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Ligand

NameCHEMBL2313274
Molecular formulaC16H17N5O2
IUPAC name6-[(E)-2-(6-aminopyridin-2-yl)ethenyl]-1,3,5-trimethylpyrrolo[3,2-d]pyrimidine-2,4-dione
Molecular weight311.345
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP0.8
SynonymsBDBM50425506
Inchi KeyACPTZWYCGODGER-BQYQJAHWSA-N
Inchi IDInChI=1S/C16H17N5O2/c1-19-11(8-7-10-5-4-6-13(17)18-10)9-12-14(19)15(22)21(3)16(23)20(12)2/h4-9H,1-3H3,(H2,17,18)/b8-7+
PubChem CID71563173
ChEMBLCHEMBL2313274
IUPHARN/A
BindingDB50425506
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
1772Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412

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