CHEMBL5077811
SMILES | CC(=O)N[C@H]1CSSC[C@@H](C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O |
InChIKey | UCISEPWWFQDZAP-ZTYVOHGWSA-N |
Chemical properties
Hydrogen bond acceptors | None |
Hydrogen bond donors | None |
Rotatable bonds | None |
Molecular weight (Da) |
Drug properties
Molecular type | Na |
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 | Human | Melanocortin | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 5.5 | 5.5 | 5.5 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 5.69 | 5.69 | 5.69 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC1 | MSHR | Human | Melanocortin | A | pEC50 | 8.26 | 8.26 | 8.26 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 5.0 | 5.0 | 5.0 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.4 | 6.4 | 6.4 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 5.44 | 6.32 | 7.2 | ChEMBL |