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. 2026 Mar 19;16(17):15674–15696. doi: 10.1039/d6ra00490c

Table 3. Predicted ADME properties and drug-likeness parameters of the synthesized heterocycles derived from 2(3H)-furanone 1. Key pharmacokinetic descriptors, including molecular weight (MW), topological polar surface area (TPSA), and lipophilicity (iLOGP), along with gastrointestinal (GI) absorption, blood–brain barrier (BBB) permeability, P-glycoprotein (P-gp) substrate prediction, and bioavailability score, were estimated using the SwissADME web tool. These parameters reflect the overall physicochemical balance and predicted oral bioavailability of the tested insecticidal candidates.

Compound Molecular weight (g mol−1) TPSA (Å2) Log P (iLOGP) GI absorption BBB permeability P-gp substrate Bioavailability score
1 292.33 35.53 3.36 High Yes No 0.55
2 291.34 38.33 3.20 High Yes No 0.55
3 399.48 55.40 3.50 High Yes Yes 0.55
4 397.47 38.77 4.36 High Yes No 0.55
5 425.48 55.84 4.49 High Yes No 0.55
7 411.45 69.40 3.45 High No No 0.55
8 410.46 72.05 3.33 High No No 0.55
9 407.46 59.39 4.16 High Yes No 0.55
10 306.36 54.98 2.99 High Yes No 0.55
11 322.42 70.00 3.21 High Yes No 0.55
12 324.81 56.15 3.54 High Yes No 0.55
13 335.40 62.09 3.45 High Yes No 0.55
14 349.39 72.65 2.88 High No No 0.55