CHEMBL187458


SMILES c1ccc(Nc2nc3ncnc-3c(NC3CCCCCC3)[nH]2)cc1
InChIKey YDYCGADXGCIRTH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 322.2

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 7.38 7.38 7.38 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.38 5.38 5.38 ChEMBL
A1 AA1R Human Adenosine A pKi 5.76 5.76 5.76 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database