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Ligand

NameCHEMBL2047166
Molecular formulaC31H36O7S
IUPAC name2-[(3S)-6-[[3-[2,3,5,6-tetramethyl-4-(3-methylsulfonylpropoxy)phenyl]phenyl]methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid
Molecular weight552.682
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.5
SynonymsSCHEMBL205337
[(3S)-6-({2',3',5',6'-tetramethyl-4'-[3-(methylsulfonyl)propoxy]biphenyl-3-yl}methoxy)-2,3-dihydro-1-benzofuran-3-yl]acetic acid
BDBM50386797
FZPYJAIVCJYEMV-RUZDIDTESA-N
Inchi KeyFZPYJAIVCJYEMV-RUZDIDTESA-N
Inchi IDInChI=1S/C31H36O7S/c1-19-21(3)31(36-12-7-13-39(5,34)35)22(4)20(2)30(19)24-9-6-8-23(14-24)17-37-26-10-11-27-25(15-29(32)33)18-38-28(27)16-26/h6,8-11,14,16,25H,7,12-13,15,17-18H2,1-5H3,(H,32,33)/t25-/m1/s1
PubChem CID57414679
ChEMBLCHEMBL2047166
IUPHARN/A
BindingDB50386797
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
91180Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
91181Free fatty acid receptor 1Q8K3T4Ffar1Rattus norvegicus (Rat)300

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