CHEMBL2443006


SMILES COc1ccccc1N1CCN(Cc2cn(-c3ccc(OCCOCCOCCF)cc3)nn2)CC1
InChIKey NJTHDWRTKWUXOY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 0
Rotatable bonds 14
Molecular weight (Da) 499.3

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
β1 ADRB1 Pig Adrenoceptors A pKi 6.92 6.92 6.92 ChEMBL
D1 DRD1 Pig Dopamine A pKi 4.37 4.37 4.37 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.0 7.0 7.0 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.7 6.7 6.7 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.54 5.55 5.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database