CHEMBL2113492


SMILES CCCCCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIKey HPUURONQWKICJL-BQVMBELUSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 6
Molecular weight (Da) 350.2

Drug properties

Molecular type Small molecule
Physiological/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 7.92 7.92 7.92 ChEMBL
A3 AA3R Rat Adenosine A pKi 5.25 5.25 5.25 ChEMBL
A2A AA2AR Rat Adenosine A pKi 6.22 6.22 6.22 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.01 6.01 6.01 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database