CHEMBL4852096


SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCNC(C)=O
InChIKey LRRDNGSYVNSAEO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 311.1

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 9.03 9.03 9.03 ChEMBL
MT1 MTR1A Human Melatonin A pKi 9.06 9.06 9.06 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.57 9.57 9.57 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 9.85 10.16 10.46 ChEMBL