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Ligand

NameCHEMBL157742
Molecular formulaC27H21NO6
IUPAC name4-(4-methoxyphenyl)-1-[(2-methoxyphenyl)methyl]-2-oxo-[1]benzofuro[3,2-b]pyridine-3-carboxylic acid
Molecular weight455.466
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
Synonyms1-(2-Methoxybenzyl)-2-oxo-4-(4-methoxyphenyl)-1,2-dihydrobenzofuro[3,2-b]pyridine-3-carboxylic acid
1-(2-Methoxy-benzyl)-4-(4-methoxy-phenyl)-2-oxo-1,2-dihydro-benzo[4,5]furo[3,2-b]pyridine-3-carboxylic acid
BDBM50075417
SCHEMBL6314933
Inchi KeyBBQVZZLPYFHCQZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H21NO6/c1-32-18-13-11-16(12-14-18)22-23(27(30)31)26(29)28(15-17-7-3-5-9-20(17)33-2)24-19-8-4-6-10-21(19)34-25(22)24/h3-14H,15H2,1-2H3,(H,30,31)
PubChem CID10173807
ChEMBLCHEMBL157742
IUPHARN/A
BindingDB50075417
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
19765Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
19764Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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