CHEMBL3580907


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

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 242.1

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 8.42 8.42 8.42 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.85 7.85 7.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 7.09 7.09 7.09 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 6.54 6.54 6.54 ChEMBL