Molecule ID: mol3575

SMILES: CC(C(=O)C(c1ccccc1)c1ccccc1)N1CCCCC1

InChI: InChI=1S/C21H25NO/c1-17(22-15-9-4-10-16-22)21(23)20(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2-3,5-8,11-14,17,20H,4,9-10,15-16H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.45 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization