Molecule ID: mol2532
SMILES: CC(=O)c1ccc(Sc2ccc(N)cc2)cc1
InChI: InChI=1S/C14H13NOS/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-9H,15H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.31 | QSARToolbox | 1 » 0 |
| 3.31 | IUPAC digitized pKa | 1 » 0 |
| 3.31 | Hunt | 1 » 0 |
| 3.31 | OCHEM | 1 » 0 |