Molecule ID: mol31602

SMILES: O/N=C/c1cc(Cl)ccc1Cl

InChI: InChI=1S/C7H5Cl2NO/c8-6-1-2-7(9)5(3-6)4-10-11/h1-4,11H/b10-4+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization