Compound Detail
CHEMBL3753379
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Basic Information
| ChEMBL ID | CHEMBL3753379 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXQXYAMWVMIBBZ-LCYFTJDESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
332.6
MW (Da)
3.72
ALogP
5
HBA
0
HBD
49.0
PSA (Ų)
0.75
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neutral amino acid transporter B(0) CHEMBL3562162 | IC50 | 5.43 | 5.43 | 3700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neutral amino acid transporter B(0) | IC50 | = | 3700.0 | nM | 5.43 | Inhibition of ASCT2 (unknown origin)-mediated glutamine transport | 26750251 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26750251 | 10.1016/j.bmcl.2015.12.031 | Neutral amino acid transporter B(0) | 1 |
Data from ChEMBL 36 via Core Engine