Molecule ID: mol22301

SMILES: CCCC/C(=N/O)C(=O)O

InChI: InChI=1S/C6H11NO3/c1-2-3-4-5(7-10)6(8)9/h10H,2-4H2,1H3,(H,8,9)/b7-5-

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization