CHEMBL3597643


SMILES O=C(NCCCCN1CCN(c2cccc3ccccc23)CC1)c1cc2ccccc2[nH]1
InChIKey PVDOYAVBGNHRBV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 426.2

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
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.14 7.14 7.14 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.93 9.93 9.93 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.26 7.26 7.26 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.08 7.08 7.08 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.89 7.89 7.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pIC50 8.1 8.1 8.1 ChEMBL
D3 DRD3 Human Dopamine A pEC50 6.85 6.85 6.85 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pEC50 6.6 6.6 6.6 ChEMBL
D2 DRD2 Human Dopamine A pIC50 7.06 7.06 7.06 ChEMBL
D2 DRD2 Human Dopamine A pEC50 7.12 7.12 7.12 ChEMBL