CHEMBL254757
SMILES | CC[C@H](NC(C)=O)c1cc(Cl)ccc1C1CCN(C(=O)[C@H]2CN(C(C)(C)C)C[C@@H]2c2ccc(Cl)cc2Cl)CC1 |
InChIKey | AZYLFDYQQJPDQC-XQFUHLNNSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 591.2 |
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 |
MC4 | MC4R | Rat | Melanocortin | A | pIC50 | 9.3 | 9.3 | 9.3 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.61 | 6.61 | 6.61 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pEC50 | 5.8 | 5.8 | 5.8 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 5.37 | 5.37 | 5.37 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 8.48 | 8.48 | 8.48 | ChEMBL |