Molecule ID: mol9506
SMILES: CN(C)C(=O)SCC(=O)O
InChI: InChI=1S/C5H9NO3S/c1-6(2)5(9)10-3-4(7)8/h3H2,1-2H3,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.49 | IUPAC digitized pKa | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |
| 3.55 | IUPAC digitized pKa | 0 » -1 |