Compound Detail
CHEMBL53036
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Basic Information
| ChEMBL ID | CHEMBL53036 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VJQAWKSCDFMQQR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
342.4
MW (Da)
5.00
ALogP
3
HBA
0
HBD
25.4
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 6.32 | 6.32 | 478.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | EC50 | = | 478.0 | nM | 6.32 | Concentration required for half-maximal inhibition of CpG-ODN effect on thymidin... | 10406648 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10406648 | 10.1016/s0960-894x(99)00291-7 | NON-PROTEIN TARGET | 1 |
| 10406648 | 10.1016/s0960-894x(99)00291-7 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine