Table 19 The \({R}^{2}\) values between computed topological indices and ADMET properties of the tuberculosis treatment drugs.

From: Exploring the properties of antituberculosis drugs through QSPR graph models and domination-based topological descriptors

Indices

Properties

\(\text{WS}\)

IA

FU

BBB

\(\text{CNS}\)

\(\text{TC}\)

\(\text{AT}\)

MTD

CT

TPY

\(DW\)

0.789

0.837

0.606

0.932

0.618

0.511

0.658

0.486

0.178

0.680

\(DHW\)

0.744

0.549

0.845

0.905

0.471

0.538

0.763

0.651

0.303

0.767

\(DTW\)

0.813

0.934

0.461

0.775

0.595

0.692

0.679

0.132

0.406

0.592

\(DH\)

0.739

0.535

0.376

0.910

0.375

0.166

0.404

0.635

0.075

0.585

\(DSC\)

0.796

0.814

0.552

0.935

0.607

0.442

0.609

0.528

0.136

0.672

\(DS{C}^{*}\)

0.858

0.179

0.711

0.925

0.173

0.165

0.674

0.880

0.407

0.851

\(DA\)

0.990

0.879

0.761

0.927

0.579

0.799

0.931

0.435

0.619

0.899

\(DSM\)

0.911

0.675

0.930

0.862

0.460

0.771

0.980

0.763

0.805

0.996