Compound Detail
CHEMBL315330
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 | CHEMBL315330 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YVXWTBUIUBFZPE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
295.4
MW (Da)
0.78
ALogP
5
HBA
4
HBD
82.6
PSA (Ų)
0.28
QED
0
Ro5 Violations
14
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Diamine acetyltransferase 1 CHEMBL4286 | Ki | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Diamine acetyltransferase 1 | Ki | = | 50000.0 | nM | 4.3 | Inhibitory activity against human SSAT | 11141084 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11141084 | 10.1021/jm000084m | Diamine acetyltransferase 1 | 1 |
Data from ChEMBL 36 via Core Engine