Compound Detail
CHEMBL341264
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 | CHEMBL341264 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WEMWNHDMPLAIPE-IWSPIJDZSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
-1.30
ALogP
6
HBA
3
HBD
110.3
PSA (Ų)
0.62
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 4.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Thymidylate kinase CHEMBL2361 | Ki | 4.24 | 4.24 | 57000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Thymidylate kinase | Ki | = | 57000.0 | nM | 4.24 | In Vitro inhibition of Thymidine Monophosphatase Kinase of Mycobacterium tubercu... | 12930144 |
| Thymidylate kinase | Ki | = | 57000.0 | nM | 4.24 | Inhibition of Mycobacterium tuberculosis TMPK by coupled spectrophotometric assa... | 15566289 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15566289 | 10.1021/jm040847w | Thymidylate kinase | 2 |
| 12930144 | 10.1021/jm021108n | Thymidylate kinase | 1 |
| 12930144 | 10.1021/jm021108n | Thymidine kinase, cytosolic | 1 |
| 12930144 | 10.1021/jm021108n | Unchecked | 1 |
| 8381182 | 10.1021/jm00055a006 | L1210 | 1 |
| 8381182 | 10.1021/jm00055a006 | P388 | 1 |
| 8381182 | 10.1021/jm00055a006 | Unchecked | 1 |
| 8381182 | 10.1021/jm00055a006 | CCRF-CEM | 1 |
| 15566289 | 10.1021/jm040847w | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine