CHEMBL3358543
SMILES | CCCC[C@H](NC(C)=O)C(=O)N[C@H]1Cc2cn(nn2)CCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O |
InChIKey | KXPGBMNMTKVKHX-ZRBRQIMBSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 13 |
Rotatable bonds | 17 |
Molecular weight (Da) | 1047.6 |
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 |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 8.29 | 8.29 | 8.29 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 8.5 | 8.5 | 8.5 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 8.79 | 8.79 | 8.79 | ChEMBL |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 8.71 | 8.71 | 8.71 | ChEMBL |