CHEMBL3769641


SMILES CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC45CC6CC(CC(O)(C6)C4)C5)ncnc32)[C@H](O)[C@@H]1O
InChIKey SGRMKEOJKLIHFE-DXZNPHBGSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 5
Molecular weight (Da) 458.2

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A3 AA3R Human Adenosine A pIC50 7.1 7.1 7.1 ChEMBL
A1 AA1R Human Adenosine A pIC50 7.43 7.43 7.43 ChEMBL
A1 AA1R Human Adenosine A pEC50 4.0 4.0 4.0 ChEMBL