Molecule ID: mol28026

SMILES: COC(=N)Nc1ccccc1

InChI: InChI=1S/C8H10N2O/c1-11-8(9)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization