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canSAR2001845
FEATURES
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NAMES
    SMILES
    CCN(CC)C(=O)c1sc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c(C#N)c1C
    InChI
    InChI=1S/C19H20N4O5S/c1-5-22(6-2)19(25)16-11(3)13(10-20)18(29-16)21-17(24)12-7-8-15(28-4)14(9-12)23(26)27/h7-9H,5-6H2,1-4H3,(H,21,24)
    MOLECULAR FORMULA
    C19H20N4O5S
    CROSS REFERENCES
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    canSAR2001845

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.12
    AlogP 3.58
    HBond donors 1
    HBond acceptors 9
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2001845.