CHEMBL578569


SMILES C=CCSc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1
InChIKey MPZZVNUKHSOLMW-WOUKDFQISA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 339.1

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
A2A AA2AR Rat Adenosine A pKi 4.85 5.33 5.82 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.27 6.27 6.27 ChEMBL
A3 AA3R Human Adenosine A pKi 5.18 5.18 5.18 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database