Compound Detail
CHEMBL130555
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Basic Information
| ChEMBL ID | CHEMBL130555 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MKPNXBOGNDTEQA-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
257.2
MW (Da)
0.33
ALogP
7
HBA
2
HBD
110.0
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human betaherpesvirus 5 CHEMBL371 | IC50 | 5.29 | 5.29 | 5100.0 | 1 |
| Human alphaherpesvirus 1 CHEMBL377 | IC50 | 4.39 | 4.39 | 41000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human betaherpesvirus 5 | IC50 | = | 5100.0 | nM | 5.29 | In vitro antiviral activity against human cytomegalovirus by plaque method. | 7562947 |
| Human alphaherpesvirus 1 | IC50 | = | 41000.0 | nM | 4.39 | Antiviral activity against herpes simplex virus type 1(HSV-1) ELISA method | 7562947 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7562947 | 10.1021/jm00020a027 | Human betaherpesvirus 5 | 2 |
| 7562947 | 10.1021/jm00020a027 | Human alphaherpesvirus 1 | 1 |
| 7562947 | 10.1021/jm00020a027 | HFF | 1 |
| 7562947 | 10.1021/jm00020a027 | KB | 1 |
Data from ChEMBL 36 via Core Engine