Compound Detail
CHEMBL1485168
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
Basic Information
| ChEMBL ID | CHEMBL1485168 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XSYLVTQRXJCUTP-UHFFFAOYSA-N |
7
Targets
11
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
304.4
MW (Da)
3.41
ALogP
4
HBA
1
HBD
59.1
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 8 meas. best 5.83
IC50 3 meas. best 6.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sphingosine 1-phosphate receptor 4 CHEMBL3230 | IC50 | 6.21 | 6.21 | 611.0 | 1 |
| Sphingosine 1-phosphate receptor 1 CHEMBL4333 | IC50 | 5.92 | 5.92 | 1188.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.83 | 5.3825 | 1464.0 | 4 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.75 | 5.75 | 1777.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.54 | 5.54 | 2866.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.47 | 5.47 | 3380.0 | 1 |
| Heat shock factor protein 1 CHEMBL5313 | EC50 | 5.41 | 5.41 | 3912.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.0 | 5.0 | 10089.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30523084 | 10.1126/science.aat9446 | Plasmodium berghei | 4 |
| 30523084 | 10.1126/science.aat9446 | HepG2-CD81 | 2 |
Data from ChEMBL 36 via Core Engine