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

CHEMBL356088

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
Cc1noc(/C=C2/CN3CCC2CC3)c1C

Basic Information

ChEMBL ID CHEMBL356088
Phase Preclinical
Structure Type MOL
InChI Key AUMOEFBGJSMWBX-GHXNOFRVSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

218.3
MW (Da)
2.40
ALogP
3
HBA
0
HBD
29.3
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H18N2O
MW 218.30
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.42

Activity Summary

IC50 1 meas. best 6.43

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Muscarinic acetylcholine receptor
CHEMBL1907609
IC50 6.43 6.43 373.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10585207 10.1021/jm9910627 Neuronal acetylcholine receptor 1
10585207 10.1021/jm9910627 Muscarinic acetylcholine receptor 1

Data from ChEMBL 36 via Core Engine