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. 2023 Dec 18;32(3):101925. doi: 10.1016/j.jsps.2023.101925

Table 5.

In-silico ADME properties of reference molecule and 5g and 5h.

Sr No. Parameters Reference 5g 5h
1. HB Donor 1 2 3
2. HB Acceptor 2 13 14
3. LogPo/w 3.496 0.072 −0.973
4. logBBB −0.487 −3.772 −3.716
5. Metabolism 2 1 2
6. % Human oral Absorption 92.674 15.211 8.391
7. PSA 46.701 202.748 212.002
8. Ro5 Violation 0 1 1
9. Ro3 Violation 0 1 1
10. Molecular Weight 206.284 462.387 427.342