Compound Detail
CHEMBL4207259
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Basic Information
| ChEMBL ID | CHEMBL4207259 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVZFIRUBPPQJDC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
465.6
MW (Da)
3.42
ALogP
7
HBA
2
HBD
93.2
PSA (Ų)
0.50
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| WM164 CHEMBL4630701 | IC50 | 4.89 | 4.89 | 13000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| WM164 | IC50 | = | 13000.0 | nM | 4.89 | Growth inhibition of human WM164 cells after 72 hrs by MTS assay | 29501942 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29501942 | 10.1016/j.ejmech.2018.02.045 | Unchecked | 2 |
| 29501942 | 10.1016/j.ejmech.2018.02.045 | WM164 | 1 |
| 29501942 | 10.1016/j.ejmech.2018.02.045 | A-375 | 1 |
| 29501942 | 10.1016/j.ejmech.2018.02.045 | RPMI-7951 | 1 |
| 29501942 | 10.1016/j.ejmech.2018.02.045 | M14 | 1 |
Data from ChEMBL 36 via Core Engine