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Ligand

NameCHEMBL45965
Molecular formulaC27H21NO6
IUPAC name4-oxo-8-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]-2,3-dihydrochromene-2-carboxylic acid
Molecular weight455.466
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.2
Synonyms4-Oxo-8-[4-(quinolin-2-ylmethoxy)-phenoxymethyl]-chroman-2-carboxylic acid
BDBM50291859
Inchi KeyDQRDRFUEDPODHS-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H21NO6/c29-24-14-25(27(30)31)34-26-18(5-3-6-22(24)26)15-32-20-10-12-21(13-11-20)33-16-19-9-8-17-4-1-2-7-23(17)28-19/h1-13,25H,14-16H2,(H,30,31)
PubChem CID15675883
ChEMBLCHEMBL45965
IUPHARN/A
BindingDB50291859
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
66563Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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