Molecule ID: mol23400

SMILES: CCC(Nc1ccccc1C)C(=O)O

InChI: InChI=1S/C11H15NO2/c1-3-9(11(13)14)12-10-7-5-4-6-8(10)2/h4-7,9,12H,3H2,1-2H3,(H,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization