Compound Detail
CHEMBL1668628
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Basic Information
| ChEMBL ID | CHEMBL1668628 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HDMKXHZOVQRQCE-KEHAOADBSA-N |
| Parent Compound | CHEMBL1739510 |
| Active Moiety | CHEMBL1739510 |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
190.2
MW (Da)
1.33
ALogP
3
HBA
2
HBD
58.6
PSA (Ų)
0.37
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 15000.0 | nM | 4.82 | Inhibition of Aeromonas proteolytica aminopeptidase by Dixon plot analysis | 21292493 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21292493 | 10.1016/j.bmc.2011.01.008 | Aminopeptidase N | 1 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Cytosol aminopeptidase | 1 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Leukotriene A-4 hydrolase | 1 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine