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PUBCHEM-ZINC03183385

 MMsINC code: MMs03005840
Type: Neutral
Formula: C6H10F3O6P
SMILES:   P(OC(C(OC)=O)C(F)(F)F)(OC)(OC)=O
InChI:   InChI=1/C6H10F3O6P/c1-12-5(10)4(6(7,8)9)15-16(11,13-2)14-3/h4H,1-3H3/t4-/m1/s1

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Potential Energy
Epot(MMFF94)=6.22227 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 266.108 g/mol  logS: -1.3571  SlogP: 0.8575  Reactive groups: 1
 
 Topological Properties
  Globularity: 0.0607374  Sterimol/B1: 3.02913  Sterimol/B2: 3.18618  Sterimol/B3: 3.41588
  Sterimol/B4: 5.16298  Sterimol/L: 12.6873 
 
 Surface and Volume Properties
  Accessible surface: 423.805  Positive charged surface: 263.712  Negative charged surface: 160.094  Volume: 191.25
  Hydrophobic surface: 253.104  Hydrophilic surface: 170.701
 
 Pharmacophoric Properties
  Hydrogen bond donors: 0  Hydrogen bond acceptors: 5  Acid groups: 0  Basic groups: 0
  Chiral centers: 1
 
 Drug- and Lead-like Properties
  Lipinski's drug-like rule: 1  Violations of Lipinski's rule: 0  Oprea's lead like rule: 1
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Ions/Tautomers related molecules: no related molecules available.