CHEMBL4581269
SMILES | CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@@H]1C(N)=O)C(C)C |
InChIKey | BBMXUZDQYHSAJB-CBPXPLCBSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 7 |
Rotatable bonds | 14 |
Molecular weight (Da) | 684.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 | 6.22 | 6.22 | 6.22 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 7.52 | 7.52 | 7.52 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 5.36 | 5.36 | 5.36 | ChEMBL |