WebThe mean logP for oral drugs is 2.5 while the logP for injectable drugs seems to be smaller. Among different types of clinical indications, drugs used for anti-HIV, and antibiotics tend to have lower logP. The molecular weights of anti-HIV drugs, antihypertensives and antibiotics appear to be larger. The ADMET scores, derived from a combination ... WebThe polar surface area ( PSA) or topological polar surface area ( TPSA) of a molecule is defined as the surface sum over all polar atoms or molecules, primarily oxygen and nitrogen, also including their attached hydrogen atoms. PSA is a commonly used medicinal chemistry metric for the optimization of a drug's ability to permeate cells.
cLogP Calculation - Osiris Property Explorer - Organic Chemistry
WebNov 14, 2004 · The area logP is large, the accuracy is very high. But the area logP<0 the accuracy is not so high. In that area, emulsion happen and hard to separate. I always wonder why I can estimate logP with this simple group additivity method. I found the answer. When I was developing QSPR model to predict logP, I happened to plot logP vs molecular volume. WebThe logP value of a compound, which is the logarithm of its partition coefficient between n-octanol and water log (c octanol /c water ), is a well established measure of the compound's hydrophilicity. Low … explanation of numbers 32
pKa and log P determination Assay
WebHigh potency (high value of pIC 50) is a desirable attribute in drug candidates, as it reduces the risk of non-specific, off-target pharmacology at a given concentration. When associated with low clearance, high potency also allows for low total dose, which lowers the risk of idiosyncratic drug reaction. [4] [5] WebLogP. Definition: A measure of the preference of a compound to dissolve in either water or an organic solvent (such as octanol) when uncharged. More technically, it is the logarithm … WebJan 10, 2024 · A change which increases molecular lipophilicity corresponding to a change in LogD = +1 has multiple expected consequences. (Top left) Potency in biochemical … explanation of normal heart function