Molecule ID: mol11712

SMILES: CC1(Cc2ccccc2)CC(=O)NC1=O

InChI: InChI=1S/C12H13NO2/c1-12(8-10(14)13-11(12)15)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization