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canSAR1769380
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NAMES
    SMILES
    COc1ccc(-c2nc3sc(CCNC(=O)C(=O)Nc4c(C)cccc4C)c(C)n3n2)cc1
    InChI
    InChI=1S/C24H25N5O3S/c1-14-6-5-7-15(2)20(14)26-23(31)22(30)25-13-12-19-16(3)29-24(33-19)27-21(28-29)17-8-10-18(32-4)11-9-17/h5-11H,12-13H2,1-4H3,(H,25,30)(H,26,31)
    MOLECULAR FORMULA
    C24H25N5O3S
    CROSS REFERENCES
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    canSAR1769380

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.17
    AlogP 3.69
    HBond donors 2
    HBond acceptors 8
    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 canSAR1769380.