CHEMBL220221


SMILES COc1ccccc1N1CCN(CCn2c(C)nc3c(sc4ccccc43)c2=O)CC1
InChIKey KRIXMAGTZZHFLF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 434.2

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 Human Adrenoceptors A pKi 7.76 7.76 7.76 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.4 9.4 9.4 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.83 8.83 8.83 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database