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canSAR1493465
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)COC(=O)CNS(=O)(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1
    InChI
    InChI=1S/C20H23N3O8S2/c1-30-15-5-3-14(4-6-15)9-10-21-19(24)13-31-20(25)12-22-33(28,29)16-7-8-18(32-2)17(11-16)23(26)27/h3-8,11,22H,9-10,12-13H2,1-2H3,(H,21,24)
    MOLECULAR FORMULA
    C20H23N3O8S2
    CROSS REFERENCES
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    canSAR1493465

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 497.09
    AlogP 1.51
    HBond donors 2
    HBond acceptors 11
    Atoms 56
    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 canSAR1493465.