Molecule ID: mol4538
SMILES: C(#Cc1nc2ccccc2[nH]1)c1ccccc1
InChI: InChI=1S/C15H10N2/c1-2-6-12(7-3-1)10-11-15-16-13-8-4-5-9-14(13)17-15/h1-9H,(H,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.20 | IUPAC digitized pKa | 1 » 0 |
| 11.30 | IUPAC digitized pKa | 0 » -1 |