Molecule ID: mol32037

SMILES: Oc1n[nH]nc1Cc1ccc2ccccc2c1

InChI: InChI=1S/C13H11N3O/c17-13-12(14-16-15-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H,8H2,(H2,14,15,16,17)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.01 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization