Compound Detail
CHEMBL3634694
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Basic Information
| ChEMBL ID | CHEMBL3634694 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PFOARMALXZGCHY-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
342.4
MW (Da)
4.05
ALogP
5
HBA
1
HBD
61.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human betaherpesvirus 5 CHEMBL371 | EC50 | 5.89 | 5.89 | 1280.0 | 1 |
| Plasmodium falciparum CHEMBL364 | EC50 | 4.58 | 4.58 | 26494.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human betaherpesvirus 5 | EC50 | = | 1280.0 | nM | 5.89 | Antiviral activity against GFP-fused Human cytomegalovirus AD169 infected in pri... | 29887512 |
| Plasmodium falciparum | EC50 | = | 26494.0 | nM | 4.58 | Antimalarial activity against Plasmodium falciparum 3D7 infected in human erythr... | 29887512 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26483135 | 10.1016/j.bmcl.2015.10.020 | RAW264.7 | 2 |
| 29887512 | 10.1016/j.bmc.2018.05.041 | CCRF-CEM | 1 |
| 29887512 | 10.1016/j.bmc.2018.05.041 | ADR5000 cell line | 1 |
| 29887512 | 10.1016/j.bmc.2018.05.041 | Plasmodium falciparum | 1 |
| 29887512 | 10.1016/j.bmc.2018.05.041 | Human betaherpesvirus 5 | 1 |
Data from ChEMBL 36 via Core Engine