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Ligand

NameSCHEMBL1279646
Molecular formulaC20H22N6O3
IUPAC name1-benzyl-4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-ethyl-1,2,4-triazolidine-3,5-dione
Molecular weight394.435
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.1
SynonymsUS9247759, 10-91
BDBM211343
CHEMBL3948447
1-benzyl-4-(1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-yl)-2-ethyl-1,2,4-triazolidine-3,5-dione
BTLCMQNNBQBXLV-UHFFFAOYSA-N
Inchi KeyBTLCMQNNBQBXLV-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22N6O3/c1-4-24-19(27)26(20(28)25(24)11-16-8-6-5-7-9-16)17-10-21-23(12-17)13-18-14(2)22-29-15(18)3/h5-10,12H,4,11,13H2,1-3H3
PubChem CID57422495
ChEMBLCHEMBL3948447
IUPHARN/A
BindingDB211343
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
519853Taste receptor type 2 member 8Q9NYW2TAS2R8Homo sapiens (Human)309

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