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canSAR202067
FEATURES
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NAMES
    SMILES
    CCOC(=O)/C(C#N)=c1\s/c(=C/Nc2ccc(NC(=O)COC)cc2)c(=O)n1CC
    InChI
    InChI=1S/C20H22N4O5S/c1-4-24-18(26)16(30-19(24)15(10-21)20(27)29-5-2)11-22-13-6-8-14(9-7-13)23-17(25)12-28-3/h6-9,11,22H,4-5,12H2,1-3H3,(H,23,25)/b16-11+,19-15-
    MOLECULAR FORMULA
    C20H22N4O5S
    CROSS REFERENCES
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    canSAR202067

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.13
    AlogP 0.60
    HBond donors 2
    HBond acceptors 9
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR202067.