General Information of the Compound
Compound ID
CP0067716
Compound Name
(9Z,12Z)-Octadeca-9,12-dienoic acid (2-hydroxy-ethyl)-amide
    Show/Hide
Synonyms
(9Z,12Z)-N-(2-Hydroxyethyl)octadeca-9,12-dien-1-amide
68171-52-8
889DYX0816
Anandamide (18:2, n-6)
C20H37NO2
CHEBI:64032
CHEMBL149859
EINECS 269-029-6
Linoleamide MEA
Linoleic ethanolamide
Linoleoyl ethanolamide
Linoleoyl monoethanolamide
Linoleylethanolamide
Monoethanolamine linoleic acid amide
N-(2-Hydroxyethyl)-linoleamide
N-(2-Hydroxyethyl)linoleamide
N-(2-hydroxyethyl)linoleoylamide
N-(9Z,12Z-octadecadienoyl)-ethanolamine
UNII-889DYX0816
n-linoleoylethanolamine
    Show/Hide
Structure
Formula
C20H37NO2
Molecular Weight
323.521
Canonical SMILES
CCCCC\C=C/C\C=C/CCCCCCCC(=O)NCCO
    Show/Hide
InChI
InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h6-7,9-10,22H,2-5,8,11-19H2,1H3,(H,21,23)/b7-6-,10-9-
    Show/Hide
InChIKey
KQXDGUVSAAQARU-HZJYTTRNSA-N
CAS
68171-52-8
Physicochemical Property
logP
4.9084
Rotatable Bonds
16
Heavy Atom Count
23
Polar Areas
49.33
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
23

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 5283446
SID: 15445558
ChEMBL ID
CHEMBL149859
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06137, Transient receptor potential cation channel subfamily V member 2
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 650 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
2
IC50 = 1400 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( N-(2-hydroxyethyl)linoleoylamide )
Drug Name N-(2-hydroxyethyl)linoleoylamide