Molecule ID: mol30555

SMILES: CC/N=C(\C)c1ccccc1O

InChI: InChI=1S/C10H13NO/c1-3-11-8(2)9-6-4-5-7-10(9)12/h4-7,12H,3H2,1-2H3/b11-8+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization