Molecule ID: mol23138

SMILES: O=C(O)c1cccc2c1Cc1c(Cl)cccc1C2

InChI: InChI=1S/C15H11ClO2/c16-14-6-2-4-10-7-9-3-1-5-11(15(17)18)12(9)8-13(10)14/h1-6H,7-8H2,(H,17,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization