CHEMBL1779806


SMILES O=C(NCCc1c(Sc2ccc(F)cc2)sc2ccc(F)cc12)C1CCC1
InChIKey HOEKPTBRWZYWIL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 403.1

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 6.71 6.71 6.71 ChEMBL
MT1 MTR1A Human Melatonin A pKi 6.04 6.04 6.04 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database