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Ligand

NameCHEMBL489618
Molecular formulaC21H26FNO3
IUPAC name(2,3-dimethoxyphenyl)-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methanol
Molecular weight359.441
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50267599
(2,3-Dimethoxyphenyl)-(1-(p-fluorobenzyl)-piperidine-4-yl)-methanol
Inchi KeyACARRFRVNJRYJL-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H26FNO3/c1-25-19-5-3-4-18(21(19)26-2)20(24)16-10-12-23(13-11-16)14-15-6-8-17(22)9-7-15/h3-9,16,20,24H,10-14H2,1-2H3
PubChem CID18734925
ChEMBLCHEMBL489618
IUPHARN/A
BindingDB50267599
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
13855-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471

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