Compound Detail
CHEMBL1409810
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Basic Information
| ChEMBL ID | CHEMBL1409810 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QUTUJRKVWNTRPO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
337.8
MW (Da)
5.24
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.67
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Staphylococcus aureus CHEMBL352 | IC50 | 6.35 | 6.35 | 448.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.17 | 5.17 | 6743.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Staphylococcus aureus | IC50 | = | 448.0 | nM | 6.35 | PUBCHEM_BIOASSAY: Inhibitors of Bacterial Quorum Sensing Structure Activity Rela... | - |
| Unchecked | IC50 | = | 6743.0 | nM | 5.17 | PubChem BioAssay. Fluorescence-based biochemical high throughput dose response a... | - |
Data from ChEMBL 36 via Core Engine