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Ligand

NameSCHEMBL3047198
Molecular formulaC18H25NO3
IUPAC name1-[(4-heptanoylphenyl)methyl]azetidine-3-carboxylic acid
Molecular weight303.402
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP0.9
SynonymsCHEMBL3739887
Inchi KeyCODVWDRZYZZSFT-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25NO3/c1-2-3-4-5-6-17(20)15-9-7-14(8-10-15)11-19-12-16(13-19)18(21)22/h7-10,16H,2-6,11-13H2,1H3,(H,21,22)
PubChem CID46872389
ChEMBLCHEMBL3739887
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
522879Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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