Compound Detail
CHEMBL92308
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Basic Information
| ChEMBL ID | CHEMBL92308 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VUBUOKJQMWJAGL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
329.4
MW (Da)
4.75
ALogP
3
HBA
0
HBD
31.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CEM-SS CHEMBL614548 | IC50 | 4.93 | 4.93 | 11800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CEM-SS | IC50 | = | 11800.0 | nM | 4.93 | Cytotoxic concentration against 50% survival of uninfected untreated control CEM... | 8709096 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8709096 | 10.1021/jm950702c | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 8709096 | 10.1021/jm950702c | CEM-SS | 1 |
Data from ChEMBL 36 via Core Engine