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PUBCHEM-ZINC02004427

 MMsINC code: MMs02845202
Type: Neutral
Formula: C24H20P2
SMILES:   P(P(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChI:   InChI=1/C24H20P2/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H

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Similarity to PDB ligands  
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Potential Energy
Epot(MMFF94)=155.121 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 370.372 g/mol  logS: -6.3203  SlogP: 5.1672  Reactive groups: 1
 
 Topological Properties
  Globularity: 0.107179  Sterimol/B1: 2.32501  Sterimol/B2: 2.68225  Sterimol/B3: 3.89612
  Sterimol/B4: 9.44849  Sterimol/L: 12.7056 
 
 Surface and Volume Properties
  Accessible surface: 607.761  Positive charged surface: 304.881  Negative charged surface: 302.88  Volume: 369.5
  Hydrophobic surface: 607.761  Hydrophilic surface: 0
 
 Pharmacophoric Properties
  Hydrogen bond donors: 0  Hydrogen bond acceptors: 0  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: 1  Oprea's lead like rule: 1
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Ions/Tautomers related molecules: no related molecules available.