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Ligand

NameCHEMBL3403187
Molecular formulaC31H33NO7
IUPAC name4-(3-carboxypropyl)-8-[(E)-2-[4-(4-phenoxybutoxy)phenyl]ethenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid
Molecular weight531.605
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP5.9
SynonymsBDBM50066948
SCHEMBL3099770
Inchi KeyKQXMBUWEISAGDL-DTQAZKPQSA-N
Inchi IDInChI=1S/C31H33NO7/c33-29(34)12-7-19-32-22-28(31(35)36)39-30-24(8-6-11-27(30)32)16-13-23-14-17-26(18-15-23)38-21-5-4-20-37-25-9-2-1-3-10-25/h1-3,6,8-11,13-18,28H,4-5,7,12,19-22H2,(H,33,34)(H,35,36)/b16-13+
PubChem CID11455387
ChEMBLCHEMBL3403187
IUPHARN/A
BindingDB50066948
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
448629Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
448630Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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