Molecule ID: mol12412
SMILES: O=C(O)c1cscn1
InChI: InChI=1S/C4H3NO2S/c6-4(7)3-1-8-2-5-3/h1-2H,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.90 | Datawarrior | 0 » -1 |
| 2.90 | OCHEM | 0 » -1 |
| 3.48 | QSARToolbox | 0 » -1 |
| 3.48 | QSARToolbox | 0 » -1 |
| 3.64 | Datawarrior | 0 » -1 |
| 3.64 | OCHEM | 0 » -1 |
| 3.81 | QSARToolbox | 0 » -1 |