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Table 5 ADME parameters of the most active compounds

From: In-silico molecular design of heterocyclic benzimidazole scaffolds as prospective anticancer agents

S. no. Comp. Molecular structure ADME parameters
Mol MW Rule of five QPlogPo/w Human oral absorption Volume Percent human oral absorption QPlogPw QPlogKp QPlogBB Donor HB Accept HB
1 16 459.5 0 4.681 1 1454.82 100.0 15.86 − 1.699 − 1.812 3.0 7.25
2 N9 430.5 0 4.748 1 1379.64 100.0 15.049 − 1.438 − 1.054 3.0 6.5
3 W20 430.5 0 4.903 1 1386.55 100.0 14.002 − 1.028 − 0.975 2.0 7.0