CHEMBL237702
SMILES | NC1CCC(CC2CCC(N(C/C(Cl)=C/c3ccccc3)C(=O)COc3ccc4ccccc4c3)CC2)CC1 |
InChIKey | IKCCMERSPGFYKB-OFWBYEQRSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 544.3 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC1 | MSHR | Mouse | Melanocortin | A | pKi | 5.72 | 5.88 | 6.39 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pKi | 4.38 | 4.94 | 5.26 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 4.21 | 4.5 | 4.66 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 5.23 | 5.38 | 5.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |