CHEMBL289413


SMILES CCCn1c(=O)c2[nH]c(-c3ccccc3)cc2n(CCC)c1=O
InChIKey UBJAFKSHHKGNMT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 311.2

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
A1 AA1R Rat Adenosine A pKi 7.89 7.89 7.89 ChEMBL
A3 AA3R Human Adenosine A pKi 7.02 7.02 7.02 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.19 6.19 6.19 ChEMBL
A1 AA1R Human Adenosine A pKi 7.47 7.47 7.47 ChEMBL
A2B AA2BR Human Adenosine A pKi 6.64 6.64 6.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database