Compound Detail
CHEMBL243186
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Basic Information
| ChEMBL ID | CHEMBL243186 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CLFRCXCBWIQVRN-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
138.1
MW (Da)
0.91
ALogP
3
HBA
2
HBD
57.5
PSA (Ų)
0.45
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leishmania donovani CHEMBL367 | IC50 | 5.48 | 5.48 | 3300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leishmania donovani | IC50 | = | 3300.0 | nM | 5.48 | Antileishmanial activity against promastigote forms of Leishmania donovani by al... | 25084548 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26986086 | 10.1016/j.ejmech.2016.03.008 | Unchecked | 11 |
| 17258462 | 10.1016/j.bmc.2006.12.038 | Unchecked | 2 |
| 25084548 | 10.1021/np5000473 | Leishmania donovani | 2 |
| 2614420 | 10.1021/np50066a009 | Epidermal growth factor receptor | 1 |
| 26986086 | 10.1016/j.ejmech.2016.03.008 | No relevant target | 1 |
| 28197313 | 10.1021/acsmedchemlett.6b00417 | Myeloperoxidase | 1 |
Data from ChEMBL 36 via Core Engine