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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2106633
CHEMBL2106633
Compound Name MAGNESIUM STEARATE
ChEMBL Synonyms MAGNESIUM STEARATE
Max Phase 1
Trade Names
Molecular Formula C36H70MgO4

Additional synonyms for CHEMBL2106633 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Mg+2].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-]
Standard InChI InChI=1S/2C18H36O2.Mg/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15 ...
Download InChI
Standard InChI Key HQKMJHAJHXVSDF-UHFFFAOYSA-L

Sources

  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL2106633

Molecule Features

CHEMBL2106633 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:N First In Class:N Chirality:Unknown Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
Pulmonary Disease, Chronic ObstructiveD029424EFO:0000341chronic obstructive pulmonary disease1ClinicalTrials
AsthmaD001249EFO:0000270asthma1ClinicalTrials

Clinical Data

ClinicalTrials.gov MAGNESIUM STEARATE
The Cochrane Collaboration MAGNESIUM STEARATE

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
591.3 590.5125 - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


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

Structural Alerts

There are no structural alerts for CHEMBL2106633

Compound Cross References

ChemSpider ChemSpider:HQKMJHAJHXVSDF-UHFFFAOYSA-L

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2106633



ACToR 212132-26-8 557-04-0
Brenda 165868
ChEBI 9254
DrugBank DB14077
eMolecules 13732249 713600
EPA CompTox Dashboard DTXSID2027208
FDA SRS 70097M6I30
MolPort MolPort-006-111-835
Nikkaji J43.178H
PubChem 11177 13288249
PubChem: Thomson Pharma 14813571
SureChEMBL SCHEMBL935

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/HQKMJHAJHXVSDF-UHFFFAOYSA-L spacer
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