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canSAR1865276
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NAMES
    SMILES
    CCC(NC(=O)Nc1cc(Cl)ccc1OC)c1c(-n2cccc2)sc2c1CCN(C)C2
    InChI
    InChI=1S/C23H27ClN4O2S/c1-4-17(25-23(29)26-18-13-15(24)7-8-19(18)30-3)21-16-9-12-27(2)14-20(16)31-22(21)28-10-5-6-11-28/h5-8,10-11,13,17H,4,9,12,14H2,1-3H3,(H2,25,26,29)
    MOLECULAR FORMULA
    C23H27ClN4O2S
    CROSS REFERENCES
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    canSAR1865276

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.15
    AlogP 5.46
    HBond donors 2
    HBond acceptors 6
    Atoms 58
    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 canSAR1865276.