CHEMBL130162


SMILES CCCN1CN(CCC)c2[nH]c(-c3ccc(OCC(=O)NCCN)cc3)nc2C1=O
InChIKey PGNSFKOREZNFHJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 414.2

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 7.22 7.22 7.22 ChEMBL
A1 AA1R Rat Adenosine A pKi 8.92 8.92 8.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database