CHEMBL517886


SMILES Nc1nc(-c2ccco2)c2nnn(Cc3ccc(N)c(F)c3)c2n1
InChIKey HQQSMDYDRILQNC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 325.1

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
A2B AA2BR Human Adenosine A pKi 7.37 7.37 7.37 ChEMBL
A3 AA3R Human Adenosine A pKi 5.97 5.97 5.97 ChEMBL
A2A AA2AR Human Adenosine A pKi 9.15 9.15 9.15 ChEMBL
A1 AA1R Human Adenosine A pKi 6.92 6.92 6.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database