CHEMBL5985967


SMILES CCn1c(=O)c2c(C)c(CN3CCNC3=O)sc2n(CC2CCO2)c1=O
InChIKey CDWIRFUAQXSUGR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 378.1

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
A2B AA2BR Human Adenosine A pKi 8.28 8.28 8.28 ChEMBL
A3 AA3R Human Adenosine A pKi 5.17 5.17 5.17 ChEMBL
A1 AA1R Human Adenosine A pKi 6.02 6.02 6.02 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.55 6.55 6.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database