Structure

InChI Key LRQKBLKVPFOOQJ-YFKPBYRVSA-N
Smile CCCC[C@H](N)C(=O)O
InChI
InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H13NO2
Molecular Weight 131.18
AlogP 0.59
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 63.32
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 9.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hot Flashes 1 D019584 ClinicalTrials

Cross References

Resources Reference
ChEBI 18347
ChEMBL CHEMBL292439
DrugBank DB15458
EPA CompTox DTXSID70883362
FDA SRS 832C8OV84S
Human Metabolome Database HMDB0001645
KEGG C01933
PDB NLE
SureChEMBL SCHEMBL8393
ZINC ZINC000001529322