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Ligand

NameCHEMBL3793957
Molecular formulaC24H30N2O4
IUPAC name2-[1-[2-(N-benzoyl-2,4-dimethylanilino)ethyl]piperidin-4-yl]oxyacetic acid
Molecular weight410.514
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.4
SynonymsBDBM50163300
Inchi KeyAHHLHGMBGXSSSV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H30N2O4/c1-18-8-9-22(19(2)16-18)26(24(29)20-6-4-3-5-7-20)15-14-25-12-10-21(11-13-25)30-17-23(27)28/h3-9,16,21H,10-15,17H2,1-2H3,(H,27,28)
PubChem CID127028866
ChEMBLCHEMBL3793957
IUPHARN/A
BindingDB50163300
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
521622Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386

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