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canSAR5479
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NAMES
    SMILES
    CCCCc1nn(CC(C)C)c(=O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
    InChI
    InChI=1S/C24H29N7O/c1-4-5-10-22-27-31(15-17(2)3)24(32)30(22)16-18-11-13-19(14-12-18)20-8-6-7-9-21(20)23-25-28-29-26-23/h6-9,11-14,17H,4-5,10,15-16H2,1-3H3,(H,25,26,28,29)
    MOLECULAR FORMULA
    C24H29N7O
    CROSS REFERENCES
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    canSAR5479

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.24
    AlogP 3.94
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR5479.