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Ligand

NameSCHEMBL1615598
Molecular formulaC21H23N5O5
IUPAC name1-[(2,3-dihydroxyphenyl)methyl]-3-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-5,5-dimethylimidazolidine-2,4-dione
Molecular weight425.445
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP1.4
SynonymsUS9247759, 12-43
CHEMBL3926477
BDBM211392
Inchi KeyBFBRLCWLVFUVJK-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23N5O5/c1-12-16(13(2)31-23-12)11-24-10-15(8-22-24)26-19(29)21(3,4)25(20(26)30)9-14-6-5-7-17(27)18(14)28/h5-8,10,27-28H,9,11H2,1-4H3
PubChem CID53373847
ChEMBLCHEMBL3926477
IUPHARN/A
BindingDB211392
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
519797Taste receptor type 2 member 8Q9NYW2TAS2R8Homo sapiens (Human)309

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