Molecule ID: mol9812
SMILES: CC(=O)C(CN(C)C)=NO
InChI: InChI=1S/C6H12N2O2/c1-5(9)6(7-10)4-8(2)3/h10H,4H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.92 | IUPAC digitized pKa | 1 » 0 |
| 7.05 | IUPAC digitized pKa | 1 » 0 |
| 7.05 | QSARToolbox | 1 » 0 |
| 10.35 | IUPAC digitized pKa | 0 » -1 |
| 10.45 | QSARToolbox | 0 » -1 |