CHEMBL4464861


SMILES Cc1cccc(NC(=O)CCN2CCC(c3ccccn3)CC2)c1
InChIKey TVMUAXPFJKYAST-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 323.2

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 Human Dopamine A pKi 7.12 7.12 7.12 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.52 5.9 6.29 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.23 6.16 7.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pIC50 5.2 5.31 5.42 ChEMBL
D4 DRD4 Human Dopamine A pEC50 6.46 6.46 6.46 ChEMBL
D3 DRD3 Human Dopamine A pEC50 6.01 6.01 6.01 ChEMBL
D2 DRD2 Human Dopamine A pEC50 5.61 6.46 7.3 ChEMBL
D2 DRD2 Human Dopamine A pIC50 5.12 5.12 5.12 ChEMBL