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canSAR672702
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NAMES
    SMILES
    O=C(NCc1cccc(C(F)(F)F)c1)c1cccc(-c2cn3ccnc3c(NCc3ccncc3)n2)c1
    InChI
    InChI=1S/C27H21F3N6O/c28-27(29,30)22-6-1-3-19(13-22)16-34-26(37)21-5-2-4-20(14-21)23-17-36-12-11-32-25(36)24(35-23)33-15-18-7-9-31-10-8-18/h1-14,17H,15-16H2,(H,33,35)(H,34,37)
    MOLECULAR FORMULA
    C27H21F3N6O
    CROSS REFERENCES
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    canSAR672702

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.17
    AlogP 5.35
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR672702.