CHEMBL416013


SMILES CCn1c(=O)c2nc[nH]c2n(CC)c1=O
InChIKey GIMNFISWKTZFKJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 208.1

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
A2A AA2AR Guinea pig Adenosine A pKi 5.48 5.48 5.48 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.43 5.46 5.48 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.75 5.75 5.75 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.57 5.57 5.57 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Rat Adenosine A pIC50 5.19 5.19 5.19 ChEMBL