Molecule ID: mol34450

SMILES: CC1=C/C(=N\c2ccc(O)cc2)C(C(C)C)=CC1=O

InChI: InChI=1S/C16H17NO2/c1-10(2)14-9-16(19)11(3)8-15(14)17-12-4-6-13(18)7-5-12/h4-10,18H,1-3H3/b17-15+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.85 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization