CHEMBL1182196


SMILES COc1ccc2ccccc2c1OCCNC[C@@H]1COc2cc3c(cc2O1)CCCC3
InChIKey YCHPAWYLSNTMMD-OAQYLSRUSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
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
α1A ADA1A Human Adrenoceptors A pKi 6.49 6.49 6.49 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 5.44 5.44 5.44 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.26 6.26 6.26 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 6.02 6.02 6.02 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database