Molecule ID: mol27938

SMILES: C/N=C(\C)Oc1ccc(C)cc1

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

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization