Chembl4205341

Chemical Properties

SMILES COCCOc1ccc(N2CCN(CCn3c(=O)n(C)c4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
Hydrogen bond acceptors 13
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight 533.3

Drug Properties

Type Small molecule
Endogenous No
Approved No
InChIKey DZAZOXNQTRLVNU-UHFFFAOYSA-N

Database Connections

External Links


Bioactivity

Receptor Experimental Data Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Rat Adenosine A pKi 9.55 9.55 9.55 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.7 9.04 9.38 ChEMBL
A1 AA1R Human Adenosine A pKi 5.77 5.77 5.77 ChEMBL