CHEMBL4754987
SMILES | CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1Cc2ccccc2C[C@@H]1C(N)=O |
InChIKey | HSJMNXXZYVFSJQ-PSWJWLENSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 8 |
Rotatable bonds | 16 |
Molecular weight (Da) | 734.4 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC4 | MC4R | Mouse | Melanocortin | A | pKd | 6.5 | 6.5 | 6.5 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pKi | 6.5 | 6.5 | 6.5 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 7.58 | 7.58 | 7.58 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 9.05 | 9.05 | 9.05 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 7.41 | 7.41 | 7.41 | ChEMBL |