Molecule ID: mol9503
SMILES: CN(C)C(=S)SCC(=O)O
InChI: InChI=1S/C5H9NO2S2/c1-6(2)5(9)10-3-4(7)8/h3H2,1-2H3,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.32 | QSARToolbox | 0 » -1 |
| 3.32 | QSARToolbox | 0 » -1 |
| 3.32 | IUPAC digitized pKa | 0 » -1 |
| 3.34 | OCHEM | 0 » -1 |
| 3.34 | Datawarrior | 0 » -1 |
| 3.38 | IUPAC digitized pKa | 0 » -1 |