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Ligand

NameCHEMBL343622
Molecular formulaC31H30ClN2O4-
IUPAC name2-[4-[(2-butyl-6-chloro-5-ethoxycarbonyl-4-phenyl-4H-pyrimidin-3-yl)methyl]phenyl]benzoate
Molecular weight530.041
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP6.9
SynonymsSodium; 4''-(2-butyl-4-chloro-5-ethoxycarbonyl-6-phenyl-6H-pyrimidin-1-ylmethyl)-biphenyl-2-carboxylate
BDBM50004159
Inchi KeyCXBDONQYBUGBPV-UHFFFAOYSA-M
Inchi IDInChI=1S/C31H31ClN2O4/c1-3-5-15-26-33-29(32)27(31(37)38-4-2)28(23-11-7-6-8-12-23)34(26)20-21-16-18-22(19-17-21)24-13-9-10-14-25(24)30(35)36/h6-14,16-19,28H,3-5,15,20H2,1-2H3,(H,35,36)/p-1
PubChem CID91928660
ChEMBLN/A
IUPHARN/A
BindingDB50004159
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
52642Type-1B angiotensin II receptorP29089Agtr1bRattus norvegicus (Rat)359

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