Compound Detail
CHEMBL426885
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
CC[C@@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL426885 |
| Phase | Preclinical |
| Structure Type | BOTH |
| InChI Key | WKNFSADCOXFTRX-MEYUZBJRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
407.5
MW (Da)
0.06
ALogP
5
HBA
4
HBD
144.5
PSA (Ų)
0.46
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Protein |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type-2 angiotensin II receptor CHEMBL4607 | Ki | 5.96 | 5.96 | 1110.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type-2 angiotensin II receptor | Ki | = | 1110.0 | nM | 5.96 | Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrial membrane | 17358051 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17358051 | 10.1021/jm0613469 | Angiotensin II receptor (AT-1) type-1 | 1 |
| 17358051 | 10.1021/jm0613469 | Type-2 angiotensin II receptor | 1 |
Data from ChEMBL 36 via Core Engine