Compound Detail
CHEMBL423039
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Basic Information
| ChEMBL ID | CHEMBL423039 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QIXDHVDGPXBRRD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
150.2
MW (Da)
1.42
ALogP
2
HBA
0
HBD
34.1
PSA (Ų)
0.49
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| K562 CHEMBL385 | IC50 | 5.44 | 5.44 | 3600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| K562 | IC50 | = | 3600.0 | nM | 5.44 | In vitro cytotoxicity against Human Chronic Leukemia K562 cells | 8558523 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18461966 | 10.1021/jf800331r | Coptotermes formosanus | 4 |
| 8558523 | 10.1021/jm950629q | Nucleic Acid | 2 |
| 8558523 | 10.1021/jm950629q | K562 | 1 |
Data from ChEMBL 36 via Core Engine