CHEMBL4782762
SMILES | CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(N)=O |
InChIKey | MKWJFYTWCUVRPG-SSNHPIBPSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 6 |
Rotatable bonds | 15 |
Molecular weight (Da) | 706.3 |
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 |
MC4 | MC4R | Mouse | Melanocortin | A | pKd | 5.0 | 5.0 | 5.0 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 7.51 | 7.51 | 7.51 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 6.8 | 6.8 | 6.8 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 6.82 | 6.82 | 6.82 | ChEMBL |