Molecule ID: mol34291

SMILES: NCC(=O)NC(COP(=O)(O)O)C(=O)NCC(=O)O

InChI: InChI=1S/C7H14N3O8P/c8-1-5(11)10-4(3-18-19(15,16)17)7(14)9-2-6(12)13/h4H,1-3,8H2,(H,9,14)(H,10,11)(H,12,13)(H2,15,16,17)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization