CHEMBL150743


SMILES CC1=C(C(N)=O)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)NCCCN2CCCCC2)=C(C)N1
InChIKey QWRDGJNWAMEFDT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 8
Molecular weight (Da) 441.2

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
α1A ADA1A Human Adrenoceptors A pKi 5.36 5.36 5.36 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 4.51 4.51 4.51 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 4.4 4.4 4.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database