Ligand Data
Ligand
Name | CHEMBL218708 |
SMILES | COc1cccc(/C(=C/CNC(C)=O)c2ccccc2)c1 |
InChIKey | SJNURYXTMIYOKB-WOJGMQOQSA-N |
Type | small-molecule |
External Links |
Structure
Properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight | 281.1 |
Bioactivity
Receptor | Affinity (nM) | Potency (nM) | ||||||||
---|---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
MT2 | MTR1B | Human | Melatonin | A (Rhodopsin) | 2.5 | 2.5 | 2.5 | |||
MT1 | MTR1A | Human | Melatonin | A (Rhodopsin) | 230 | 230 | 230 |