Compound Detail
CHEMBL150457
p-Xyloquinone Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL150457 |
| Name | p-Xyloquinone |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MYKLQMNSFPAPLZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
13
Publications
0
Known Names
Molecular Properties
136.2
MW (Da)
1.03
ALogP
2
HBA
0
HBD
34.1
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.19
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | IC50 | = | 640.0 | nM | 6.19 | Antiproliferative activity against human HL60 cells | 18052030 |
| K562 | IC50 | = | 750.0 | nM | 6.12 | In vitro cytotoxicity against Human Chronic Leukemia K562 cells | 8558523 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18461966 | 10.1021/jf800331r | Coptotermes formosanus | 4 |
| 8558523 | 10.1021/jm950629q | Nucleic Acid | 2 |
| 8576915 | 10.1021/jm9405147 | No relevant target | 2 |
| 8558523 | 10.1021/jm950629q | K562 | 1 |
| 8576915 | 10.1021/jm9405147 | ADMET | 1 |
| 18052030 | 10.1021/np070436t | HL-60 | 1 |
| 1710653 | 10.1021/np50073a012 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Candida albicans | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Candida tropicalis | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Pichia kudriavzevii | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Cryptococcus neoformans | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Aspergillus niger | 1 |
| 20851600 | 10.1016/j.bmcl.2010.08.129 | Aspergillus flavus | 1 |
Data from ChEMBL 36 via Core Engine