UCM 454


SMILES CCC(=O)NCc1cc2c(n1Cc1ccc(cc1)Cl)cccc2OC
InChIKey XXXKKZBZKUDKMA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 356.1

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 8.1 8.1 8.1 Guide to Pharmacology
MT2 MTR1B Human Melatonin A pKi 8.05 8.06 8.06 ChEMBL
MT1 MTR1A Human Melatonin A pKi 5.89 5.89 5.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database