Structure via PubChem · Public domain (PubChem)
velusetrag
Sign in to saveVelusetrag (INN, USAN; previously known as TD-5108) is an experimental drug candidate for the treatment of gastric neuromuscular disorders including gastroparesis, and lower gastrointestinal motility disorders including chronic idiopathic constipation and irritable bowel syndrome. It is a potent, selective, high efficacy 5-HT4 receptor serotonin agonist being developed by Theravance Biopharma and Alfa Wassermann. Velusetrag demonstrates less selectivity for other serotonin receptors, such as 5-HT2 and 5-HT3, to earlier generation 5-HT agonists like cisapride and tegaserod.
In the Vinony graph
Vinony's link graph records 1,368 inbound references to velusetrag, and connects out to N-methylserotonin, glaucine and 5-carboxamidotryptamine.
Vinony files it under 2-Quinolones, Chemical pages without DrugBank identifier and Drugs not assigned an ATC code.
Vinony links it to 4 Wikipedia language editions.
Chemical data
- Formula
- C25H36N4O5S
- Molecular weight
- 504.6 g/mol
- IUPAC name
- N-[8-[(2R)-2-hydroxy-3-[methyl(methylsulfonyl)amino]propyl]-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-propan-2-ylquinoline-3-carboxamide
- SMILES
- CC(C)N1C2=CC=CC=C2C=C(C1=O)C(=O)NC3CC4CCC(C3)N4C[C@H](CN(C)S(=O)(=O)C)O
- InChIKey
- HXLOHDZQBKCUCR-FNNAPWSISA-N
- XLogP
- 1.7
- Polar surface area
- 119 Ų
- H-bond donors
- 2
- H-bond acceptors
- 7
- Formal charge
- 0
via PubChem
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 504.240641
Show 4 more facts
- chemical formula
- C₂₅H₃₆N₄O₅S
- canonical SMILES
- CC(C)N1C2=CC=CC=C2C=C(C1=O)C(=O)NC3CC4CCC(C3)N4CC(CN(C)S(=O)(=O)C)O
- isomeric SMILES
- CC(C)N1C2=CC=CC=C2C=C(C1=O)C(=O)NC3CC4CCC(C3)N4C[C@H](CN(C)S(=O)(=O)C)O
- Commons category
- Velusetrag
Sources (1)
via Wikidata · CC0
~4 min read
Encyclopedic overview
2 sectionsContents
- See also
- References
{{Infobox drug | drug_name = | IUPAC_name = N-((1R,3r,5S)-8-{(2R)-2-hydroxy-3-[(methanesulfonyl)(methyl)amino]propyl}-8-azabicyclo[3.2.1]octan-3-yl)-2-oxo-1-(propan-2-yl)-1H-quinoline-3-carboxamide | image = Velusetrag structure.svg | image_class = skin-invert-image | width = 250 | image2 = Velusetrag2.png | image_class2 = bg-transparent
| pronounce = | tradename = | Drugs.com = | MedlinePlus = | pregnancy_AU = | pregnancy_AU_comment = | pregnancy_US = | pregnancy_category = | routes_of_administration = Oral | legal_AU = | legal_AU_comment = | legal_CA = | legal_DE = | legal_NZ = | legal_UK = | legal_US = IND | legal_UN = | legal_status =
Excerpted from Wikipedia’s “velusetrag” article, available under the CC BY-SA 4.0 licence.