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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL186467
CHEMBL186467
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C26H40O2

Additional synonyms for CHEMBL186467 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCCCCCCC[C@H]1C[C@]2(C)[C@@H](O)CCC2C3CCC4=CC(=O)CCC4=C13
Standard InChI InChI=1S/C26H40O2/c1-3-4-5-6-7-8-9-19-17-26(2)23(14-15-24(26 ...
Download InChI
Standard InChI Key FPFITAPEARIFHY-NBSQGIEASA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL186467

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
384.6 384.3028 6.53 7 37.3 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 7.33 7.33 0 28 0.51

Structural Alerts

There are 8 structural alerts for CHEMBL186467. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:FPFITAPEARIFHY-NBSQGIEASA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL186467



BindingDB 50154005
PubChem 44396490

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