CHEMBL137879


SMILES CCn1cc2c(nc(N)n3nc(-c4ccco4)nc23)n1
InChIKey KHXVFMOMODNRAN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 269.1

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
A2A AA2AR Rat Adenosine A pKi 7.95 7.95 7.95 ChEMBL
A1 AA1R Rat Adenosine A pKi 7.02 7.02 7.02 ChEMBL
A2B AA2BR Human Adenosine A pKi 7.19 7.19 7.19 ChEMBL
A3 AA3R Human Adenosine A pKi 5.42 5.96 6.48 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.71 8.71 8.72 ChEMBL
A1 AA1R Human Adenosine A pKi 8.3 8.3 8.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database