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Ligand

NameCHEMBL129463
Molecular formulaC33H29FO7
IUPAC name3-[3-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxyphenoxy]propoxy]-9-oxoxanthen-4-yl]propanoic acid
Molecular weight556.586
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP6.9
Synonyms3-{3-[3-(5-Ethyl-4''-fluoro-2-hydroxy-biphenyl-4-yloxy)-propoxy]-9-oxo-9H-xanthen-4-yl}-propionic acid
BDBM50029460
Inchi KeyAGHWHQVSFVVCAO-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H29FO7/c1-2-20-18-26(21-8-10-22(34)11-9-21)27(35)19-30(20)40-17-5-16-39-28-14-12-25-32(38)23-6-3-4-7-29(23)41-33(25)24(28)13-15-31(36)37/h3-4,6-12,14,18-19,35H,2,5,13,15-17H2,1H3,(H,36,37)
PubChem CID9807782
ChEMBLCHEMBL129463
IUPHARN/A
BindingDB50029460
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4887Leukotriene B4 receptor 1Q15722LTB4RHomo sapiens (Human)352

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