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canSAR652250
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NAMES
    SMILES
    O=S(=O)(c1cccc2ccccc12)N(CCCN1CCN(c2ccccc2)CC1)CC1CC1
    InChI
    InChI=1S/C27H33N3O2S/c31-33(32,27-13-6-9-24-8-4-5-12-26(24)27)30(22-23-14-15-23)17-7-16-28-18-20-29(21-19-28)25-10-2-1-3-11-25/h1-6,8-13,23H,7,14-22H2
    MOLECULAR FORMULA
    C27H33N3O2S
    CROSS REFERENCES
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    canSAR652250

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.23
    AlogP 4.45
    HBond donors 0
    HBond acceptors 5
    Atoms 66
    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 canSAR652250.