Compound Detail
CHEMBL3329653
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3329653 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XDBJCRBXUIYEQZ-ATVHPVEESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
402.4
MW (Da)
3.48
ALogP
4
HBA
4
HBD
112.3
PSA (Ų)
0.50
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.31 | 6.31 | 488.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 488.0 | nM | 6.31 | Cytotoxicity against human HL60 cells assessed as cell viability after 48 hrs by... | 25089810 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25089810 | 10.1016/j.ejmech.2014.07.108 | MV4-11 | 2 |
| 25089810 | 10.1016/j.ejmech.2014.07.108 | MOLM-13 | 2 |
| 25089810 | 10.1016/j.ejmech.2014.07.108 | THP-1 | 2 |
| 25089810 | 10.1016/j.ejmech.2014.07.108 | NON-PROTEIN TARGET | 1 |
| 25089810 | 10.1016/j.ejmech.2014.07.108 | Aurora kinase B | 1 |
| 25089810 | 10.1016/j.ejmech.2014.07.108 | Receptor-type tyrosine-protein kinase FLT3 | 1 |
Data from ChEMBL 36 via Core Engine