Molecule ID: mol26292

SMILES: Cn1cc(C(=O)O)nc2c(=O)n(C)c(=O)nc1-2

InChI: InChI=1S/C9H8N4O4/c1-12-3-4(8(15)16)10-5-6(12)11-9(17)13(2)7(5)14/h3H,1-2H3,(H,15,16)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.20 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization