Molecule ID: mol19272

SMILES: O=C(Nc1cc(Cl)cc(Cl)c1O)Nc1cc(Cl)cc(Cl)c1O

InChI: InChI=1S/C13H8Cl4N2O3/c14-5-1-7(16)11(20)9(3-5)18-13(22)19-10-4-6(15)2-8(17)12(10)21/h1-4,20-21H,(H2,18,19,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization