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Compound 25
  CheckMol                        TMF02:r0:m0
MF=C15H13FO2 MW=244.27
 18 19  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3081    0.7660   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6162    0.0236   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3199    2.2744   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6279   -1.4613   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9242    0.7896   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6279    3.0286   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9360   -2.1919   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3434   -2.2037   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9360    2.2980   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6397    4.5370   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9478   -3.6768   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3552   -3.6885   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9478    5.2912   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3552    5.2912   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6633   -4.4192   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2559    4.5488   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9596    6.7997   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5  1  0  0  0  0
  3  6 01  0  1  0  0
  4  7 02  0  1  0  0
  5  8 02  0  1  0  0
  5  9 01  0  1  0  0
  6 10 02  0  1  0  0
  7 11  1  0  0  0  0
  8 12 01  0  1  0  0
  9 13 02  0  1  0  0
 11 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16 02  0  1  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
  7 10 01  0  1  0  0
 13 16 01  0  1  0  0
M  END

Flurbiprofen

₹ 0.00 0.00

Chemical Name - Flurbiprofen
Mol Weight - 244.264
Smiles - CC(C(O)=O)c(cc1)cc(F)c1-c1ccccc1

Property Name	Property Value
Mol Name	Flurbiprofen
Molweight	244.264
Monoisotopic Mass	244.089958
Clogp	3.3303
Clogs	-4.362
H Acceptors	2
H Donors	1
Total Surface Area	188.23
Relative Psa	0.13887
Polar Surface Area	37.3
Druglikeness	-1.1265
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Shape Index	0.61111
Molecular Flexibility	0.41579
Molecular Complexity	0.7177
Fragments	1
Non H Atoms	18
Non Ch Atoms	3
Electronegative Atoms	3
Stereo Centers	1
Rotatable Bonds	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	3
Symmetric Atoms	2
Acidic Oxygens	1
Smiles	CC(C(O)=O)c(cc1)cc(F)c1-c1ccccc1
InChIKey
InChI	C15H13O2F

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Flurbiprofen