CHEMBL1524932
SMILES | COCCCn1c(N)c(-c2nc3ccccc3n2C)c2nc3ccccc3nc21 |
InChIKey | QXNGSBMMEOFHHP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 386.2 |
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 |
CXCR5 | CXCR5 | Human | Chemokine | A | pIC50 | 4.79 | 4.79 | 4.79 | ChEMBL |
CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.56 | 4.69 | 4.82 | ChEMBL |
apelin | APJ | Human | Apelin | A | pIC50 | 4.71 | 4.71 | 4.71 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 4.9 | 4.9 | 4.9 | ChEMBL |