propertycalculator
Property calculator
- Create a physicochemical property profile for your compound in a second
- Reject compounds with unsuitable logP, insufficient number of H-bond acceptors/donors, too many rotatable bonds, etc.
- Prioritize compounds with highest ligand efficiency (low number of heavy atoms and logP)
propertycalculator.txt · Last modified: 2013/01/13 13:31 by flack