Compound Detail
CHEMBL159357
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Basic Information
| ChEMBL ID | CHEMBL159357 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GBERTTMWNLKZHB-ZSOIEALJSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
392.9
MW (Da)
4.53
ALogP
6
HBA
1
HBD
81.5
PSA (Ų)
0.36
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.62 | 4.62 | 24000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 24000.0 | nM | 4.62 | Inhibitory concentration against recombinant UDP-N-Acetylmuramate/L-Alanine Liga... | 11844704 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11844704 | 10.1016/s0960-894x(01)00832-0 | Unchecked | 1 |
| 11844704 | 10.1016/s0960-894x(01)00832-0 | Staphylococcus aureus | 1 |
| 11844704 | 10.1016/s0960-894x(01)00832-0 | Escherichia coli | 1 |
| 11844704 | 10.1016/s0960-894x(01)00832-0 | CHO | 1 |
Data from ChEMBL 36 via Core Engine