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canSAR1620069
FEATURES
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NAMES
    SMILES
    CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(O)c3ccccc3c2O)c1
    InChI
    InChI=1S/C27H23ClN2O7S/c1-2-30(17-8-4-3-5-9-17)38(35,36)18-12-13-22(28)23(14-18)29-25(32)16-37-27(34)21-15-24(31)19-10-6-7-11-20(19)26(21)33/h3-15,31,33H,2,16H2,1H3,(H,29,32)
    MOLECULAR FORMULA
    C27H23ClN2O7S
    CROSS REFERENCES
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    canSAR1620069

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 554.09
    AlogP 4.92
    HBond donors 3
    HBond acceptors 9
    Atoms 61
    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 canSAR1620069.