CHEMBL1760945


SMILES COc1ccc2ccn(CCNC(C)=O)c2n1
InChIKey GPYJQMJXDIABBK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
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 9.22 9.22 9.22 ChEMBL
MT1 MTR1A Human Melatonin A pKi 8.85 8.85 8.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 8.68 8.68 8.68 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 8.4 8.4 8.4 ChEMBL