Compound Detail
CHEMBL1355821
TEMEFOS 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL1355821 |
| Name | TEMEFOS |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | WWJZWCUNLNYYAU-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
20
Known Names
Molecular Properties
466.5
MW (Da)
5.63
ALogP
9
HBA
0
HBD
55.4
PSA (Ų)
0.41
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
IC50 3 meas. best 7.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.93 | 6.1233 | 11.8 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 11.8 | nM | 7.93 | PubChem BioAssay. SW480 viability from Cell TiterGlo-IC50. (Class of assay: co... | - |
| Unchecked | IC50 | = | 3033.9 | nM | 5.52 | PubChem BioAssay. SNU-C1 viability from Cell TiterGlo-IC50. (Class of assay: c... | - |
| Unchecked | IC50 | = | 12095.8 | nM | 4.92 | PubChem BioAssay. RKO viability from Cell TiterGlo-IC50. (Class of assay: conf... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34225166 | 10.1016/j.bmc.2021.116299 | Unchecked | 3 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 24704612 | 10.1016/j.ejmech.2014.03.067 | Aedes aegypti | 1 |
| 37253304 | 10.1016/j.bmc.2023.117315 | Aedes aegypti | 1 |
Data from ChEMBL 36 via Core Engine