Molecule ID: mol38214

SMILES: N#Cc1ccc(-c2nnc(-c3ccccc3)o2)cc1

InChI: InChI=1S/C15H9N3O/c16-10-11-6-8-13(9-7-11)15-18-17-14(19-15)12-4-2-1-3-5-12/h1-9H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.65 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization