CHEMBL338015


SMILES COc1cccc(N2CCN(C(=O)COc3ccc4cccc(N5CCN(C)CC5)c4c3)CC2)c1OC
InChIKey JHJZWCFGCZBIET-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 504.3

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
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 9.36 9.36 9.36 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 9.21 9.21 9.21 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.87 7.87 7.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pEC50 7.52 7.52 7.52 ChEMBL