Compound Detail
CHEMBL3416948
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Basic Information
| ChEMBL ID | CHEMBL3416948 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MLSHNEVKVSMHDB-FMIVXFBMSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
402.9
MW (Da)
5.58
ALogP
4
HBA
1
HBD
41.0
PSA (Ų)
0.43
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cell division protein FtsZ CHEMBL3999 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cell division protein FtsZ | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of Escherichia coli FtsZ | 25791674 |
| Unchecked | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of bacterial FtsZ GTPase activity (unknown origin) | 25815151 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25791674 | 10.1016/j.ejmech.2015.03.026 | Cell division protein FtsZ | 1 |
| 25815151 | 10.1021/ml500497s | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine