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canSAR1124011
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NAMES
    SMILES
    Cc1cc(-c2cn(CC(=O)N3CCc4nc(N)sc4CC3)c(-c3ccccc3)n2)ccc1F
    InChI
    InChI=1S/C25H24FN5OS/c1-16-13-18(7-8-19(16)26)21-14-31(24(28-21)17-5-3-2-4-6-17)15-23(32)30-11-9-20-22(10-12-30)33-25(27)29-20/h2-8,13-14H,9-12,15H2,1H3,(H2,27,29)
    MOLECULAR FORMULA
    C25H24FN5OS
    CROSS REFERENCES
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    canSAR1124011

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 461.17
    AlogP 4.33
    HBond donors 2
    HBond acceptors 6
    Atoms 57
    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 canSAR1124011.