Molecule ID: mol33205

SMILES: COc1ccc(C(=N)N)cc1

InChI: InChI=1S/C8H10N2O/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H3,9,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization