Compound Detail
CHEMBL3349025
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3349025 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PQUIYLVBEAXSHI-HGOUYRHRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
280.2
MW (Da)
-1.51
ALogP
10
HBA
4
HBD
151.9
PSA (Ų)
0.29
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.65
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenosylhomocysteinase CHEMBL2664 | Ki | 6.65 | 6.65 | 224.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenosylhomocysteinase | Ki | = | 224.0 | nM | 6.65 | concentration dependent inhibition of S-Adenosyl-homocysteine hydrolase was dete... | 9171871 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9171871 | 10.1021/jm960828p | Adenosylhomocysteinase | 2 |
| 9171871 | 10.1021/jm960828p | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine