CHEMBL301726


SMILES COc1ccccc1N1CCN(CCn2nc(-c3ccccc3)c(C(C)=O)c(N)c2=O)CC1
InChIKey HPKLBVVRBBCHTN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 447.2

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 7.66 7.66 7.66 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.32 8.32 8.32 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.03 9.03 9.03 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.91 6.91 6.91 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database