CHEMBL3759859


SMILES COc1ccc2ccc3oc(CCNC(=O)C4CC4)cc3c2c1
InChIKey VKYUOILGTCMHLV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 309.1

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 7.96 7.96 7.96 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.14 7.14 7.14 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 8.24 8.24 8.24 ChEMBL