CHEMBL301707


SMILES COc1ccccc1N1CCN(CCn2c(=O)[nH]c3c([nH]c4ccccc43)c2=O)CC1
InChIKey AQASGOHUMGAWJJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 419.2

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 Human Adrenoceptors A pKi 8.74 8.74 8.74 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 9.68 9.68 9.68 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.44 9.44 9.44 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.54 9.56 9.57 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.3 7.3 7.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database