CHEMBL410091
SMILES | C[C@@H]1NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NN)CC(=O)NC(C(=O)NN[C@H](Cc2ccc(O)cc2)C(=O)C(=O)O)NC(=O)C(=O)[C@@H](Cc2ccccc2)NC1=O |
InChIKey | XEZOOYRFZJZPBS-UOCTVQLESA-N |
Chemical properties
Hydrogen bond acceptors | 20 |
Hydrogen bond donors | 20 |
Rotatable bonds | 24 |
Molecular weight (Da) | 1420.6 |
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 |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 5.65 | 5.65 | 5.65 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.21 | 5.21 | 5.21 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 4.96 | 4.96 | 4.96 | ChEMBL |