Molecule ID: mol17788

SMILES: O=C(Nc1cc(Cl)ccc1O)OCCCl

InChI: InChI=1S/C9H9Cl2NO3/c10-3-4-15-9(14)12-7-5-6(11)1-2-8(7)13/h1-2,5,13H,3-4H2,(H,12,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
14.31 OCHEM -1 » -2
14.31 Baltruschat ChEMBL -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization