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Ligand

NameTAK-875
Molecular formulaC29H32O7S
IUPAC name2-[(3S)-6-[[3-[2,6-dimethyl-4-(3-methylsulfonylpropoxy)phenyl]phenyl]methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid
Molecular weight524.628
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.7
SynonymsFasiglifam
1000413-72-8
TAK875
TAK 875
UNII-GLP1W4JXAH
[ Show all ]
Inchi KeyBZCALJIHZVNMGJ-HSZRJFAPSA-N
Inchi IDInChI=1S/C29H32O7S/c1-19-12-25(34-10-5-11-37(3,32)33)13-20(2)29(19)22-7-4-6-21(14-22)17-35-24-8-9-26-23(15-28(30)31)18-36-27(26)16-24/h4,6-9,12-14,16,23H,5,10-11,15,17-18H2,1-3H3,(H,30,31)/t23-/m1/s1
PubChem CID24857286
ChEMBLCHEMBL1829174
IUPHAR6484
BindingDB50386790
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
36309Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
36311Free fatty acid receptor 1Q8K3T4Ffar1Rattus norvegicus (Rat)300
36312Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330
36308Free fatty acid receptor 3O14843FFAR3Homo sapiens (Human)346
36310Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377
558389Melanocortin receptor 4P70596Mc4rRattus norvegicus (Rat)332

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