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Table 4 Substructure search with distinct query and additional filter ‘ZINC34%’ on compound name

From: Molecule database framework: a framework for creating database applications with chemical structure search capability

SMILES

First page (s)

Second page (s)

Hits

OCC1CCN1

1.2

-

0

CCCC1CCOC1

1.3

-

1

CCNCCOCC

1.0

0.7

49

CCCCCC

1.2

0.6

198

c1ccccc1

4.2

0.6

981

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Journal of Cheminformatics

ISSN: 1758-2946

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