CHEMBL4291422


SMILES CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCc3ccccc3)cc2)n(CCCC)c1=O
InChIKey FNSZLPLAVPNAJY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 14
Molecular weight (Da) 586.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pKi 6.24 6.24 6.24 ChEMBL
A3 AA3R Human Adenosine A pKi 6.22 6.22 6.22 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.5 6.5 6.5 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.89 5.89 5.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database