Compound Detail
CHEMBL5278583
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Basic Information
| ChEMBL ID | CHEMBL5278583 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RWUFSDSPFFBHHT-ITUBUZOLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
353.5
MW (Da)
5.07
ALogP
2
HBA
3
HBD
56.2
PSA (Ų)
0.58
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bacillus subtilis CHEMBL359 | EC50 | 5.01 | 5.01 | 9800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bacillus subtilis | EC50 | = | 9800.0 | nM | 5.01 | Antibacterial activity against Bacillus subtilis NBRC/ATCC 111470 assessed as re... | 34802242 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Bacillus subtilis | 2 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Staphylococcus epidermidis | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Escherichia coli | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Pectobacterium carotovorum | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Enterococcus raffinosus | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Pseudomonas putida | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | MCF7 | 1 |
| 34802242 | 10.1021/acs.jnatprod.1c00811 | Paraburkholderia caledonica | 1 |
Data from ChEMBL 36 via Core Engine