CHEMBL1089103
| SMILES | C[C@H]1CN(C(=O)[C@H]2CN(c3ccccn3)C[C@@H]2c2ccc(F)cc2F)C[C@@H](C)[C@]1(O)c1ccccc1 |
| InChIKey | CSQOOKHGXFRBEQ-MHMLHYMTSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 491.2 |
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 |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 7.1 | 7.1 | 7.1 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 7.15 | 7.15 | 7.15 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.82 | 7.82 | 7.82 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pEC50 | 6.02 | 6.02 | 6.02 | ChEMBL |