CHEMBL3317574


SMILES Nc1nc(CCCc2ccccc2)nc2cn(-c3ccccc3)nc12
InChIKey QXNZRRSDCMNJDB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 329.2

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 6.37 7.04 7.26 ChEMBL
A1 AA1R Human Adenosine A pKi 8.28 8.28 8.28 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Human Adenosine A pIC50 6.37 6.37 6.37 ChEMBL
A1 AA1R Human Adenosine A pIC50 7.37 7.37 7.37 ChEMBL
A2B AA2BR Human Adenosine A pIC50 6.37 6.37 6.37 ChEMBL