CHEMBL516770


SMILES Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(O)c3)c2n1
InChIKey QTWZRFYFVZATOS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 3
Molecular weight (Da) 323.1

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
A1 AA1R Human Adenosine A pKi 6.6 6.6 6.6 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.8 8.8 8.8 ChEMBL
A2B AA2BR Human Adenosine A pKi 7.08 7.08 7.08 ChEMBL
A3 AA3R Human Adenosine A pKi 5.87 5.87 5.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database