CHEMBL4848885


SMILES CCOc1nc2ccc(OC)cc2n1CCCNC(C)=O
InChIKey HJOUELOCKKMZBA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 291.2

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 8.35 8.35 8.35 ChEMBL
MT1 MTR1A Human Melatonin A pKi 8.96 8.96 8.96 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.46 9.46 9.46 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 9.74 10.09 10.44 ChEMBL