CHEMBL116827


SMILES COc1ccc(-n2nc3c(N)nc4c(N)cccc4n3c2=O)cc1
InChIKey JNRCICWEAQCTEH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 322.1

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
A3 AA3R Human Adenosine A pKi 7.66 7.66 7.66 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.98 5.98 5.98 ChEMBL
A1 AA1R Human Adenosine A pKi 6.73 6.73 6.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database