CHEMBL327116


SMILES CCS(=O)(=O)Nc1ccc2c(c1)C(c1c[nH]cn1)CCC2
InChIKey BBMAPNYYKCUOGH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 305.1

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
α2B ADA2B Rat Adrenoceptors A pKi 7.65 7.65 7.65 ChEMBL
α1B ADA1B Golden hamster Adrenoceptors A pKi 5.87 5.87 5.87 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 5.69 5.69 5.69 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.64 7.64 7.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database