Molecule ID: mol13362

SMILES: Cc1cc(-c2cc(C)n(C)n2)nn1C

InChI: InChI=1S/C10H14N4/c1-7-5-9(11-13(7)3)10-6-8(2)14(4)12-10/h5-6H,1-4H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.60 Datawarrior 2 » 1
2.22 Datawarrior 1 » 0
2.22 OCHEM 1 » 0
2.22 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization