CHEMBL521826
SMILES | COC(=O)Nc1ccc2occ(CCNC(=O)C(C)C)c2c1 |
InChIKey | CQWNTRFWWAONMJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 304.1 |
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 |
MT2 | MTR1B | Human | Melatonin | A | pIC50 | 5.34 | 5.34 | 5.34 | ChEMBL |
MT1 | MTR1A | Human | Melatonin | A | pIC50 | 5.27 | 5.27 | 5.27 | ChEMBL |