Molecule ID: mol3939

SMILES: Cc1ccno1

InChI: InChI=1S/C4H5NO/c1-4-2-3-5-6-4/h2-3H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.30 QSARToolbox 1 » 0
2.30 IUPAC digitized pKa 1 » 0
2.30 Datawarrior 1 » 0
2.30 OCHEM 1 » 0
2.30 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization