CHEMBL3981581
| SMILES | N=C(N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H](NC(=O)C2CCCCC2)CCC(=O)NCC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(N)=O)NC1=O |
| InChIKey | CAXNNMYXBQZZIP-LFSOJSGESA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 13 |
| Rotatable bonds | 15 |
| Molecular weight (Da) | 964.5 |
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 |
| MC1 | MSHR | Human | Melanocortin | A | pKi | 10.6 | 10.6 | 10.6 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 6.78 | 6.78 | 6.78 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |