Compound Detail
CHEMBL5993330
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Basic Information
| ChEMBL ID | CHEMBL5993330 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WHRSAYAWGGXIMW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
427.5
MW (Da)
2.95
ALogP
6
HBA
2
HBD
106.6
PSA (Ų)
0.60
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Alkaline phosphatase, tissue-nonspecific isozyme CHEMBL5979 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Alkaline phosphatase, tissue-nonspecific isozyme | IC50 | = | 550.0 | nM | 6.26 | Enzyme Kinetic Assay: To determine the inhibition selectivity for inhibitor cand... | - |
Data from ChEMBL 36 via Core Engine