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

CHEMBL1784993

ACETYLAMINOCHOLINE IODIDE
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
CC(=O)NOCC[N+](C)(C)C.[I-]

Basic Information

ChEMBL ID CHEMBL1784993
Name ACETYLAMINOCHOLINE IODIDE
Phase Preclinical
Structure Type MOL
InChI Key OVUJAYBGSUHGKX-UHFFFAOYSA-N
Parent Compound CHEMBL1789673
Active Moiety CHEMBL1789673
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

161.2
MW (Da)
-0.24
ALogP
2
HBA
1
HBD
38.3
PSA (Ų)
0.35
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H17IN2O2
MW 288.13
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 0.23

Activity Summary

Ki 1 meas. best 4.2

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
Ki 4.2 4.2 63000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked Ki = 63000.0 nM 4.2 Displacement of [3H]epibatidine from nAChR in rat cerebral cortex 19006672

Literature References

PubMed DOI Target Context # Activities
19006672 10.1016/j.bmc.2008.10.045 Unchecked 1

Data from ChEMBL 36 via Core Engine