CHEMBL403280


SMILES CC(C)Oc1ccccc1N1CCN(C2CCC(NC(=O)Nc3ccc(F)cc3F)CC2)CC1
InChIKey NIQWPNGICRVKCM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 472.3

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
α1B ADA1B Human Adrenoceptors A pKi 6.32 6.72 7.12 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.58 8.07 8.57 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.85 8.18 8.51 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.45 8.3 9.16 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.32 6.72 7.12 PDSP Ki database
α1D ADA1D Human Adrenoceptors A pKi 7.58 8.13 8.57 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 7.45 8.3 9.16 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database