Comparison of mechanistic tissue partitioning (Kp) prediction methods
Mechanisms | Poulin Homogeneous | Berezhkovskiy | Rogers and Rowland | Lukacova | Trapp Intracellular |
---|---|---|---|---|---|
Albumin binding | Yes | Yes | Yes | Yes | No |
Neutral phospholipid binding | Yes | Yes | Yes | Yes | No |
Neutral lipid binding | Yes | Yes | Yes | Yes | No |
Acidic phospholipid binding | No | No | Yes | Yes | No |
Cytosolic ion partitioning | No | No | Yes | Yes | Yes |
Lysosomal ion trapping | No | No | No | No | Yes |
Mitochondria ion partitioning | No | No | No | No | Yes |
Membrane potential | No | No | No | No | Yes |
Intracellular water | Yes | Yes | Yes | Yes | Yes |
Extracellular water | Yes | Yes | Yes | Yes | No |
Tissue-specific composition | Yes | Yes | Yes | Yes | No |