CHEMBL3828479


SMILES COc1cc(Nc2nc3c(N4CCCC4)ncnc3s2)cc(OC)c1OC
InChIKey NICBIAZGYVMWPV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 387.1

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
A3 AA3R Human Adenosine A pKi 5.89 5.89 5.89 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.99 6.99 6.99 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database