CHEMBL4597530


SMILES CCCN(CCCCNC(=O)c1ccc(-c2ccccn2)cc1)C[C@@H]1C[C@H]1c1cc(F)ccc1OC
InChIKey OHSIGBOKYLDSHG-AZGAKELHSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 13
Molecular weight (Da) 489.3

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
D4 DRD4 Human Dopamine A pKi 6.24 6.24 6.24 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.31 5.31 5.31 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.95 5.95 5.95 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.39 8.39 8.39 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.87 5.87 5.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pIC50 4.84 4.84 4.84 ChEMBL
D3 DRD3 Human Dopamine A pEC50 6.9 7.67 8.45 ChEMBL