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Ligand

NameCHEMBL2409016
Molecular formulaC21H22N6O2S
IUPAC nameN-[(3-methyl-1,2-oxazol-5-yl)methyl]-1-(5-methyl-4-thiophen-2-ylpyrimidin-2-yl)-5-propylpyrazole-4-carboxamide
Molecular weight422.507
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50437422
Inchi KeyGXTJNLVWCUPEAP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N6O2S/c1-4-6-17-16(20(28)22-11-15-9-14(3)26-29-15)12-24-27(17)21-23-10-13(2)19(25-21)18-7-5-8-30-18/h5,7-10,12H,4,6,11H2,1-3H3,(H,22,28)
PubChem CID72163265
ChEMBLCHEMBL2409016
IUPHARN/A
BindingDB50437422
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
107902Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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