CHEMBL223829


SMILES CC(Oc1ccccc1-c1cccs1)C1=NCCN1
InChIKey LJLYHROZJUTILK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 272.1

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
α2B ADA2B Human Adrenoceptors A pKi 6.67 6.67 6.67 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.77 7.77 7.77 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 7.14 7.14 7.14 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pEC50 6.0 6.0 6.0 ChEMBL
α2A ADA2A Human Adrenoceptors A pEC50 7.38 7.38 7.38 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 7.23 7.23 7.23 ChEMBL