canSAR2174892
FEATURES
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NAMES
    SMILES
    CC(C)=C(F)CN=C(O)[C@H]1C[C@@H]2C[C@@H]2N1C(=O)Cn1nc(C(N)=O)c2ccccc21
    InChI
    InChI=1S/C21H24FN5O3/c1-11(2)14(22)9-24-21(30)17-8-12-7-16(12)27(17)18(28)10-26-15-6-4-3-5-13(15)19(25-26)20(23)29/h3-6,12,16-17H,7-10H2,1-2H3,(H2,23,29)(H,24,30)/t12-,16-,17+/m0/s1
    MOLECULAR FORMULA
    C21H24FN5O3
    CROSS REFERENCES
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    canSAR2174892
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight413.19
    AlogP2.34
    HBond donors3
    HBond acceptors8
    Atoms54
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2174892.