CHEMBL457102


SMILES O=C(c1ccccc1)c1sc(NCCc2cccs2)nc1-c1ccco1
InChIKey GHMVNUPBBMBPQG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 380.1

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
A2A AA2AR Human Adenosine A pKi 7.92 7.92 7.92 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.92 7.92 7.92 PDSP Ki database
A1 AA1R Human Adenosine A pKi 5.17 5.17 5.17 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database