Compound Detail
CHEMBL2158201
MANGIFERIN HEPTASULFATE Enter ChEMBL ID:
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O=c1c2cc(OS(=O)(=O)O)c(OS(=O)(=O)O)cc2oc2cc(OS(=O)(=O)O)c([C@@H]3O[C@H](COS(=O)(=O)O)[C@@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]3OS(=O)(=O)O)c(O)c12
Basic Information
| ChEMBL ID | CHEMBL2158201 |
| Name | MANGIFERIN HEPTASULFATE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZAYZYKTZYDABSH-PXHCZXJWSA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
982.8
MW (Da)
-2.98
ALogP
25
HBA
8
HBD
504.9
PSA (Ų)
0.05
QED
3
Ro5 Violations
16
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21732671 | 10.1021/jm2006589 | Mus musculus | 11 |
| 21732671 | 10.1021/jm2006589 | No relevant target | 9 |
| 21732671 | 10.1021/jm2006589 | Plasma | 8 |
| 21732671 | 10.1021/jm2006589 | NON-PROTEIN TARGET | 7 |
| 21732671 | 10.1021/jm2006589 | Blood | 4 |
| 21732671 | 10.1021/jm2006589 | Coagulation factor X | 3 |
| 21732671 | 10.1021/jm2006589 | Vitamin K-dependent protein C | 2 |
| 21732671 | 10.1021/jm2006589 | Coagulation factor X/antithrombin III | 2 |
| 21732671 | 10.1021/jm2006589 | Prothrombin | 2 |
Data from ChEMBL 36 via Core Engine