CHEMBL405174
SMILES | CC(=O)Nc1cc2ccccc2cc1C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |
InChIKey | HQOYMPPRYNULSG-FZCBKRAZSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 8 |
Rotatable bonds | 16 |
Molecular weight (Da) | 717.3 |
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 |
MC3 | MC3R | Mouse | Melanocortin | A | pKd | 5.6 | 5.6 | 5.6 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pKi | 5.6 | 5.6 | 5.6 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 7.34 | 7.34 | 7.34 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.1 | 5.1 | 5.1 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 7.68 | 7.68 | 7.68 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.22 | 7.94 | 8.66 | ChEMBL |