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canSAR1266391
FEATURES
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NAMES
    SMILES
    COc1ccc(COC(=O)c2cc3c(s2)C(=O)c2c(O)cccc2C3=O)cc1
    InChI
    InChI=1S/C21H14O6S/c1-26-12-7-5-11(6-8-12)10-27-21(25)16-9-14-18(23)13-3-2-4-15(22)17(13)19(24)20(14)28-16/h2-9,22H,10H2,1H3
    MOLECULAR FORMULA
    C21H14O6S
    CROSS REFERENCES
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    canSAR1266391

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.05
    AlogP 3.59
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    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 canSAR1266391.