Molecule ID: mol30673

SMILES: Cc1cc(O)ccc1N=C1C=CC(=O)C=C1

InChI: InChI=1S/C13H11NO2/c1-9-8-12(16)6-7-13(9)14-10-2-4-11(15)5-3-10/h2-8,16H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization