Compound Detail
CHEMBL390841
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Basic Information
| ChEMBL ID | CHEMBL390841 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZCLQMXZHBQFNLS-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
184.2
MW (Da)
0.29
ALogP
4
HBA
4
HBD
98.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Staphylococcus aureus CHEMBL352 | EC50 | 6.17 | 6.17 | 670.0 | 1 |
| Staphylococcus epidermidis CHEMBL353 | EC50 | 6.17 | 6.17 | 670.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Staphylococcus epidermidis | EC50 | = | 670.0 | nM | 6.17 | Antibacterial activity against Staphylococcus epidermidis | 17035037 |
| Staphylococcus aureus | EC50 | = | 670.0 | nM | 6.17 | Antibacterial activity against Staphylococcus aureus | 17035037 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17035037 | 10.1016/j.bmc.2006.09.034 | Staphylococcus epidermidis | 1 |
| 17035037 | 10.1016/j.bmc.2006.09.034 | Staphylococcus aureus | 1 |
Data from ChEMBL 36 via Core Engine