CHEMBL122401


SMILES CCCCNC(=O)c1ccc(Br)c(-n2nc(CCC)n(Cc3ccc(-c4ccccc4S(=O)(=O)NC(=O)c4cc(Cl)ccc4Cl)cc3F)c2=O)c1
InChIKey JKXFAOAAQSTEDR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 13
Molecular weight (Da) 815.1

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
AT2 AGTR2 Rat Angiotensin A pIC50 9.44 9.74 10.04 ChEMBL
AT1 AGTR1 Rabbit Angiotensin A pIC50 9.36 9.36 9.36 ChEMBL
AT2 AGTR2 Human Angiotensin A pIC50 8.7 8.7 8.7 ChEMBL
AT1 AGTR1 Human Angiotensin A pIC50 8.8 8.8 8.8 ChEMBL