MRS1505


SMILES CCCOC(=O)c1c(nc(c(c1CC)C(=O)SCCC)CC)c1cccc(c1)Cl
InChIKey RPTCJTNYKDJGHU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 9
Molecular weight (Da) 433.1

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
A3 AA3R Human Adenosine A pKi 8.1 8.1 8.1 Guide to Pharmacology
A3 AA3R Rat Adenosine A pKi 6.09 6.09 6.09 ChEMBL
A2A AA2AR Rat Adenosine A pKi 4.62 4.62 4.62 ChEMBL
A3 AA3R Human Adenosine A pKi 8.1 8.1 8.1 ChEMBL
A1 AA1R Rat Adenosine A pKi 4.38 4.38 4.38 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database