Research Article
Sulfa Drugs as Inhibitors of Carbonic Anhydrase: New Targets for the Old Drugs
Table 3
Calculated ADME properties of compounds 1a–5a and 1b–5b.
| Compound | | | | MWt | HBDH | MNO | TPSA |
| 1a | 2.712 | 1.523 | 1.93 | 412.259 | 2 | 9 | 122.65 | 2a | 3.346 | 2.077 | 1.69 | 448.292 | 2 | 9 | 122.65 | 3a | 2.397 | 0.965 | 1.681 | 398.232 | 2 | 9 | 122.65 | 4a | 2.997 | 2.08 | 2.173 | 426.286 | 2 | 9 | 122.65 | 5a | 2.766 | 0.588 | 1.118 | 432.677 | 2 | 9 | 122.65 | 1b | 0.542 | −0.112 | 0.779 | 264.307 | 3 | 6 | 97.97 | 2b | 1.168 | 0.676 | 0.633 | 300.341 | 3 | 6 | 97.97 | 3b | 0.169 | −0.681 | 0.487 | 250.28 | 3 | 6 | 97.97 | 4b | 0.926 | 0.484 | 1.06 | 278.334 | 3 | 6 | 97.97 | 5b | 0.811 | −0.468 | 0.235 | 284.725 | 3 | 6 | 97.97 |
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