Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2287990

3-CINNAMYLIDENEMYOSMINE
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/c1ccccc1)\C=C1/CCN=C1c1cccnc1

Basic Information

ChEMBL ID CHEMBL2287990
Name 3-CINNAMYLIDENEMYOSMINE
Phase Preclinical
Structure Type MOL
InChI Key NDUABLOLCNWROE-SDQFYIDFSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

260.3
MW (Da)
3.91
ALogP
2
HBA
0
HBD
25.2
PSA (Ų)
0.82
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H16N2
MW 260.34
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.08

Activity Summary

IC50 1 meas. best 5.45

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Nicotinic acetylcholine receptor alpha8 subunit
CHEMBL2366437
IC50 5.45 5.45 3520.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1584/jpestics.G06-11 Nicotinic acetylcholine receptor alpha8 subunit 1

Data from ChEMBL 36 via Core Engine