CHEMBL63799


SMILES Fc1cccc(CCC2(F)CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1
InChIKey GTODTBQKTGFPQO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 449.2

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 7.66 7.66 7.66 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pEC50 6.36 6.36 6.36 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pEC50 8.29 8.29 8.3 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pIC50 9.12 9.13 9.15 ChEMBL