CHEMBL4089965


SMILES COc1ccc2cccc(CCC(=O)NS(C)(=O)=O)c2n1
InChIKey VLVYAYQOCLLVBD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 308.1

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
MT1 MTR1A Human Melatonin A pKi 8.3 8.3 8.3 ChEMBL
MT2 MTR1B Human Melatonin A pKi 10.52 10.52 10.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.1 9.1 9.1 ChEMBL