CHEMBL1081039


SMILES O=C(Nc1ccc(-c2ccncc2)c(-c2ccccn2)n1)C1CC1
InChIKey OHTMLKHQLZWGCY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 316.1

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
A2B AA2BR Human Adenosine A pKi 7.33 7.33 7.33 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.06 6.06 6.06 ChEMBL
A1 AA1R Human Adenosine A pKi 6.03 6.03 6.03 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database