CHEMBL5818817


SMILES O[C@@H]1[C@H](O)CS[C@H]1c1nnc2c(NCc3cc(Cl)cc(Cl)c3)nccn12
InChIKey OMLGKEMOBJEFNY-JHJVBQTASA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 411.0

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
A2A AA2AR Human Adenosine A pKi 5.26 5.26 5.26 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A3 AA3R Human Adenosine A pIC50 6.26 6.26 6.26 ChEMBL