CHEMBL1774383


SMILES COc1ccccc1N1CCN(CC(F)CCNC(=O)c2ccc(-c3ccccn3)cc2)CC1
InChIKey DXTFDOIEUMNMMV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 462.2

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-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.31 7.31 7.31 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.69 7.69 7.69 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.69 5.69 5.69 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.41 6.41 6.41 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pEC50 7.14 7.14 7.14 ChEMBL
D3 DRD3 Human Dopamine A pIC50 6.16 6.29 6.41 ChEMBL