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Ligand

NameCHEMBL1777866
Molecular formulaC18H13ClF3NO3
IUPAC name3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]hex-4-ynoic acid
Molecular weight383.751
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.6
SynonymsBDBM50344073
rac-3-(4-(3-chloro-5-(trifluoromethyl)pyridin-2-yloxy)phenyl)hex-4-ynoic acid
Inchi KeyKJKPJGXGFQYFKV-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H13ClF3NO3/c1-2-3-12(8-16(24)25)11-4-6-14(7-5-11)26-17-15(19)9-13(10-23-17)18(20,21)22/h4-7,9-10,12H,8H2,1H3,(H,24,25)
PubChem CID54582630
ChEMBLCHEMBL1777866
IUPHARN/A
BindingDB50344073
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
170574Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
170575Free fatty acid receptor 1Q76JU9Ffar1Mus musculus (Mouse)300

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