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Ligand

NameCHEMBL410732
Molecular formulaC28H30N2O5
IUPAC name3-[2-[[3-[4-(2-phenylethylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl]methyl]phenyl]propanoic acid
Molecular weight474.557
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.2
SynonymsBDBM50047283
3-{2-[3-(4-Phenethylcarbamoyl-oxazol-2-yl)-7-oxa-bicyclo[2.2.1]hept-2-ylmethyl]-phenyl}-propionic acid
Inchi KeyAXLHXZFESBJRKM-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H30N2O5/c31-25(32)13-10-19-8-4-5-9-20(19)16-21-23-11-12-24(35-23)26(21)28-30-22(17-34-28)27(33)29-15-14-18-6-2-1-3-7-18/h1-9,17,21,23-24,26H,10-16H2,(H,29,33)(H,31,32)
PubChem CID19875435
ChEMBLCHEMBL410732
IUPHARN/A
BindingDB50047283
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
16824Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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