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Ligand

NameCHEMBL2047159
Molecular formulaC29H34O8S
IUPAC name2-[(3S)-6-[[3-[2,6-dimethyl-4-(3-methylsulfonylpropoxy)phenyl]phenyl]methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid;hydrate
Molecular weight542.643
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogPNone
SynonymsFOFXXEHXOCAJIW-GNAFDRTKSA-N
[(3S)-6-({2',6'-dimethyl-4'-[3-(methylsulfonyl)propoxy]biphenyl-3-yl}methoxy)-2,3-dihydro-1-benzofuran-3-yl]acetic acid hydrate
Inchi KeyFOFXXEHXOCAJIW-GNAFDRTKSA-N
Inchi IDInChI=1S/C29H32O7S.H2O/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);1H2/t23-;/m1./s1
PubChem CID46869922
ChEMBLCHEMBL2047159
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83242Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
83243Free fatty acid receptor 1Q8K3T4Ffar1Rattus norvegicus (Rat)300
83245Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330
83244Free fatty acid receptor 3O14843FFAR3Homo sapiens (Human)346
83246Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377

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