100000212152_100000749161 [0,1,0,1,0,0|2,0,0]=4 4502 B16R2.138301 O=[N+]([O-])c1cc(ccc1OC2CCC2)F 34a_100000748789_100000749161 [0,1,0,1,0,0|2,0,0]=4 4503 B16R2.27462 CC1(CO1)COc2ccccc2[N+](=O)[O-] 34a_100000186319_100000760498 [0,1,0,1,0,0|2,0,0]=4 4504 B16R2.12625 Cc1ccc(c(c1)OCC2CC2)[N+](=O)[O-] 34a_100000195450_100000742324 [0,1,0,1,0,0|2,0,0]=4 4505 B16R2.12625 Cc1ccc(c(c1)OCC2CC2)[N+](=O)[O-] 7a_100000195450_100000742324 [0,1,0,1,0,0|2,0,0]=4 4506 B16R2.12625 Cc1ccc(c(c1)OCC2CO2)[N+](=O)[O-] 34a_100000195450_102125554688 [0,1,0,1,0,0|2,0,0]=4 4507 B16R2.12625 Cc1ccc(c(c1)OCC2CO2)[N+](=O)[O-] 7a_100000195450_102125554688 [0,1,0,1,0,0|2,0,0]=4 4508 B16R2.12625 Cc1ccc(c(c1)OCC2CS2)[N+](=O)[O-] 7a_100000195450_100000031435 [0,1,0,1,0,0|2,0,0]=4 4509 B16R2.12625 Cc1ccc(c(c1)OC[C@@H]2CO2)[N+](=O)[O-] 7a_100000195450_100000745022 [0,1,0,1,0,0|2,0,0]=4 4510 B16R2.12625 O=[N+]([O-])c1ccc(cc1NCC2CC2)F 34a_100000746377_100000742324 [0,1,0,1,0,0|1,0,0]=3 4511 B16R2.12625 O=[N+]([O-])c1ccc(cc1NCC2CO2)F 34a_100000746377_102125554688 [0,1,0,1,0,0|1,0,0]=3 4512 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)Br 7a_100011934350_100000742324 [0,1,0,1,0,0|2,0,0]=4 4513 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)Cl 34a_100000746067_100000742324 [0,1,0,1,0,0|2,0,0]=4 4514 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)Cl 7a_100000746067_100000742324 [0,1,0,1,0,0|2,0,0]=4 4515 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)F 34a_100000210785_100000742324 [0,1,0,1,0,0|2,0,0]=4 4516 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)F 7a_100000210785_100000742324 [0,1,0,1,0,0|2,0,0]=4 4517 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CC2)I 7a_100000072657_100000742324 [0,1,0,1,0,0|2,0,0]=4 4518 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)Br 7a_100011934350_102125554688 [0,1,0,1,0,0|2,0,0]=4 4519 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)Cl 34a_100000746067_102125554688 [0,1,0,1,0,0|2,0,0]=4 4520 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)Cl 7a_100000746067_102125554688 [0,1,0,1,0,0|2,0,0]=4 4521 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)F 34a_100000210785_102125554688 [0,1,0,1,0,0|2,0,0]=4 4522 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)F 7a_100000210785_102125554688 [0,1,0,1,0,0|2,0,0]=4 4523 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CO2)I 7a_100000072657_102125554688 [0,1,0,1,0,0|2,0,0]=4 4524 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CS2)Br 7a_100011934350_100000031435 [0,1,0,1,0,0|2,0,0]=4 4525 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CS2)Cl 7a_100000746067_100000031435 [0,1,0,1,0,0|2,0,0]=4 4526 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CS2)F 7a_100000210785_100000031435 [0,1,0,1,0,0|2,0,0]=4 4527 B16R2.12625 O=[N+]([O-])c1ccc(cc1OCC2CS2)I 7a_100000072657_100000031435 [0,1,0,1,0,0|2,0,0]=4 4528 B16R2.12625 O=[N+]([O-])c1ccc(cc1OC[C@@H]2CO2)Br 7a_100011934350_100000745022 [0,1,0,1,0,0|2,0,0]=4 4529 B16R2.12625 O=[N+]([O-])c1ccc(cc1OC[C@@H]2CO2)Cl 7a_100000746067_100000745022 [0,1,0,1,0,0|2,0,0]=4 4530 B16R2.12625 O=[N+]([O-])c1ccc(cc1OC[C@@H]2CO2)F 7a_100000210785_100000745022 [0,1,0,1,0,0|2,0,0]=4 4531 B16R2.12625 O=[N+]([O-])c1ccc(cc1OC[C@@H]2CO2)I 7a_100000072657_100000745022 [0,1,0,1,0,0|2,0,0]=4 4532 B16R2.84546 Cc1ccc(c(c1)OC2CCC2)[N+](=O)[O-] 34a_100000195450_100000749161 [0,1,0,1,0,0|2,0,0]=4 4533 B16R2.84546 O=[N+]([O-])c1ccc(cc1NC2CCC2)F 34a_100000746377_100000749161 [0,1,0,1,0,0|1,0,0]=3 4534 B16R2.84546 O=[N+]([O-])c1ccc(cc1NC2COC2)F 34a_100000746377_100009818527 [0,1,0,1,0,0|2,0,0]=4 4535 B16R2.84546 O=[N+]([O-])c1ccc(cc1OC2CCC2)Cl 34a_100000746067_100000749161 [0,1,0,1,0,0|2,0,0]=4 4536 B16R2.84546 O=[N+]([O-])c1ccc(cc1OC2CCC2)F 34a_100000210785_100000749161 [0,1,0,1,0,0|2,0,0]=4 4537 B16R2.27530 CN(CC1CC1)c2ccccc2[N+](=O)[O-] 2230a_100000156515_100000742324 [0,1,0,1,0,0|1,0,0]=3 4538 B16R2.27530 CN(CC1CC1)c2ccccc2[N+](=O)[O-] 269982a_100000156515_100000756562 [0,1,0,1,0,0|1,0,0]=3 4539 B16R2.27530 CN(CC1CO1)c2ccccc2[N+](=O)[O-] 2230a_100000156515_100011216344 [0,1,0,1,0,0|1,0,0]=3 4540 B16R2.27530 CN(CC1CO1)c2ccccc2[N+](=O)[O-] 269982a_100000156515_102125554688 [0,1,0,1,0,0|1,0,0]=3 4541 B16R2.27530 CN(CC1CS1)c2ccccc2[N+](=O)[O-] 269982a_100000156515_100000031435 [0,1,0,1,0,0|1,0,0]=3 4542 B16R2.27530 CN(C[C@@H]1CO1)c2ccccc2[N+](=O)[O-] 269982a_100000156515_100000745022 [0,1,0,1,0,0|1,0,0]=3 4543 B16R2.27530 O=C(CC1CC1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000742324 [0,1,0,1,0,0|2,0,0]=4 4544 B16R2.27530 O=C(CC1CO1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100011216344 [0,1,0,1,0,0|2,0,0]=4 4545 B16R2.27530 O=C(CC1CS1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000031435 [0,1,0,1,0,0|2,0,0]=4 4546 B16R2.27530 O=C(C[C@@H]1CO1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000745022 [0,1,0,1,0,0|2,0,0]=4 4547 B16R2.145832 CN(c1ccccc1[N+](=O)[O-])C2CCC2 269982a_100000156515_100000749161 [0,1,0,1,0,0|1,0,0]=3 4548 B16R2.145832 CN(c1ccccc1[N+](=O)[O-])C2COC2 269982a_100000156515_100000687716 [0,1,0,1,0,0|2,0,0]=4 4549 B16R2.145832 O=C(c1ccccc1[N+](=O)[O-])C2CCC2 1458a_100000188706_100000749161 [0,1,0,1,0,0|2,0,0]=4 4550 B16R2.25780 Cc1cccc(c1OCC2CC2)[N+](=O)[O-] 34a_100000763257_100000742324 [0,1,0,1,0,0|2,0,0]=4 4551 B16R2.25780 Cc1cccc(c1OCC2CC2)[N+](=O)[O-] 7a_100000763257_100000742324 [0,1,0,1,0,0|2,0,0]=4 4552 B16R2.25780 Cc1cccc(c1OCC2CO2)[N+](=O)[O-] 34a_100000763257_102125554688 [0,1,0,1,0,0|2,0,0]=4 4553 B16R2.25780 Cc1cccc(c1OCC2CO2)[N+](=O)[O-] 7a_100000763257_102125554688 [0,1,0,1,0,0|2,0,0]=4 4554 B16R2.25780 Cc1cccc(c1OCC2CS2)[N+](=O)[O-] 7a_100000763257_100000031435 [0,1,0,1,0,0|2,0,0]=4 4555 B16R2.25780 Cc1cccc(c1OC[C@@H]2CO2)[N+](=O)[O-] 7a_100000763257_100000745022 [0,1,0,1,0,0|2,0,0]=4 4556 B16R2.25780 O=[N+]([O-])c1cccc(c1NCC2CC2)F 34a_100000687224_100000742324 [0,1,0,1,0,0|1,0,0]=3 4557 B16R2.25780 O=[N+]([O-])c1cccc(c1NCC2CO2)F 34a_100000687224_102125554688 [0,1,0,1,0,0|1,0,0]=3 4558 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CC2)Br 34a_100000689966_100000742324 [0,1,0,1,0,0|2,0,0]=4 4559 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CC2)Cl 34a_100000686934_100000742324 [0,1,0,1,0,0|2,0,0]=4 4560 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CC2)Cl 7a_100000686934_100000742324 [0,1,0,1,0,0|2,0,0]=4 4561 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CC2)F 34a_100000690172_100000742324 [0,1,0,1,0,0|2,0,0]=4 4562 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CO2)Br 34a_100000689966_102125554688 [0,1,0,1,0,0|2,0,0]=4 4563 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CO2)Cl 34a_100000686934_102125554688 [0,1,0,1,0,0|2,0,0]=4 4564 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CO2)Cl 7a_100000686934_102125554688 [0,1,0,1,0,0|2,0,0]=4 4565 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CO2)F 34a_100000690172_102125554688 [0,1,0,1,0,0|2,0,0]=4 4566 B16R2.25780 O=[N+]([O-])c1cccc(c1OCC2CS2)Cl 7a_100000686934_100000031435 [0,1,0,1,0,0|2,0,0]=4 4567 B16R2.25780 O=[N+]([O-])c1cccc(c1OC[C@@H]2CO2)Cl 7a_100000686934_100000745022 [0,1,0,1,0,0|2,0,0]=4 4568 B16R2.136441 Cc1cccc(c1OC2CCC2)[N+](=O)[O-] 34a_100000763257_100000749161 [0,1,0,1,0,0|2,0,0]=4 4569 B16R2.136441 O=[N+]([O-])c1cccc(c1NC2CCC2)F 34a_100000687224_100000749161 [0,1,0,1,0,0|1,0,0]=3 4570 B16R2.136441 O=[N+]([O-])c1cccc(c1NC2COC2)F 34a_100000687224_100009818527 [0,1,0,1,0,0|2,0,0]=4 4571 B16R2.136441 O=[N+]([O-])c1cccc(c1OC2CCC2)Br 34a_100000689966_100000749161 [0,1,0,1,0,0|2,0,0]=4 4572 B16R2.136441 O=[N+]([O-])c1cccc(c1OC2CCC2)Cl 34a_100000686934_100000749161 [0,1,0,1,0,0|2,0,0]=4 4573 B16R2.136441 O=[N+]([O-])c1cccc(c1OC2CCC2)F 34a_100000690172_100000749161 [0,1,0,1,0,0|2,0,0]=4 4574 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])NCC2CC2 34a_100011424894_100000742324 [0,1,0,1,0,0|1,0,0]=3 4575 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])NCC2CO2 34a_100011424894_102125554688 [0,1,0,1,0,0|1,0,0]=3 4576 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OCC2CC2 34a_100000740142_100000742324 [0,1,0,1,0,0|2,0,0]=4 4577 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OCC2CC2 7a_100000740142_100000742324 [0,1,0,1,0,0|2,0,0]=4 4578 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OCC2CO2 34a_100000740142_102125554688 [0,1,0,1,0,0|2,0,0]=4 4579 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OCC2CO2 7a_100000740142_102125554688 [0,1,0,1,0,0|2,0,0]=4 4580 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OCC2CS2 7a_100000740142_100000031435 [0,1,0,1,0,0|2,0,0]=4 4581 B16R2.136422 Cc1cccc(c1[N+](=O)[O-])OC[C@@H]2CO2 7a_100000740142_100000745022 [0,1,0,1,0,0|2,0,0]=4 4582 B16R2.136422 O=[N+]([O-])c1c(cccc1NCC2CC2)F 34a_100011219493_100000742324 [0,1,0,1,0,0|1,0,0]=3 4583 B16R2.136422 O=[N+]([O-])c1c(cccc1NCC2CO2)F 34a_100011219493_102125554688 [0,1,0,1,0,0|1,0,0]=3 4584 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)Br 34a_100011934925_100000742324 [0,1,0,1,0,0|2,0,0]=4 4585 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)Br 7a_100011934925_100000742324 [0,1,0,1,0,0|2,0,0]=4 4586 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)Cl 34a_100011999376_100000742324 [0,1,0,1,0,0|2,0,0]=4 4587 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)Cl 7a_100011999376_100000742324 [0,1,0,1,0,0|2,0,0]=4 4588 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)F 34a_100011217962_100000742324 [0,1,0,1,0,0|2,0,0]=4 4589 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)F 7a_100011217962_100000742324 [0,1,0,1,0,0|2,0,0]=4 4590 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CC2)I 7a_100010150324_100000742324 [0,1,0,1,0,0|2,0,0]=4 4591 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)Br 34a_100011934925_102125554688 [0,1,0,1,0,0|2,0,0]=4 4592 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)Br 7a_100011934925_102125554688 [0,1,0,1,0,0|2,0,0]=4 4593 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)Cl 34a_100011999376_102125554688 [0,1,0,1,0,0|2,0,0]=4 4594 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)Cl 7a_100011999376_102125554688 [0,1,0,1,0,0|2,0,0]=4 4595 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)F 34a_100011217962_102125554688 [0,1,0,1,0,0|2,0,0]=4 4596 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)F 7a_100011217962_102125554688 [0,1,0,1,0,0|2,0,0]=4 4597 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CO2)I 7a_100010150324_102125554688 [0,1,0,1,0,0|2,0,0]=4 4598 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CS2)Br 7a_100011934925_100000031435 [0,1,0,1,0,0|2,0,0]=4 4599 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CS2)Cl 7a_100011999376_100000031435 [0,1,0,1,0,0|2,0,0]=4 4600 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CS2)F 7a_100011217962_100000031435 [0,1,0,1,0,0|2,0,0]=4 4601 B16R2.136422 O=[N+]([O-])c1c(cccc1OCC2CS2)I 7a_100010150324_100000031435 [0,1,0,1,0,0|2,0,0]=4 4602 B16R2.136422 O=[N+]([O-])c1c(cccc1OC[C@@H]2CO2)Br 7a_100011934925_100000745022 [0,1,0,1,0,0|2,0,0]=4 4603 B16R2.136422 O=[N+]([O-])c1c(cccc1OC[C@@H]2CO2)Cl 7a_100011999376_100000745022 [0,1,0,1,0,0|2,0,0]=4 4604 B16R2.136422 O=[N+]([O-])c1c(cccc1OC[C@@H]2CO2)F 7a_100011217962_100000745022 [0,1,0,1,0,0|2,0,0]=4 4605 B16R2.136422 O=[N+]([O-])c1c(cccc1OC[C@@H]2CO2)I 7a_100010150324_100000745022 [0,1,0,1,0,0|2,0,0]=4 4606 B16R2.136599 Cc1cccc(c1[N+](=O)[O-])NC2CCC2 34a_100011424894_100000749161 [0,1,0,1,0,0|1,0,0]=3 4607 B16R2.136599 Cc1cccc(c1[N+](=O)[O-])NC2COC2 34a_100011424894_100009818527 [0,1,0,1,0,0|2,0,0]=4 4608 B16R2.136599 Cc1cccc(c1[N+](=O)[O-])OC2CCC2 34a_100000740142_100000749161 [0,1,0,1,0,0|2,0,0]=4 4609 B16R2.136599 O=[N+]([O-])c1c(cccc1NC2CCC2)F 34a_100011219493_100000749161 [0,1,0,1,0,0|1,0,0]=3 4610 B16R2.136599 O=[N+]([O-])c1c(cccc1NC2COC2)F 34a_100011219493_100009818527 [0,1,0,1,0,0|2,0,0]=4 4611 B16R2.136599 O=[N+]([O-])c1c(cccc1OC2CCC2)Br 34a_100011934925_100000749161 [0,1,0,1,0,0|2,0,0]=4 4612 B16R2.136599 O=[N+]([O-])c1c(cccc1OC2CCC2)Cl 34a_100011999376_100000749161 [0,1,0,1,0,0|2,0,0]=4 4613 B16R2.136599 O=[N+]([O-])c1c(cccc1OC2CCC2)F 34a_100011217962_100000749161 [0,1,0,1,0,0|2,0,0]=4 4614 B14R1.899 C#CCCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000688953 [0,0,0,0,1,1|1,0,1]=4 4615 B14R1.899 C=CCCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000754431 [0,0,0,0,1,1|1,0,1]=4 4616 B14R1.899 CCCCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000210210 [0,0,0,0,1,1|1,0,0]=3 4617 B14R1.899 CCCCOc1cccc(c1)[N+](=O)[O-] 34a_100000185994_100000210210 [0,0,0,0,1,1|2,0,0]=4 4618 B14R1.899 CCCCOc1cccc(c1)[N+](=O)[O-] 7a_100000185994_100000210211 [0,0,0,0,1,1|2,0,0]=4 4619 B14R1.899 COCCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100011201679 [0,0,0,0,1,1|2,0,0]=4 4620 B14R1.899 CSCCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000212216 [0,0,0,0,1,1|2,0,0]=4 4621 B14R1.899 NCCOCc1cccc(c1)[N+](=O)[O-] 34a_100000210304_100000737091 [0,0,0,0,1,1|2,0,0]=4 4622 B14R1.899 O=[N+]([O-])c1cccc(c1)NCCCF 34a_100000184103_100011934791 [0,0,0,0,1,1|1,0,0]=3 4623 B14R1.899 O=[N+]([O-])c1cccc(c1)NCCCO 34a_100000184103_100000230001 [0,0,0,0,1,1|1,0,0]=3 4624 B14R1.899 O=[N+]([O-])c1cccc(c1)OCCCF 34a_100000185994_100011934791 [0,0,0,0,1,1|2,0,0]=4 4625 B14R1.899 O=[N+]([O-])c1cccc(c1)OCCCF 7a_100000185994_100011934791 [0,0,0,0,1,1|2,0,0]=4 4626 B14R1.899 O=[N+]([O-])c1cccc(c1)OCCCO 34a_100000185994_100000230001 [0,0,0,0,1,1|2,0,0]=4 4627 B14R1.899 O=[N+]([O-])c1cccc(c1)OCCCO 7a_100000185994_100011215043 [0,0,0,0,1,1|2,0,0]=4 4628 B16R1.1424 CCCCOc1ccccc1NC[N+](=O)[O-] 34a_100000743494_100000761209 [0,0,0,0,0,2|2,0,0]=4 4629 B16R1.1424 CCCCOc1ccccc1SC[N+](=O)[O-] 62a_100000230755_100000761209 [0,0,0,0,0,2|2,0,0]=4 4630 B16R1.1424 O=[N+]([O-])CSc1ccccc1CCCCO 62a_100012092669_100000761209 [0,0,0,0,0,2|2,0,0]=4