CHEMBL3648362


SMILES CC(=O)NCCC1CCc2ccc3nc(C)sc3c21
InChIKey JDFVYDLICOGWLH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 274.1

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 10.07 10.07 10.07 ChEMBL
MT1 MTR1A Human Melatonin A pKi 10.43 10.43 10.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pIC50 9.55 9.55 9.55 ChEMBL
MT1 MTR1A Human Melatonin A pIC50 9.82 9.82 9.82 ChEMBL