Compound Detail
CHEMBL1277682
ISOMAMMEIGIN Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1277682 |
| Name | ISOMAMMEIGIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DJKBNLZZTMVBGL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
404.5
MW (Da)
5.58
ALogP
5
HBA
1
HBD
76.7
PSA (Ų)
0.45
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| dengue virus type 2 CHEMBL613966 | EC50 | 5.58 | 5.58 | 2600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| dengue virus type 2 | EC50 | = | 2600.0 | nM | 5.58 | Antiviral activity against DENV2 | 31128447 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20943395 | 10.1016/j.bmc.2010.09.044 | Acetylcholinesterase | 1 |
| 31128447 | 10.1016/j.ejmech.2019.05.010 | dengue virus type 2 | 1 |
| 35816877 | 10.1016/j.ejmech.2022.114576 | dengue virus type 2 | 1 |
| 35816877 | 10.1016/j.ejmech.2022.114576 | Vero | 1 |
| 35816877 | 10.1016/j.ejmech.2022.114576 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine