CHEMBL495232
| SMILES | COC(=O)Nc1ccc2occ(CCNC(=O)C3CC3)c2c1 |
| InChIKey | KYSCWFKYUJDVHS-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| 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 |
| MT2 | MTR1B | Human | Melatonin | A | pIC50 | 5.23 | 5.23 | 5.23 | ChEMBL |
| MT1 | MTR1A | Human | Melatonin | A | pIC50 | 5.09 | 5.09 | 5.09 | ChEMBL |