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Valine


  • SKU Code: CH136762
Chemical Name - Valine
Mol Weight - 117.147
Smiles - CC(C)[C@@H](C(O)=O)N
Property Name Property Value
Mol NameValine
Molweight117.147
Monoisotopic Mass117.078979
Clogp-2.3184
Clogs-0.836
H Acceptors3
H Donors2
Total Surface Area95.64
Relative Psa0.43298
Polar Surface Area63.32
Druglikeness-15.719
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.625
Molecular Flexibility0.76286
Molecular Complexity0.73241
Fragments1
Non H Atoms8
Non Ch Atoms3
Electronegative Atoms3
Stereo Centers1
Rotatable Bonds2
Sp3 Atoms6
Symmetric Atoms1
Amines1
Alkyl Amines1
Basic Nitrogens1
Acidic Oxygens1
SmilesCC(C)[C@@H](C(O)=O)N
InChIC5H11NO2

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