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canSAR1984484
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NAMES
    SMILES
    Cc1cc(C)nc(NS(=O)(=O)c2ccc(Nc3nccc(N(C)c4ccc5c(C)n(C)nc5c4)n3)cc2)n1
    InChI
    InChI=1S/C26H27N9O2S/c1-16-14-17(2)29-26(28-16)33-38(36,37)21-9-6-19(7-10-21)30-25-27-13-12-24(31-25)34(4)20-8-11-22-18(3)35(5)32-23(22)15-20/h6-15H,1-5H3,(H,27,30,31)(H,28,29,33)
    MOLECULAR FORMULA
    C26H27N9O2S
    CROSS REFERENCES
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    canSAR1984484

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 529.20
    AlogP 4.39
    HBond donors 2
    HBond acceptors 11
    Atoms 65
    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 canSAR1984484.