Molecule ID: mol9273
SMILES: CSc1nc(=O)cn[nH]1
InChI: InChI=1S/C4H5N3OS/c1-9-4-6-3(8)2-5-7-4/h2H,1H3,(H,6,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.17 | IUPAC digitized pKa | 1 » 0 |
| 5.92 | IUPAC digitized pKa | 0 » -1 |
| 5.94 | IUPAC digitized pKa | 0 » -1 |