CHEMBL175734


SMILES O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1cc2ccccc2s1
InChIKey KKTITOSWJRVWOF-ONEGZZNKSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 459.1

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
D4 DRD4 Human Dopamine A pKi 5.75 5.75 5.75 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.76 5.76 5.76 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.75 8.22 8.96 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.41 6.41 6.41 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.61 6.76 6.83 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pIC50 8.02 8.02 8.02 ChEMBL
D2 DRD2 Human Dopamine A pIC50 6.59 6.59 6.59 ChEMBL