Molecule ID: mol35818

SMILES: Cc1cccc2c(C(=O)O)cc3cc(C(=O)O)c4cccc(C)c4c3c12

InChI: InChI=1S/C22H16O4/c1-11-5-3-7-14-16(21(23)24)9-13-10-17(22(25)26)15-8-4-6-12(2)19(15)20(13)18(11)14/h3-10H,1-2H3,(H,23,24)(H,25,26)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization