Molecule ID: mol20656
SMILES: CSc1ncc[nH]1
InChI: InChI=1S/C4H6N2S/c1-7-4-5-2-3-6-4/h2-3H,1H3,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.95 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 5.95 | OCHEM | 1 » 0 |
| 5.95 | Baltruschat ChEMBL | 1 » 0 |