Molecule ID: mol13926

SMILES: COc1ccccc1/C=C/C=N/O

InChI: InChI=1S/C10H11NO2/c1-13-10-7-3-2-5-9(10)6-4-8-11-12/h2-8,12H,1H3/b6-4+,11-8+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization