Comprehensive data on a 2D-QSAR model for Heme Oxygenase isoform 1 inhibitors

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Comprehensive data on a 2D-QSAR model for Heme Oxygenase isoform 1 inhibitors

The data have been obtained from the Heme Oxygenase Database (HemeOxDB) and refined according to the 2D-QSAR requirements. These data provide information about a set of more than 380 Heme Oxygenase-1 (HO-1) inhibitors. The development of the 2D-QSAR model has been undertaken with the use of CORAL software using SMILES, molecular graphs and hybrid descriptors (SMILES and graph together). The 2D-...

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ژورنال

عنوان ژورنال: Data in Brief

سال: 2017

ISSN: 2352-3409

DOI: 10.1016/j.dib.2017.09.036