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PUBCHEM-ZINC05863155

 MMsINC code: MMs03422743
Type: Neutral
Formula: C18H26FNO2S
SMILES:   S(=O)(=O)(N(C1CCCCC1)C1CCCCC1)c1ccc(F)cc1
InChI:   InChI=1/C18H26FNO2S/c19-15-11-13-18(14-12-15)23(21,22)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h11-14,16-17H,1-10H2

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Potential Energy
Epot(MMFF94)=42.0656 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 339.475 g/mol  logS: -4.5357  SlogP: 4.4818  Reactive groups: 0
 
 Topological Properties
  Globularity: 0.222601  Sterimol/B1: 3.38934  Sterimol/B2: 4.15002  Sterimol/B3: 4.91208
  Sterimol/B4: 8.43  Sterimol/L: 12.6712 
 
 Surface and Volume Properties
  Accessible surface: 541.656  Positive charged surface: 348.923  Negative charged surface: 192.733  Volume: 322.875
  Hydrophobic surface: 496.975  Hydrophilic surface: 44.681
 
 Pharmacophoric Properties
  Hydrogen bond donors: 0  Hydrogen bond acceptors: 2  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.