CHEMBL3739922


SMILES CCCn1c(Br)nc2c(N)nc(NCCCc3ccccc3)nc21
InChIKey GTYFGLCBNPFEEH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 388.1

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
A2A AA2AR Human Adenosine A pKi 6.55 6.55 6.55 ChEMBL
A1 AA1R Human Adenosine A pKi 6.23 6.23 6.23 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.2 5.2 5.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database