EntityQ766383· pop 24· linked from 148 articlesquantitative structure-activity relationshipSign in to savequantitative prediction of the biological, ecotoxicological or pharmaceutical activity of a moleculeConnectionshypothesisEntitysupport vector machineEntitypartition coefficientEntitydrug designEntityLipinski's rule of fiveEntitypartial least squares regressionEntityEuropean UnionConceptInternational Standard Book NumberEntityPythonEntityorganic chemistryEntityenzymeEntitychemical compoundEntitychemical reactionEntitylearningEntityWayback MachineEntitydigital object identifierEntityInternational Standard Serial NumberEntitypharmacologyEntityalkaneEntityboiling pointEntityCategoriesCheminformaticsComputational chemistryDrug discoveryMedicinal chemistryParadoxes