This version needs Smiles structure List. If you
already have Smiles, select RDKit tab. Select Output Option, Paste one
Smiles string then click Add to File Button. (Professional version
will accept Batch conversion)You will see the sdf format and table at
File tab. Select all and paste them to text editor or spreadsheet.
RDKit
Smiles
SDF
file SMILES
Formula
Weight
Chi
FractionCSP3
HallKierAlpha
Kappa
LabuteASA
Lipinski
Number
TPSA
RDKit
Finger Print