CHEMBL80132


SMILES COc1ccccc1N1CCN(CCNc2cc(C)nn(C)c2=O)CC1
InChIKey COXFKNBPMUTWPD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 357.2

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 7.48 7.48 7.48 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.73 7.73 7.73 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.75 7.75 7.75 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.49 7.49 7.49 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database