canSAR1087354
FEATURES
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NAMES
    SMILES
    Cn1cc(-c2cc(Cl)ccc2Oc2ccc(S(=O)(=O)Nc3ncns3)cc2C#N)ccc1=O
    InChI
    InChI=1S/C21H14ClN5O4S2/c1-27-11-13(2-7-20(27)28)17-9-15(22)3-5-19(17)31-18-6-4-16(8-14(18)10-23)33(29,30)26-21-24-12-25-32-21/h2-9,11-12H,1H3,(H,24,25,26)
    MOLECULAR FORMULA
    C21H14ClN5O4S2
    CROSS REFERENCES
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    canSAR1087354
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight499.02
    AlogP4.02
    HBond donors1
    HBond acceptors9
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087354.