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canSAR1686140
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NAMES
    SMILES
    COc1ccc(-c2nc(NC(=O)C3=NN(c4cccc(C)c4)C(=O)CC3)sc2C)cc1
    InChI
    InChI=1S/C23H22N4O3S/c1-14-5-4-6-17(13-14)27-20(28)12-11-19(26-27)22(29)25-23-24-21(15(2)31-23)16-7-9-18(30-3)10-8-16/h4-10,13H,11-12H2,1-3H3,(H,24,25,29)
    MOLECULAR FORMULA
    C23H22N4O3S
    CROSS REFERENCES
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    canSAR1686140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.14
    AlogP 4.56
    HBond donors 1
    HBond acceptors 7
    Atoms 53
    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 canSAR1686140.