Chembl112065


SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIKey OJZXUFDBDMQATJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 443.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations D2

Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Pig Dopamine A pKi 6.24 6.24 6.24 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.57 7.57 7.57 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.1 8.58 9.8 ChEMBL
D3 DRD3 Human Dopamine A pKd 7.4 7.4 7.4 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.12 7.27 7.38 ChEMBL
D2 DRD2 Human Dopamine A pEC50 7.92 7.92 7.92 ChEMBL