CHEMBL129903


SMILES NCCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIKey XZUQLQNOMFGRFJ-FLNNQWSLSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 4
Molecular weight (Da) 323.1

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
oxoglutarate OXGR1 Rat Oxoglutarate A pKi 6.78 6.78 6.78 ChEMBL
A3 AA3R Rat Adenosine A pKi 4.83 6.33 7.83 ChEMBL
A3 AA3R Human Adenosine A pKi 4.71 6.29 8.02 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.51 7.29 8.44 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database