Compound Detail
CHEMBL5274876
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Basic Information
| ChEMBL ID | CHEMBL5274876 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DIKKMLXONNITJY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
508.7
MW (Da)
6.92
ALogP
5
HBA
2
HBD
86.8
PSA (Ų)
0.23
QED
2
Ro5 Violations
11
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Angiotensinogen CHEMBL5291508 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Angiotensinogen | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of rat adrenal cortex angiotensin II | 29656203 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29656203 | 10.1016/j.ejmech.2018.03.076 | Angiotensinogen | 1 |
| 29656203 | 10.1016/j.ejmech.2018.03.076 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine