Your Molecules: |
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Supported Formats: |
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Ouput Options for XLOGS result |
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Druglikeness
Properties Filter
(Rule of Five) |
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Number of Hydrogen Bond Donors
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Number of Hydrogen Bond Acceptors
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Number of Rotatable Bonds
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Number of Rings
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Total Number of Nitrogen and Oxygen Atoms
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Range of LOGP value (PARTITION COEFFICIENT)
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Reference: Baogen Duan, Yanling Wang, and Renxiao Wang*. "An Atom/Group additive model for solubility computation: Success and Limitation", To be submitted, 2012.
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