Molecule ID: mol9414
SMILES: CCOC(=S)SCC(=O)O
InChI: InChI=1S/C5H8O3S2/c1-2-8-5(9)10-3-4(6)7/h2-3H2,1H3,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.07 | QSARToolbox | 0 » -1 |
| 3.07 | QSARToolbox | 0 » -1 |
| 3.07 | IUPAC digitized pKa | 0 » -1 |
| 3.09 | IUPAC digitized pKa | 0 » -1 |