Molecule ID: mol13380
SMILES: CN(C)c1ncc(-c2ccccc2)s1
InChI: InChI=1S/C11H12N2S/c1-13(2)11-12-8-10(14-11)9-6-4-3-5-7-9/h3-8H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.89 | QSARToolbox | 1 » 0 |
| 4.89 | OCHEM | 1 » 0 |
| 4.89 | Datawarrior | 1 » 0 |