canSAR1417356
FEATURES
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NAMES
    SMILES
    CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4csc(-c5ccncc5)n4)c3)sc2C1
    InChI
    InChI=1S/C24H22N6O2S2/c1-30-10-7-18-20(13-30)34-24(28-18)29-21(31)17-4-2-3-15(11-17)12-26-22(32)19-14-33-23(27-19)16-5-8-25-9-6-16/h2-6,8-9,11,14H,7,10,12-13H2,1H3,(H,26,32)(H,28,29,31)
    MOLECULAR FORMULA
    C24H22N6O2S2
    CROSS REFERENCES
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    canSAR1417356
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight490.12
    AlogP3.83
    HBond donors2
    HBond acceptors8
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417356.