Molecule ID: mol9502
SMILES: S=C(S)N1CCOCC1
InChI: InChI=1S/C5H9NOS2/c8-5(9)6-1-3-7-4-2-6/h1-4H2,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.65 | IUPAC digitized pKa | 0 » -1 |
| 4.73 | IUPAC digitized pKa | 0 » -1 |
| 5.16 | IUPAC digitized pKa | 0 » -1 |
| 5.19 | IUPAC digitized pKa | 0 » -1 |
| 5.45 | IUPAC digitized pKa | 0 » -1 |
| 5.65 | IUPAC digitized pKa | 0 » -1 |