Compound Detail
CHEMBL295553
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Basic Information
| ChEMBL ID | CHEMBL295553 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NQPFPURBDBKHFL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
316.4
MW (Da)
3.82
ALogP
3
HBA
2
HBD
57.5
PSA (Ų)
0.59
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Liposome CHEMBL614676 | IC50 | 4.19 | 4.19 | 64000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Liposome | IC50 | = | 64000.0 | nM | 4.19 | Inhibition of 2,2'-azobis(2-aminopropane)hydrochloride (AAPH) induced lipid pero... | 8201600 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8201600 | 10.1021/jm00037a017 | Unchecked | 2 |
| 8201600 | 10.1021/jm00037a017 | Arachidonate 5-lipoxygenase | 1 |
| 8201600 | 10.1021/jm00037a017 | Liposome | 1 |
| 8201600 | 10.1021/jm00037a017 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine