CHEMBL366042
| SMILES | CC(C)(N)C/N=C(\Nc1ccc(C(=O)NCCc2ccc(Cl)cc2Cl)cc1)NC1CCCCC1 |
| InChIKey | VOAHDPCQCTZCKL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 503.2 |
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 |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 8.28 | 8.28 | 8.28 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 5.89 | 5.89 | 5.89 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.28 | 6.28 | 6.28 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 5.54 | 5.54 | 5.54 | ChEMBL |