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SULPHOSALICYLIC ACID
  CheckMol                        TMF02:r0:m0
MF=C7H6O6S MW=218.18
 14 14  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5085    0.0118   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4849    0.0118   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118   -1.4849   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5085   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2728    2.2628   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3199    2.2628   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2610    3.7713   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3317    3.7713   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0471    4.5373   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5456    4.5255   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0589    6.0458   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5338    6.0340   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8302    3.7948   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6 02  0  1  0  0
  5  7 01  0  1  0  0
  6  8 01  0  1  0  0
  7  9 02  0  1  0  0
  8 10 02  0  1  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
  9 10 01  0  1  0  0
M  END

Sulphosalicylic Acid

₹ 0.00 0.00

Property Name	Property Value
Mol Name	SULPHOSALICYLIC ACID
Molweight	218.185
Monoisotopic Mass	217.98851
Clogp	-1.4303
Clogs	0.061
H Acceptors	6
H Donors	3
Total Surface Area	138.64
Relative Psa	0.58367
Polar Surface Area	120.28
Druglikeness	-3.4125
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Shape Index	0.5
Molecular Flexibility	0.46241
Molecular Complexity	0.69862
Fragments	1
Non H Atoms	14
Non Ch Atoms	7
Electronegative Atoms	7
Rotatable Bonds	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	4
Symmetric Atoms	1
Acidic Oxygens	2
Smiles	OC(c(cc(cc1)S(O)(=O)=O)c1O)=O

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Sulphosalicylic Acid