CHEMBL3121722


SMILES Cn1c(=O)c2[nH]c(-c3ccc(OCCC4CCNCC4)cc3)nc2n(C)c1=O
InChIKey ZHRIQRKXGCFORG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 383.2

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 8.54 8.54 8.54 ChEMBL
A3 AA3R Human Adenosine A pKi 8.19 8.19 8.19 ChEMBL
A2A AA2AR Human Adenosine A pKi 9.54 9.54 9.54 ChEMBL
A1 AA1R Human Adenosine A pKi 8.88 8.88 8.88 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database