Compound Detail
CHEMBL1075970
4-ACETYL-2-BENZOXAZOLINONE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1075970 |
| Name | 4-ACETYL-2-BENZOXAZOLINONE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FZAQRVWPQCXSPC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
12
Publications
0
Known Names
Molecular Properties
177.2
MW (Da)
1.32
ALogP
3
HBA
1
HBD
63.1
PSA (Ų)
0.67
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fusarium culmorum CHEMBL612752 | IC50 | 5.4 | 5.4 | 4000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fusarium culmorum | IC50 | = | 4000.0 | nM | 5.4 | Inhibition of 3-acetyldeoxynivalenol production by Fusarium culmorum in liquid c... | 19191669 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19919060 | 10.1021/np900371j | P388 | 1 |
| 19919060 | 10.1021/np900371j | Micrococcus luteus | 1 |
| 19919060 | 10.1021/np900371j | Staphylococcus aureus | 1 |
| 19919060 | 10.1021/np900371j | Escherichia coli | 1 |
| 19919060 | 10.1021/np900371j | Enterobacter cloacae | 1 |
| 19919060 | 10.1021/np900371j | Enterococcus faecalis | 1 |
| 19919060 | 10.1021/np900371j | Streptococcus pneumoniae | 1 |
| 19919060 | 10.1021/np900371j | Candida albicans | 1 |
| 19919060 | 10.1021/np900371j | Neisseria gonorrhoeae | 1 |
| 19919060 | 10.1021/np900371j | Cryptococcus neoformans | 1 |
| 19919060 | 10.1021/np900371j | Stenotrophomonas maltophilia | 1 |
| 19191669 | 10.1021/jf802813h | Fusarium culmorum | 1 |
Data from ChEMBL 36 via Core Engine