CHEMBL3759084


SMILES COc1ccc2ccc3oc(CNC(=O)CF)cc3c2c1
InChIKey UROMGDLPCGUXCO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 287.1

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 9.15 9.15 9.15 ChEMBL
MT1 MTR1A Human Melatonin A pKi 8.24 8.24 8.24 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 8.96 8.96 8.96 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 8.02 8.02 8.02 ChEMBL