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canSAR394781
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NAMES
    SMILES
    NS(=O)(=O)c1ccc(CN2CCCN(CCC(O)(c3ccccc3)c3cccc(O)c3)CC2)cc1
    InChI
    InChI=1S/C27H33N3O4S/c28-35(33,34)26-12-10-22(11-13-26)21-30-16-5-15-29(18-19-30)17-14-27(32,23-6-2-1-3-7-23)24-8-4-9-25(31)20-24/h1-4,6-13,20,31-32H,5,14-19,21H2,(H2,28,33,34)
    MOLECULAR FORMULA
    C27H33N3O4S
    CROSS REFERENCES
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    canSAR394781

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.22
    AlogP 2.87
    HBond donors 4
    HBond acceptors 7
    Atoms 68
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR394781.