Molecule ID: mol9403

SMILES: Cc1nn(C)c(N)nc1=O

InChI: InChI=1S/C5H8N4O/c1-3-4(10)7-5(6)9(2)8-3/h1-2H3,(H2,6,7,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization