CHEMBL4289983
| SMILES | CCCC[C@H](NC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |
| InChIKey | KYDKNSTYQUOGNQ-ZXYZSCNASA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 7 |
| Rotatable bonds | 17 |
| Molecular weight (Da) | 660.3 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 6.55 | 6.55 | 6.55 | ChEMBL |
| MC1 | MSHR | Human | Melanocortin | A | pEC50 | 7.6 | 7.6 | 7.6 | ChEMBL |
| MC1 | MSHR | Human | Melanocortin | A | pIC50 | 6.61 | 6.61 | 6.61 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.5 | 6.5 | 6.5 | ChEMBL |