Compound Detail
CHEMBL3234398
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Basic Information
| ChEMBL ID | CHEMBL3234398 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GZLDQGFGOFNQQP-UHFFFAOYSA-N |
5
Targets
24
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
431.7
MW (Da)
6.29
ALogP
5
HBA
2
HBD
76.0
PSA (Ų)
0.44
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 24 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Staphylococcus epidermidis CHEMBL353 | IC50 | 5.7 | 5.5 | 2000.0 | 3 |
| Staphylococcus aureus CHEMBL352 | IC50 | 5.4 | 5.28 | 4000.0 | 5 |
| Enterococcus faecium CHEMBL357 | IC50 | 4.8 | 4.7 | 16000.0 | 3 |
| Enterococcus faecalis CHEMBL362 | IC50 | 4.8 | 4.8 | 16000.0 | 4 |
| Escherichia coli CHEMBL354 | IC50 | 4.19 | 4.19 | 64000.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24571273 | 10.1021/np5000457 | Staphylococcus aureus | 7 |
| 24571273 | 10.1021/np5000457 | Escherichia coli | 5 |
| 24571273 | 10.1021/np5000457 | Klebsiella pneumoniae | 5 |
| 24571273 | 10.1021/np5000457 | Enterococcus faecalis | 4 |
| 24571273 | 10.1021/np5000457 | Staphylococcus epidermidis | 3 |
| 24571273 | 10.1021/np5000457 | Enterococcus faecium | 3 |
| 24571273 | 10.1021/np5000457 | Bacillus thuringiensis | 1 |
| 24571273 | 10.1021/np5000457 | Bacillus subtilis | 1 |
Data from ChEMBL 36 via Core Engine