Compound Detail
CHEMBL84383
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Basic Information
| ChEMBL ID | CHEMBL84383 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GDDKVRXIZHLJJU-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
217.2
MW (Da)
1.39
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.69
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase CHEMBL247 | IC50 | 5.22 | 5.22 | 6070.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 6070.0 | nM | 5.22 | Inhibition of RNA-dependent DNA polymerase activity of Human immunodeficiency vi... | - |
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 6070.0 | nM | 5.22 | Inhibition of HIV1 reverse transcriptase | 26708112 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12773053 | 10.1021/jm020546r | Rattus norvegicus | 2 |
| 12773053 | 10.1021/jm020546r | No relevant target | 1 |
| - | 10.1007/s00044-007-9004-0 | Vero | 1 |
| - | 10.1007/s00044-007-9004-0 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 26708112 | 10.1016/j.ejmech.2015.11.025 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine