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Ligand

NameCHEMBL3597632
Molecular formulaC35H32F5NO5
IUPAC name4-[1-(3-carboxypropyl)-4-fluoro-2-methyl-7-[2-[4-[4-(2,3,4,6-tetrafluorophenyl)butoxy]phenyl]ethynyl]indol-3-yl]butanoic acid
Molecular weight641.635
Hydrogen bond acceptor10
Hydrogen bond donor2
XlogP7.5
SynonymsBDBM50104919
HOXJOAWSVADHMC-UHFFFAOYSA-N
4,4'-[4-fluoro-2-methyl-7-({4-[4-(2,3,4,6-tetrafluorophenyl)butoxy]phenyl}ethynyl)-1H-indole-1,3-diyl]dibutanoic Acid
SCHEMBL598080
Inchi KeyHOXJOAWSVADHMC-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H32F5NO5/c1-21-25(7-4-8-30(42)43)32-27(36)17-14-23(35(32)41(21)18-5-9-31(44)45)13-10-22-11-15-24(16-12-22)46-19-3-2-6-26-28(37)20-29(38)34(40)33(26)39/h11-12,14-17,20H,2-9,18-19H2,1H3,(H,42,43)(H,44,45)
PubChem CID46830963
ChEMBLCHEMBL3597632
IUPHARN/A
BindingDB50104919
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
477748Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340
477749Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
477750Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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