CHEMBL4066279


SMILES COc1ccc2cccc([C@H](CO)CNC(=O)CF)c2c1
InChIKey UABQHOOBSITMAZ-LBPRGKRZSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 291.1

Drug properties

Molecular type Small molecule
Endogenous/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 7.28 7.28 7.28 ChEMBL
MT1 MTR1A Human Melatonin A pKi 6.46 6.46 6.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 7.6 7.6 7.6 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 5.98 5.98 5.98 ChEMBL