canSAR1773345
FEATURES
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NAMES
    SMILES
    COc1cnc(C(=O)Nc2ccc(Cl)c([C@@]3(C(F)F)N=C(N)O[C@@H]4C[C@@H]43)c2)c(C)c1
    InChI
    InChI=1S/C20H19ClF2N4O3/c1-9-5-11(29-2)8-25-16(9)17(28)26-10-3-4-14(21)12(6-10)20(18(22)23)13-7-15(13)30-19(24)27-20/h3-6,8,13,15,18H,7H2,1-2H3,(H2,24,27)(H,26,28)/t13-,15+,20+/m0/s1
    MOLECULAR FORMULA
    C20H19ClF2N4O3
    CROSS REFERENCES
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    canSAR1773345
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight436.11
    AlogP3.50
    HBond donors3
    HBond acceptors7
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773345.