Chembl194493


SMILES O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccc([N+](=O)[O-])cc1
InChIKey DWDPBNBMFRTKEL-OWOJBTEDSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 448.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pKi 8.46 8.92 9.15 ChEMBL
D3 DRD3 Human Dopamine A pIC50 8.66 8.66 8.66 ChEMBL
D3 DRD3 Human Dopamine A pEC50 8.66 8.66 8.66 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.51 7.64 7.71 ChEMBL
D2 DRD2 Human Dopamine A pIC50 7.86 7.86 7.86 ChEMBL
D2 DRD2 Human Dopamine A pEC50 7.86 7.86 7.86 ChEMBL