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Ligand

NameCHEMBL119670
Molecular formulaC24H24N2O3
IUPAC name3-[3-(2-benzamidoethyl)-5-(pyridin-3-ylmethyl)phenyl]propanoic acid
Molecular weight388.467
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.8
SynonymsSCHEMBL8306298
3-[3-(2-Benzoylamino-ethyl)-5-pyridin-3-ylmethyl-phenyl]-propionic acid
BDBM50060372
Inchi KeyHYXQMEZXMZNHQJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24N2O3/c27-23(28)9-8-18-13-19(10-12-26-24(29)22-6-2-1-3-7-22)15-21(14-18)16-20-5-4-11-25-17-20/h1-7,11,13-15,17H,8-10,12,16H2,(H,26,29)(H,27,28)
PubChem CID10500482
ChEMBLCHEMBL119670
IUPHARN/A
BindingDBN/A
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
127447Thromboxane A2 receptorP34978Tbxa2rRattus norvegicus (Rat)341

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