CHEMBL5190234
SMILES | C[C@H](c1ccc(-c2cc(Cl)ccc2C(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCOCCOCCOCCOCCN=[N+]=[N-])cc1)N(CC1CC1)c1nc(C(=O)NS(=O)(=O)C2CC2)c(C2CC2)s1 |
InChIKey | PEWIBHKJSPHMGG-AFLCPGBUSA-N |
Chemical properties
Hydrogen bond acceptors | 31 |
Hydrogen bond donors | 2 |
Rotatable bonds | 82 |
Molecular weight (Da) | 1665.8 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 |
chemerin | CML1 | Human | Chemerin receptor | A | pEC50 | 6.42 | 6.42 | 6.42 | ChEMBL |
chemerin | CML1 | Human | Chemerin receptor | A | pIC50 | 7.0 | 7.0 | 7.0 | ChEMBL |