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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL321585
CHEMBL321585
Compound Name
ChEMBL Synonyms Docosatetra-7Z,10Z,13Z,16Z-Enoyl Ethanolamide
Max Phase 0
Trade Names
Molecular Formula C24H41NO2

Additional synonyms for CHEMBL321585 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)NCCO
Standard InChI InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-1 ...
Download InChI
Standard InChI Key FMVHVRYFQIXOAF-DOFZRALJSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL321585

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
375.6 375.3137 6.39 18 49.33 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 2 1 3 2 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 7.05 7.05 0 27 0.22

Structural Alerts

There are 5 structural alerts for CHEMBL321585. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:FMVHVRYFQIXOAF-DOFZRALJSA-N
PubChem SID: 26754695 SID: 26754696 SID: 26754697
Wikipedia Docosatetraenoylethanolamide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL321585



ACToR 150314-35-5
BindingDB 85675
ChEBI 34478
eMolecules 1934526
Guide to Pharmacology 5445
Human Metabolome Database HMDB13626
KEGG Ligand C13829
LINCS LSM-43901
MolPort MolPort-003-983-551
PubChem 5282273
PubChem: Thomson Pharma 15473689
SureChEMBL SCHEMBL6259736
ZINC ZINC04654958

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/FMVHVRYFQIXOAF-DOFZRALJSA-N spacer
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