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Chem Donepezil | Cheminformatics

Donepezil


  • SKU Code: CH136935
Chemical Name - Donepezil
Mol Weight - 379.498
Smiles - COc(c(OC)c1)cc(CC2CC3CCN(Cc4ccccc4)CC3)c1C2=O.[H+].[Cl-]
Property Name Property Value
Mol NameDonepezil
Molweight379.498
Monoisotopic Mass379.214744
Clogp4.2149
Clogs-4.347
H Acceptors4
Total Surface Area299.91
Relative Psa0.122
Polar Surface Area38.77
Druglikeness5.6409
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.60714
Molecular Flexibility0.42744
Molecular Complexity0.83685
Fragments3
Non H Atoms28
Non Ch Atoms4
Electronegative Atoms4
Stereo Centers1
Rotatable Bonds6
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3 Atoms14
Symmetric Atoms4
Amines1
Alkyl Amines1
Basic Nitrogens1
SmilesCOc(c(OC)c1)cc(CC2CC3CCN(Cc4ccccc4)CC3)c1C2=O.[H+].[Cl-]
InChIKey
InChICl.C24H29NO3.H

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1 - Donepezil
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