CHEMBL175934


SMILES COc1cc2nc(N3CCN(C(=O)C4CCSS4)CC3)nc(N)c2cc1OC
InChIKey PUSDBRIZNFZIFK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 421.1

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
α1B ADA1B Rat Adrenoceptors A pKd 8.76 8.76 8.76 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 7.73 7.73 7.73 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.31 9.31 9.31 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.09 9.09 9.09 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 9.27 9.27 9.27 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database