Molecule ID: mol14566
SMILES: S=C(NCc1ccccc1)c1ccccc1
InChI: InChI=1S/C14H13NS/c16-14(13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h1-10H,11H2,(H,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.16 | QSARToolbox | 0 » -1 |
| 12.16 | Datawarrior | 0 » -1 |
| 12.16 | OCHEM | 0 » -1 |