Compound Detail
CHEMBL208800
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Basic Information
| ChEMBL ID | CHEMBL208800 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JYCSUZZTVRYVRO-CSKARUKUSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
386.5
MW (Da)
3.39
ALogP
5
HBA
2
HBD
90.7
PSA (Ų)
0.74
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 6.89 | 6.89 | 130.0 | 1 |
| MV4-11 CHEMBL613835 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Receptor-type tyrosine-protein kinase FLT3 | IC50 | = | 130.0 | nM | 6.89 | Inhibition of FLT3 | 16580199 |
| MV4-11 | IC50 | = | 2000.0 | nM | 5.7 | Antiproliferative activity against human MV4-11 cells | 16580199 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16580199 | 10.1016/j.bmcl.2006.03.032 | Receptor-type tyrosine-protein kinase FLT3 | 1 |
| 16580199 | 10.1016/j.bmcl.2006.03.032 | MV4-11 | 1 |
Data from ChEMBL 36 via Core Engine