CHEMBL4457246
SMILES | CCCCN(c1nc2ccccc2o1)[C@@H](C)c1ccc(-c2ccccc2-c2nnn[nH]2)cc1 |
InChIKey | XEHFWPJFUYLUSK-SFHVURJKSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 438.2 |
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 | 5.12 | 5.12 | 5.12 | ChEMBL |
CXCR4 | CXCR4 | Human | Chemokine | A | pIC50 | 5.0 | 5.0 | 5.0 | ChEMBL |