CHEMBL2398484


SMILES C[C@@H](O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
InChIKey HMSFWLUZEDMXMM-SSDOTTSWSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 288.1

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
A2A AA2AR Human Adenosine A pKi 8.1 8.11 8.12 ChEMBL
A1 AA1R Human Adenosine A pKi 7.47 7.47 7.47 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2A AA2AR Human Adenosine A pIC50 6.38 6.38 6.38 ChEMBL