Compound Detail
CHEMBL331367
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Basic Information
| ChEMBL ID | CHEMBL331367 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WRWPGPOQLCWOFL-UVTDQMKNSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
278.4
MW (Da)
3.14
ALogP
4
HBA
2
HBD
52.6
PSA (Ų)
0.38
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peptide deformylase, mitochondrial CHEMBL4647 | IC50 | 5.0 | 5.0 | 9910.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peptide deformylase, mitochondrial | IC50 | = | 9910.0 | nM | 5.0 | In vitro inhibitory concentration required against peptide deformylase (PDF) | 12951107 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12951107 | 10.1016/s0960-894x(03)00675-9 | Peptide deformylase, mitochondrial | 1 |
| 12951107 | 10.1016/s0960-894x(03)00675-9 | Staphylococcus aureus | 1 |
| 12951107 | 10.1016/s0960-894x(03)00675-9 | Escherichia coli | 1 |
| 12951107 | 10.1016/s0960-894x(03)00675-9 | Pseudomonas aeruginosa | 1 |
Data from ChEMBL 36 via Core Engine