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Ligand

NameCHEMBL3287725
Molecular formulaC25H32O6
IUPAC name3-[4-[4-(3,3-dimethylbutanoyl)-3-hydroxy-2-methylphenoxy]butoxy]-2-methylbenzoic acid
Molecular weight428.525
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP6.1
SynonymsBDBM50017270
SCHEMBL17176248
3-[4-[3-Hydroxy-4-(3,3-dimethylbutyryl)-2-methylphenoxy]butoxy]-2-methylbenzoic acid
Inchi KeyAXCUOQYTJKESER-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H32O6/c1-16-18(24(28)29)9-8-10-21(16)30-13-6-7-14-31-22-12-11-19(23(27)17(22)2)20(26)15-25(3,4)5/h8-12,27H,6-7,13-15H2,1-5H3,(H,28,29)
PubChem CID86765132
ChEMBLCHEMBL3287725
IUPHARN/A
BindingDB50017270
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16562Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
557741Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872
16563Metabotropic glutamate receptor 3P31422Grm3Rattus norvegicus (Rat)879

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