CHEMBL238368
| SMILES | NCC1CCC(CN(C/C(Cl)=C/c2ccccc2)C(=O)CCCc2c[nH]c3ccccc23)CC1 |
| InChIKey | FNSWPCQCHDBPLU-ONUIUJJFSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 477.3 |
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 |
| MC1 | MSHR | Mouse | Melanocortin | A | pKi | 5.8 | 5.8 | 5.8 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 4.48 | 4.48 | 4.48 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 5.6 | 5.6 | 5.6 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |