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DSC-ZINC01610754

 MMsINC code: MMs01221671
Type: Neutral
Formula: C6H8O6P2
SMILES:   P(O)(O)(=O)c1ccccc1P(O)(O)=O
InChI:   InChI=1/C6H8O6P2/c7-13(8,9)5-3-1-2-4-6(5)14(10,11)12/h1-4H,(H2,7,8,9)(H2,10,11,12)

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Potential Energy
Epot(MMFF94)=-62.9758 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 238.072 g/mol  logS: -0.10488  SlogP: -2.8478  Reactive groups: 0
 
 Topological Properties
  Globularity: 0.136234  Sterimol/B1: 3.33562  Sterimol/B2: 3.49913  Sterimol/B3: 4.23652
  Sterimol/B4: 5.60636  Sterimol/L: 9.28704 
 
 Surface and Volume Properties
  Accessible surface: 371.68  Positive charged surface: 175.018  Negative charged surface: 196.663  Volume: 172.5
  Hydrophobic surface: 152.834  Hydrophilic surface: 218.846
 
 Pharmacophoric Properties
  Hydrogen bond donors: 6  Hydrogen bond acceptors: 6  Acid groups: 0  Basic groups: 0
  Chiral centers: 0
 
 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.