Structure

InChI Key AXOIZCJOOAYSMI-UHFFFAOYSA-N
Smiles C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C
InChI
InChI=1S/C14H30N2O4/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6/h7-12H2,1-6H3/q+2

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H30N2O4+2
Molecular Weight 290.4
AlogP 0.27
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 9.0
Polar Surface Area 52.6
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 20.0

Cross References

Resources Reference
ChEBI 45652
ChEMBL CHEMBL703
DrugBank DB00202
DrugCentral 2489
FDA SRS J2R869A8YF
Human Metabolome Database HMDB0014347
Guide to Pharmacology 4004
KEGG C07546
PDB SCK
PharmGKB PA451522
SureChEMBL SCHEMBL41537
ZINC ZINC000001530820