CHEMBL3890609


SMILES OCc1cc(F)c(F)cc1CNc1nc(Cl)nc2c1ncn2[C@@]12C[C@H](O)[C@H](O)[C@@H]1C2
InChIKey FCXFKNMITJNUQK-QUPAPELASA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 437.1

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
A3 AA3R Human Adenosine A pKi 7.39 7.39 7.39 ChEMBL
A1 AA1R Human Adenosine A pKi 5.72 5.72 5.72 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.12 5.12 5.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database