General Information of the Compound
Compound ID
CP0210785
Compound Name
Aceclidine
    Show/Hide
Synonyms
(-)-aceclidine
ACECLIDINE
GTPL288
R-(-)-aceclidine
ZB016005
[(8R)-1-azoniabicyclo[2.2.2]octan-8-yl] acetate
    Show/Hide
Structure
Formula
C9H15NO2
Molecular Weight
169.224
Canonical SMILES
CC(=O)OC1CN2CCC1CC2
    Show/Hide
InChI
InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3
    Show/Hide
InChIKey
WRJPSSPFHGNBMG-UHFFFAOYSA-N
CAS
827-61-2
Physicochemical Property
logP
0.6437
Rotatable Bonds
1
Heavy Atom Count
12
Polar Areas
29.54
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Complexity
12

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 1979
SID: 15171162
ChEMBL ID
CHEMBL20835
DrugBank ID
DB13262
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01310, Muscarinic acetylcholine receptor M1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000398 A-9 Mus musculus (Mouse)  1
1
EC50 = 4466 nM
   TI
   LI
   LO
   TS
Protein ID: PT06153, Muscarinic acetylcholine receptor M3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000398 A-9 Mus musculus (Mouse)  1
1
EC50 = 10000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( ACECLIDINE )
Drug Name ACECLIDINE
Indication
Glaucoma/ocular hypertension
Approved
Target(s)
Muscarinic acetylcholine receptor M5 (CHRM5)
Inhibitor
Muscarinic acetylcholine receptor M4 (CHRM4)
Inhibitor
Muscarinic acetylcholine receptor M3 (CHRM3)
Inhibitor
Muscarinic acetylcholine receptor M1 (CHRM1)
Inhibitor
Muscarinic acetylcholine receptor M2 (CHRM2)
Inhibitor