Clazosentan
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This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Explore a selection of our essential drug information below, or:
Identification
- Generic Name
- Clazosentan
- DrugBank Accession Number
- DB06677
- Background
Not Available
- Type
- Small Molecule
- Groups
- Investigational
- Structure
- Weight
- Average: 577.58
Monoisotopic: 577.149200671 - Chemical Formula
- C25H23N9O6S
- Synonyms
- Clazosentan
- External IDs
- AXV-034343
- AXV-343434
- RO 61-1790
- RO-61-1790
- VML-588
Pharmacology
- Indication
Investigated for use/treatment in strokes.
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- Pharmacodynamics
Not Available
- Mechanism of action
Target Actions Organism AEndothelin-1 receptor antagonistHumans - 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 Clazosentan Sodium 0L77PK62L1 503271-02-1 PZNSONUYVNYXJZ-UHFFFAOYSA-N - International/Other Brands
- Pivlaz
Categories
- ATC Codes
- C04AX33 — Clazosentan
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as pyridinylpyrimidines. These are compounds containing a pyridinylpyrimidine skeleton, which consists of a pyridine linked (not fused) to a pyrimidine by a bond.
- Kingdom
- Organic compounds
- Super Class
- Organoheterocyclic compounds
- Class
- Diazines
- Sub Class
- Pyrimidines and pyrimidine derivatives
- Direct Parent
- Pyridinylpyrimidines
- Alternative Parents
- Diarylethers / Pyridinesulfonamides / Anisoles / Methoxybenzenes / Phenoxy compounds / Methylpyridines / Alkyl aryl ethers / Imidolactams / Organosulfonamides / Aminosulfonyl compounds show 7 more
- Substituents
- Alcohol / Alkyl aryl ether / Aminosulfonyl compound / Anisole / Aromatic heteromonocyclic compound / Azacycle / Azole / Benzenoid / Diaryl ether / Ether show 23 more
- Molecular Framework
- Aromatic heteromonocyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 3DRR0X4728
- CAS number
- 180384-56-9
- InChI Key
- LFWCJABOXHSRGC-UHFFFAOYSA-N
- InChI
- InChI=1S/C25H23N9O6S/c1-15-7-8-20(27-14-15)41(36,37)32-24-21(40-19-6-4-3-5-18(19)38-2)25(39-12-11-35)29-22(28-24)16-9-10-26-17(13-16)23-30-33-34-31-23/h3-10,13-14,35H,11-12H2,1-2H3,(H,28,29,32)(H,30,31,33,34)
- IUPAC Name
- N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-[2-(1H-1,2,3,4-tetrazol-5-yl)pyridin-4-yl]pyrimidin-4-yl]-5-methylpyridine-2-sulfonamide
- SMILES
- COC1=CC=CC=C1OC1=C(NS(=O)(=O)C2=CC=C(C)C=N2)N=C(N=C1OCCO)C1=CC=NC(=C1)C1=NN=NN1
References
- General References
- Not Available
- External Links
- ChemSpider
- 4938283
- BindingDB
- 50066370
- ChEMBL
- CHEMBL109648
- ZINC
- ZINC000003939238
Clinical Trials
- Clinical Trials
Clinical Trial & Rare Diseases Add-on Data Package
Explore 4,000+ rare diseases, orphan drugs & condition pairs, clinical trial why stopped data, & more. Preview package Phase Status Purpose Conditions Count Start Date Why Stopped 100+ additional columns Unlock 175K+ rows when you subscribe.View sample data3 Completed Prevention Aneurysmal Subarachnoid Hemorrhage (A-sah) 1 somestatus stop reason just information to hide 3 Completed Treatment Aneurysmal Subarachnoid Hemorrhage (A-sah) 1 somestatus stop reason just information to hide 3 Terminated Treatment Aneurysmal Subarachnoid Hemorrhage (A-sah) 1 somestatus stop reason just information to hide 2 Completed Prevention Aneurysmal Subarachnoid Hemorrhage (A-sah) 1 somestatus stop reason just information to hide 2 Completed Treatment Aneurysmal Subarachnoid Hemorrhage (A-sah) 1 somestatus stop reason just information to hide
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
- Not Available
- Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Solid
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 0.0428 mg/mL ALOGPS logP 2.03 ALOGPS logP 2.83 Chemaxon logS -4.1 ALOGPS pKa (Strongest Acidic) 3.53 Chemaxon pKa (Strongest Basic) 2.11 Chemaxon Physiological Charge -2 Chemaxon Hydrogen Acceptor Count 12 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 200.11 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 169.08 m3·mol-1 Chemaxon Polarizability 56.12 Å3 Chemaxon Number of Rings 5 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 255.5442296 predictedDarkChem Lite v0.1.0 [M-H]- 211.96294 predictedDeepCCS 1.0 (2019) [M+H]+ 255.2917296 predictedDarkChem Lite v0.1.0 [M+H]+ 214.35852 predictedDeepCCS 1.0 (2019) [M+Na]+ 256.5940296 predictedDarkChem Lite v0.1.0 [M+Na]+ 220.27104 predictedDeepCCS 1.0 (2019)
Targets
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1. DetailsEndothelin-1 receptor
- Kind
- Protein
- Organism
- Humans
- Pharmacological action
- Yes
- Actions
- Antagonist
- General Function
- Receptor for endothelin-1. Mediates its action by association with G proteins that activate a phosphatidylinositol-calcium second messenger system. The rank order of binding affinities for ET-A is: ET1 > ET2 >> ET3
- Specific Function
- endothelin receptor activity
- Gene Name
- EDNRA
- Uniprot ID
- P25101
- Uniprot Name
- Endothelin-1 receptor
- Molecular Weight
- 48721.76 Da
References
- Motte S, McEntee K, Naeije R: Endothelin receptor antagonists. Pharmacol Ther. 2006 Jun;110(3):386-414. Epub 2005 Oct 10. [Article]
- Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]
Drug created at March 19, 2008 16:47 / Updated at August 26, 2024 19:23