Compound Detail
CHEMBL237629
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Basic Information
| ChEMBL ID | CHEMBL237629 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SXDOGZYSINLLPH-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
348.4
MW (Da)
4.93
ALogP
4
HBA
2
HBD
42.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas.
IC50 1 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C-X-C chemokine receptor type 4 CHEMBL5556 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C-X-C chemokine receptor type 4 | IC50 | = | 1.0 | nM | 9.0 | Competitive Binding Assay: A synthetic 14-mer peptide, TN14003, was previously r... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17958344 | 10.1021/jm070679i | C-X-C chemokine receptor type 4 | 2 |
Data from ChEMBL 36 via Core Engine