Molecule ID: mol15482

SMILES: CC1=CC(=Nc2ccc(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

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.85 Datawarrior 0 » -1
8.85 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization