CHEMBL4458797


SMILES CC(C)NCC(O)COc1ccccc1CCCSCC(=O)NCCOCCOCCN
InChIKey KFWWDEAEUAATKO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 20
Molecular weight (Da) 471.3

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
β2 ADRB2 Human Adrenoceptors A pKi 8.54 8.54 8.54 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.54 5.54 5.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Human Adrenoceptors A pIC50 7.72 7.72 7.72 ChEMBL