CHEMBL5208415


SMILES Nc1nc(C(=O)NCc2cccnc2)cn2c1nc1ccccc12
InChIKey DMRGTSADNQMEHM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 318.1

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
A2A AA2AR Human Adenosine A pKi 9.07 9.07 9.07 ChEMBL
A1 AA1R Human Adenosine A pKi 8.12 8.12 8.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Human Adenosine A pIC50 6.76 6.76 6.76 ChEMBL
A2A AA2AR Human Adenosine A pEC50 8.87 8.87 8.87 ChEMBL