MRS928


SMILES COc1cc(OC)c2c(c1)oc(c(c2=O)OC)c1ccccc1
InChIKey CBTHKWVPSIGKMI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 312.1

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
A2A AA2AR Human Adenosine A pKi 5.2 5.2 5.2 Guide to Pharmacology
A1 AA1R Rat Adenosine A pKi 6.3 6.3 6.3 Guide to Pharmacology
A2A AA2AR Rat Adenosine A pKi 5.19 5.19 5.19 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.29 6.29 6.29 ChEMBL
A3 AA3R Human Adenosine A pKi 5.92 5.92 5.92 ChEMBL
A3 AA3R Human Adenosine A pKi 5.9 5.9 5.9 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database