Molecule ID: mol2378

SMILES: C#CCCN

InChI: InChI=1S/C4H7N/c1-2-3-4-5/h1H,3-5H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.25 OCHEM 1 » 0
8.25 Hunt 1 » 0
9.23 OCHEM 1 » 0
9.23 QSARToolbox 1 » 0
9.23 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization