CHEMBL100004


SMILES CCO/C(O)=C1/C(C)=NC(C)=C(C(=O)OCCSc2ccccc2)C1C
InChIKey CUHAMGYOMBKPLA-HTXNQAPBSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 375.2

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
PAF PTAFR Guinea pig Platelet-activating factor A pKi 7.16 7.16 7.16 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.19 5.19 5.19 ChEMBL
A3 AA3R Human Adenosine A pKi 5.25 5.25 5.25 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.15 5.15 5.15 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database