Compound Detail
CHEMBL69898
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Basic Information
| ChEMBL ID | CHEMBL69898 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PSJHZGDAMLMKFJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
413.4
MW (Da)
4.42
ALogP
5
HBA
2
HBD
105.3
PSA (Ų)
0.48
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oryctolagus cuniculus CHEMBL374 | Kd | 7.6 | 7.6 | 25.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oryctolagus cuniculus | Kd | = | 25.12 | nM | 7.6 | Potency of the Angiotensin II-induced contraction of rabbit aortic strips | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81149-5 | Oryctolagus cuniculus | 1 |
| - | 10.1016/S0960-894X(01)81149-5 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine