Compound Detail
CHEMBL4453399
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Basic Information
| ChEMBL ID | CHEMBL4453399 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DIJDMPHMIHDNNZ-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
270.2
MW (Da)
1.45
ALogP
6
HBA
0
HBD
82.4
PSA (Ų)
0.53
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Giardia intestinalis CHEMBL612652 | IC50 | 5.3 | 5.3 | 5000.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Giardia intestinalis | IC50 | = | 5000.0 | nM | 5.3 | Antiparasitic activity against Giardia lamblia WB trophozoites after 24 to 48 hr... | 30468386 |
| Giardia intestinalis | IC50 | = | 5011.87 | nM | 5.3 | Antiparasitic activity against Giardia lamblia WB trophozoites after 24 to 48 hr... | 30468386 |
| Giardia intestinalis | IC50 | = | 5000.0 | nM | 5.3 | Antiparasitic activity against Giardia lamblia P15 WB assessed a inhibition of p... | 33151678 |
Literature References
Data from ChEMBL 36 via Core Engine