CHEMBL489640


SMILES OC[C@H]1O[C@@H](n2cnc3c(NC4CC5CCC4C5)ncnc32)[C@H](O)[C@@H]1O
InChIKey YKPCEENRZZBDMC-STHLEMNDSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 4
Molecular weight (Da) 361.2

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
A1 AA1R Guinea pig Adenosine A pKi 9.15 9.32 9.49 ChEMBL
A1 AA1R Rat Adenosine A pKi 9.04 9.3 9.38 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.31 5.31 5.31 ChEMBL
A3 AA3R Human Adenosine A pKi 7.0 7.0 7.0 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.9 5.9 5.9 ChEMBL
A1 AA1R Human Adenosine A pKi 9.27 9.27 9.27 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database