Molecule ID: mol8942
SMILES: CC(=O)S
InChI: InChI=1S/C2H4OS/c1-2(3)4/h1H3,(H,3,4)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.20 | AttenGpKa training set | 0 » -1 |
| 3.33 | QSARToolbox | 0 » -1 |
| 3.33 | OCHEM | 0 » -1 |
| 3.33 | OCHEM | 0 » -1 |
| 3.56 | AttenGpKa training set | 0 » -1 |
| 3.62 | QSARToolbox | 0 » -1 |
| 3.62 | QSARToolbox | 0 » -1 |
| 3.62 | IUPAC digitized pKa | 0 » -1 |
| 3.71 | Datawarrior | 0 » -1 |
| 3.71 | OCHEM | 0 » -1 |