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KMID : 1059519930370040448
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Journal of the Korean Chemical Society
1993 Volume.37 No. 4 p.448 ~ p.452
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Structure-Activity Relationship (II). Structure and Activity of Folate Analogues
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Park Seong-Sik
Yoh Soo-Dong
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Abstract
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To find out a correlation between anti-folate activity and physical properties of folate analogues, geometric parameters, dipole moment, net charges, HOMO and LUMO energies were calculated. The electronic properties do not give any correlations with inhibition of folate reductase, but the calculated geometries show some correlations.
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KEYWORD
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