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Ligand

NameCHEMBL2409026
Molecular formulaC22H22N6OS
IUPAC name1-(5-methyl-4-thiophen-2-ylpyrimidin-2-yl)-5-propyl-N-(pyridin-4-ylmethyl)pyrazole-4-carboxamide
Molecular weight418.519
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50437429
Inchi KeyTWQFXEREFWTUNH-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22N6OS/c1-3-5-18-17(21(29)24-13-16-7-9-23-10-8-16)14-26-28(18)22-25-12-15(2)20(27-22)19-6-4-11-30-19/h4,6-12,14H,3,5,13H2,1-2H3,(H,24,29)
PubChem CID72163409
ChEMBLCHEMBL2409026
IUPHARN/A
BindingDB50437429
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
329297Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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