CHEMBL1927088


SMILES COc1ccccc1N1CCN(CCCN/C(=N\C#N)c2ccccn2)CC1
InChIKey QDINHVYVESYLKG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 378.2

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 7.7 7.7 7.7 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 8.33 8.33 8.33 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.66 8.38 9.1 ChEMBL
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 8.79 8.79 8.79 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database