Molecule ID: mol12383

SMILES: CC(=O)c1cc[nH]n1

InChI: InChI=1S/C5H6N2O/c1-4(8)5-2-3-6-7-5/h2-3H,1H3,(H,6,7)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.85 Datawarrior 0 » -1
11.85 OCHEM 0 » -1
11.85 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization