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Chem Benzamide | Cheminformatics

Benzamide


  • SKU Code: CH137279
Chemical Name - Benzamide
Mol Weight - 121.139
Smiles - NC(c1ccccc1)=O
Property Name Property Value
Mol NameBenzamide
Molweight121.139
Monoisotopic Mass121.052764
Clogp0.7469
Clogs-1.705
H Acceptors2
H Donors1
Total Surface Area99.53
Relative Psa0.28444
Polar Surface Area43.09
Druglikeness-0.67966
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.66667
Molecular Flexibility0.4098
Molecular Complexity0.62123
Fragments1
Non H Atoms9
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Symmetric Atoms2
Amides1
SmilesNC(c1ccccc1)=O
InChIKeyInChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
InChIKXDAEFPNCMNJSK-UHFFFAOYSA-N

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