CHEMBL346692


SMILES O=C(NCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cc2ccccc2[nH]1
InChIKey WIYPXJWKJSYBKF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 444.1

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
D3 DRD3 Rat Dopamine A pKi 9.21 9.21 9.21 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.77 5.77 5.77 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 5.78 5.78 5.78 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.81 8.71 9.18 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.51 7.51 7.51 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.51 6.59 6.99 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 10.59 10.59 10.59 ChEMBL