CHEMBL216295
SMILES | CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H]1CC(=O)ONCCCC[C@H](C(N)=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O |
InChIKey | AQZUWHBMAIRHAI-ZVMIYURWSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 13 |
Rotatable bonds | 16 |
Molecular weight (Da) | 1039.5 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 9.8 | 9.8 | 9.8 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 10.7 | 10.7 | 10.7 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 10.06 | 10.06 | 10.06 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 9.8 | 9.8 | 9.8 | ChEMBL |