Compound Detail
CHEMBL5418807
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Basic Information
| ChEMBL ID | CHEMBL5418807 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMWNZXVYTGQBHC-ZIOPAAQOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
4.69
ALogP
6
HBA
0
HBD
77.1
PSA (Ų)
0.35
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Leishmania major CHEMBL612879 | IC50 | 5.36 | 5.36 | 4390.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Leishmania major | IC50 | = | 4390.0 | nM | 5.36 | Antileishmanial activity against Leishmania major IR-173 promastigotes assessed ... | 37859713 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37859713 | 10.1039/d3md00220a | Leishmania major | 2 |
| 37859713 | 10.1039/d3md00220a | Vero | 1 |
| 37859713 | 10.1039/d3md00220a | THP-1 | 1 |
| 37859713 | 10.1039/d3md00220a | ADMET | 1 |
Data from ChEMBL 36 via Core Engine