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Ligand

NameCHEMBL255861
Molecular formulaC20H15ClN4O3S
IUPAC name2-(3-chlorophenoxy)-N-[2-(5-methylfuran-2-yl)-6-(1,3-thiazol-2-yl)pyrimidin-4-yl]acetamide
Molecular weight426.875
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.9
SynonymsBDBM50237077
2-(3-chlorophenoxy)-N-(2-(5-methylfuran-2-yl)-6-(thiazol-2-yl)pyrimidin-4-yl)acetamide
Inchi KeyAGJUEHKKCLPMSY-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15ClN4O3S/c1-12-5-6-16(28-12)19-23-15(20-22-7-8-29-20)10-17(25-19)24-18(26)11-27-14-4-2-3-13(21)9-14/h2-10H,11H2,1H3,(H,23,24,25,26)
PubChem CID44448024
ChEMBLCHEMBL255861
IUPHARN/A
BindingDB50237077
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4933Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
4934Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412

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