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canSAR1013220
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NAMES
    SMILES
    CC(C)Nc1ncc2nc(Nc3c(F)cc(F)cc3F)n([C@H]3CC[C@@H](C(N)=O)CC3)c2n1
    InChI
    InChI=1S/C21H24F3N7O/c1-10(2)27-20-26-9-16-19(30-20)31(13-5-3-11(4-6-13)18(25)32)21(28-16)29-17-14(23)7-12(22)8-15(17)24/h7-11,13H,3-6H2,1-2H3,(H2,25,32)(H,28,29)(H,26,27,30)/t11-,13+
    MOLECULAR FORMULA
    C21H24F3N7O
    CROSS REFERENCES
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    canSAR1013220

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.20
    AlogP 4.02
    HBond donors 4
    HBond acceptors 8
    Atoms 56
    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 canSAR1013220.