CHEMBL197796


SMILES COc1ccc(NC(=O)N2CCN(c3ccc(SC)cc3)CC2)cc1N1CCN(C)CC1
InChIKey BNXUKTBRYQQOIZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 455.2

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
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 7.78 7.78 7.78 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 6.48 6.48 6.48 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.94 5.94 5.94 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.05 6.05 6.05 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.88 5.88 5.88 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database