CHEMBL2113475


SMILES CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4ccco4)ncnc32)[C@H](O)[C@@H]1O
InChIKey LPDCHGHGIIEPMA-MEQWQQMJSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 374.1

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 Rat Adenosine A pKi 6.14 6.14 6.14 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.21 5.21 5.21 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.07 5.07 5.07 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database