Compound Detail
CHEMBL5875339
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Basic Information
| ChEMBL ID | CHEMBL5875339 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XKKGJWBONQHIEL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
210.2
MW (Da)
1.90
ALogP
4
HBA
0
HBD
44.8
PSA (Ų)
0.43
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 1 CHEMBL335 | IC50 | 5.54 | 5.54 | 2900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 1 | IC50 | = | 2900.0 | nM | 5.54 | Inhibition Assay: The degree of inhibition activity for PTP1B was investigated b... | - |
Data from ChEMBL 36 via Core Engine