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Table 2 Different ADMET parameters of aesculin derivatives

From: Aesculin based glucosamine-6-phosphate synthase inhibitors as novel preservatives for food and pharmaceutical products: in-silico studies, antioxidant, antimicrobial and preservative efficacy evaluation

Compound(s) ADMET profile
No. of rotatable bond DonorHB AcceptHB QPlogPo/w QPlogBB QPPMDCK QPPCaco
Compound 1 1 5 11 0.648 2.227 36.288 89.19
Compound 2 2 6 12 0.22 2.842 9.9130 26.85
Aesculin 2 4 10 0.21 3–21 23.33 21.21
Streptomycin 9 12 15 2.06 4.20 0.78 3
Ciprofloxacin 3 2 6 1.02 2.23 0.80 4
Ampicillin 4 3 5 1.35 0.99 0.90 0.89
Fluconazole 5 1 5 2.32 0.88 0.87 0.93