canSAR2207488
FEATURES
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NAMES
    SMILES
    CC(C)=C(F)CNC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)Cn1nc(C(N)=O)c2ccnc(C)c21
    InChI
    InChI=1S/C21H25FN6O3/c1-10(2)14(22)8-25-21(31)16-7-12-6-15(12)28(16)17(29)9-27-19-11(3)24-5-4-13(19)18(26-27)20(23)30/h4-5,12,15-16H,6-9H2,1-3H3,(H2,23,30)(H,25,31)/t12-,15-,16+/m1/s1
    MOLECULAR FORMULA
    C21H25FN6O3
    CROSS REFERENCES
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    canSAR2207488
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight428.20
    AlogP1.21
    HBond donors3
    HBond acceptors9
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2207488.