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canSAR2205844
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NAMES
    SMILES
    C=CC(=O)N1CCCC(n2nc(-c3ccc(Oc4cccc(NS(C)(=O)=O)c4)cc3F)c3c(N)ncnc32)C1
    InChI
    InChI=1S/C26H26FN7O4S/c1-3-22(35)33-11-5-7-17(14-33)34-26-23(25(28)29-15-30-26)24(31-34)20-10-9-19(13-21(20)27)38-18-8-4-6-16(12-18)32-39(2,36)37/h3-4,6,8-10,12-13,15,17,32H,1,5,7,11,14H2,2H3,(H2,28,29,30)
    MOLECULAR FORMULA
    C26H26FN7O4S
    CROSS REFERENCES
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    canSAR2205844

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 551.18
    AlogP 3.73
    HBond donors 3
    HBond acceptors 11
    Atoms 65
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2205844.