CHEMBL1209318
SMILES | CC(C)N(CC(C1CCCCC1)N1CCN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2c2ccc(F)cc2F)CC1)C(=O)c1cccnn1 |
InChIKey | DOVNDOSDULTCGE-QSVHXPHUSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 8 |
Molecular weight (Da) | 624.4 |
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 |
MC1 | MSHR | Human | Melanocortin | A | pEC50 | 5.92 | 5.92 | 5.92 | ChEMBL |
MC1 | MSHR | Human | Melanocortin | A | pIC50 | 5.72 | 5.72 | 5.72 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pEC50 | 6.31 | 6.31 | 6.31 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.89 | 6.89 | 6.89 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 6.11 | 6.11 | 6.11 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 7.05 | 7.05 | 7.05 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 7.19 | 7.47 | 7.75 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 8.04 | 8.15 | 8.27 | ChEMBL |