CHEMBL95175


SMILES O=C1OCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(-c4ncccn4)cc23)CC1
InChIKey VROFQJNNYWWTGM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 485.2

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
α1B ADA1B Golden hamster Adrenoceptors A pKi 8.74 8.74 8.74 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 9.25 9.25 9.25 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 7.28 7.28 7.28 ChEMBL
D1 DRD1 Rat Dopamine A pKi 5.75 5.75 5.75 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 6.44 6.44 6.44 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.4 6.4 6.4 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.12 5.12 5.12 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.55 5.55 5.55 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.33 7.33 7.33 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database