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Ligand

NameMLS000735645
Molecular formulaC24H26FNO3
IUPAC name(3-fluoro-4-methoxyphenyl)-[1-[[4-(4-hydroxybut-1-ynyl)phenyl]methyl]piperidin-3-yl]methanone
Molecular weight395.474
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.6
SynonymsCHEMBL1301171
MolPort-005-026-074
HMS2663A23
MCULE-2323039769
SMR000318161
[ Show all ]
Inchi KeyADPYZLWJEHJGCR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26FNO3/c1-29-23-12-11-20(15-22(23)25)24(28)21-6-4-13-26(17-21)16-19-9-7-18(8-10-19)5-2-3-14-27/h7-12,15,21,27H,3-4,6,13-14,16-17H2,1H3
PubChem CID16191974
ChEMBLCHEMBL1301171
IUPHARN/A
BindingDBN/A
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
2953Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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