Molecule ID: mol13708

SMILES: NNC(=O)CC(NCCO)C(=O)O

InChI: InChI=1S/C6H13N3O4/c7-9-5(11)3-4(6(12)13)8-1-2-10/h4,8,10H,1-3,7H2,(H,9,11)(H,12,13)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.13 Datawarrior 2 » 1
2.13 OCHEM 2 » 1
2.13 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization