CHEMBL1836317


SMILES CS(=O)(=O)NC[C@H]1CC[C@H](Nc2nc3c(s2)CCSc2ccccc2-3)CC1
InChIKey UWSBTSAJZMIHBL-HDJSIYSDSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 423.1

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
Y5 NPY5R Rat Neuropeptide Y A pKi 8.85 8.85 8.85 ChEMBL
Y5 NPY5R Human Neuropeptide Y A pKi 8.82 8.82 8.82 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.79 5.79 5.79 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.4 6.51 6.61 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 5.12 5.12 5.12 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.32 6.32 6.32 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.3 6.3 6.3 ChEMBL
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.98 5.98 5.98 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Y5 NPY5R Human Neuropeptide Y A pIC50 8.74 8.74 8.74 ChEMBL