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Quantitative structure-activity relationships

Term · Chemistry · MLC-T-CHM-009752

Mathematical models that correlate the structural or physicochemical properties of chemical compounds with their biological activities. These relationships are developed by analyzing a series of compounds and their measured activities, often using statistical methods. QSAR models are frequently employed in drug discovery to predict the activity of new compounds.

Table 1. Record
IdentifierMLC-T-CHM-009752
FieldChemistry
SubjectOrganic and Biomolecular Chemistry
ReferencesPAC, 1994, 66, 1077. 'Glossary of terms used in physical organic chemistry (IUPAC Recommendations 1994)' on page 1155 (https://doi.org/10.1351/pac199466051077)
See alsoCorrelation analysis
Record as JSON
{
  "id": "MLC-T-CHM-009752",
  "term": "Quantitative structure-activity relationships",
  "field": "Chemistry",
  "definition": "Mathematical models that correlate the structural or physicochemical properties of chemical compounds with their biological activities. These relationships are developed by analyzing a series of compounds and their measured activities, often using statistical methods. QSAR models are frequently employed in drug discovery to predict the activity of new compounds.",
  "subject": "Organic and Biomolecular Chemistry",
  "see_also": [
    "correlation analysis"
  ],
  "references": [
    "PAC, 1994, 66, 1077. 'Glossary of terms used in physical organic chemistry (IUPAC Recommendations 1994)' on page 1155 (https://doi.org/10.1351/pac199466051077)"
  ],
  "url": "https://mlchart.com/terminology/chemistry/quantitative-structure-activity-relationships/"
}

Record 10,364 of 13,678 in Chemistry terminology (MLC-0109). Request the full dataset.