CHEMBL392094
SMILES | COc1ccc2c(c1)c(CC(=O)N(CCCCN)C13CC4CC(CC(C4)C1)C3)c(C)n2C(=O)c1ccc(Cl)cc1 |
InChIKey | ARYXHCOOGIRDOL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 561.3 |
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 |
MC5 | MC5R | Human | Melanocortin | A | pKi | 4.46 | 4.46 | 4.46 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 4.72 | 4.72 | 4.72 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pKi | 5.51 | 5.51 | 5.51 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |