CHEMBL4451303


SMILES Cn1c(=O)c2c(nc3n2CCN([C@@H]2CCCc4ccccc42)C3)n(C)c1=O
InChIKey GEMWFQCNZGPNFF-OAHLLOKOSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 1
Molecular weight (Da) 365.2

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
A2A AA2AR Rat Adenosine A pKi 6.29 6.29 6.29 ChEMBL
A1 AA1R Rat Adenosine A pKi 7.0 7.0 7.0 ChEMBL
A3 AA3R Human Adenosine A pKi 4.85 4.85 4.85 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.22 6.22 6.22 ChEMBL
A1 AA1R Human Adenosine A pKi 6.41 6.41 6.41 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database