CIRSIMARITIN


SMILES COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC
InChIKey ZIIAJIWLQUVGHB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 314.1

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 Rat Adenosine A pKi 5.52 5.52 5.52 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.92 5.92 5.92 ChEMBL
A3 AA3R Human Adenosine A pKi 5.76 5.76 5.76 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database