Compound Detail
CHEMBL50573
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Basic Information
| ChEMBL ID | CHEMBL50573 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QSJPQXTVKNZDHR-CWRNSKLLSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
266.4
MW (Da)
2.84
ALogP
3
HBA
1
HBD
49.8
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Candida tropicalis CHEMBL612870 | IC50 | 4.2 | 4.2 | 63000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Candida tropicalis | IC50 | = | 63000.0 | nM | 4.2 | Inhibitory activity against Candida tropicalis | 16297620 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15027875 | 10.1021/jm0305319 | Homo sapiens | 1 |
| 15027875 | 10.1021/jm0305319 | Plasmodium falciparum | 1 |
| 16297620 | 10.1016/j.bmcl.2005.10.101 | Candida albicans | 1 |
| 16297620 | 10.1016/j.bmcl.2005.10.101 | Candida tropicalis | 1 |
| 16297620 | 10.1016/j.bmcl.2005.10.101 | Pichia kudriavzevii | 1 |
Data from ChEMBL 36 via Core Engine