CHEMBL10873


SMILES C=CCn1c(=O)c2[nH]c(-c3ccccc3)nc2n(C)c1=O
InChIKey MJCQAXMJLOGLCR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 282.1

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
A2B AA2BR Rat Adenosine A pKi 6.76 6.76 6.76 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.72 5.72 5.72 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.52 6.76 7.0 ChEMBL
A2B AA2BR Human Adenosine A pKi 7.43 7.43 7.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Bovine Adenosine A pIC50 8.4 8.4 8.4 ChEMBL