CHEMBL1779807


SMILES O=C(CBr)NCCc1c(Sc2ccc(F)cc2)sc2ccc(F)cc12
InChIKey YYDDDHFJIVHFDU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 441.0

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
MT2 MTR1B Human Melatonin A pKi 8.28 8.28 8.28 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.66 7.66 7.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 8.14 8.14 8.14 ChEMBL