canSAR1644318
FEATURES
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NAMES
    SMILES
    CC1CC/C(=N/Nc2nc3ccccc3s2)c2cc(-c3cccc(C(=O)O)n3)ccc21
    InChI
    InChI=1S/C24H20N4O2S/c1-14-9-12-19(27-28-24-26-20-5-2-3-8-22(20)31-24)17-13-15(10-11-16(14)17)18-6-4-7-21(25-18)23(29)30/h2-8,10-11,13-14H,9,12H2,1H3,(H,26,28)(H,29,30)/b27-19-
    MOLECULAR FORMULA
    C24H20N4O2S
    CROSS REFERENCES
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    canSAR1644318
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight428.13
    AlogP5.77
    HBond donors2
    HBond acceptors6
    Atoms51
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1644318.