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Ligand

NameCHEMBL1777867
Molecular formulaC16H13BrN2O3
IUPAC name3-[4-(5-bromopyrimidin-2-yl)oxyphenyl]hex-4-ynoic acid
Molecular weight361.195
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.1
Synonymsrac-3-(4-(5-bromopyrimidin-2-yloxy)phenyl)hex-4-ynoic acid
BDBM50344074
Inchi KeyUSGBHZYCIIHVDP-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H13BrN2O3/c1-2-3-12(8-15(20)21)11-4-6-14(7-5-11)22-16-18-9-13(17)10-19-16/h4-7,9-10,12H,8H2,1H3,(H,20,21)
PubChem CID54582631
ChEMBLCHEMBL1777867
IUPHARN/A
BindingDB50344074
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
344307Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
344308Free fatty acid receptor 1Q76JU9Ffar1Mus musculus (Mouse)300

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