SIBENADET


SMILES O=S(=O)(CCCOCCc1ccccc1)CCNCCc1ccc(O)c2nc(O)sc12
InChIKey DBCKRBGYGMVSTI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 13
Molecular weight (Da) 464.1

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
β1 ADRB1 Human Adrenoceptors A pKi 5.41 5.41 5.41 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.4 8.4 8.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Human Adrenoceptors A pEC50 9.2 9.2 9.2 ChEMBL
D2 DRD2 Human Dopamine A pIC50 7.0 7.0 7.0 ChEMBL
D2 DRD2 Human Dopamine A pEC50 8.35 8.52 8.7 ChEMBL