Compound Detail
CHEMBL600474
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Basic Information
| ChEMBL ID | CHEMBL600474 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JFFGMMHKHNXQAF-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
2.27
ALogP
5
HBA
3
HBD
126.7
PSA (Ų)
0.59
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cystine/glutamate transporter CHEMBL1075149 | Ki | 4.28 | 4.28 | 52000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cystine/glutamate transporter | Ki | = | 52000.0 | nM | 4.28 | Competitive inhibition of [3H]L-glutamate uptake at amino acid transport system ... | 19932968 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19932968 | 10.1016/j.bmc.2009.11.001 | Cystine/glutamate transporter | 5 |
Data from ChEMBL 36 via Core Engine