canSAR2164775
FEATURES
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NAMES
    SMILES
    CC1(N)CCN(c2cccnc2NC(=O)c2nc(-c3nc(C(N)=O)ncc3F)cnc2N)CC1
    InChI
    InChI=1S/C21H23FN10O2/c1-21(25)4-7-32(8-5-21)13-3-2-6-26-18(13)31-20(34)15-16(23)27-10-12(29-15)14-11(22)9-28-19(30-14)17(24)33/h2-3,6,9-10H,4-5,7-8,25H2,1H3,(H2,23,27)(H2,24,33)(H,26,31,34)
    MOLECULAR FORMULA
    C21H23FN10O2
    CROSS REFERENCES
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    canSAR2164775
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight466.20
    AlogP0.72
    HBond donors7
    HBond acceptors12
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2164775.