Propofol Hemisuccinate

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Propofol Hemisuccinate
DrugBank Accession Number
DB16947
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
Weight
Average: 278.348
Monoisotopic: 278.151809188
Chemical Formula
C16H22O4
Synonyms
  • Butanedioic acid, 1-(2,6-bis(1-methylethyl)phenyl) ester
  • Succinic acid monopropofol ester

Pharmacology

Indication

Not Available

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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

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Active Moieties
NameKindUNIICASInChI Key
PropofolprodrugYI7VU623SF2078-54-8OLBCVFGFOZPWHH-UHFFFAOYSA-N

Categories

Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
OIC0UYZ1W6
CAS number
184869-48-5
InChI Key
ORMHJJCIJXWHFH-UHFFFAOYSA-N
InChI
InChI=1S/C16H22O4/c1-10(2)12-6-5-7-13(11(3)4)16(12)20-15(19)9-8-14(17)18/h5-7,10-11H,8-9H2,1-4H3,(H,17,18)
IUPAC Name
4-[2,6-bis(propan-2-yl)phenoxy]-4-oxobutanoic acid
SMILES
CC(C)C1=CC=CC(C(C)C)=C1OC(=O)CCC(O)=O

References

General References
Not Available
ChemSpider
8101260

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility0.0179 mg/mLALOGPS
logP3.6ALOGPS
logP3.9Chemaxon
logS-4.2ALOGPS
pKa (Strongest Acidic)4.49Chemaxon
pKa (Strongest Basic)-7.2Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area63.6 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity76.47 m3·mol-1Chemaxon
Polarizability30.13 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
Not Available

Drug created at September 14, 2022 18:49 / Updated at December 01, 2022 11:33