CHEMBL223451


SMILES CCCNc1c(C(=O)OCCC)cnc2c1cnn2CC(Cl)c1ccccc1
InChIKey WDOUIWVVHIIBTH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 400.2

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 Bovine Adenosine A pKi 6.84 6.84 6.84 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.86 5.86 5.86 ChEMBL
A1 AA1R Human Adenosine A pKi 6.8 6.8 6.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database