CHEMBL256597


SMILES CC(C)Oc1ccccc1N1CCN(C2CCC(NC(=O)Nc3c(Cl)cccc3Cl)CC2)CC1
InChIKey ZWNBANLWZZXEKO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 504.2

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
α1B ADA1B Human Adrenoceptors A pKi 6.54 6.92 7.3 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.8 8.2 8.59 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.48 7.85 8.21 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.26 7.79 8.33 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.54 6.92 7.3 PDSP Ki database
α1D ADA1D Human Adrenoceptors A pKi 7.48 8.02 8.59 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 7.26 7.79 8.33 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database