Compound Detail
CHEMBL281335
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Basic Information
| ChEMBL ID | CHEMBL281335 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RGMMTOZHCJCZRW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
224.3
MW (Da)
2.57
ALogP
4
HBA
3
HBD
77.8
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cavia porcellus CHEMBL369 | IC50 | 5.12 | 5.085 | 7600.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cavia porcellus | IC50 | = | 7600.0 | nM | 5.12 | Inhibitory concentration of the Compound was tested against LTD4 induced contrac... | 1560434 |
| Cavia porcellus | IC50 | = | 8900.0 | nM | 5.05 | Inhibitory activity of the Compound was tested against U-46619 induced contracti... | 1560434 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1560434 | 10.1021/jm00085a006 | Cavia porcellus | 6 |
| 37839345 | 10.1016/j.ejmech.2023.115823 | Staphylococcus aureus | 2 |
| 27112454 | 10.1016/j.bmc.2016.04.020 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine