CHEMBL249322
| SMILES | CN1CCN[C@@H](C(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N2CCC(C(=O)NC(C)(C)C)(C3CCC(C)(C)CC3)CC2)C1 |
| InChIKey | LNCCYFHBELRZJF-RRPNLBNLSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 585.4 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC5 | MC5R | Human | Melanocortin | A | pEC50 | 5.95 | 5.95 | 5.95 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.62 | 6.62 | 6.62 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 6.26 | 6.26 | 6.26 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pIC50 | 6.79 | 6.79 | 6.79 | ChEMBL |