Multiparameter optimisation
Term · Chemistry · MLC-T-CHM-007649
The simultaneous balancing of several compound properties in drug discovery, such as potency, selectivity, solubility, permeability, metabolic stability and safety, so that a candidate meets all targets together instead of excelling in one. Scores such as the CNS MPO combine six properties (clogP, clogD, molecular weight, polar surface area, hydrogen-bond donors and pKa) into a desirability value from 0 to 6.
| Identifier | MLC-T-CHM-007649 |
|---|---|
| Field | Chemistry |
| Subject | Chemistry and Human Health |
| References | PAC, 2013, 85, 1725. 'Glossary of terms used in medicinal chemistry. Part II (IUPAC Recommendations 2013)' on page 1742 (https://doi.org/10.1351/PAC-REC-12-11-23) |
Record as JSON
{
"id": "MLC-T-CHM-007649",
"term": "Multiparameter optimisation",
"field": "Chemistry",
"definition": "The simultaneous balancing of several compound properties in drug discovery, such as potency, selectivity, solubility, permeability, metabolic stability and safety, so that a candidate meets all targets together instead of excelling in one. Scores such as the CNS MPO combine six properties (clogP, clogD, molecular weight, polar surface area, hydrogen-bond donors and pKa) into a desirability value from 0 to 6.",
"subject": "Chemistry and Human Health",
"references": [
"PAC, 2013, 85, 1725. 'Glossary of terms used in medicinal chemistry. Part II (IUPAC Recommendations 2013)' on page 1742 (https://doi.org/10.1351/PAC-REC-12-11-23)"
],
"url": "https://mlchart.com/terminology/chemistry/multiparameter-optimisation/"
}
Record 8,114 of 13,676 in Chemistry terminology (MLC-0109). Request the full dataset.