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Ligand

NameCHEMBL2047160
Molecular formulaC32H35NO6
IUPAC name2-[(3S)-6-[[3-[2,6-dimethyl-4-[3-(2-oxopyrrolidin-1-yl)propoxy]phenyl]phenyl]methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid
Molecular weight529.633
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
SynonymsBDBM50386791
Inchi KeyBBWSUMXKRYUIHW-RUZDIDTESA-N
Inchi IDInChI=1S/C32H35NO6/c1-21-14-27(37-13-5-12-33-11-4-8-30(33)34)15-22(2)32(21)24-7-3-6-23(16-24)19-38-26-9-10-28-25(17-31(35)36)20-39-29(28)18-26/h3,6-7,9-10,14-16,18,25H,4-5,8,11-13,17,19-20H2,1-2H3,(H,35,36)/t25-/m1/s1
PubChem CID57414540
ChEMBLCHEMBL2047160
IUPHARN/A
BindingDB50386791
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
19902Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
19903Free fatty acid receptor 1Q8K3T4Ffar1Rattus norvegicus (Rat)300

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