CHEMBL291303


SMILES COc1cc2[nH]c(=O)n(CCN3C[C@@H]4CCc5c(OC)cccc5[C@@H]4C3)c(=O)c2cc1OC
InChIKey IATJRNATRBECGI-HNAYVOBHSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 451.2

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 pKi 8.85 8.85 8.85 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKd 7.52 7.52 7.52 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.19 8.19 8.19 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 9.62 9.62 9.62 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 8.53 8.53 8.53 ChEMBL
α1A ADA1A Human Adrenoceptors A pKd 9.01 9.01 9.01 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database