CHEMBL1209788
SMILES | Cc1cc2c(cc1Cl)C1(CCN(C(=O)[C@@H]3CN(C4CCOCC4)C[C@H]3c3ccc(F)cc3F)CC1)O[C@@H]2C(C)(C)C#N |
InChIKey | BCFFSQJVHOEAAU-MWSYKCOMSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 597.3 |
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 |
MC4 | MC4R | Rat | Melanocortin | A | pEC50 | 8.96 | 8.96 | 8.96 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 8.47 | 8.47 | 8.47 | ChEMBL |
MT2 | MTR1B | Human | Melatonin | A | pIC50 | 5.82 | 5.82 | 5.82 | ChEMBL |
MT2 | MTR1B | Human | Melatonin | A | pEC50 | 5.77 | 5.77 | 5.77 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.91 | 6.91 | 6.91 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.12 | 6.12 | 6.12 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 6.32 | 6.32 | 6.32 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 8.57 | 8.57 | 8.57 | ChEMBL |