Molecule ID: mol30540

SMILES: Cc1cc(O)c(C)c(O)c1O

InChI: InChI=1S/C8H10O3/c1-4-3-6(9)5(2)8(11)7(4)10/h3,9-11H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.87 AttenGpKa training set 0 » -1
12.80 AttenGpKa training set -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization