CHEMBL196476


SMILES COc1cccc2cc(C(=O)NCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)oc12
InChIKey OVCZXWAILUTIOQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 475.1

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
D4 DRD4 Rat Dopamine A pKi 6.43 6.43 6.43 ChEMBL
D3 DRD3 Rat Dopamine A pKi 9.89 9.89 9.89 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 6.96 6.96 6.96 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.14 6.14 6.14 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.14 6.14 6.14 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.74 6.74 6.74 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.89 9.89 9.89 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.43 6.43 6.43 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.89 9.89 9.89 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database