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canSAR1832585
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NAMES
    SMILES
    Cc1cc(C)c(C=CP(=O)(O)CC(=O)CC(=O)O)c(-c2ccc(F)c(C)c2)c1
    InChI
    InChI=1S/C21H22FO5P/c1-13-8-14(2)18(6-7-28(26,27)12-17(23)11-21(24)25)19(9-13)16-4-5-20(22)15(3)10-16/h4-10H,11-12H2,1-3H3,(H,24,25)(H,26,27)
    MOLECULAR FORMULA
    C21H22FO5P
    CROSS REFERENCES
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    canSAR1832585

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.12
    AlogP 4.70
    HBond donors 2
    HBond acceptors 5
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1832585.