canSAR281237
FEATURES
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NAMES
    SMILES
    COC(=O)c1c(C(F)(F)F)[nH]c2c(O)cc3c(c12)[C@H](CCl)CN3C(=O)c1cc2cc(NC(=O)c3cc4cc(OC)ccc4cn3)ccc2[nH]1
    InChI
    InChI=1S/C34H25ClF3N5O6/c1-48-20-5-3-15-13-39-22(9-16(15)8-20)31(45)40-19-4-6-21-17(7-19)10-23(41-21)32(46)43-14-18(12-35)26-24(43)11-25(44)29-27(26)28(33(47)49-2)30(42-29)34(36,37)38/h3-11,13,18,41-42,44H,12,14H2,1-2H3,(H,40,45)/t18-/m1/s1
    MOLECULAR FORMULA
    C34H25ClF3N5O6
    CROSS REFERENCES
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    canSAR281237
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight691.14
    AlogP6.95
    HBond donors4
    HBond acceptors11
    Atoms74
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR281237.