Molecule ID: mol16528

SMILES: O/N=C/c1ccc[n+](COCc2ccccc2)c1

InChI: InChI=1S/C14H14N2O2/c17-15-9-14-7-4-8-16(10-14)12-18-11-13-5-2-1-3-6-13/h1-10H,11-12H2/p+1/b15-9+

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.25 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization