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Ligand

NameCHEMBL413563
Molecular formulaC24H35NO5
IUPAC name7-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-6-oxopiperidin-1-yl]heptanoic acid
Molecular weight417.546
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.6
Synonyms7-{(R)-2-[(E)-(S)-3-Hydroxy-4-(3-methoxymethyl-phenyl)-but-1-enyl]-6-oxo-piperidin-1-yl}-heptanoic acid
BDBM50166472
SCHEMBL4934128
Inchi KeyBCCRAFCMMIFCKU-WRBWEIJPSA-N
Inchi IDInChI=1S/C24H35NO5/c1-30-18-20-9-6-8-19(16-20)17-22(26)14-13-21-10-7-11-23(27)25(21)15-5-3-2-4-12-24(28)29/h6,8-9,13-14,16,21-22,26H,2-5,7,10-12,15,17-18H2,1H3,(H,28,29)/b14-13+/t21-,22-/m1/s1
PubChem CID11742697
ChEMBLCHEMBL413563
IUPHARN/A
BindingDB50166472
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
20057Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488

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