Molecule ID: mol31813
SMILES: O=C1NC(=O)C2(CCCC2)C(=O)N1
InChI: InChI=1S/C8H10N2O3/c11-5-8(3-1-2-4-8)6(12)10-7(13)9-5/h1-4H2,(H2,9,10,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.83 | QSARToolbox | 0 » -1 |
| 8.83 | QSARToolbox | 0 » -1 |
| 8.83 | OCHEM | 0 » -1 |
| 8.83 | OCHEM | 0 » -1 |