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canSAR503528
FEATURES
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NAMES
    SMILES
    CC(NC(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1nnc(S)s1
    InChI
    InChI=1S/C20H20N6O6S3/c1-12(17(27)22-19-23-24-20(33)34-19)21-18(28)16(11-13-5-3-2-4-6-13)25-35(31,32)15-9-7-14(8-10-15)26(29)30/h2-10,12,16,25H,11H2,1H3,(H,21,28)(H,24,33)(H,22,23,27)
    MOLECULAR FORMULA
    C20H20N6O6S3
    CROSS REFERENCES
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    canSAR503528

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 536.06
    AlogP 1.77
    HBond donors 3
    HBond acceptors 12
    Atoms 55
    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 canSAR503528.