Compound Detail
CHEMBL151565
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Basic Information
| ChEMBL ID | CHEMBL151565 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MHQJAWRJJKMFDP-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
1
PK Parameters
5
Publications
0
Known Names
Molecular Properties
391.5
MW (Da)
4.12
ALogP
4
HBA
2
HBD
64.3
PSA (Ų)
0.69
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nucleic Acid CHEMBL345 | IC50 | 6.64 | 6.29 | 230.0 | 3 |
| Human immunodeficiency virus type 1 reverse transcriptase CHEMBL247 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 0.01717 | hr | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nucleic Acid | IC50 | = | 230.0 | nM | 6.64 | Concentration required to inhibit wild type RNA dependent DNA polymerase. | 8978855 |
| Nucleic Acid | IC50 | = | 740.0 | nM | 6.13 | Concentration required to inhibit P236L type RNA dependent DNA polymerase. | 8978855 |
| Nucleic Acid | IC50 | = | 800.0 | nM | 6.1 | Concentration required to inhibit Y181C type RNA dependent DNA polymerase. | 8978855 |
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 2000.0 | nM | 5.7 | In vitro for inhibition of HIV-1 reverse transcriptase. | 8978855 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8978855 | 10.1021/jm960269m | Nucleic Acid | 3 |
| 8978855 | 10.1021/jm960269m | Human immunodeficiency virus type 1 reverse transcriptase | 2 |
| 8978855 | 10.1021/jm960269m | Unchecked | 2 |
| 8978855 | 10.1021/jm960269m | Human immunodeficiency virus 1 | 1 |
| 8978855 | 10.1021/jm960269m | ADMET | 1 |
Data from ChEMBL 36 via Core Engine