Compound Detail
CHEMBL371867
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Basic Information
| ChEMBL ID | CHEMBL371867 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LKRMJZDWDPMTPZ-LCYFTJDESA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
271.3
MW (Da)
2.09
ALogP
4
HBA
2
HBD
79.5
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 integrase CHEMBL3471 | IC50 | 6.66 | 6.66 | 220.0 | 1 |
| RNA-directed RNA polymerase CHEMBL4296320 | IC50 | 4.54 | 4.54 | 29000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 integrase | IC50 | = | 220.0 | nM | 6.66 | Strand transfer inhibitory activity against HIV-1 integrase | 16250669 |
| RNA-directed RNA polymerase | IC50 | = | 29000.0 | nM | 4.54 | Inhibitory concentration against NS5B HCV polymerase using [alpha-32P]UTP as rad... | 16190757 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16250669 | 10.1021/jm050549e | Human immunodeficiency virus type 1 integrase | 1 |
| 16190757 | 10.1021/jm0504454 | RNA-directed RNA polymerase | 1 |
Data from ChEMBL 36 via Core Engine