CHEMBL71865


SMILES O=C(NC/C=C\CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccccc1
InChIKey DHOCETPWLQILEE-PLNGDYQASA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 403.1

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
D3 DRD3 Rat Dopamine A pKi 8.31 8.31 8.31 ChEMBL
D2 DRD2 Rat Dopamine A pKi 7.7 7.7 7.7 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.58 8.99 9.4 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.82 8.21 8.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pIC50 8.22 8.22 8.22 ChEMBL
D2 DRD2 Human Dopamine A pIC50 8.13 8.13 8.13 ChEMBL