Molecule ID: mol3069

SMILES: CC(N)=O

InChI: InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.05 AttenGpKa training set 1 » 0
15.10 AttenGpKa training set 0 » -1
16.50 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization