CHEMBL89934


SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(c2csc3cc(F)ccc23)CC1
InChIKey IWOQWCKSTOAOMQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 435.2

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
D1 DRD1 Rat Dopamine A pKi 5.56 5.56 5.56 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.28 6.28 6.28 ChEMBL
D4 DRD4 Human Dopamine A pKi 8.3 8.3 8.3 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.4 7.4 7.4 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.1 8.1 8.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Rat Dopamine A pIC50 5.92 5.92 5.92 ChEMBL
D4 DRD4 Human Dopamine A pIC50 7.54 7.54 7.54 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 7.21 7.21 7.21 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 7.77 7.77 7.77 ChEMBL