CHEMBL550313


SMILES CCCn1c(=O)c2[nH]c3cccnc3c2n(CCC)c1=O
InChIKey RAUCYLZBLWPEFM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 286.1

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
A1 AA1R Human Adenosine A pKi 6.88 6.88 6.88 PDSP Ki database
A1 AA1R Human Adenosine A pKi 6.88 6.88 6.88 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.24 6.24 6.24 PDSP Ki database
A2A AA2AR Human Adenosine A pKi 6.24 6.24 6.24 ChEMBL
A3 AA3R Human Adenosine A pKi 7.77 7.77 7.77 PDSP Ki database
A3 AA3R Human Adenosine A pKi 7.78 7.78 7.78 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database