CHEMBL4126860


SMILES CCCN(CCC)c1nc(N2CCN(C(=O)c3ccco3)[C@@H]3CCCC[C@@H]32)nc2cc(OC)c(OC)cc12
InChIKey PGMSQKAWALUURX-PKTZIBPZSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 0
Rotatable bonds 9
Molecular weight (Da) 521.3

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
α1D ADA1D Rat Adrenoceptors A pKd 7.23 7.23 7.23 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 9.89 9.89 9.89 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 10.2 10.2 10.2 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.73 8.73 8.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database