CHEMBL4175366


SMILES Cn1c(-c2ccccc2)nc2c(NC3CCCC3)ncnc21
InChIKey DZCYRAQDBABOGP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 293.2

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
A2B AA2BR Human Adenosine A pKi 5.07 5.07 5.07 ChEMBL
A3 AA3R Human Adenosine A pKi 6.07 6.07 6.07 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.3 6.3 6.3 ChEMBL
A1 AA1R Human Adenosine A pKi 8.55 8.55 8.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Human Adenosine A pIC50 7.85 7.85 7.85 ChEMBL