CHEMBL445325


SMILES COc1cc2ncn(CCN3C[C@@H]4CCc5c(OC)cccc5[C@@H]4C3)c(=O)c2cc1OC
InChIKey VPUVFWFLLOJNOU-OXJNMPFZSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 435.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1D ADA1D Rat Adrenoceptors A pKi 8.11 8.11 8.11 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKd 7.07 7.07 7.07 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 7.82 7.82 7.82 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 9.57 9.57 9.57 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 8.97 8.97 8.97 ChEMBL
α1A ADA1A Human Adrenoceptors A pKd 9.23 9.23 9.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database