CHEMBL3287402


SMILES O=Cc1cc2cc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)ccn2n1
InChIKey BRJGIZVBTXYEBD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 8
Molecular weight (Da) 446.1

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
D1 DRD1 Human Dopamine A pKi 6.75 6.75 6.75 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.05 7.05 7.05 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.25 7.25 7.25 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.22 8.22 8.22 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.85 7.85 7.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 8.3 8.3 8.3 ChEMBL
D2 DRD2 Human Dopamine A pIC50 7.54 7.6 7.66 ChEMBL