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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1201766
CHEMBL1201766
Compound Name FOSPROPOFOL
ChEMBL Synonyms LUSEDRA | FOSPROPOFOL DISODIUM | AQUAVAN
Max Phase 4 (Approved)
Trade Names AQUAVAN | LUSEDRA
Molecular Formula C13H21O5P

Additional synonyms for CHEMBL1201766 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(C)c1cccc(C(C)C)c1OCOP(=O)(O)O
Standard InChI InChI=1S/C13H21O5P/c1-9(2)11-6-5-7-12(10(3)4)13(11)17-8-18-1 ...
Download InChI
Standard InChI Key QVNNONOFASOXQV-UHFFFAOYSA-N

Sources

  • Orange Book
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1201766

Molecule Features

CHEMBL1201766 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:Y Oral:N Parenteral:Y Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
Unknown Not Available FDA

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
Adenomatous Polyposis ColiD011125EFO:0000662polyp3ClinicalTrials

Clinical Data

ClinicalTrials.gov FOSPROPOFOL
The Cochrane Collaboration FOSPROPOFOL

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
288.3 288.1127 3.38 6 75.99 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 2 0 5 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
1.67 - 1.73 -2.6 1 19 0.62

Structural Alerts

There are 7 structural alerts for CHEMBL1201766. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:QVNNONOFASOXQV-UHFFFAOYSA-N
DailyMed fospropofol disodium
Wikipedia Fospropofol

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1201766



ChEBI 135193
DrugBank DB06716
DrugCentral 3249
FDA SRS LZ257RZP7K
Guide to Pharmacology 7475
Human Metabolome Database HMDB0015661
IBM Patent System FBE3B6853C2C2A63B0E278892F34D217
PubChem 3038498
PubChem: Thomson Pharma 14751209
SureChEMBL SCHEMBL3821874
ZINC ZINC000002519740

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