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DSC-ZINC04352555

 MMsINC code: MMs01221780
Type: Neutral
Formula: C5H15O5P
SMILES:   P(OC)(OC)(OC)(OC)OC
InChI:   InChI=1/C5H15O5P/c1-6-11(7-2,8-3,9-4)10-5/h1-5H3

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Similarity to PDB ligands  
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Potential Energy
Epot(MMFF94)=200.112 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 186.144 g/mol  logS: -0.26378  SlogP: 1.3467  Reactive groups: 1
 
 Topological Properties
  Globularity: 0.555377  Sterimol/B1: 2.37008  Sterimol/B2: 3.67927  Sterimol/B3: 4.35583
  Sterimol/B4: 6.926  Sterimol/L: 10.0582 
 
 Surface and Volume Properties
  Accessible surface: 368.327  Positive charged surface: 348.231  Negative charged surface: 20.0956  Volume: 171.625
  Hydrophobic surface: 348.231  Hydrophilic surface: 20.096
 
 Pharmacophoric Properties
  Hydrogen bond donors: 0  Hydrogen bond acceptors: 5  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.