Molecule ID: mol13758
SMILES: c1ccc(CNc2nccs2)cc1
InChI: InChI=1S/C10H10N2S/c1-2-4-9(5-3-1)8-12-10-11-6-7-13-10/h1-7H,8H2,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.15 | Datawarrior | 1 » 0 |
| 5.15 | QSARToolbox | 1 » 0 |
| 5.15 | OCHEM | 1 » 0 |