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Ligand

NameSMR000082502
Molecular formulaC18H25N3O3
IUPAC nameN-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2,2-dimethyl-N-propan-2-ylpropanamide
Molecular weight331.416
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsN-isopropyl-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2,2-dimethylpropanamide
AC1LO60W
MLS000066618
MLS002548687
CHEMBL1421666
[ Show all ]
Inchi KeyAHRIGIJMRXJQEF-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25N3O3/c1-12(2)21(17(22)18(3,4)5)11-15-19-16(20-24-15)13-7-9-14(23-6)10-8-13/h7-10,12H,11H2,1-6H3
PubChem CID1258023
ChEMBLCHEMBL1421666
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
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GLASS IDNameUniProtGeneSpeciesLength
5819Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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