Drug-likeness profile of ligands
Sl. No. | Molecular wt. (g/mol) | HBA | HBD | TPSA (Å)2 | Log P | Bioavailability | Log S | Csp3 | RB | MR | Lipinski violations |
---|---|---|---|---|---|---|---|---|---|---|---|
1 | 598.66 | 9 | 3 | 156.7 | 3.46 | 0.17 | –4.5 | 0.48 | 18 | 159.06 | 2 |
2 | 519.68 | 5 | 4 | 150.7 | 2.06 | 0.55 | –4.12 | 0.81 | 14 | 144.39 | 1 |
3 | 894.11 | 8 | 4 | 178.72 | 5.63 | 0.17 | –9.14 | 0.52 | 22 | 262.84 | 2 |
4 | 597.64 | 9 | 8 | 310.6 | –3.17 | 0.17 | 0.65 | 0.57 | 20 | 146.7 | 3 |
5 | 883 | 10 | 4 | 193.1 | 5.05 | 0.17 | –8.41 | 0.39 | 17 | 251.54 | 2 |
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The authors are heartily thankful to the management of ISF College of Pharmacy for constant encouragement, support, and motivation.
AC: Data curation. AS: Investigation. PAC: Writing—original article, Writing—editing and review.
The authors declare that they have no conflicts of interest.
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© The Author(s) 2023.