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Ligand

NameCHEMBL3342950
Molecular formulaC28H28N2O6
IUPAC name4-acetyl-8-[[4-(4-phenylbutoxy)benzoyl]amino]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid
Molecular weight488.54
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50033034
Inchi KeyIMSUYCTYIZAUQJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H28N2O6/c1-19(31)30-18-25(28(33)34)36-26-23(11-7-12-24(26)30)29-27(32)21-13-15-22(16-14-21)35-17-6-5-10-20-8-3-2-4-9-20/h2-4,7-9,11-16,25H,5-6,10,17-18H2,1H3,(H,29,32)(H,33,34)
PubChem CID118716774
ChEMBLCHEMBL3342950
IUPHARN/A
BindingDB50033034
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
447074Cysteinyl leukotriene receptor 1Q9Y271CYSLTR1Homo sapiens (Human)337
447075Cysteinyl leukotriene receptor 2Q9NS75CYSLTR2Homo sapiens (Human)346

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