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Ligand

NameCHEMBL599204
Molecular formulaC31H37NO4
IUPAC name3-[2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-4-[(4-methylphenoxy)methyl]phenyl]propanoic acid
Molecular weight487.64
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP6.7
SynonymsBDBM50307442
SCHEMBL2984721
3-{2-({[1-(3,5-Dimethylphenyl)-3-methylbutyl]amino}-carbonyl)-4-[(4-methylphenoxy)methyl]phenyl}propanoic acid
Inchi KeyFTAFMJDXEACGGN-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H37NO4/c1-20(2)14-29(26-16-22(4)15-23(5)17-26)32-31(35)28-18-24(8-9-25(28)10-13-30(33)34)19-36-27-11-6-21(3)7-12-27/h6-9,11-12,15-18,20,29H,10,13-14,19H2,1-5H3,(H,32,35)(H,33,34)
PubChem CID23017221
ChEMBLCHEMBL599204
IUPHARN/A
BindingDB50307442
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
86551Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365

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