CHEMBL4472121
SMILES | CCCCN(c1nc2ccccc2o1)C(CC)c1ccc(-c2ccccc2-c2nnn[nH]2)cc1 |
InChIKey | PFEPVQJOFADWCF-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 452.2 |
Drug properties
Molecular type | Small molecule |
Physiological/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 |
chemerin | CML1 | Human | Chemerin receptor | A | pIC50 | 6.03 | 6.03 | 6.03 | ChEMBL |
chemerin | CML1 | Human | Chemerin receptor | A | pEC50 | 5.35 | 5.35 | 5.35 | ChEMBL |
CXCR4 | CXCR4 | Human | Chemokine | A | pIC50 | 5.06 | 5.06 | 5.06 | ChEMBL |