Structure

InChI Key GHKABPDNWHXLHG-UHFFFAOYSA-N
Smile Cc1cc(-c2ccccc2)nnc1NCCN1CCOCC1.Cl
InChI
InChI=1S/C17H22N4O.ClH/c1-14-13-16(15-5-3-2-4-6-15)19-20-17(14)18-7-8-21-9-11-22-12-10-21;/h2-6,13H,7-12H2,1H3,(H,18,20);1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H24Cl2N4O
Molecular Weight 371.31
AlogP 2.2
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 50.28
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Acetylcholinesterase inhibitor PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 51040
ChEMBL CHEMBL1364551
EPA CompTox DTXSID2045864
FDA SRS 82Y7NT6DFT
PubChem 33254
SureChEMBL SCHEMBL124092