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Ligand

NameCHEMBL3596457
Molecular formulaC24H24F3NO2
IUPAC name4-[[3-(furan-2-yl)-5-(trifluoromethyl)phenyl]methoxymethyl]-4-phenylpiperidine
Molecular weight415.456
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50108644
SCHEMBL13404159
Inchi KeySTYGRMVBZWGQRW-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24F3NO2/c25-24(26,27)21-14-18(13-19(15-21)22-7-4-12-30-22)16-29-17-23(8-10-28-11-9-23)20-5-2-1-3-6-20/h1-7,12-15,28H,8-11,16-17H2
PubChem CID24785190
ChEMBLCHEMBL3596457
IUPHARN/A
BindingDB50108644
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
502801Substance-P receptorQ5DUB1TACR1Meriones unguiculatus (Mongolian jird)407
567406Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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