canSAR2162332
FEATURES
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NAMES
    SMILES
    CC(C(O)=NCCF)c1ccc(O[C@H]2CCN(c3nc(N(C)C)ncc3F)C2)cc1
    InChI
    InChI=1S/C21H27F2N5O2/c1-14(20(29)24-10-9-22)15-4-6-16(7-5-15)30-17-8-11-28(13-17)19-18(23)12-25-21(26-19)27(2)3/h4-7,12,14,17H,8-11,13H2,1-3H3,(H,24,29)/t14?,17-/m0/s1
    MOLECULAR FORMULA
    C21H27F2N5O2
    CROSS REFERENCES
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    canSAR2162332
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.21
    AlogP3.37
    HBond donors1
    HBond acceptors7
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2162332.