Molecule ID: mol38312

SMILES: N[C@@H]1CCNC[C@@H]1C(=O)O

InChI: InChI=1S/C6H12N2O2/c7-5-1-2-8-3-4(5)6(9)10/h4-5,8H,1-3,7H2,(H,9,10)/t4-,5+/m0/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization