Compound Detail
CHEMBL132535
GLYCYRIN 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
Basic Information
| ChEMBL ID | CHEMBL132535 |
| Name | GLYCYRIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FWWGXZYUURXJLK-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
382.4
MW (Da)
4.40
ALogP
6
HBA
2
HBD
89.1
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.05
Ki 1 meas. best 4.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 4.37 | 4.37 | 42600.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 4.05 | 4.05 | 88100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 42600.0 | nM | 4.37 | Uncompetitive inhibition of Bacillus subtilis N-terminal hexahistidine-tagged Ft... | 28196701 |
| NON-PROTEIN TARGET | EC50 | = | 88100.0 | nM | 4.05 | Antiviral activity against KJ56-1 Bovine rotavirus G8P[7] infected in african gr... | 20850329 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28196701 | 10.1016/j.bmcl.2017.01.095 | Unchecked | 9 |
| 14643306 | 10.1016/j.bmcl.2003.09.052 | Mus musculus | 8 |
| 20850329 | 10.1016/j.bmc.2010.07.073 | NON-PROTEIN TARGET | 4 |
| 20064716 | 10.1016/j.bmcl.2009.12.106 | Unchecked | 2 |
| 20850329 | 10.1016/j.bmc.2010.07.073 | ADMET | 1 |
| 20850329 | 10.1016/j.bmc.2010.07.073 | Unchecked | 1 |
| 22074222 | 10.1021/np2004775 | Streptococcus mutans | 1 |
| 22074222 | 10.1021/np2004775 | Streptococcus sobrinus | 1 |
| 22074222 | 10.1021/np2004775 | Prevotella intermedia | 1 |
| 26841168 | 10.1021/acs.jnatprod.5b00877 | Nuclear factor erythroid 2-related factor 2 | 1 |
| 28196701 | 10.1016/j.bmcl.2017.01.095 | Bacillus subtilis | 1 |
Data from ChEMBL 36 via Core Engine