Compound Detail
CHEMBL279534
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Cc1cn(C2C=CC(COP(=O)(OCC(Cl)(Cl)Cl)OCC(Cl)(Cl)Cl)O2)c(=O)[nH]c1=O
Basic Information
| ChEMBL ID | CHEMBL279534 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZAOLLDCKXJLRG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
567.0
MW (Da)
4.20
ALogP
8
HBA
1
HBD
108.8
PSA (Ų)
0.29
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| C8166 CHEMBL614533 | EC50 | 6.4 | 6.4 | 400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| C8166 | EC50 | = | 400.0 | nM | 6.4 | Ability to inhibit the replication of HIV-1 IIIB infected C8166 cells | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80315-7 | C8166 | 2 |
| - | 10.1016/S0960-894X(00)80315-7 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine