ACECLIDINE

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Synonyms
Status
Molecule Category Free-form
ATC S01EB08
UNII 0578K3ELIO
EPA CompTox DTXSID2045658

Structure

InChI Key WRJPSSPFHGNBMG-UHFFFAOYSA-N
Smiles CC(=O)OC1CN2CCC1CC2
InChI
InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H15NO2
Molecular Weight 169.22
AlogP 0.64
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 1.0
Polar Surface Area 29.54
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 12.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Acetylcholine receptor
- 120-510 - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Rattus norvegicus
- 23-510 - - -

Cross References

Resources Reference
ChEBI 93847
ChEMBL CHEMBL20835
DrugBank DB13262
DrugCentral 4314
FDA SRS 0578K3ELIO
SureChEMBL SCHEMBL121393
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