Synonyms
Status
Molecule Category Free-form
UNII E524N2IXA3
EPA CompTox DTXSID00883219

Structure

InChI Key AHLPHDHHMVZTML-BYPYZUCNSA-N
Smiles NCCC[C@H](N)C(=O)O
InChI
InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H12N2O2
Molecular Weight 132.16
AlogP -0.86
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 89.34
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 9.0

Cross References

Resources Reference
ChEBI 15729
ChEMBL CHEMBL446143
DrugBank DB00129
DrugCentral 3401
FDA SRS E524N2IXA3
Human Metabolome Database HMDB0000214
Guide to Pharmacology 725
KEGG C00077
PDB ORN
PharmGKB PA164783814
PubChem 6262
SureChEMBL SCHEMBL8579
ZINC ZINC000001532530