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Ligand

NameCHEMBL129647
Molecular formulaC21H21NO2
IUPAC name(4-methoxyphenyl)-spiro[indene-1,4'-piperidine]-1'-ylmethanone
Molecular weight319.404
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.1
Synonyms1-(4-Methoxybenzoyl)spiro[piperidine-4,1'-[1H]indene]
BDBM50001429
4-methoxyphenyl-spiro[1H-indene-1,4''-(hexahydropyridine)]-1-ylmethanone
Inchi KeyCVILDSCBKGDBGS-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21NO2/c1-24-18-8-6-17(7-9-18)20(23)22-14-12-21(13-15-22)11-10-16-4-2-3-5-19(16)21/h2-11H,12-15H2,1H3
PubChem CID10448639
ChEMBLCHEMBL129647
IUPHARN/A
BindingDB50001429
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
51474Oxytocin receptorP70536OxtrRattus norvegicus (Rat)388

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