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Ligand

NameCHEMBL2386369
Molecular formulaC21H21FO5S
IUPAC name3-[2-fluoro-4-[2-[3-(2-methylsulfonylethoxymethyl)phenyl]ethynyl]phenyl]propanoic acid
Molecular weight404.452
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.8
SynonymsBDBM50434298
Inchi KeyBBMCULPOTOCQTK-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21FO5S/c1-28(25,26)12-11-27-15-18-4-2-3-16(13-18)5-6-17-7-8-19(20(22)14-17)9-10-21(23)24/h2-4,7-8,13-14H,9-12,15H2,1H3,(H,23,24)
PubChem CID73345870
ChEMBLCHEMBL2386369
IUPHARN/A
BindingDB50434298
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
19613Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
19612Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377

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