Structure

InChI Key AHLPHDHHMVZTML-BYPYZUCNSA-N
Smile 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

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Brain Diseases 3 D001927 ClinicalTrials
Liver Failure, Acute 2 D017114 ClinicalTrials
Medulloblastoma 2 D008527 ClinicalTrials
Skin Neoplasms 2 D012878 ClinicalTrials
Neuroblastoma 2 D009447 ClinicalTrials
Propionic Acidemia 1 D056693 ClinicalTrials
Diabetes Mellitus, Type 1 1 D003922 ClinicalTrials

Cross References

Resources Reference
ChEBI 15729
ChEMBL CHEMBL446143
DrugBank DB00129
DrugCentral 3401
EPA CompTox DTXSID00883219
FDA SRS E524N2IXA3
Human Metabolome Database HMDB0000214
Guide to Pharmacology 725
KEGG C00077
PDB ORN
PharmGKB PA164783814
PubChem 6262
SureChEMBL SCHEMBL8579
ZINC ZINC000001532530