CHEMBL42558


SMILES COc1cccc(OC)c1OCCNCCOc1ccccc1Cc1ccccc1
InChIKey ONMIMCVGCGOVHM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 12
Molecular weight (Da) 407.2

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
α1D ADA1D Rat Adrenoceptors A pKd 7.78 7.78 7.78 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKd 7.17 7.17 7.17 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.55 8.55 8.55 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 7.23 7.35 7.47 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.44 8.44 8.44 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.4 9.4 9.4 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.97 7.97 7.97 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database