Table 21 Actual vs predicted boiling points of selected drugs.

From: Graph theoretic and machine learning approaches in molecular property prediction of bladder cancer therapeutics

Drug

Actual Boiling Point

Predicted Boiling Point

Lenalidomide

614.0

527.3968

Thalidomide

487.8

527.4473

Cabozantinib

758.1

750.0370

Sorafenib

523.3

567.2910

Sunitinib

521.1

563.1876

Axitinib

668.9

607.0214

Lenvatinib

627.2

588.0196

Erlotinib

553.6

568.9768

Neratinib

757.0

757.7549

Ifosfamide

386.5

393.5012

Cytarabine

543.7

500.2678

Docetaxel

900.5

915.7302

Paclitaxel

957.1

952.6943

Valrubicin

867.7

858.0580

Mitomycin C

581.8

558.9791

Erdafitinib

662.3

666.7420

Gemcitabine

482.7

524.5323

Back to article page