CHEMBL216269


SMILES CCCN1C(=O)N2C[C@@H](C(C)C)N=C2c2[nH]c(C34CCC(O)(CC3)CC4)nc21
InChIKey WREHUVWNPSWCPW-YJPTXTSQSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 385.2

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
A2A AA2AR Rat Adenosine A pKi 5.96 5.96 5.96 ChEMBL
A1 AA1R Rat Adenosine A pKd 9.9 9.9 9.9 ChEMBL
A1 AA1R Rat Adenosine A pKi 8.4 8.4 8.4 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.7 5.7 5.7 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.8 5.8 5.8 ChEMBL
A1 AA1R Human Adenosine A pKi 7.46 7.46 7.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database