CHEMBL24461


SMILES Cc1noc(NS(=O)(=O)c2ccccc2-c2ccc(-c3ncco3)cc2)c1C
InChIKey LJGUZUROJOJEMI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 395.1

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
ETB EDNRB Rat Endothelin A pKi 5.72 5.72 5.72 ChEMBL
ETA EDNRA Rat Endothelin A pKi 8.85 8.85 8.85 ChEMBL
ETB EDNRB Human Endothelin A pKi 4.73 4.73 4.73 ChEMBL
ETA EDNRA Human Endothelin A pKi 8.85 8.85 8.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database