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Ligand

NameCHEMBL2386367
Molecular formulaC19H17FO4S
IUPAC name3-[2-fluoro-4-[2-[3-(methylsulfonylmethyl)phenyl]ethynyl]phenyl]propanoic acid
Molecular weight360.399
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.0
SynonymsBDBM50434300
SCHEMBL12985288
Inchi KeyFUKMWJUBXLRZAE-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H17FO4S/c1-25(23,24)13-16-4-2-3-14(11-16)5-6-15-7-8-17(18(20)12-15)9-10-19(21)22/h2-4,7-8,11-12H,9-10,13H2,1H3,(H,21,22)
PubChem CID66562388
ChEMBLCHEMBL2386367
IUPHARN/A
BindingDB50434300
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
87504Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
87505Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377

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