Molecule ID: mol31156

SMILES: OC(O)C#Cc1ccccc1

InChI: InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5,9-11H

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.77 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization