Compound Detail
CHEMBL3306179
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O=C(OCCCCCCCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1cc(O)c(O)c(O)c1
Basic Information
| ChEMBL ID | CHEMBL3306179 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OSQPPGTYKIFNTH-UHFFFAOYSA-O |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
599.7
MW (Da)
7.86
ALogP
5
HBA
3
HBD
87.0
PSA (Ų)
0.05
QED
2
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | EC50 | 6.0 | 6.0 | 1000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | EC50 | = | 1000.0 | nM | 6.0 | Antitrypanosomal activity against Trypanosoma cruzi Y intracellular trypomastigo... | 30033393 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30033393 | 10.1016/j.ejmech.2018.06.040 | Trypanosoma cruzi | 1 |
Data from ChEMBL 36 via Core Engine