Molecule ID: mol9398

SMILES: Cc1c(O)nc(O)n1C(N)=O

InChI: InChI=1S/C5H7N3O3/c1-2-3(9)7-5(11)8(2)4(6)10/h9H,1H3,(H2,6,10)(H,7,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization