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canSAR546259
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NAMES
    SMILES
    CCCSCCCCC1(Cc2ccncc2)C(=O)N(c2ccccc2)c2ccccc21
    InChI
    InChI=1S/C27H30N2OS/c1-2-19-31-20-9-8-16-27(21-22-14-17-28-18-15-22)24-12-6-7-13-25(24)29(26(27)30)23-10-4-3-5-11-23/h3-7,10-15,17-18H,2,8-9,16,19-21H2,1H3
    MOLECULAR FORMULA
    C27H30N2OS
    CROSS REFERENCES
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    canSAR546259

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.21
    AlogP 6.55
    HBond donors 0
    HBond acceptors 3
    Atoms 61
    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 canSAR546259.