Let’s not forget tautomers
نویسندگان
چکیده
منابع مشابه
Let’s not forget tautomers
A compound exhibits tautomerism if it can be represented by two structures that are related by an intramolecular movement of hydrogen from one atom to another. The different tautomers of a molecule usually have different molecular fingerprints, hydrophobicities and pKa's as well as different 3D shape and electrostatic properties; additionally, proteins frequently preferentially bind a tautomer ...
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ژورنال
عنوان ژورنال: Journal of Computer-Aided Molecular Design
سال: 2009
ISSN: 0920-654X,1573-4951
DOI: 10.1007/s10822-009-9303-2