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Ligand

NameCHEMBL55366
Molecular formulaC26H24N6O2
IUPAC name7-methyl-2-propan-2-yloxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrido[1,2-a]pyrimidin-4-one
Molecular weight452.518
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50282299
2-Isopropoxy-7-methyl-3-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-pyrido[1,2-a]pyrimidin-4-one
Inchi KeyBVIWHTOPFDFFHS-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H24N6O2/c1-16(2)34-25-22(26(33)32-15-17(3)8-13-23(32)27-25)14-18-9-11-19(12-10-18)20-6-4-5-7-21(20)24-28-30-31-29-24/h4-13,15-16H,14H2,1-3H3,(H,28,29,30,31)
PubChem CID44298809
ChEMBLCHEMBL55366
IUPHARN/A
BindingDB50282299
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
33786Type-1 angiotensin II receptorP25104AGTR1Bos taurus (Bovine)359

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