Molecule ID: mol11164
SMILES: C[N+](C)(C)CCN(CC(=O)O)CC(=O)O
InChI: InChI=1S/C9H18N2O4/c1-11(2,3)5-4-10(6-8(12)13)7-9(14)15/h4-7H2,1-3H3,(H-,12,13,14,15)/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.32 | QSARToolbox | 1 » 0 |
| 2.32 | IUPAC digitized pKa | 1 » 0 |
| 5.45 | IUPAC digitized pKa | 0 » -1 |