Research Article
Degree-Based Molecular Descriptors and QSPR Analysis of Breast Cancer Drugs
Table 2
Physicochemical properties of breast cancer drugs.
| SI no | Drug name | BP | EV | FP | MR | LogP | MV |
| 1 | Alpelisib | — | — | — | 106.7 | −0.02 | 317.4 | 2 | Azacitidine | 534.5 | 93.2 | 277 | 51.1 | −1.99 | 117.1 | 3 | Cytarabine | 545.7 | 94.8 | 283.8 | 52.6 | −1.93 | 128.4 | 4 | Daunorubicin | 770 | 117.6 | 419.5 | 130 | 2.92 | 339.4 | 5 | Dexamethasone | 568.2 | 98 | 297.5 | 100.2 | 1.87 | 296.2 | 6 | Docetaxel | 900.5 | 137.1 | 498.4 | 205.2 | 6.55 | 585.7 | 7 | Doxorubicin | 810.3 | 123.5 | 443.8 | 131.5 | 2.82 | 336.6 | 8 | Glasdegib | 633.4 | 93.6 | 336.9 | 106.9 | 2.77 | 281 | 9 | Gilteritinib | 696.9 | 102.1 | 375.3 | 157.8 | 4.35 | 444.9 | 10 | Ivosidenib | 854.3 | 124.1 | 470 | 140.1 | 0.38 | 383.6 | 11 | Midostaurin | — | — | — | 160.3 | 5.27 | 385.7 | 12 | Olaparib | — | — | — | 116.9 | 0 | 301.8 | 13 | Paclitaxel | 957.1 | 146 | 532.6 | 219.3 | 7.38 | 610.6 | 14 | Palbociclib | 711.5 | 104 | 384.1 | 123.9 | 0.99 | 340.7 | 15 | Pamidronic acid | 658.7 | 111 | 352.2 | 40.9 | −3.4 | 117.6 | 16 | Prednisone | 573.7 | 98.7 | 314.8 | 94.1 | 1.57 | 273.6 | 17 | Ribociclib | 730.8 | 106.7 | 395.8 | 123.4 | −0.74 | 311.4 | 18 | Tioguanine | 460.7 | 72.1 | 232.4 | 41.9 | −0.99 | 80.2 | 19 | Toremifene | 535.1 | 81.2 | 277.4 | 123.7 | 7.82 | 367.6 | 20 | Tucatinib | — | — | — | 135.2 | 3.62 | 339 | 21 | Venetoclax | — | — | — | 234.4 | 10.88 | 647.7 |
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