aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD29101 | 0.09 | 171.16 | C6H9O3N3 | Cc1ncc([N+](=O)[O-])n1CCO |
|
AD29102 | 1.09 | 183.12 | C6H5O4N3 | Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] |
|
AD29103 | 1.54 | 197.15 | C7H7O4N3 | CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] |
|
AD29104 | 0.73 | 227.22 | C12H9O2N3 | Cn1c2nc(=O)[nH]c(=O)c-2cc2ccccc21 |
|
AD29105 | 1.17 | 194.15 | C7H6O3N4 | CNc1ccc([N+](=O)[O-])c2nonc12 |
|
AD29106 | 0.91 | 227.18 | C8H9O5N3 | O=[N+]([O-])c1ccc(NCCO)c([N+](=O)[O-])c1 |
|
AD29107 | 1.02 | 178.19 | C9H10O2N2 | NC1Cc2ccc([N+](=O)[O-])cc2C1 |
|
AD29108 | 1.48 | 180.21 | C9H12O2N2 | CC(N)Cc1ccccc1[N+](=O)[O-] |
|
AD29109 | 1.48 | 180.21 | C9H12O2N2 | CC(N)Cc1ccc([N+](=O)[O-])cc1 |
|
AD29110 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1ncc([N+](=O)[O-])cc1Cl |