CHEMBL4127811


SMILES Cc1nc2c(N)nc(NCCc3ccccc3)nc2s1
InChIKey YSKUWASMFFERQA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 285.1

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
A3 AA3R Human Adenosine A pKi 6.26 6.26 6.26 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.11 7.11 7.11 ChEMBL
A1 AA1R Human Adenosine A pKi 6.85 6.85 6.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pIC50 5.96 5.96 5.96 ChEMBL