CHEMBL269776
| SMILES | NCCCNC(=O)[C@H](CNCc1c[nH]c2ccccc12)NCc1ccc2ccccc2c1 |
| InChIKey | LEUXVEFDUIWOPN-VWLOTQADSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 5 |
| Rotatable bonds | 11 |
| Molecular weight (Da) | 429.3 |
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 | Human | Melanocortin | A | pKi | 6.16 | 6.18 | 6.2 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 4.4 | 4.42 | 4.44 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 4.25 | 4.28 | 4.3 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 4.57 | 4.58 | 4.6 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |