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propertieschemaxon [2012/10/14 11:23] – rkisspropertieschemaxon [2012/10/14 11:35] – rkiss
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 **Aromatic 8-membered rings:** Number of aromatic 8-membered rings **Aromatic 8-membered rings:** Number of aromatic 8-membered rings
  
-**ASA (at pH=7.4):** Total solvent accessible surface area (in Angstrom2) of major microspecies at pH=7.4+**ASA (at pH=7.4):** Total solvent accessible surface area (in Angstrom<sup>2</sup>) of major microspecies at pH=7.4
  
-**ASA+ (at pH=7.4):** Solvent accessible surface area (in Angstrom2) of all atoms with positive partial charge of major microspecies at pH=7.4+**ASA+ (at pH=7.4):** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all atoms with positive partial charge of major microspecies at pH=7.4
  
-**ASA- (at pH=7.4):** Solvent accessible surface area (in Angstrom2) of all atoms with negative partial charge of major microspecies at pH=7.4+**ASA- (at pH=7.4):** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all atoms with negative partial charge of major microspecies at pH=7.4
  
-**ASA_H (at pH=7.4):** Solvent accessible surface area (in Angstrom2) of all hydrophobic (|qi|<0.125) atoms (|qi| is the absolute value of the partial charge of the atom) of major microspecies at pH=7.4+**ASA_H (at pH=7.4):** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all hydrophobic (|qi|<0.125) atoms (|qi| is the absolute value of the partial charge of the atom) of major microspecies at pH=7.4
  
-**ASA_P (at pH=7.4):** Solvent accessible surface area (in Angstrom2) of all polar (|qi|>0.125) atoms (|qi| is the absolute value of the partial charge of the atom) of major microspecies at pH=7.4+**ASA_P (at pH=7.4):** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all polar (|qi|>0.125) atoms (|qi| is the absolute value of the partial charge of the atom) of major microspecies at pH=7.4
  
-**ASA:** Total solvent accessible surface area (in Angstrom2)+**ASA:** Total solvent accessible surface area (in Angstrom<sup>2</sup>)
  
-**ASA+:** Solvent accessible surface area (in Angstrom2) of all atoms with positive partial charge+**ASA+:** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all atoms with positive partial charge
  
-**ASA-:** Solvent accessible surface area (in Angstrom2) of all atoms with negative partial charge+**ASA-:** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all atoms with negative partial charge
  
-**ASA_H:** Solvent accessible surface area (in Angstrom2) of all hydrophobic (|qi|<0.125) atoms (|qi| is the absolute value of the partial charge of the atom)+**ASA_H:** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all hydrophobic (|qi|<0.125) atoms (|qi| is the absolute value of the partial charge of the atom)
  
-**ASA_P:** Solvent accessible surface area (in Angstrom2) of all polar (|qi|>0.125) atoms (|qi| is the absolute value of the partial charge of the atom)+**ASA_P:** Solvent accessible surface area (in Angstrom<sup>2</sup>) of all polar (|qi|>0.125) atoms (|qi| is the absolute value of the partial charge of the atom)
  
 **Asymmetric atoms:** Number of asymmetric atoms **Asymmetric atoms:** Number of asymmetric atoms
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 **H-bond donors:** Number of hydrogen bond donor atoms **H-bond donors:** Number of hydrogen bond donor atoms
  
-**H-bond donors (at pH=7.4):** Number of hydrogen bond donor atoms of the major microspecies at pH=7.4”+**H-bond donors (at pH=7.4):** Number of hydrogen bond donor atoms of the major microspecies at pH=7.4
  
 **H-bond donor sites:** Number of hydrogen bond donor sites **H-bond donor sites:** Number of hydrogen bond donor sites