CHEMBL3828401


SMILES CCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCCN(CC)CC)cc2)n(CCC)c1=O
InChIKey BOIXVSBQJYQUBQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 0
Rotatable bonds 13
Molecular weight (Da) 510.3

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
A2A AA2AR Rat Adenosine A pKi 6.18 6.18 6.18 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.46 6.46 6.46 ChEMBL
A2B AA2BR Human Adenosine A pKi 6.47 6.47 6.47 ChEMBL
A3 AA3R Human Adenosine A pKi 6.2 6.2 6.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database