Molecule ID: mol13611

SMILES: COCc1nc(C)c[nH]1

InChI: InChI=1S/C6H10N2O/c1-5-3-7-6(8-5)4-9-2/h3H,4H2,1-2H3,(H,7,8)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization