Molecule ID: mol10695
SMILES: O=C(NO)C1C2CCC(O2)C1C(=O)NO
InChI: InChI=1S/C8H12N2O5/c11-7(9-13)5-3-1-2-4(15-3)6(5)8(12)10-14/h3-6,13-14H,1-2H2,(H,9,11)(H,10,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.30 | IUPAC digitized pKa | 0 » -1 |
| 9.30 | QSARToolbox | 0 » -1 |
| 9.30 | OCHEM | 0 » -1 |