CHEMBL244562


SMILES O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccc(-c2cccc(=O)[nH]2)cc1
InChIKey GTRAXVNCZVAHOO-OWOJBTEDSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 496.1

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-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.97 7.97 7.97 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.53 7.53 7.53 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.22 9.22 9.22 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.81 7.81 7.81 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.63 7.63 7.63 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pIC50 9.0 9.0 9.0 ChEMBL
D2 DRD2 Human Dopamine A pIC50 7.39 7.39 7.39 ChEMBL