CHEMBL4846261
| SMILES | CC(C)[C@@H]1CNC(=N)N1C[C@@H]1CCCN1[C@@H](CC1CCCCC1)N1C[C@@H]([C@@H](C)O)N(CC23CC4CC(CC(C4)C2)C3)C1=N |
| InChIKey | OKZXFXHBCZJFEJ-OUQQWPLESA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 595.5 |
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 | 5.8 | 5.8 | 5.8 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 6.7 | 6.7 | 6.7 | ChEMBL |
| MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 6.43 | 6.43 | 6.43 | ChEMBL |
| MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 6.22 | 6.22 | 6.22 | ChEMBL |