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canSAR660931
FEATURES
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NAMES
    SMILES
    Cc1ccc(C(=O)NCCO)cc1-c1nnc2ccc(Sc3ccc(F)cc3F)cn12
    InChI
    InChI=1S/C22H18F2N4O2S/c1-13-2-3-14(22(30)25-8-9-29)10-17(13)21-27-26-20-7-5-16(12-28(20)21)31-19-6-4-15(23)11-18(19)24/h2-7,10-12,29H,8-9H2,1H3,(H,25,30)
    MOLECULAR FORMULA
    C22H18F2N4O2S
    CROSS REFERENCES
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    canSAR660931

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.11
    AlogP 3.86
    HBond donors 2
    HBond acceptors 6
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR660931.