CHEMBL4062425
SMILES | CC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(N)=O |
InChIKey | BUMLYNRSGDYSCP-IJERZTCISA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 8 |
Rotatable bonds | 19 |
Molecular weight (Da) | 908.3 |
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 | 5.08 | 5.08 | 5.08 | ChEMBL |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 4.85 | 4.85 | 4.85 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 5.1 | 5.1 | 5.1 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.12 | 5.12 | 5.12 | ChEMBL |