CHEMBL259130


SMILES CC(C)Cn1c(=O)c2[nH]c(-c3cnn(Cc4cccc(F)c4)c3)nc2n(C)c1=O
InChIKey NAJBDLXZHBQZJD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 396.2

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
A2B AA2BR Human Adenosine A pKi 7.22 7.22 7.22 ChEMBL
A3 AA3R Human Adenosine A pKi 6.97 6.97 6.97 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.52 6.52 6.52 ChEMBL
A1 AA1R Human Adenosine A pKi 6.45 6.45 6.45 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database