CHEMBL4127078


SMILES CCCCCC(=O)N1CCN(c2nc(N)c3cc(OC)c(OC)cc3n2)[C@@H]2CCCC[C@@H]21
InChIKey RGGIGJAIAGZDRS-RBUKOAKNSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 441.3

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
α1A ADA1A Human Adrenoceptors A pKi 8.24 8.24 8.24 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 9.04 9.04 9.04 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.43 8.43 8.43 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKd 6.81 6.81 6.81 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database