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57775-29-8,MFCD00864588
Catalog No.:AA00IA7J

57775-29-8 | Carazolol

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10mg
≥98%
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$49.00   $34.00
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100mg
95%
in stock  
$105.00   $74.00
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250mg
95%
in stock  
$198.00   $139.00
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1g
95%
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$552.00   $387.00
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5g
95%
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$1,402.00   $982.00
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10g
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$2,379.00   $1,666.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00IA7J
Chemical Name:
Carazolol
CAS Number:
57775-29-8
Molecular Formula:
C18H22N2O2
Molecular Weight:
298.3795
MDL Number:
MFCD00864588
SMILES:
OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C
Properties
Computed Properties
 
Complexity:
350  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.6  

Literature

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Journal: Current medicinal chemistry 20120301

Title: In silico screening for agonists and blockers of the β(2) adrenergic receptor: implications of inactive and activated state structures.

Journal: Journal of computational chemistry 20120215

Title: Drug design for ever, from hype to hope.

Journal: Journal of computer-aided molecular design 20120101

Title: Structural insights from binding poses of CCR2 and CCR5 with clinically important antagonists: a combined in silico study.

Journal: PloS one 20120101

Title: Molecular dynamics simulations of the effect of the G-protein and diffusible ligands on the β2-adrenergic receptor.

Journal: Journal of molecular biology 20111209

Title: In vivo and in vitro studies of the role of the adrenergic system and follicular wall contractility in the pathogenesis and resolution of bovine follicular cysts.

Journal: Theriogenology 20111101

Title: Ligand-dependent perturbation of the conformational ensemble for the GPCR β2 adrenergic receptor revealed by HDX.

Journal: Structure (London, England : 1993) 20111012

Title: Ligand-induced modulation of the free-energy landscape of G protein-coupled receptors explored by adaptive biasing techniques.

Journal: PLoS computational biology 20111001

Title: The role of conformational ensembles in ligand recognition in G-protein coupled receptors.

Journal: Journal of the American Chemical Society 20110824

Title: Progress in structure based drug design for G protein-coupled receptors.

Journal: Journal of medicinal chemistry 20110714

Title: The pharmacological effects of the thermostabilising (m23) mutations and intra and extracellular (β36) deletions essential for crystallisation of the turkey β-adrenoceptor.

Journal: Naunyn-Schmiedeberg's archives of pharmacology 20110701

Title: Evolution of β-blockers: from anti-anginal drugs to ligand-directed signalling.

Journal: Trends in pharmacological sciences 20110401

Title: Docking-based virtual screening for ligands of G protein-coupled receptors: not only crystal structures but also in silico models.

Journal: Journal of molecular graphics & modelling 20110201

Title: Structure of a nanobody-stabilized active state of the β(2) adrenoceptor.

Journal: Nature 20110113

Title: Structure and function of an irreversible agonist-β(2) adrenoceptor complex.

Journal: Nature 20110113

Title: Prooxidant action of carazolol in the Fenton-like reaction.

Journal: Luminescence : the journal of biological and chemical luminescence 20110101

Title: Predicting novel binding modes of agonists to β adrenergic receptors using all-atom molecular dynamics simulations.

Journal: PLoS computational biology 20110101

Title: Chemogenomic analysis of G-protein coupled receptors and their ligands deciphers locks and keys governing diverse aspects of signalling.

Journal: PloS one 20110101

Title: Mining significant substructure pairs for interpreting polypharmacology in drug-target network.

Journal: PloS one 20110101

Title: ss-TEA: Entropy based identification of receptor specific ligand binding residues from a multiple sequence alignment of class A GPCRs.

Journal: BMC bioinformatics 20110101

Title: Molecular basis of ligand dissociation in β-adrenergic receptors.

Journal: PloS one 20110101

Title: Differential modulation of Beta-adrenergic receptor signaling by trace amine-associated receptor 1 agonists.

Journal: PloS one 20110101

Title: Modeling of human prokineticin receptors: interactions with novel small-molecule binders and potential off-target drugs.

Journal: PloS one 20110101

Title: The effect of arrestin conformation on the recruitment of c-Raf1, MEK1, and ERK1/2 activation.

Journal: PloS one 20110101

Title: Human health risk assessment of pharmaceuticals in water: issues and challenges ahead.

Journal: International journal of environmental research and public health 20101101

Title: FoldGPCR: structure prediction protocol for the transmembrane domain of G protein-coupled receptors from class A.

Journal: Proteins 20100801

Title: Structure-based discovery of A2A adenosine receptor ligands.

Journal: Journal of medicinal chemistry 20100513

Title: Lambing rates and litter size following carazolol administration prior to insemination in Kivircik ewes.

Journal: Animal reproduction science 20100301

Title: Dynamics of the beta2-adrenergic G-protein coupled receptor revealed by hydrogen-deuterium exchange.

Journal: Analytical chemistry 20100201

Title: Ligand-specific regulation of the extracellular surface of a G-protein-coupled receptor.

Journal: Nature 20100107

Title: Chiral separations of some beta-adrenergic agonists and antagonists on AmyCoat column by HPLC.

Journal: Chirality 20100101

Title: Forced unbinding of GPR17 ligands from wild type and R255I mutant receptor models through a computational approach.

Journal: BMC structural biology 20100101

Title: Predicting drug-target interaction networks based on functional groups and biological features.

Journal: PloS one 20100101

Title: Cell distribution after intracoronary bone marrow stem cell delivery in damaged and undamaged myocardium: implications for clinical trials.

Journal: Stem cell research & therapy 20100101

Title: A full pharmacological analysis of the three turkey β-adrenoceptors and comparison with the human β-adrenoceptors.

Journal: PloS one 20100101

Title: Ligand-regulated oligomerization of beta(2)-adrenoceptors in a model lipid bilayer.

Journal: The EMBO journal 20091104

Title: Ligand entry and exit pathways in the beta2-adrenergic receptor.

Journal: Journal of molecular biology 20091002

Title: X-ray structure breakthroughs in the GPCR transmembrane region.

Journal: Biochemical pharmacology 20090701

Title: Identifying conformational changes of the beta(2) adrenoceptor that enable accurate prediction of ligand/receptor interactions and screening for GPCR modulators.

Journal: Journal of computer-aided molecular design 20090501

Title: Chiral separation of beta-adrenergic blockers on CelluCoat column by HPLC.

Journal: Talanta 20090430

Title: Rapid method for the determination of tranquilizers and a beta-blocker in porcine and bovine kidney by liquid chromatography with tandem mass spectrometry.

Journal: Analytica chimica acta 20090401

Title: Allosteric modulation of adenosine receptors.

Journal: Purinergic signalling 20090301

Title: Computing highly correlated positions using mutual information and graph theory for G protein-coupled receptors.

Journal: PloS one 20090101

Title: Analysis of full and partial agonists binding to beta2-adrenergic receptor suggests a role of transmembrane helix V in agonist-specific conformational changes.

Journal: Journal of molecular recognition : JMR 20090101

Title: [Determination of azaperone and carazolol residues in animals kidney using LC-MS/MS method].

Journal: Roczniki Panstwowego Zakladu Higieny 20090101

Title: G-protein-coupled receptor structure: what can we learn?

Journal: F1000 biology reports 20090101

Title: Structural constraints for the binding of short peptides to claudin-4 revealed by surface plasmon resonance.

Journal: The Journal of biological chemistry 20081107

Title: Structural basis for ligand binding and specificity in adrenergic receptors: implications for GPCR-targeted drug discovery.

Journal: Biochemistry 20081021

Title: Use of the X-ray structure of the beta2-adrenergic receptor for drug discovery. Part 2: Identification of active compounds.

Journal: Bioorganic & medicinal chemistry letters 20081015

Title: Facile radiosynthesis of fluorine-18 labeled beta-blockers. Synthesis, radiolabeling, and ex vivo biodistribution of [18F]-(2S and 2R)-1-(1-fluoropropan-2-ylamino)-3-(m-tolyloxy)propan-2-ol.

Journal: Journal of medicinal chemistry 20080828

Title: Selective structure-based virtual screening for full and partial agonists of the beta2 adrenergic receptor.

Journal: Journal of medicinal chemistry 20080828

Title: Structure of a beta1-adrenergic G-protein-coupled receptor.

Journal: Nature 20080724

Title: Active state-like conformational elements in the beta2-AR and a photoactivated intermediate of rhodopsin identified by dynamic properties of GPCRs.

Journal: Biochemistry 20080715

Title: Comprehensive screening and quantification of veterinary drugs in milk using UPLC-ToF-MS.

Journal: Analytical and bioanalytical chemistry 20080701

Title: On the applicability of GPCR homology models to computer-aided drug discovery: a comparison between in silico and crystal structures of the beta2-adrenergic receptor.

Journal: Journal of medicinal chemistry 20080522

Title: Crystallizing thinking about the beta2-adrenergic receptor.

Journal: Molecular pharmacology 20080501

Title: Virtual screening of GPCRs: an in silico chemogenomics approach.

Journal: BMC bioinformatics 20080101

Title: GPCR engineering yields high-resolution structural insights into beta2-adrenergic receptor function.

Journal: Science (New York, N.Y.) 20071123

Title: High-resolution crystal structure of an engineered human beta2-adrenergic G protein-coupled receptor.

Journal: Science (New York, N.Y.) 20071123

Title: Biochemistry. Signaling across the cell membrane.

Journal: Science (New York, N.Y.) 20071123

Title: Effect of carazolol on the oestrous behaviour and concentrations of luteinising hormone and steroids in lactating cows during the periovulatory period.

Journal: The Veterinary record 20070609

Title: Determination of residues of azaperone in the kidneys by liquid chromatography with fluorescence detection.

Journal: Analytica chimica acta 20070314

Title: Adrenergic stimulation and blocking of hormonal secretion activity of cultured cow granulosa cells.

Journal: Journal of physiology and pharmacology : an official journal of the Polish Physiological Society 20061101

Title: The influence of alpha-adrenergic receptors stimulator and blockers and beta-blocker on the ovary and endocrinological activity in heifers during superovulation.

Journal: Journal of physiology and pharmacology : an official journal of the Polish Physiological Society 20061101

Title: Influence of supplemental magnesium, tryptophan, vitamin C, and vitamin E on stress responses of pigs to vibration.

Journal: Journal of animal science 20050701

Title: Screening for library-assisted identification and fully validated quantification of 22 beta-blockers in blood plasma by liquid chromatography-mass spectrometry with atmospheric pressure chemical ionization.

Journal: Journal of chromatography. A 20041126

Title: Development of a rapid screening test for veterinary sedatives and the beta-blocker carazolol in porcine kidney by ELISA.

Journal: The Analyst 20040201

Title: Integrated acquisition of analytical and biopharmaceutical screening data for beta-adrenergic-drugs employing diversified macrocycle supported potentiometric detection in HPLC systems.

Journal: Current medicinal chemistry 20020801

Title: Separation of carvedilol enantiomers in very small volumes of human plasma by capillary electrophoresis with laser-induced fluorescence.

Journal: Journal of chromatography. B, Biomedical sciences and applications 20010505

Title: Evidence for the binding of beta-adrenoceptor blockers to microsomal Na+/K+-ATPase in guinea pig heart preparations.

Journal: Canadian journal of physiology and pharmacology 20010101

Title: Multiresidue analysis of tranquilizers and the beta-blocker Carazolol in meat by liquid chromatography/tandem mass spectrometry.

Journal: Rapid communications in mass spectrometry : RCM 20010101

Title: Carazolol: a potent, selective beta 3-adrenoceptor agonist.

Journal: European journal of pharmacology 19951130

Title: Carazolol, an extremely potent beta-adrenergic blocker: binding to beta-receptors in brain membranes.

Journal: Life sciences 19790611

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