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canSAR560638
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NAMES
    SMILES
    COc1ccc2ncc(F)c(CCN3CC(O)C(CNCc4nc5c(cc4Cl)OCC(=O)N5)C3)c2n1
    InChI
    InChI=1S/C24H26ClFN6O4/c1-35-22-3-2-17-23(31-22)14(16(26)8-28-17)4-5-32-10-13(19(33)11-32)7-27-9-18-15(25)6-20-24(29-18)30-21(34)12-36-20/h2-3,6,8,13,19,27,33H,4-5,7,9-12H2,1H3,(H,29,30,34)
    MOLECULAR FORMULA
    C24H26ClFN6O4
    CROSS REFERENCES
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    canSAR560638

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.17
    AlogP 1.78
    HBond donors 3
    HBond acceptors 10
    Atoms 62
    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 canSAR560638.