Compound Detail
CHEMBL375228
TETRAIODOPHENOLPHTHALEINE Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL375228 |
| Name | TETRAIODOPHENOLPHTHALEINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QROHRCGRGMYXAB-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
821.9
MW (Da)
5.98
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.14
QED
2
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Beta-lactamase CHEMBL2026 | IC50 | 5.42 | 4.9467 | 3800.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Beta-lactamase | IC50 | = | 3800.0 | nM | 5.42 | Inhibition of 1 nM AmpC beta lactamase | 17149857 |
| Beta-lactamase | IC50 | = | 19000.0 | nM | 4.72 | Inhibition of 20 nM AmpC beta lactamase | 17149857 |
| Beta-lactamase | IC50 | = | 20000.0 | nM | 4.7 | Inhibition of 10 nM AmpC beta lactamase | 17149857 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17149857 | 10.1021/jm061103g | Beta-lactamase | 4 |
| 20180535 | 10.1021/jm901613f | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine