0 B21R1.4525285 CCN(CC)CC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C#N 6a_100000061448_100000177621 [1,0,0,0,0,0|1,0,1]=3 1 B23R1.51090702 CCC(C(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O)C(=O)N(CC)CC 1458a_100009843786_200011763339 [0,1,0,0,0,0|1,0,2]=4 2 B23R2.1025807 N#CC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C(=O)C2CCCC2 6a_100000061448_100000698645 [0,0,0,1,0,0|2,0,0]=3 3 B20R1.29598 CCN(CC)C(=O)C(=O)Cc1ccc(c(c1)[N+](=O)[O-])O 1458a_200000187824_100010149780 [2,0,0,0,0,0|1,0,1]=4 4 B20R1.29598 CCN(CC)C(=O)C(=O)Nc1ccc(c(c1)[N+](=O)[O-])O 22a_100000032192_200000187824 [2,0,0,0,0,0|2,0,0]=4 5 B20R1.29598 CCN(CC)C(=O)C(=O)Nc1ccc(c(c1)[N+](=O)[O-])O 527a_100000032192_200000187824 [2,0,0,0,0,0|2,0,0]=4 6 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])Br)C#N 6a_100011933973_100000177621 [2,0,0,0,0,0|1,0,1]=4 7 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])C)C#N 6a_100009866143_100000177621 [2,0,0,0,0,0|1,0,1]=4 8 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])Cl)C#N 6a_100000050399_100000177621 [2,0,0,0,0,0|1,0,1]=4 9 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])F)C#N 6a_100012002401_100000177621 [2,0,0,0,0,0|1,0,1]=4 10 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])I)C#N 6a_100000732959_100000177621 [2,0,0,0,0,0|1,0,1]=4 11 B20R1.29435 CCN(CC)CC(=Cc1cc(cc(c1)[N+](=O)[O-])O)C#N 6a_200009842276_100000177621 [2,0,0,0,0,0|0,0,1]=3 12 B20R1.521064 CC/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)N(CC)CC 11a_100000724800_200020681858 [2,0,0,0,0,0|1,0,1]=4 13 B20R1.521064 CC/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)N(CC)CC 1626a_100000724800_200020681858 [2,0,0,0,0,0|1,0,1]=4 14 B20R1.521064 CC/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)N(CC)CC 240690a_100000724800_200020681858 [2,0,0,0,0,0|1,0,1]=4 15 B20R1.29470 CCN(CC)CC(=Cc1ccc(c(c1)[N+](=O)[O-])F)C#N 6a_100000690874_100000177621 [2,0,0,0,0,0|1,0,1]=4 16 B20R1.866704 CC(C)C(=O)C(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C#N 6a_100000061448_100000737028 [2,0,0,0,0,0|2,0,0]=4 17 B22R1.8679433 CCN(CC)C(=O)C(C)C(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O 1458a_100009843786_100000735968 [1,1,0,0,0,0|0,0,2]=4 18 B22R1.8679433 CCN(CC)C(=O)C(F)C(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O 1458a_100009843786_200000034631 [1,1,0,0,0,0|1,0,1]=4 19 B22R2.412554 Cc1cc(cc(c1)[N+](=O)[O-])C=C(C#N)C(=O)C2CCCC2 6a_100009866143_100000698645 [1,0,0,1,0,0|2,0,0]=4 20 B22R2.412554 N#CC(=Cc1cc(cc(c1)[N+](=O)[O-])Br)C(=O)C2CCCC2 6a_100011933973_100000698645 [1,0,0,1,0,0|2,0,0]=4 21 B22R2.412554 N#CC(=Cc1cc(cc(c1)[N+](=O)[O-])Cl)C(=O)C2CCCC2 6a_100000050399_100000698645 [1,0,0,1,0,0|2,0,0]=4 22 B22R2.412554 N#CC(=Cc1cc(cc(c1)[N+](=O)[O-])F)C(=O)C2CCCC2 6a_100012002401_100000698645 [1,0,0,1,0,0|2,0,0]=4 23 B22R2.412554 N#CC(=Cc1cc(cc(c1)[N+](=O)[O-])I)C(=O)C2CCCC2 6a_100000732959_100000698645 [1,0,0,1,0,0|2,0,0]=4 24 B22R2.412554 N#CC(=Cc1cc(cc(c1)[N+](=O)[O-])O)C(=O)C2CCCC2 6a_200009842276_100000698645 [1,0,0,1,0,0|1,0,0]=3 25 B22R2.418837 N#CC(=Cc1ccc(c(c1)[N+](=O)[O-])F)C(=O)C2CCCC2 6a_100000690874_100000698645 [1,0,0,1,0,0|2,0,0]=4 26 B22R2.59301283 N#CC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C(=O)C2CCC2 6a_100000061448_100000748118 [1,0,0,1,0,0|2,0,0]=4 27 B24R2.2557207 N#CC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C(=O)NC2CCCC2 6a_100000061448_100000242653 [0,0,0,1,0,1|2,0,0]=4 28 B24R2.1362241 N#CC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C(=O)C2CCCCC2 6a_100000061448_100011245039 [0,1,0,1,0,0|2,0,0]=4 29 B22R1.10299998 CCN(CC)CCC(=Cc1cc(c(c(c1)[N+](=O)[O-])O)F)C#N 6a_100000061448_200000224628 [1,0,0,0,0,1|1,0,1]=4