Compound Detail
CHEMBL5844094
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Basic Information
| ChEMBL ID | CHEMBL5844094 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LDXNSXVCMPPYAY-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
301.4
MW (Da)
2.91
ALogP
5
HBA
2
HBD
54.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.3 | 5.35 | 500.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 500.0 | nM | 6.3 | Biochemical Assay: In brief, this Rpn11 bioassay employs a fluorescent polarizat... | - |
| Unchecked | IC50 | = | 7800.0 | nM | 5.11 | Biochemical Assay: In brief, this Rpn11 bioassay employs a fluorescent polarizat... | - |
| Unchecked | IC50 | = | 23000.0 | nM | 4.64 | Biochemical Assay: In brief, this Rpn11 bioassay employs a fluorescent polarizat... | - |
Data from ChEMBL 36 via Core Engine