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

CHEMBL2287991

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
Clc1ccc(C2=NCCC/C2=C\c2ccccc2)cn1

Basic Information

ChEMBL ID CHEMBL2287991
Phase Preclinical
Structure Type MOL
InChI Key FTKOIFWKQNWBHH-SDNWHVSQSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

282.8
MW (Da)
4.40
ALogP
2
HBA
0
HBD
25.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15ClN2
MW 282.77
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.58

Activity Summary

IC50 1 meas. best 7.67

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Nicotinic acetylcholine receptor alpha8 subunit
CHEMBL2366437
IC50 7.67 7.67 21.2 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