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Table 1 Dependence of ligand efficiency on C°

From: The nature of ligand efficiency

N bnH

KD/Mc

ηbind (C°)a

C° = 0.1 M

C° = 1 M

C° = 10 M

10

10−3

0.20

0.30

0.40

20

10−6

0.25

0.30

0.35

30

10−9

0.27

0.30

0.33

  1. aLigand efficiency defined in (11)
  2. bNumber of non-hydrogen atoms in molecular structure
  3. cDissociation constant for protein–ligand complex
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Journal of Cheminformatics

ISSN: 1758-2946

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