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canSAR2000987
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NAMES
    SMILES
    Cc1c(C(=O)NCc2ccc3c(c2)OCO3)sc(=O)n1Cc1cccc(F)c1
    InChI
    InChI=1S/C20H17FN2O4S/c1-12-18(28-20(25)23(12)10-14-3-2-4-15(21)7-14)19(24)22-9-13-5-6-16-17(8-13)27-11-26-16/h2-8H,9-11H2,1H3,(H,22,24)
    MOLECULAR FORMULA
    C20H17FN2O4S
    CROSS REFERENCES
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    canSAR2000987

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.09
    AlogP 3.06
    HBond donors 1
    HBond acceptors 6
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2000987.