Compound Detail
CHEMBL1817674
VIRIDAPHIN A1 GLUCOSIDE 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
C[C@@H]1Cc2c(c(O)c3c(=O)cc4oc5c(O)cc(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)c6c(=O)c7c8c(c56)c4c3c2O[C@@]8(O)[C@@H](C)O[C@@H]7C)[C@@H](C)O1
Basic Information
| ChEMBL ID | CHEMBL1817674 |
| Name | VIRIDAPHIN A1 GLUCOSIDE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HYHJXJZKQSIEPS-CZTBGZCOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
706.6
MW (Da)
1.68
ALogP
15
HBA
7
HBD
235.0
PSA (Ų)
0.10
QED
3
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HL-60 CHEMBL383 | IC50 | 4.64 | 4.64 | 23000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | IC50 | = | 23000.0 | nM | 4.64 | Cytotoxicity against human HL60 cells | 21830784 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21830784 | 10.1021/np2001286 | HL-60 | 1 |
| 21830784 | 10.1021/np2001286 | Bacillus subtilis | 1 |
Data from ChEMBL 36 via Core Engine