CHEMBL338606


SMILES COc1ccccc1N1CCN(CCCCNC(=O)/C=C/c2ccc(F)cc2)CC1
InChIKey ZIAICQQANCNQNU-JLHYYAGUSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 411.2

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
5-HT2A 5HT2A Pig 5-Hydroxytryptamine A pKi 6.48 6.48 6.48 ChEMBL
D1 DRD1 Pig Dopamine A pKi 5.96 5.96 5.96 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.37 7.37 7.37 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.16 9.32 9.47 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.57 7.64 7.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 8.41 8.41 8.41 ChEMBL
D2 DRD2 Human Dopamine A pEC50 8.77 8.77 8.77 ChEMBL