Molecule ID: mol15855
SMILES: CCOC(=S)S
InChI: InChI=1S/C3H6OS2/c1-2-4-3(5)6/h2H2,1H3,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.70 | QSARToolbox | 0 » -1 |
| 1.70 | QSARToolbox | 0 » -1 |
| 1.79 | Datawarrior | 0 » -1 |
| 1.79 | OCHEM | 0 » -1 |
| 1.90 | QSARToolbox | 0 » -1 |
| 2.74 | AttenGpKa training set | 0 » -1 |