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canSAR127079
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NAMES
    SMILES
    CCOC(=O)N1c2ccc(C(F)(F)F)cc2N(C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2nnn(CC(=O)OC)n2)CC1CC
    InChI
    InChI=1S/C27H25F9N6O4/c1-4-18-12-40(20-11-15(25(28,29)30)6-7-19(20)42(18)24(44)46-5-2)22(23-37-39-41(38-23)13-21(43)45-3)14-8-16(26(31,32)33)10-17(9-14)27(34,35)36/h6-11,18,22H,4-5,12-13H2,1-3H3
    MOLECULAR FORMULA
    C27H25F9N6O4
    CROSS REFERENCES
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    canSAR127079

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 668.18
    AlogP 6.25
    HBond donors 0
    HBond acceptors 10
    Atoms 71
    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 canSAR127079.