Compound Detail
CHEMBL1738815
PENTACHLOROPSEUDILIN 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 | CHEMBL1738815 |
| Name | PENTACHLOROPSEUDILIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FBRLLYYPGGXCKT-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
331.4
MW (Da)
5.65
ALogP
1
HBA
2
HBD
36.0
PSA (Ų)
0.70
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Myosin-J heavy chain CHEMBL1781867 | IC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of Dictyostelium discoideum myosin 1b ATPase activity by spectrophoto... | 21534527 |
| Myosin-J heavy chain | IC50 | = | 100000.0 | nM | 4.0 | Inhibition of Dictyostelium discoideum myosin 5b ATPase activity by spectrophoto... | 21534527 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33341499 | 10.1016/j.bmc.2020.115928 | MDA-MB-231 | 4 |
| 21534527 | 10.1021/jm200259f | Unchecked | 2 |
| 21534527 | 10.1021/jm200259f | Myosin-J heavy chain | 1 |
| 33341499 | 10.1016/j.bmc.2020.115928 | Unchecked | 1 |
| 33341499 | 10.1016/j.bmc.2020.115928 | Myosin light chain kinase 2, skeletal/cardiac muscle | 1 |
| 33341499 | 10.1016/j.bmc.2020.115928 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine