CHEMBL3352878
SMILES | CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O |
InChIKey | FAONKRMCZFSASU-PCYFNTAWSA-N |
Chemical properties
Hydrogen bond acceptors | 11 |
Hydrogen bond donors | 13 |
Rotatable bonds | 33 |
Molecular weight (Da) | 1037.6 |
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 | 9.64 | 9.64 | 9.64 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 8.63 | 8.63 | 8.63 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 9.54 | 9.54 | 9.54 | ChEMBL |