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Ligand

NameCAY10583
Molecular formulaC25H25NO3
IUPAC name2-[4-[(N-pentanoylanilino)methyl]phenyl]benzoic acid
Molecular weight387.479
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.3
SynonymsDTXSID40680163
4'-{[Pentanoyl(phenyl)amino]methyl}[1,1'-biphenyl]-2-carboxylic acid
MolPort-009-019-544
CAY 10583
4'-[[(1-oxopentyl)phenylamino]methyl]-[1,1'-biphenyl]-2-carboxylic acid
[ Show all ]
Inchi KeyIUJTVDNJFPZYBL-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25NO3/c1-2-3-13-24(27)26(21-9-5-4-6-10-21)18-19-14-16-20(17-15-19)22-11-7-8-12-23(22)25(28)29/h4-12,14-17H,2-3,13,18H2,1H3,(H,28,29)
PubChem CID51529932
ChEMBLN/A
IUPHAR6161
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
553988Leukotriene B4 receptor 2Q9JJL9Ltb4r2Mus musculus (Mouse)360
553989Leukotriene B4 receptor 2Q9NPC1LTB4R2Homo sapiens (Human)358

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