CGP 46381 - Moligand™ , Antagonist of GABA B receptor, CAS No.123691-14-5, Antagonist of GABA B receptor

CAS: 123691-14-5 Cat. No.: C288919 Molecular Weight: 219.26
AVAILABLE TO ORDER
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
Synonyms
3-Aminopropyl-cyclohexylmethylphosphinic acid | PDSP2_000414 | Q27075907 | NCGC00025076-02 | Phosphinic acid, (3-aminopropyl)(cyclohexylmethyl)- | J-004973 | DTXSID30154065 | Phosphinic acid, P-(3-aminopropyl)-P-(cyclohexylmethyl)- | BPBio1_000552 | CGP46
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
10mg
C288919-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$436.90
50mg
C288919-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,792.90
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
3-Aminopropyl-cyclohexylmethylphosphinic acid | PDSP2_000414 | Q27075907 | NCGC00025076-02 | Phosphinic acid, (3-aminopropyl)(cyclohexylmethyl)- | J-004973 | DTXSID30154065 | Phosphinic acid, P-(3-aminopropyl)-P-(cyclohexylmethyl)- | BPBio1_000552 | CGP46
Specifications & Purity
Moligand™
Biochemical and Physiological Mechanisms
Brain penetrant, selective GABABreceptor antagonist (IC50= 4.9μM).
Storage
Room temperature
Shipped In
Normal
Grade
Moligand™
Action Type
ANTAGONIST
Mechanism of action
Antagonist of GABA B receptor
Names and Identifiers
Canonical SmilesC1CCC(CC1)CP(=O)(CCCN)O
IUPAC Name3-aminopropyl(cyclohexylmethyl)phosphinic acid
InChIKeyXOESDNIUAWGCLU-UHFFFAOYSA-N
INCHI1S/C10H22NO2P/c11-7-4-8-14(12,13)9-10-5-2-1-3-6-10/h10H,1-9,11H2,(H,12,13)
Isomeric SMILES C1CCC(CC1)CP(=O)(CCCN)O
Molecular Weight 219.26
Reaxy-Rn 7410825
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7410825&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganophosphorus compounds
ClassNot available
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentOrganophosphorus compounds
Alternative Parents Organopnictogen compounds  Organic oxides  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organophosphorus compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as organophosphorus compounds. These are organic compounds containing the phosphorus atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
KCTD8 Tbio BTB/POZ domain-containing protein KCTD8 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
GABBR2 Tclin Gamma-aminobutyric acid type B receptor subunit 2 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
GABBR1 Tclin Gamma-aminobutyric acid type B receptor subunit 1 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
KCTD12 Tchem BTB/POZ domain-containing protein KCTD12 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
KCTD16 Tbio BTB/POZ domain-containing protein KCTD16 (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySolvent:water, Max Conc. mg/mL: 21.93, Max Conc. mM: 100
Molecular Weight219.260 g/mol
XLogP3-1.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass219.139 Da
Monoisotopic Mass219.139 Da
Topological Polar Surface Area63.300 Ų
Heavy Atom Count14
Formal Charge0
Complexity202.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

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