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Ligand

NameCHEMBL1777861
Molecular formulaC20H15F5O4
IUPAC name3-[4-[2-(difluoromethoxy)-4-(trifluoromethyl)phenoxy]phenyl]hex-4-ynoic acid
Molecular weight414.328
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP5.6
Synonymsrac-3-(4-(2-(difluoromethoxy)-4-(trifluoromethyl)phenoxy)phenyl)hex-4-ynoic acid
BDBM50344068
Inchi KeyXTXMTBWPTJUGRV-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15F5O4/c1-2-3-13(10-18(26)27)12-4-7-15(8-5-12)28-16-9-6-14(20(23,24)25)11-17(16)29-19(21)22/h4-9,11,13,19H,10H2,1H3,(H,26,27)
PubChem CID53248846
ChEMBLCHEMBL1777861
IUPHARN/A
BindingDB50344068
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
400836Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
400837Free fatty acid receptor 1Q76JU9Ffar1Mus musculus (Mouse)300

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