Compound Detail
CHEMBL1785001
ACETYLDIMETHYLPIPERAZINIUM IODIDE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1785001 |
| Name | ACETYLDIMETHYLPIPERAZINIUM IODIDE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VXBLRKDEHGKPAC-UHFFFAOYSA-M |
| Parent Compound | CHEMBL356911 |
| Active Moiety | CHEMBL356911 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
157.2
MW (Da)
-0.08
ALogP
1
HBA
0
HBD
20.3
PSA (Ų)
0.45
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.44 | 5.44 | 3600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 3600.0 | nM | 5.44 | Displacement of [3H]epibatidine from nAChR in rat cerebral cortex | 19006672 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| 19006672 | 10.1016/j.bmc.2008.10.045 | Unchecked | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine