CHEMBL4846505


SMILES CCOc1nc2cc(Cl)c(OC)cc2n1CCCNC(C)=O
InChIKey IYSSQVBXXUIIGE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 325.1

Drug properties

Molecular type Small molecule
Endogenous/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 8.8 8.8 8.8 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.89 7.89 7.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.52 9.52 9.52 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 8.67 8.85 9.03 ChEMBL