CHEMBL3580909


SMILES C=CCNC(=O)Cc1c[nH]c2ccc(OC)cc12
InChIKey BRKWQBQNZRMYKO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 244.1

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 8.31 8.31 8.31 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.77 7.77 7.77 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 6.88 6.88 6.88 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 6.28 6.28 6.28 ChEMBL