Compound Detail
CHEMBL25496
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Basic Information
| ChEMBL ID | CHEMBL25496 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YMZPJFZAPPZUFR-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
218.3
MW (Da)
2.75
ALogP
3
HBA
0
HBD
27.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C8166 CHEMBL614533 | EC50 | 6.22 | 5.5533 | 600.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C8166 | EC50 | = | 600.0 | nM | 6.22 | Tested against HIV-1 111B for Inhibition of viral replication by determining red... | - |
| C8166 | EC50 | = | 6000.0 | nM | 5.22 | Tested against HIV-1 111B for Inhibition of viral replication by determining red... | - |
| C8166 | EC50 | = | 6000.0 | nM | 5.22 | Inhibitory activity against HIV-111B in C8166 cells | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)00022-X | C8166 | 2 |
| - | 10.1016/0960-894X(95)00203-6 | C8166 | 2 |
| - | 10.1016/0960-894X(95)00203-6 | Human immunodeficiency virus type 1 reverse transcriptase | 2 |
| - | 10.1016/S0960-894X(97)00022-X | Unchecked | 1 |
| - | 10.1016/0960-894X(95)00203-6 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine