CHEMBL4593522
SMILES | c1ccc(-c2nnn[nH]2)c(-c2ccc(CN(CC3CCCC3)c3nc4ccccc4o3)cc2)c1 |
InChIKey | HMTFEFNPGQVTJW-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 450.2 |
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 | pEC50 | 5.08 | 5.08 | 5.08 | ChEMBL |
chemerin | CML1 | Human | Chemerin receptor | A | pIC50 | 5.66 | 5.66 | 5.66 | ChEMBL |
CXCR4 | CXCR4 | Human | Chemokine | A | pIC50 | 5.46 | 5.46 | 5.46 | ChEMBL |