CHEMBL398487
SMILES | Cn1nnnc1CC1(Cc2ccccc2)CCN(C(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)[C@H]2Cc3ccccc3CN2)CC1 |
InChIKey | RHHUKGGTCWPXCS-IHLOFXLRSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 2 |
Rotatable bonds | 9 |
Molecular weight (Da) | 611.3 |
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 | Human | Melanocortin | A | pEC50 | 5.75 | 5.75 | 5.75 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.08 | 6.08 | 6.08 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 7.28 | 7.28 | 7.28 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 6.96 | 6.96 | 6.96 | ChEMBL |