CHEMBL3758717


SMILES COc1ccc2ccc3oc(CNC(C)=O)cc3c2c1
InChIKey OLPXPLWYIHZBLK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 269.1

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 9.4 9.4 9.4 ChEMBL
MT1 MTR1A Human Melatonin A pKi 8.68 8.68 8.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.01 9.01 9.01 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 8.11 8.11 8.11 ChEMBL