This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- Myristalkonium
- DrugBank Accession Number
- DB13774
- Background
Not Available
- Type
- Small Molecule
- Groups
- Experimental
- Structure
Structure for Myristalkonium (DB13774)
- Weight
- Average: 332.595
Monoisotopic: 332.331176777 - Chemical Formula
- C23H42N
- Synonyms
- Miristalkonium
- Myristalkonium cation
- Myristalkonium ion
- Myristyl-benzalkonium
- Tetradecylbenzyldimethylammonium
- Zephiramine cation
- Zephiramine ion
Pharmacology
- Indication
Not Available
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Prevent Adverse Drug Events TodayTap into our Clinical API for life-saving information on contraindications & blackbox warnings, population restrictions, harmful risks, & more.Avoid life-threatening adverse drug events with our Clinical API- 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
Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.- 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
Products
Drug product information from 10+ global regionsOur datasets provide approved product information including:dosage, form, labeller, route of administration, and marketing period.Access drug product information from over 10 global regions.- Product Ingredients
Ingredient UNII CAS InChI Key Myristalkonium chloride 0W255OL75T 139-08-2 OCBHHZMJRVXXQK-UHFFFAOYSA-M - Mixture Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image Youjie Weishi Air Disinfectant Myristalkonium chloride (0.64 g/1000mL) + Methenamine (1.5 g/1000mL) Liquid Extracorporeal Hebei Youjie Weishi Technology Co., Ltd. 2020-04-02 Not applicable US 
- Unapproved/Other Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image Youjie Weishi Air Disinfectant Myristalkonium chloride (0.64 g/1000mL) + Methenamine (1.5 g/1000mL) Liquid Extracorporeal Hebei Youjie Weishi Technology Co., Ltd. 2020-04-02 Not applicable US
Categories
- ATC Codes
- R02AA10 — Myristyl-benzalkonium
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
- Kingdom
- Organic compounds
- Super Class
- Benzenoids
- Class
- Benzene and substituted derivatives
- Sub Class
- Phenylmethylamines
- Direct Parent
- Phenylmethylamines
- Alternative Parents
- Benzylamines / Aralkylamines / Tetraalkylammonium salts / Organopnictogen compounds / Organic salts / Hydrocarbon derivatives / Organic cations
- Substituents
- Amine / Aralkylamine / Aromatic homomonocyclic compound / Benzylamine / Hydrocarbon derivative / Organic cation / Organic nitrogen compound / Organic salt / Organonitrogen compound / Organopnictogen compound
- Molecular Framework
- Aromatic homomonocyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- I5M8YK41GK
- CAS number
- 16287-71-1
- InChI Key
- WNBGYVXHFTYOBY-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H42N/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23/h15-17,19-20H,4-14,18,21-22H2,1-3H3/q+1
- IUPAC Name
- benzyldimethyltetradecylazanium
- SMILES
- CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
References
- General References
- Not Available
- External Links
- ChemSpider
- 8426
- BindingDB
- 50147575
- 1370587
- ChEMBL
- CHEMBL1180074
- ZINC
- ZINC000038141586
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
Form Route Strength Liquid Extracorporeal - Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Not Available
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 3.57e-06 mg/mL ALOGPS logP 3.84 ALOGPS logP 3.52 Chemaxon logS -8 ALOGPS pKa (Strongest Acidic) 18.11 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 15 Chemaxon Refractivity 120.4 m3·mol-1 Chemaxon Polarizability 45.32 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted GC-MS Spectrum - GC-MS Predicted GC-MS splash10-000x-6951000000-d3698f8988afd0aa2a3f Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 191.25937 predictedDeepCCS 1.0 (2019) [M+H]+ 193.65565 predictedDeepCCS 1.0 (2019) [M+Na]+ 199.99855 predictedDeepCCS 1.0 (2019)
Drug created at June 23, 2017 20:48 / Updated at June 12, 2020 16:53