CHEMBL6171552
| SMILES | N=C1NC[C@H](CCO)N1CCN(CCN1C[C@H](CCO)N(CCCC2CCCCC2)C1=N)CCN1C[C@H](Cc2c[nH]cn2)N(CCc2ccc(F)cc2)C1=N |
| InChIKey | QVBZBXDXVHGXMX-FSEITFBQSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 7 |
| Rotatable bonds | 22 |
| Molecular weight (Da) | 764.5 |
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 |
| MC4 | MC4R | Mouse | Melanocortin | A | pKd | 6.4 | 6.4 | 6.4 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 5.0 | 5.0 | 5.0 | ChEMBL |
| MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.87 | 5.87 | 5.87 | ChEMBL |
| MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 5.81 | 5.81 | 5.81 | ChEMBL |