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PUBCHEM-ZINC05915146

 MMsINC code: MMs03442360
Type: Neutral
Formula: C11H15O4P
SMILES:   P(OC)(OC)(=O)C1(O)Cc2c(C1)cccc2
InChI:   InChI=1/C11H15O4P/c1-14-16(13,15-2)11(12)7-9-5-3-4-6-10(9)8-11/h3-6,12H,7-8H2,1-2H3

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Potential Energy
Epot(MMFF94)=60.6829 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 242.211 g/mol  logS: -1.47804  SlogP: 0.88944  Reactive groups: 0
 
 Topological Properties
  Globularity: 0.0639361  Sterimol/B1: 2.3718  Sterimol/B2: 3.4424  Sterimol/B3: 3.73991
  Sterimol/B4: 5.76481  Sterimol/L: 13.0981 
 
 Surface and Volume Properties
  Accessible surface: 448.491  Positive charged surface: 313.202  Negative charged surface: 135.289  Volume: 220.625
  Hydrophobic surface: 382.244  Hydrophilic surface: 66.247
 
 Pharmacophoric Properties
  Hydrogen bond donors: 1  Hydrogen bond acceptors: 4  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.