NAV

Phenylmercuric borate

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

Identification

Generic Name
Phenylmercuric borate
DrugBank Accession Number
DB13834
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
Similar Structures
Weight
Average: 633.22
Monoisotopic: 636.031975
Chemical Formula
C12H13BHg2O4
Synonyms
  • Phenylmercuric borate
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Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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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

Categories

ATC Codes
D08AK02 — Phenylmercuric borate
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
Kingdom
Organic compounds
Super Class
Benzenoids
Class
Benzene and substituted derivatives
Sub Class
Not Available
Direct Parent
Benzene and substituted derivatives
Alternative Parents
Metal aryls / Aryl mercury compounds / Organic transition metal salts / Organic metalloid salts / Organic oxoanionic compounds / Organic oxides / Hydrocarbon derivatives / Organic cations
Substituents
Aromatic homomonocyclic compound / Aryl mercury compound / Hydrocarbon derivative / Metal aryl / Monocyclic benzene moiety / Organic borate / Organic cation / Organic hydroxide / Organic metalloid salt / Organic oxide
Molecular Framework
Not Available
External Descriptors
Not Available
Affected organisms
Not Available

Chemical Identifiers

UNII
61RG8BXK1F
CAS number
8017-88-7
InChI Key
OASPSZUQLPQSSC-UHFFFAOYSA-M
InChI
InChI=1S/2C6H5.BH2O3.2Hg.H2O/c2*1-2-4-6-5-3-1;2-1(3)4;;;/h2*1-5H;2-3H;;;1H2/q;;-1;2*+1;/p-1
IUPAC Name
bis(phenylmercuryylium) dihydrogen borate hydroxide
SMILES
[OH-].OB(O)[O-].[Hg+]C1=CC=CC=C1.[Hg+]C1=CC=CC=C1

References

General References
Not Available
ChemSpider
24767657
ChEMBL
CHEMBL3833355
Wikipedia
Phenylmercuric_borate

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 Solubility54.1 mg/mLALOGPS
logP0.28ALOGPS
logP0.9Chemaxon
logS-0.8ALOGPS
Physiological Charge1Chemaxon
Hydrogen Acceptor Count0Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area0 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity25.47 m3·mol-1Chemaxon
Polarizability10.77 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
Not Available
Chromatographic Properties
Collision Cross Sections (CCS)
Not Available

Drug created at June 23, 2017 20:49 / Updated at February 21, 2021 18:54