CHEMBL3314918


SMILES CC(C)Nc1ncc(C(=O)O)c2nc(-c3ccco3)nn12
InChIKey XCVQRDMKSKEIRQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 287.1

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 4.76 4.76 4.76 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.12 5.12 5.12 ChEMBL
A1 AA1R Human Adenosine A pKi 5.35 5.35 5.35 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database