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Ligand

NameCHEMBL3291305
Molecular formulaC20H21N5O
IUPAC name8-(furan-2-yl)-2-oct-1-ynyl-9-prop-2-ynylpurin-6-amine
Molecular weight347.422
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50018692
SCHEMBL15253099
Inchi KeyAMJBNGGDQPNIDK-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21N5O/c1-3-5-6-7-8-9-12-16-22-18(21)17-20(23-16)25(13-4-2)19(24-17)15-11-10-14-26-15/h2,10-11,14H,3,5-8,13H2,1H3,(H2,21,22,23)
PubChem CID57344114
ChEMBLCHEMBL3291305
IUPHARN/A
BindingDB50018692
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8934Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410

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