LogP Predictor Surface Generation

User 4c643b9fac

28-01-2014 16:44:18


I'm just asking what the key for the colours in the MarvinSketch represent please. There are red, blue and white colours.



ChemAxon d51151248d

11-02-2014 12:35:30

Dear Neil, 

the logP plugin is able to display the calculated atomic logP increments in 3D representing hydrophilicity/hydrophobicity. The sign of these values are represented with blue-white-red colour scale. The bluer the atom is, the more hydrophobic it is. The redder the atom is, the more hydrophil it is. Atoms with nearly 0 increment becomes white etc. Also note that the increment values are displayed with the surface colour on the left side of the result window.

Best regards,