CHEMBL1940403


SMILES OC1(c2ccc(Cl)cc2)CCN(CCCSc2ccc(F)cc2)CC1
InChIKey FGTGRXMIFIZGBG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 379.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D5 DRD5 Human Dopamine A pKi 6.95 6.95 6.95 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 5.98 5.98 5.98 ChEMBL
H1 HRH1 Human Histamine A pKi 6.94 6.94 6.94 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.74 7.03 7.31 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.06 8.34 8.68 ChEMBL
D2 DRD2 Human Dopamine A pKd 8.71 8.71 8.71 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.5 6.81 7.13 ChEMBL
D4 DRD4 Rat Dopamine A pKi 6.61 7.62 8.62 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.03 7.08 7.14 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.1 6.1 6.1 ChEMBL
D1 DRD1 Human Dopamine A pKi 7.57 7.57 7.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database