CHEMBL256040


SMILES CC(C)Oc1ccccc1N1CCN(C2CCC(NC(=O)Nc3c(Cl)cc(Cl)cc3Cl)CC2)CC1
InChIKey IEMSLTPIYQZIGD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 538.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pKi 6.32 6.63 6.95 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.29 7.74 8.19 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.6 8.02 8.43 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.99 7.59 8.19 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.29 7.88 8.43 PDSP Ki database
α1B ADA1B Human Adrenoceptors A pKi 6.32 6.63 6.95 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 6.99 7.59 8.19 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database