CHEMBL4061566
| SMILES | CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O |
| InChIKey | XTNWQOXFVSNCOT-ZLCORKTQSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 12 |
| Rotatable bonds | 15 |
| Molecular weight (Da) | 983.5 |
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 | Human | Melanocortin | A | pEC50 | 9.03 | 9.03 | 9.03 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 8.29 | 8.29 | 8.29 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 9.47 | 9.47 | 9.47 | ChEMBL |