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canSAR1498932
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NAMES
    SMILES
    Cc1cccc(CN2C(=O)c3ccccc3Sc3ccc(C(=O)NC4CCCCC4)cc32)c1
    InChI
    InChI=1S/C28H28N2O2S/c1-19-8-7-9-20(16-19)18-30-24-17-21(27(31)29-22-10-3-2-4-11-22)14-15-26(24)33-25-13-6-5-12-23(25)28(30)32/h5-9,12-17,22H,2-4,10-11,18H2,1H3,(H,29,31)
    MOLECULAR FORMULA
    C28H28N2O2S
    CROSS REFERENCES
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    canSAR1498932

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.19
    AlogP 6.37
    HBond donors 1
    HBond acceptors 4
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1498932.