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Chem Chlorzoxazone Unilink | Cheminformatics

Chlorzoxazone


  • SKU Code: CH139778
Chemical Name - Chlorzoxazone
Mol Weight - 169.567
Smiles - O=C1Oc(ccc(Cl)c2)c2N1
Property Name Property Value
Mol NameChlorzoxazone
Molweight169.567
Monoisotopic Mass168.993056
Clogp1.7076
Clogs-3.252
H Acceptors3
H Donors1
Total Surface Area114.39
Relative Psa0.3016
Polar Surface Area38.33
Druglikeness-9.1831
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.63636
Molecular Complexity0.72824
Fragments1
Non H Atoms11
Non Ch Atoms4
Electronegative Atoms4
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
Amides1
SmilesO=C1Oc(ccc(Cl)c2)c2N1
InChIKeyInChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)
InChITZFWDZFKRBELIQ-UHFFFAOYSA-N

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