CHEMBL558890


SMILES COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)[C@@H]4CCCC[C@@H]43)nc(N)c2cc1OC
InChIKey RZKGYUBITDXCBT-WEAPTXNRSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 505.2

Drug properties

Molecular type Small molecule
Endogenous/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 8.85 8.85 8.85 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.47 8.47 8.47 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.31 9.31 9.31 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database