Compound Detail
CHEMBL1770210
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Basic Information
| ChEMBL ID | CHEMBL1770210 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IXXUDZTUAVWCOK-UHFFFAOYSA-N |
| Parent Compound | CHEMBL245470 |
| Active Moiety | CHEMBL245470 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
386.5
MW (Da)
4.02
ALogP
3
HBA
1
HBD
59.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.67
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SH-SY5Y CHEMBL614910 | IC50 | 5.67 | 5.67 | 2120.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SH-SY5Y | IC50 | = | 2120.0 | nM | 5.67 | Cytotoxicity against human SH-SY5Y cells assessed as cell viability after 48 hrs... | 21367493 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21367493 | 10.1016/j.ejmech.2011.02.005 | Unchecked | 1 |
| 21367493 | 10.1016/j.ejmech.2011.02.005 | SH-SY5Y | 1 |
Data from ChEMBL 36 via Core Engine