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canSAR1499237
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)c2ccc(F)c(Nc3ncnc4cnc(N5CCCCCC5)nc34)c2)cc1C(F)(F)F
    InChI
    InChI=1S/C27H25F4N7O2/c1-40-22-9-7-17(13-18(22)27(29,30)31)35-25(39)16-6-8-19(28)20(12-16)36-24-23-21(33-15-34-24)14-32-26(37-23)38-10-4-2-3-5-11-38/h6-9,12-15H,2-5,10-11H2,1H3,(H,35,39)(H,33,34,36)
    MOLECULAR FORMULA
    C27H25F4N7O2
    CROSS REFERENCES
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    canSAR1499237

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 555.20
    AlogP 5.96
    HBond donors 2
    HBond acceptors 9
    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 canSAR1499237.