Compound Detail
CHEMBL1813182
XYLARENONE A Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1813182 |
| Name | XYLARENONE A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PSGJCHLXOJTCGB-SXHPEXCUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
264.3
MW (Da)
0.98
ALogP
4
HBA
2
HBD
70.1
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.61 | 5.61 | 2430.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2430.0 | nM | 5.61 | Inhibition of pepsin from porcine gastric mucosa using Arg-Glu-(EDANS)- Ser-Gln-... | 21510613 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21510613 | 10.1021/np1005983 | Proprotein convertase subtilisin/kexin type 7 | 5 |
| 21510613 | 10.1021/np1005983 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine