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Ligand

NameCHEMBL209566
Molecular formulaC21H23N3O3
IUPAC name3-[3-methyl-4-[5-[5-(2-methylpropyl)pyridin-2-yl]-1,2,4-oxadiazol-3-yl]phenyl]propanoic acid
Molecular weight365.433
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50186924
SCHEMBL4044277
3-(4-(5-(5-isobutylpyridin-2-yl)-1,2,4-oxadiazol-3-yl)-3-methylphenyl)propanoic acid
Inchi KeyDNEWRWUHAVFNJE-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23N3O3/c1-13(2)10-16-5-8-18(22-12-16)21-23-20(24-27-21)17-7-4-15(11-14(17)3)6-9-19(25)26/h4-5,7-8,11-13H,6,9-10H2,1-3H3,(H,25,26)
PubChem CID11624780
ChEMBLCHEMBL209566
IUPHARN/A
BindingDB50186924
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
64302Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
64305Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
64304Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378
64303Sphingosine 1-phosphate receptor 4O95977S1PR4Homo sapiens (Human)384
64301Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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