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Compound 121
  CheckMol                        TMF02:r0:m0
MF=C22H28F2O5 MW=410.46
 29 32  0 10  1               999 V2000
    0.0000   -0.0000   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1552   -0.4764   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1548   -1.5840   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7027    0.9766   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6439   -0.7741   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6312   -3.0131   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3100   -1.2624   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4645   -0.2144   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7622    1.2981   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7269    2.1080   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6681    0.3573   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1203   -2.2033   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3692   -4.1207   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1199   -3.3108   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3104   -2.3700   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2156    1.8102   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1925    0.3692   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8341   -3.7991   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5963   -4.7400   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4541    2.7154   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6677    3.1798   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6689    1.8222   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8345   -4.9067   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2394    3.4776   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4661    4.2398   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1219    2.2985   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1679    5.0020   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7880    5.0020   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1100    4.2517   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  1  0  0
  2  4  1  0  1  0  0
  2  5  1  0  2  0  0
  3  6  1  0  2  0  0
  3  7  1  0  1  0  0
  3  8  1  6  0  0  0
  4  9  1  6  0  0  0
  4 10  1  0  1  0  0
  5 11  1  0  1  0  0
  5 12  1  1  1  0  0
  6 13  2  0  1  0  0
  6 14  1  0  1  0  0
  7 15  2  0  1  0  0
 10 16  1  0  1  0  0
 11 17  1  6  1  0  0
 13 18  1  0  1  0  0
 14 19  1  1  0  0  0
 16 20  1  0  1  0  0
 16 21  1  6  0  0  0
 17 22  1  0  1  0  0
 18 23  2  0  0  0  0
 20 24  1  1  0  0  0
 20 25  1  0  0  0  0
 22 26  1  1  0  0  0
 25 27  2  0  0  0  0
 25 28  1  0  0  0  0
 28 29  1  0  0  0  0
 11 16  1  0  2  0  0
 12 14  1  0  1  0  0
 15 18  1  0  1  0  0
 20 22  1  0  1  0  0
M  END

Flumethasone

₹ 0.00 0.00

Chemical Name - Flumethasone
Mol Weight - 410.455
Smiles - C[C@H](C[C@@H]([C@H](C[C@@H](C([C@]1(C)C=C2)=CC2=O)F)[C@@]11F)[C@]2(C)C[C@@H]1O)[C@@]2(C(CO)=O)O

Property Name	Property Value
Mol Name	Flumethasone
Molweight	410.455
Monoisotopic Mass	410.190481
Clogp	1.1374
Clogs	-3.433
H Acceptors	5
H Donors	3
Total Surface Area	273.92
Relative Psa	0.23868
Polar Surface Area	94.83
Druglikeness	4.2291
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Shape Index	0.44828
Molecular Flexibility	0.17889
Molecular Complexity	1.0404
Fragments	1
Non H Atoms	29
Non Ch Atoms	7
Electronegative Atoms	7
Stereo Centers	9
Rotatable Bonds	2
Rings Closures	4
Small Rings	4
Sp3 Atoms	19
Smiles	C[C@H](C[C@@H]([C@H](C[C@@H](C([C@]1(C)C=C2)=CC2=O)F)[C@@]11F)[C@]2(C)C[C@@H]1O)[C@@]2(C(CO)=O)O
InChIKey	InChI=1S/C22H28F2O5/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-19(15,2)21(14,24)17(27)9-20(13,3)22(11,29)18(28)10-25/h4-5,7,11,13-14,16-17,25,27,29H,6,8-10H2,1-3H3/t11-,13+,14-,16+,17-,19-,20-,21-,22-/m0/s1
InChI	WXURHACBFYSXBI-DZJRQRCNSA-N

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Flumethasone