Compound Detail
CHEMBL1933682
MAPLEXIN C 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
O=C(O[C@H]1[C@H](O)[C@@H](CO)OC[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
Basic Information
| ChEMBL ID | CHEMBL1933682 |
| Name | MAPLEXIN C |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BHJGLIPKIVIMEJ-LTCOOKNTSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
468.4
MW (Da)
-0.58
ALogP
13
HBA
8
HBD
223.7
PSA (Ų)
0.20
QED
2
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | IC50 | 4.73 | 4.73 | 18800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | IC50 | = | 18800.0 | nM | 4.73 | Antioxidant activity assessed as DPPH free radical scavenging activity after 30 ... | 22079755 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22079755 | 10.1016/j.bmcl.2011.10.073 | Unchecked | 2 |
| 22079755 | 10.1016/j.bmcl.2011.10.073 | Radical scavenging activity | 1 |
Data from ChEMBL 36 via Core Engine