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canSAR988626
FEATURES
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(=O)O)cc1OC
    InChI
    InChI=1S/C31H28FNO6/c1-37-28-13-8-20(17-29(28)38-2)9-14-30(34)33-27(31(35)36)16-21-7-10-23-18-25(12-11-22(23)15-21)39-19-24-5-3-4-6-26(24)32/h3-15,17-18,27H,16,19H2,1-2H3,(H,33,34)(H,35,36)/b14-9+
    MOLECULAR FORMULA
    C31H28FNO6
    CROSS REFERENCES
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    canSAR988626

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 529.19
    AlogP 5.40
    HBond donors 2
    HBond acceptors 7
    Atoms 67
    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 canSAR988626.