Compound Detail
CHEMBL1652664
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Basic Information
| ChEMBL ID | CHEMBL1652664 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XMDQAICFEBPNJK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
482.9
MW (Da)
3.39
ALogP
8
HBA
1
HBD
110.6
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lymphocyte CHEMBL612599 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lymphocyte | IC50 | = | 3000.0 | nM | 5.52 | Immunosuppressive activity in peripheral blood lymphocytes isolated from two ind... | 21171614 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21171614 | 10.1021/jm101254z | Lymphocyte | 1 |
Data from ChEMBL 36 via Core Engine