[3H]GR65630   Click here for help

GtoPdb Ligand ID: 2303

Synonyms: [3H]-GR65630
 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 50.68
Molecular weight 267.14
XLogP 2.47
No. Lipinski's rules broken 0
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Canonical SMILES O=C(c1cn(c2c1cccc2)C)CCc1nc[nH]c1C
Isomeric SMILES O=C(c1cn(c2c1cccc2)C)CCc1nc[nH]c1C
InChI InChI=1S/C16H17N3O/c1-11-14(18-10-17-11)7-8-16(20)13-9-19(2)15-6-4-3-5-12(13)15/h3-6,9-10H,7-8H2,1-2H3,(H,17,18)
1. Hirata T, Keto Y, Funatsu T, Akuzawa S, Sasamata M. (2007)
Evaluation of the pharmacological profile of ramosetron, a novel therapeutic agent for irritable bowel syndrome.
J Pharmacol Sci, 104 (3): 263-73. [PMID:17652911]
2. Lankiewicz S, Lobitz N, Wetzel CH, Rupprecht R, Gisselmann G, Hatt H. (1998)
Molecular cloning, functional expression, and pharmacological characterization of 5-hydroxytryptamine3 receptor cDNA and its splice variants from guinea pig.
Mol Pharmacol, 53 (2): 202-12. [PMID:9463477]