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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL138921
CHEMBL138921
Compound Name ARACHIDONOYL DOPAMINE
ChEMBL Synonyms Arachidonoyl Dopamine
Max Phase 0
Trade Names
Molecular Formula C28H41NO3

Additional synonyms for CHEMBL138921 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/CCCC(=O)NCCc1ccc(O)c(O)c1
Standard InChI InChI=1S/C28H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-1 ...
Download InChI
Standard InChI Key MVVPIAAVGAWJNQ-DOFZRALJSA-N

Structural Alerts

There are 6 structural alerts for CHEMBL138921. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL138921

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
439.6 439.3086 7.44 17 69.56 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 3 1 4 3 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
9.79 - 7.12 7.11 1 32 0.13

Compound Cross References

ChemSpider ChemSpider:MVVPIAAVGAWJNQ-DOFZRALJSA-N
PubChem SID: 26754733 SID: 26754735
Wikipedia N-Arachidonoyl_dopamine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL138921



BindingDB 20462
ChEBI 31231
eMolecules 534718
Guide to Pharmacology 4261
KEGG Ligand C12271
MolPort MolPort-003-940-300
Nikkaji J1.042.178K
PubChem 5282105
PubChem: Thomson Pharma 14905876
SureChEMBL SCHEMBL154051
ZINC ZINC04102443

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