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. 2022 Jul 19;8(8):e10003. doi: 10.1016/j.heliyon.2022.e10003

Table 10.

Descriptors values for newly designed pyrazole carbohydrazide derivatives and their predicted anticancer activity against kidney cancer cell line - ACHN calculated according to the developed 2D-QSAR mathematical model.

New Designed Molecules Diameter PEOE_VSA_PNEG Q_VSA_PNEG opr_nrot pIC50
Image 28 14 115.36006 143.62318 8 9.54
Image 29 14 115.36006 143.62318 7 9.33
Image 30 15 115.36006 143.62318 7 9.06
Image 31 14 94.995941 123.25906 7 8.54
Image 32 18 115.36006 157.19011 7 8.50