CHEMBL3754496


SMILES C=CCN(CC=C)CCc1c[nH]c2ccc(F)cc12
InChIKey ALTKABGEMCJWJH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 258.2

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-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 6.32 6.32 6.32 ChEMBL
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.37 5.37 5.37 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.75 5.75 5.75 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 6.12 6.12 6.12 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.66 6.66 6.66 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.1 6.1 6.1 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.4 6.4 6.4 ChEMBL
H1 HRH1 Human Histamine A pKi 7.1 7.1 7.1 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 5.9 5.9 5.9 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.93 6.93 6.93 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.13 7.13 7.13 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.78 7.78 7.78 ChEMBL
H3 HRH3 Human Histamine A pKi 5.68 5.68 5.68 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.99 6.99 6.99 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.92 6.92 6.92 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.61 6.61 6.61 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.1 7.1 7.1 ChEMBL
κ OPRK Human Opioid A pKi 5.66 5.66 5.66 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.61 5.61 5.61 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database