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Ligand

NameCHEMBL1777863
Molecular formulaC19H14BrNO3
IUPAC name3-[4-(2-bromo-4-cyanophenoxy)phenyl]hex-4-ynoic acid
Molecular weight384.229
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.2
SynonymsBDBM50344070
rac-3-(4-(2-bromo-4-cyanophenoxy)phenyl)hex-4-ynoic acid
Inchi KeyVIXBOSFBBFQKIJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H14BrNO3/c1-2-3-15(11-19(22)23)14-5-7-16(8-6-14)24-18-9-4-13(12-21)10-17(18)20/h4-10,15H,11H2,1H3,(H,22,23)
PubChem CID54582628
ChEMBLCHEMBL1777863
IUPHARN/A
BindingDB50344070
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
356247Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
356248Free fatty acid receptor 1Q76JU9Ffar1Mus musculus (Mouse)300

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