CHEMBL396638
| SMILES | NCCN(C(=O)COc1ccc2ccccc2c1)C1CCC2(CCCCC2)CC1 |
| InChIKey | XZBPEHLEYCPQBU-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 394.3 |
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 |
| MC1 | MSHR | Mouse | Melanocortin | A | pKi | 5.22 | 5.22 | 5.22 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 5.47 | 5.47 | 5.47 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 5.31 | 5.31 | 5.31 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |