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chemaxoncalclogp [2012/10/14 11:47] rkisschemaxoncalclogp [2012/10/15 09:11] (current) rkiss
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 ====== ChemAxon logP calculator ====== ====== ChemAxon logP calculator ======
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 +{{:propcalc_logp.png?800|}}
  
 Calculates logarithm of the octanol/water partition coefficient Calculates logarithm of the octanol/water partition coefficient
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 == Method == == Method ==
  
-Weights of the three, built-in calculation methods: VG <ref>Viswanadhan, V. N.; Ghose, A. K.; Revankar, G. R.; Robins, R. K. J. Chem. Inf. Comput. Sci., 1989, 29, 163-172</ref>)KLOP (ref: Klopman, G.; Li, Ju-Yun.; Wang, S.; Dimayuga, M. J. Chem. Inf. Comput. Sci., 1994, 34, 752)PHYS (ref:PHYSPROP© database)+Weights of the three, built-in calculation methods: 
 +  * VG (Viswanadhan, V. N.; Ghose, A. K.; Revankar, G. R.; Robins, R. K. J. Chem. Inf. Comput. Sci., 1989, 29, 163-172) 
 +  * KLOP (Klopman, G.; Li, Ju-Yun.; Wang, S.; Dimayuga, M. J. Chem. Inf. Comput. Sci., 1994, 34, 752) 
 +  * PHYS (PHYSPROP© database)
  
 **Cl<sup>-</sup> concentration** **Cl<sup>-</sup> concentration**
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 Consider tautomerization and resonance Consider tautomerization and resonance
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-==== References ==== 
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chemaxoncalclogp.1350215277.txt.gz · Last modified: 2012/10/14 11:47 by rkiss