CHEMBL435218


SMILES O=C(NCCCCN1CCN(c2ccc(Cl)cc2Cl)CC1)c1cc2ccccc2o1
InChIKey GWZLKJUHKRQBRB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 445.1

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
α2A ADA2A Rat Adrenoceptors A pKi 5.72 5.72 5.72 ChEMBL
D3 DRD3 Rat Dopamine A pKi 9.39 9.39 9.39 ChEMBL
D1 DRD1 Rat Dopamine A pKi 5.12 5.12 5.12 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 6.11 6.11 6.11 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.39 6.39 6.39 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.04 6.04 6.04 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database