Molecule ID: mol34367

SMILES: Cc1cccc2c1C1CCC2c2cccc(C(=O)O)c21

InChI: InChI=1S/C18H16O2/c1-10-4-2-5-12-11-8-9-14(16(10)12)17-13(11)6-3-7-15(17)18(19)20/h2-7,11,14H,8-9H2,1H3,(H,19,20)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization