MEA   Click here for help

GtoPdb Ligand ID: 5221

Synonyms: N-myristoylethanolamine
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 15
Topological polar surface area 49.33
Molecular weight 271.25
XLogP 5.51
No. Lipinski's rules broken 2
SMILES / InChI / InChIKey
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Canonical SMILES CCCCCCCCCCCCCC(=O)NCCO
Isomeric SMILES CCCCCCCCCCCCCC(=O)NCCO
InChI InChI=1S/C16H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(19)17-14-15-18/h18H,2-15H2,1H3,(H,17,19)
InChI Key JHIXEZNTXMFXEK-UHFFFAOYSA-N
References
1. Ueda N, Yamanaka K, Yamamoto S. (2001)
Purification and characterization of an acid amidase selective for N-palmitoylethanolamine, a putative endogenous anti-inflammatory substance.
J. Biol. Chem., 276 (38): 35552-7. [PMID:11463796]