CHEMBL3415019


SMILES COc1ccccc1N1CCN(CCCNC(=O)c2cn(C)c3ccccc23)CC1
InChIKey ZAQWTEPNQWYHIK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 406.2

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
α1B ADA1B Rat Adrenoceptors A pKd 6.78 6.78 6.78 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 7.28 7.28 7.28 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database