CHEMBL13735


SMILES COc1ccccc1N1CCN(CCn2c(=O)[nH]c3sccc3c2=O)CC1
InChIKey HESSOZXPIKFUEI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 386.1

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
α1A ADA1A Bovine Adrenoceptors A pKi 9.74 9.74 9.74 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 9.64 9.64 9.64 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.91 8.91 8.91 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 9.28 9.28 9.28 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.51 9.51 9.51 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.46 9.46 9.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database