Compound Detail
CHEMBL1651087
(+)-OXYPEUCEDANIN 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 | CHEMBL1651087 |
| Name | (+)-OXYPEUCEDANIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NUCBCBCPICFGMZ-AWEZNQCLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
286.3
MW (Da)
3.10
ALogP
5
HBA
0
HBD
65.1
PSA (Ų)
0.55
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholinesterase CHEMBL5763 | IC50 | 4.19 | 4.19 | 64000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholinesterase | IC50 | = | 64000.0 | nM | 4.19 | Inhibition of horse serum BChE after 2 mins by Ellman's reaction | 20964319 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20964319 | 10.1021/np100531x | Cholinesterase | 1 |
Data from ChEMBL 36 via Core Engine