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Ligand

NameCHEMBL201847
Molecular formulaC26H28N4O4
IUPAC nameN-benzyl-N-methyl-2-[4-(3-methyl-2,4-dioxo-1-propyl-5H-pyrrolo[3,2-d]pyrimidin-6-yl)phenoxy]acetamide
Molecular weight460.534
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.5
SynonymsSCHEMBL6510258
Inchi KeyADWOSTXXECVYGD-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28N4O4/c1-4-14-30-22-15-21(27-24(22)25(32)29(3)26(30)33)19-10-12-20(13-11-19)34-17-23(31)28(2)16-18-8-6-5-7-9-18/h5-13,15,27H,4,14,16-17H2,1-3H3
PubChem CID11496303
ChEMBLCHEMBL201847
IUPHARN/A
BindingDBN/A
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
3185Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
3184Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332

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