Molecule ID: mol30870

SMILES: Cc1cc(O)c(-c2c(O)cc(C)c(O)c2O)c(O)c1O

InChI: InChI=1S/C14H14O6/c1-5-3-7(15)9(13(19)11(5)17)10-8(16)4-6(2)12(18)14(10)20/h3-4,15-20H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.40 AttenGpKa training set -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization