CHEMBL70740


SMILES O=S1(=O)CCCc2cccc(NCC3=NCCN3)c21
InChIKey WAXAHQBOIDNYSY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 279.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pKi 5.67 5.67 5.67 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 5.57 5.57 5.57 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.21 6.21 6.21 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.1 6.1 6.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2C ADA2C Human Adrenoceptors A pEC50 5.2 5.2 5.2 ChEMBL