Molecule ID: mol9242
SMILES: CC(C)NC(=S)S
InChI: InChI=1S/C4H9NS2/c1-3(2)5-4(6)7/h3H,1-2H3,(H2,5,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.79 | IUPAC digitized pKa | 0 » -1 |
| 2.91 | IUPAC digitized pKa | 0 » -1 |
| 3.10 | OCHEM | 0 » -1 |
| 3.10 | QSARToolbox | 0 » -1 |
| 3.10 | Datawarrior | 0 » -1 |