ramelteon


SMILES CCC(=O)NCC[C@@H]1CCc2c1c1CCOc1cc2
InChIKey YLXDSYKOBKBWJQ-LBPRGKRZSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 259.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 7DB6 7VH0 7VGZ 6ME2 6ME9

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pKi 9.95 10.15 10.35 ChEMBL
MT1 MTR1A Human Melatonin A pKi 10.85 10.86 10.86 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.96 7.96 7.96 Drug Central
MT1 MTR1A Human Melatonin A pKi 10.9 10.9 10.9 Guide to Pharmacology
MT2 MTR1B Human Melatonin A pKi 7.98 7.98 7.98 Drug Central
MT2 MTR1B Human Melatonin A pKi 10.0 10.0 10.0 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database