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Compound 80
  CheckMol                        TMF02:r0:m0
MF=C24H30ClNO3 MW=415.96
 30 31  0  5  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -5.6564    1.2255   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4577    2.5100   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9038    3.9123   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -7.9661    2.6279   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0705    4.8904   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.5015    4.4426   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -8.3431    4.1009   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9441    1.4848   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8230    6.3752   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.2541    5.9274   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -8.4374    0.0825   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4207    6.9055   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.8518    6.4577   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4155   -1.0606   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9762   -0.1650   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1732    8.3903   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6043    7.9425   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9088   -2.4629   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4695   -1.5673   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7709    8.9206   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4476   -2.7103   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9408   -4.1127   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4796   -4.3601   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.9729   -5.7624   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.5251   -3.1935   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.5117   -6.0099   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.0639   -3.4410   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.5572   -4.8433   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0943    2.3568   -0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  1  0  0
  3  5  1  0  1  0  0
  4  6 02  0  2  0  0
  4  7 01  0  1  0  0
  5  8  1  0  1  0  0
  5  9  1  0  0  0  0
  6 10 01  0  1  0  0
  7 11 02  0  1  0  0
  9 12  1  0  0  0  0
 10 13 02  0  1  0  0
 11 14  1  0  0  0  0
 12 15  1  0  1  0  0
 12 16  1  0  1  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  1  0  0
 16 20  1  0  1  0  0
 17 21  1  0  0  0  0
 19 22  1  0  1  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25 02  0  1  0  0
 24 26 01  0  1  0  0
 25 27 01  0  1  0  0
 26 28 02  0  1  0  0
 27 29 02  0  1  0  0
  6  8  1  0  1  0  0
 11 13 01  0  1  0  0
 20 22  1  0  1  0  0
 28 29 01  0  1  0  0
M  CHG  1   1  -1
M  CHG  1  30   1
M  END

Donepezil

₹ 0.00 0.00

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 Name	Donepezil
Molweight	379.498
Monoisotopic Mass	379.214744
Clogp	4.2149
Clogs	-4.347
H Acceptors	4
Total Surface Area	299.91
Relative Psa	0.122
Polar Surface Area	38.77
Druglikeness	5.6409
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.60714
Molecular Flexibility	0.42744
Molecular Complexity	0.83685
Fragments	3
Non H Atoms	28
Non Ch Atoms	4
Electronegative Atoms	4
Stereo Centers	1
Rotatable Bonds	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	14
Symmetric Atoms	4
Amines	1
Alkyl Amines	1
Basic Nitrogens	1
Smiles	COc(c(OC)c1)cc(CC2CC3CCN(Cc4ccccc4)CC3)c1C2=O.[H+].[Cl-]
InChIKey
InChI	Cl.C24H29NO3.H

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Donepezil