Molecule ID: mol13405
SMILES: [O-][S+](Cc1ccccc1)c1ncc[nH]1
InChI: InChI=1S/C10H10N2OS/c13-14(10-11-6-7-12-10)8-9-4-2-1-3-5-9/h1-7H,8H2,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.80 | Datawarrior | 0 » -1 |
| 9.80 | OCHEM | 0 » -1 |
| 9.80 | Baltruschat ChEMBL | 0 » -1 |
| 9.80 | QSARToolbox | 0 » -1 |
| 9.80 | OCHEM | 0 » -1 |