CHEMBL147961


SMILES OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(-n4cncn4)cc23)CC1)c1ccccc1
InChIKey IYKHNVFYEXEGFE-SANMLTNESA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 9
Molecular weight (Da) 444.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pIC50 6.4 6.4 6.4 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pEC50 8.13 8.13 8.13 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pIC50 8.39 8.39 8.39 ChEMBL