blarcamesine   Click here for help

GtoPdb Ligand ID: 11586

Synonyms: AE-37 | AE37 | Anavex 2-73 | Anavex2-73 | THD-DP-FM
Compound class: Synthetic organic
Comment: Blarcamesine (Anavex2-73) is a Sigma-1 (σ1) protein agonist and muscarinic acetylcholine receptor modulator [6]. Anavex are investigating it for potential to slow progression in neurodegenerative conditions including Parkinson's and Alzheimer's diseases, and Rett syndrome [2]. Anticonvulsant, anti-amnesic, neuroprotective and antidepressant activities in response to blarcamesine have been identified in a number of animal models of neurodegenerative and neurodevelopmental conditions [3-6].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 12.47
Molecular weight 281.18
XLogP 3.63
No. Lipinski's rules broken 0
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Canonical SMILES CN(CC1CCOC1(c1ccccc1)c1ccccc1)C
Isomeric SMILES CN(CC1CCOC1(c1ccccc1)c1ccccc1)C
InChI InChI=1S/C19H23NO/c1-20(2)15-18-13-14-21-19(18,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
11031 blarcamesine
Synonyms Click here for help
AE-37 | AE37 | Anavex 2-73 | Anavex2-73 | THD-DP-FM
Database Links Click here for help
CAS Registry No. 195615-83-9 (source: WHO INN record)
ChEMBL Ligand CHEMBL4297224
DrugBank Ligand DB05592
GtoPdb PubChem SID 442878620
PubChem CID 9882189
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UniChem Compound Search for chemical match using the InChIKey BOTHKNZTGGXFEQ-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey BOTHKNZTGGXFEQ-UHFFFAOYSA-N