Molecule ID: mol3488

SMILES: OC1=CC(O)C(=NCc2ccccc2)C(O)=C1

InChI: InChI=1S/C13H13NO3/c15-10-6-11(16)13(12(17)7-10)14-8-9-4-2-1-3-5-9/h1-7,11,15-17H,8H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.20 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization