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Ligand

NameCHEMBL90663
Molecular formulaC36H35N5O5
IUPAC namepropan-2-yl 2-[2-butyl-4-oxo-3-[[4-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]methyl]imidazo[4,5-c]pyridin-5-yl]-2-phenylacetate
Molecular weight617.706
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP6.9
SynonymsBDBM50285811
{2-Butyl-4-oxo-3-[2''-(5-oxo-4,5-dihydro-[1,2,4]oxadiazol-3-yl)-biphenyl-4-ylmethyl]-3,4-dihydro-imidazo[4,5-c]pyridin-5-yl}-phenyl-acetic acid isopropyl ester
Inchi KeyBVCSSFYDTBHIHO-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H35N5O5/c1-4-5-15-30-37-29-20-21-40(31(35(43)45-23(2)3)26-11-7-6-8-12-26)34(42)32(29)41(30)22-24-16-18-25(19-17-24)27-13-9-10-14-28(27)33-38-36(44)46-39-33/h6-14,16-21,23,31H,4-5,15,22H2,1-3H3,(H,38,39,44)
PubChem CID136026557
ChEMBLCHEMBL90663
IUPHARN/A
BindingDB50285811
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
33602Type-2 angiotensin II receptorP35351Agtr2Rattus norvegicus (Rat)363

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