CHEMBL196817


SMILES COc1cccc(OC)c1OCCNCCOc1ccccc1OCc1ccc([N+](=O)[O-])cc1
InChIKey ZWJVFWQBNXKWES-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 14
Molecular weight (Da) 468.2

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 9.4 9.4 9.4 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.9 8.9 8.9 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 10.3 10.3 10.3 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.93 7.93 7.93 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database