Molecule ID: mol6889
SMILES: Cc1n[nH]c(-c2ccccc2)c1C
InChI: InChI=1S/C11H12N2/c1-8-9(2)12-13-11(8)10-6-4-3-5-7-10/h3-7H,1-2H3,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.47 | IUPAC digitized pKa | 1 » 0 |
| 3.47 | AttenGpKa training set | 1 » 0 |
| 3.47 | AttenGpKa training set | 1 » 0 |