Molecule ID: mol9343
SMILES: O=C(O)c1cccs1
InChI: InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.32 | QSARToolbox | 0 » -1 |
| 3.32 | QSARToolbox | 0 » -1 |
| 3.46 | Datawarrior | 0 » -1 |
| 3.46 | OCHEM | 0 » -1 |
| 3.47 | QSARToolbox | 0 » -1 |
| 3.48 | QSARToolbox | 0 » -1 |
| 3.48 | QSARToolbox | 0 » -1 |
| 3.49 | IUPAC digitized pKa | 0 » -1 |
| 3.49 | IUPAC digitized pKa | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |
| 3.50 | QSARToolbox | 0 » -1 |
| 3.53 | QSARToolbox | 0 » -1 |
| 3.53 | IUPAC digitized pKa | 0 » -1 |
| 3.53 | IUPAC digitized pKa | 0 » -1 |
| 3.54 | IUPAC digitized pKa | 0 » -1 |
| 3.55 | IUPAC digitized pKa | 0 » -1 |
| 3.56 | IUPAC digitized pKa | 0 » -1 |