Molecule ID: mol26740

SMILES: Nc1ccc(/C=C/c2cccc3cc4ccccc4nc23)cc1

InChI: InChI=1S/C21H16N2/c22-19-12-9-15(10-13-19)8-11-16-5-3-6-18-14-17-4-1-2-7-20(17)23-21(16)18/h1-14H,22H2/b11-8+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.60 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization