Compound Detail
CHEMBL341005
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Basic Information
| ChEMBL ID | CHEMBL341005 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BZEVAOVZVAWBDP-BYPYZUCNSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
304.2
MW (Da)
-0.95
ALogP
9
HBA
4
HBD
169.5
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MT4 CHEMBL388 | EC50 | 4.92 | 4.91 | 12000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MT4 | EC50 | = | 12000.0 | nM | 4.92 | Protection of MT-4 cells against the cytopathic effect of HIV-1 (4 days) | 7562935 |
| MT4 | EC50 | = | 12500.0 | nM | 4.9 | Protection of MT-4 cells against the cytopathic effect of HIV-2 (8 days) | 7562935 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8831773 | 10.1021/jm960314q | Human alphaherpesvirus 3 | 4 |
| 8831773 | 10.1021/jm960314q | NON-PROTEIN TARGET | 3 |
| 7562935 | 10.1021/jm00020a015 | MT4 | 3 |
| 8831773 | 10.1021/jm960314q | Human immunodeficiency virus 1 | 2 |
| 7562935 | 10.1021/jm00020a015 | Unchecked | 2 |
| 8831773 | 10.1021/jm960314q | Human alphaherpesvirus 1 | 1 |
| 8831773 | 10.1021/jm960314q | ADMET | 1 |
| 8831773 | 10.1021/jm960314q | Human alphaherpesvirus 2 | 1 |
| 8831773 | 10.1021/jm960314q | Cytomegalovirus | 1 |
| 8831773 | 10.1021/jm960314q | Human betaherpesvirus 5 | 1 |
| 8831773 | 10.1021/jm960314q | Vaccinia virus | 1 |
| 8831773 | 10.1021/jm960314q | Moloney murine sarcoma virus | 1 |
| 8831773 | 10.1021/jm960314q | MT4 | 1 |
| 8831773 | 10.1021/jm960314q | Human immunodeficiency virus 2 | 1 |
Data from ChEMBL 36 via Core Engine