aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32051 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1cc([N+](=O)[O-])cc(N)n1 |
|
AD32052 | 1.12 | 190.16 | C8H6O2N4 | Nc1ncc2cccc([N+](=O)[O-])c2n1 |
|
AD32053 | 1.18 | 196.19 | C6H4O2N4S | Nc1ncnc2sc([N+](=O)[O-])cc12 |
|
AD32054 | 0.96 | 196.16 | C8H8O4N2 | COC(=O)c1cc(N)cc([N+](=O)[O-])c1 |
|
AD32055 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1cc([N+](=O)[O-])ncc1N |
|
AD32056 | 0.96 | 196.16 | C8H8O4N2 | COC(=O)c1ccc([N+](=O)[O-])c(N)c1 |
|
AD32057 | 1.18 | 196.19 | C6H4O2N4S | Nc1ccc2nsnc2c1[N+](=O)[O-] |
|
AD32058 | 0.96 | 196.16 | C8H8O4N2 | COC(=O)c1ccc([N+](=O)[O-])cc1N |
|
AD32059 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1ncc([N+](=O)[O-])cc1N |
|
AD32060 | 0.93 | 188.57 | C6H5O2N4Cl | Cc1nc(Cl)nc(N)c1[N+](=O)[O-] |