CHEMBL2326203
SMILES | CCC(=O)NCCCc1cc(OC)ccc1-c1cccc(OC)c1 |
InChIKey | ZNOFYIUJRHQQNE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 327.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MT2 | MTR1B | Human | Melatonin | A | pKi | 9.47 | 9.47 | 9.47 | ChEMBL |
MT1 | MTR1A | Human | Melatonin | A | pKi | 7.49 | 7.49 | 7.49 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MT2 | MTR1B | Human | Melatonin | A | pEC50 | 9.7 | 9.7 | 9.7 | ChEMBL |
MT1 | MTR1A | Human | Melatonin | A | pEC50 | 8.53 | 8.53 | 8.53 | ChEMBL |