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canSAR1013243
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NAMES
    SMILES
    O=c1n(-c2ccccc2F)cnn1CCCN1CCN(CC(O)(Cn2cncn2)c2ccc(F)cc2F)CC1
    InChI
    InChI=1S/C26H29F3N8O2/c27-20-6-7-21(23(29)14-20)26(39,16-35-18-30-17-31-35)15-34-12-10-33(11-13-34)8-3-9-37-25(38)36(19-32-37)24-5-2-1-4-22(24)28/h1-2,4-7,14,17-19,39H,3,8-13,15-16H2
    MOLECULAR FORMULA
    C26H29F3N8O2
    CROSS REFERENCES
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    canSAR1013243

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 542.24
    AlogP 1.64
    HBond donors 1
    HBond acceptors 10
    Atoms 68
    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 canSAR1013243.