Molecule ID: mol7213

SMILES: Cc1ncc(C(N)=O)c(N(C)C)n1

InChI: InChI=1S/C8H12N4O/c1-5-10-4-6(7(9)13)8(11-5)12(2)3/h4H,1-3H3,(H2,9,13)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.93 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization