CHEMBL3904191
SMILES | O=C(NC[C@H]1CCN(CC(c2ccccc2)c2ccccc2)C(=O)[C@@H](CCCN2CCCCC2)N1)c1ccc2ccccc2c1 |
InChIKey | IDXRWSTZYJEJCO-ZEEKBPLESA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 11 |
Molecular weight (Da) | 602.4 |
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 |
MC1 | MSHR | Human | Melanocortin | A | pIC50 | 5.04 | 5.04 | 5.04 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 5.65 | 5.65 | 5.65 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 5.46 | 5.46 | 5.46 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 7.51 | 7.51 | 7.52 | ChEMBL |