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canSAR1967864
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NAMES
    SMILES
    COc1ncc2ncnc(Nc3cc(C(=O)Nc4cc(CN5CCCC5)cc(C(F)(F)F)c4)ccc3C)c2n1
    InChI
    InChI=1S/C27H26F3N7O2/c1-16-5-6-18(11-21(16)35-24-23-22(32-15-33-24)13-31-26(36-23)39-2)25(38)34-20-10-17(14-37-7-3-4-8-37)9-19(12-20)27(28,29)30/h5-6,9-13,15H,3-4,7-8,14H2,1-2H3,(H,34,38)(H,32,33,35)
    MOLECULAR FORMULA
    C27H26F3N7O2
    CROSS REFERENCES
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    canSAR1967864

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.21
    AlogP 5.35
    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 canSAR1967864.