Compound Detail
CHEMBL1210916
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 | CHEMBL1210916 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VKARRIOSXXOKPE-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
288.4
MW (Da)
2.97
ALogP
2
HBA
2
HBD
57.5
PSA (Ų)
0.51
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Candida parapsilosis CHEMBL612868 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Candida parapsilosis | IC50 | = | 2000.0 | nM | 5.7 | Antifungal activity against Candida parapsilosis | 20591665 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Staphylococcus aureus | 2 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Candida albicans | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Nakaseomyces glabratus | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Candida tropicalis | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Pichia kudriavzevii | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Candida parapsilosis | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Pseudomonas aeruginosa | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Escherichia coli | 1 |
| 20591665 | 10.1016/j.bmcl.2010.06.020 | Streptococcus pyogenes | 1 |
Data from ChEMBL 36 via Core Engine