CHEMBL4060087
SMILES | C[C@@H]1NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC1=O |
InChIKey | PQOVOLYOYBBMRV-VNPODFCCSA-N |
Chemical properties
Hydrogen bond acceptors | 12 |
Hydrogen bond donors | 14 |
Rotatable bonds | 11 |
Molecular weight (Da) | 871.3 |
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 |
MC1 | MSHR | Mouse | Melanocortin | A | pKi | 8.59 | 8.59 | 8.59 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pKi | 6.72 | 6.72 | 6.72 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pKi | 7.27 | 7.27 | 7.27 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |