CHEMBL493424
SMILES | C=CCC(=O)NCCc1coc2ccc(NC(=O)OC)cc12 |
InChIKey | UOEGGYOPOMYPQQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 302.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MT1 | MTR1A | Human | Melatonin | A | pIC50 | 5.57 | 5.57 | 5.57 | ChEMBL |
MT2 | MTR1B | Human | Melatonin | A | pIC50 | 6.25 | 6.25 | 6.25 | ChEMBL |