Compound Detail
CHEMBL231450
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Basic Information
| ChEMBL ID | CHEMBL231450 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZCHBFHCAGSBARE-WEVVVXLNSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
281.3
MW (Da)
1.73
ALogP
6
HBA
2
HBD
84.9
PSA (Ų)
0.82
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.54 | 5.54 | 2850.0 | 1 |
| Insulin-like growth factor 1 receptor CHEMBL1957 | IC50 | 5.28 | 5.28 | 5300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2850.0 | nM | 5.54 | Inhibition of DPPH radical scavenging activity | 17197183 |
| Insulin-like growth factor 1 receptor | IC50 | = | 5300.0 | nM | 5.28 | Inhibition of IGF1R by ELISA | 20178321 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17197183 | 10.1016/j.bmcl.2006.12.040 | Unchecked | 1 |
| 20178321 | 10.1021/jm901798e | Insulin-like growth factor 1 receptor | 1 |
| 20178321 | 10.1021/jm901798e | Insulin receptor | 1 |
| 20178321 | 10.1021/jm901798e | MCF7 | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine