CHEMBL4563944


SMILES COc1ccccc1N1CCN(CCCNC(=O)NN(Cc2ccccc2)c2ccc(F)cc2)CC1
InChIKey MTISNBALOIDBIX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 491.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pKi 9.26 9.26 9.26 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.6 7.6 7.6 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.18 8.27 8.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pIC50 7.31 7.31 7.31 ChEMBL
D4 DRD4 Human Dopamine A pEC50 6.47 7.61 8.74 ChEMBL