CHEMBL1650380


SMILES CCC(=O)Nc1cc(-c2ccc3c(c2)OCO3)nc(-c2ccc3c(c2)OCO3)n1
InChIKey FPGLLUINTXSLFA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 391.1

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
A3 AA3R Human Adenosine A pKi 7.84 7.84 7.84 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.59 5.59 5.59 ChEMBL
A1 AA1R Human Adenosine A pKi 8.28 8.28 8.28 ChEMBL
A2B AA2BR Human Adenosine A pKi 5.78 5.78 5.78 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database