Compound Detail
CHEMBL3143182
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Basic Information
| ChEMBL ID | CHEMBL3143182 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VHIGLUZDMVZXLK-RCCFBDPRSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
504.4
MW (Da)
3.34
ALogP
7
HBA
2
HBD
97.7
PSA (Ų)
0.28
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 3 CHEMBL613132 | EC50 | 7.47 | 7.34 | 34.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 3 | EC50 | = | 34.0 | nM | 7.47 | The compound was tested for its effective concentration required to reduce virus... | 10866384 |
| Human alphaherpesvirus 3 | EC50 | = | 61.0 | nM | 7.21 | The compound was tested for its effective concentration required to reduce virus... | 10866384 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10866384 | 10.1016/s0960-894x(00)00193-1 | Human alphaherpesvirus 3 | 4 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | NON-PROTEIN TARGET | 1 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | HEL | 1 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | Human alphaherpesvirus 1 | 1 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | Human alphaherpesvirus 2 | 1 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | Cytomegalovirus | 1 |
| 10866384 | 10.1016/s0960-894x(00)00193-1 | Human immunodeficiency virus 1 | 1 |
Data from ChEMBL 36 via Core Engine