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canSAR2003570
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NAMES
    SMILES
    Cc1nn(Cc2ccc(NC(=O)c3c(C)c4ccccc4n3C)cc2)c(C)c1CC(=O)O
    InChI
    InChI=1S/C25H26N4O3/c1-15-20-7-5-6-8-22(20)28(4)24(15)25(32)26-19-11-9-18(10-12-19)14-29-17(3)21(13-23(30)31)16(2)27-29/h5-12H,13-14H2,1-4H3,(H,26,32)(H,30,31)
    MOLECULAR FORMULA
    C25H26N4O3
    CROSS REFERENCES
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    canSAR2003570

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.20
    AlogP 4.23
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2003570.