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Table 6 Docking energy scores (S) in kcal/mol for compounds 4d, 5, and 7 and the reference AAZ in CA II, CA IX and CA XII active sites

From: Discovery of a new potent oxindole multi-kinase inhibitor among a series of designed 3-alkenyl-oxindoles with ancillary carbonic anhydrase inhibitory activity as antiproliferative agents

Compound

 

(S) in kcal/mol

 

CA II

CAIX

CA XII

4d

 − 9.95

 − 8.92

 − 9.09

5

 − 9.24

 − 8.02

 − 8.93

7

 − 9.00

 − 8.66

 − 9.16

AAZ

 − 9.59

 − 9.17

 − 7.74

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BMC Chemistry

ISSN: 2661-801X

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