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canSAR2050918
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NAMES
    SMILES
    O=C1c2cc3c(cc2-c2c1c1ccc(F)cc1c(=O)n2CCCNCCO)OCO3
    InChI
    InChI=1S/C22H19FN2O5/c23-12-2-3-13-16(8-12)22(28)25(6-1-4-24-5-7-26)20-14-9-17-18(30-11-29-17)10-15(14)21(27)19(13)20/h2-3,8-10,24,26H,1,4-7,11H2
    MOLECULAR FORMULA
    C22H19FN2O5
    CROSS REFERENCES
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    canSAR2050918

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.13
    AlogP 2.05
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2050918.