CHEMBL4877442
| SMILES | CCC[C@@H]1CN([C@H](Cc2ccccc2)N2CCC[C@H]2CN2C(=N)NC[C@H]2C(C)C)C(=N)N1CC12CC3CC(CC(C3)C1)C2 |
| InChIKey | XLUWJXRVETXPPG-GGJGGFGGSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 11 |
| Molecular weight (Da) | 587.5 |
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 |
| MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 5.18 | 5.18 | 5.18 | ChEMBL |
| MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.17 | 5.17 | 5.17 | ChEMBL |
| MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 5.7 | 5.7 | 5.7 | ChEMBL |