Compound Detail
CHEMBL3337529
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Basic Information
| ChEMBL ID | CHEMBL3337529 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WCZPXJJNPSYRIV-JHYUDYDFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
140.1
MW (Da)
-0.36
ALogP
3
HBA
1
HBD
49.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leishmania donovani CHEMBL367 | IC50 | 5.16 | 5.16 | 6900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leishmania donovani | IC50 | = | 6900.0 | nM | 5.16 | Antileishmanial activity against promastigote forms of Leishmania donovani by al... | 25084548 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25084548 | 10.1021/np5000473 | Leishmania donovani | 2 |
Data from ChEMBL 36 via Core Engine