CHEMBL4291015


SMILES CCCCn1c(=O)c2c(nc3n2CCCN3CCc2ccc(OCC(=O)NCCCN(CC)CC)cc2)n(CCCC)c1=O
InChIKey FCICSYWLKUXKAR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 1
Rotatable bonds 18
Molecular weight (Da) 609.4

Drug properties

Molecular type Small molecule
Endogenous/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 6.5 6.5 6.5 ChEMBL
A1 AA1R Rat Adenosine A pKi 7.61 7.61 7.61 ChEMBL
A2B AA2BR Human Adenosine A pKi 6.9 6.9 6.9 ChEMBL
A3 AA3R Human Adenosine A pKi 6.61 6.61 6.61 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database