Molecule ID: mol25174

SMILES: CCOc1cc[n+](O)cc1

InChI: InChI=1S/C7H10NO2/c1-2-10-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3/q+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization