CHEMBL420965


SMILES c1ccc(CNC[C@@H]2CCN(CCc3c[nH]c4ccc(-n5cnnc5)cc34)C2)cc1
InChIKey JCFDYNJSFCXYRT-FQEVSTJZSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 400.2

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 7.33 7.36 7.43 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pEC50 9.03 9.08 9.1 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pIC50 9.22 9.27 9.3 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 5.36 5.36 5.36 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pIC50 8.27 8.27 8.27 ChEMBL