CHEMBL3827598


SMILES CCCCn1c(=O)c2c(nc3n2CCCN3c2ccc(OCCN(C)C)cc2)n(CCCC)c1=O
InChIKey KKTVRWXNIYLETN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 0
Rotatable bonds 11
Molecular weight (Da) 482.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Rat Adenosine A pKi 7.25 7.25 7.25 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.99 5.99 5.99 ChEMBL
A1 AA1R Human Adenosine A pKi 6.27 6.27 6.27 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.98 5.98 5.98 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database