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canSAR503205
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NAMES
    SMILES
    CCCCCN(C(=O)Nc1ccc(C(C)C)cc1)C1Cc2ccc(SC(C)(C)C(=O)O)cc2C1
    InChI
    InChI=1S/C28H38N2O3S/c1-6-7-8-15-30(27(33)29-23-12-9-20(10-13-23)19(2)3)24-16-21-11-14-25(18-22(21)17-24)34-28(4,5)26(31)32/h9-14,18-19,24H,6-8,15-17H2,1-5H3,(H,29,33)(H,31,32)
    MOLECULAR FORMULA
    C28H38N2O3S
    CROSS REFERENCES
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    canSAR503205

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.26
    AlogP 6.96
    HBond donors 2
    HBond acceptors 5
    Atoms 72
    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 canSAR503205.