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canSAR649688
FEATURES
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NAMES
    SMILES
    CC(C)OC(=O)c1c(-c2ccc(-c3ccccc3)cc2)csc1NC(=O)/C=C\C(=O)O
    InChI
    InChI=1S/C24H21NO5S/c1-15(2)30-24(29)22-19(14-31-23(22)25-20(26)12-13-21(27)28)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-15H,1-2H3,(H,25,26)(H,27,28)/b13-12-
    MOLECULAR FORMULA
    C24H21NO5S
    CROSS REFERENCES
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    canSAR649688

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.11
    AlogP 5.23
    HBond donors 2
    HBond acceptors 6
    Atoms 52
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR649688.