CHEMBL517502


SMILES COc1ccc2cc(-c3ccccc3CO)cc(CCNC(C)=O)c2c1
InChIKey WWCRUUZZXIRALU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 349.2

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
MT1 MTR1A Human Melatonin A pKi 8.23 8.23 8.23 ChEMBL
MT2 MTR1B Human Melatonin A pKi 8.73 8.73 8.73 PDSP Ki database
MT2 MTR1B Human Melatonin A pKi 8.73 8.73 8.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database