CHEMBL137969


SMILES COc1c[nH]c2ncc(CCNC(C)=O)c-2c1
InChIKey COGBYVKHQGKYBA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 233.1

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 6.93 6.93 6.93 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.4 7.4 7.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 6.42 6.42 6.42 ChEMBL
MT1 MTR1A Human Melatonin A pIC50 6.9 6.9 6.9 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 5.96 5.96 5.96 ChEMBL