CHEMBL3342855


SMILES COc1ccccc1N1CCN(CC2COC3(CCS(=O)(=O)CC3)O2)CC1
InChIKey BQWXWYVQIVCGBP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 396.2

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
α1B ADA1B Human Adrenoceptors A pKi 6.54 6.54 6.54 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.01 8.01 8.01 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.29 7.29 7.29 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.09 7.09 7.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database