Molecule ID: mol5675

SMILES: NC(=O)c1ccco1

InChI: InChI=1S/C5H5NO2/c6-5(7)4-2-1-3-8-4/h1-3H,(H2,6,7)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
-1.76 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization