Compound Detail
CHEMBL2229404
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 | CHEMBL2229404 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NWRZWUQIRAPKGM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
190.2
MW (Da)
-0.20
ALogP
2
HBA
1
HBD
70.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.77 | 5.77 | 1700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 1700.0 | nM | 5.77 | Displacement of [3H]IMI from nicotinic acetylcholine receptor in Drosophila mela... | 19253973 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1584/jpestics.R07-05 | Aulacophora | 3 |
| - | 10.1584/jpestics.R07-05 | Spodoptera litura | 3 |
| - | 10.1584/jpestics.R07-05 | Myzus persicae | 3 |
| 19253973 | 10.1021/jf803985r | Aphis gossypii | 1 |
| 19253973 | 10.1021/jf803985r | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine