Molecule ID: mol25104

SMILES: Cc1cc(=O)c(O)c(C(N)=O)n1C

InChI: InChI=1S/C8H10N2O3/c1-4-3-5(11)7(12)6(8(9)13)10(4)2/h3,12H,1-2H3,(H2,9,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization