Compound Detail
CHEMBL3679990
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 | CHEMBL3679990 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SXFQBUKKIKMRPM-UHFFFAOYSA-N |
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
452.5
MW (Da)
3.56
ALogP
8
HBA
2
HBD
115.9
PSA (Ų)
0.48
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 6.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutaminase kidney isoform, mitochondrial CHEMBL2146302 | IC50 | 6.62 | 6.5033 | 240.0 | 3 |
| Unchecked CHEMBL612545 | IC50 | 6.62 | 6.445 | 240.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutaminase kidney isoform, mitochondrial | IC50 | = | 240.0 | nM | 6.62 | Enzyme Assay-Time Dependence: Compounds were assessed for their ability to inhib... | - |
| Glutaminase kidney isoform, mitochondrial | IC50 | = | 240.0 | nM | 6.62 | Recombinant Enzyme Assay: Compounds were assessed for their ability to inhibit t... | - |
| Unchecked | IC50 | = | 240.0 | nM | 6.62 | Recombinant Enzyme Assay - Time Dependence: Compounds were assessed for their ab... | - |
| Glutaminase kidney isoform, mitochondrial | IC50 | = | 540.0 | nM | 6.27 | Recombinant Enzyme Assa: Compounds were assessed for their ability to inhibit th... | - |
| Unchecked | IC50 | = | 540.0 | nM | 6.27 | Modified Recombinant Enzyme Assay: Glutaminase reaction buffer was prepared [50 ... | - |
Data from ChEMBL 36 via Core Engine