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canSAR186419
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NAMES
    SMILES
    CCCOc1ccc(NC(C)=O)cc1-c1nc2c(CCC)nn(C)c2c(=O)[nH]1
    InChI
    InChI=1S/C20H25N5O3/c1-5-7-15-17-18(25(4)24-15)20(27)23-19(22-17)14-11-13(21-12(3)26)8-9-16(14)28-10-6-2/h8-9,11H,5-7,10H2,1-4H3,(H,21,26)(H,22,23,27)
    MOLECULAR FORMULA
    C20H25N5O3
    CROSS REFERENCES
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    canSAR186419

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.20
    AlogP 3.02
    HBond donors 2
    HBond acceptors 8
    Atoms 53
    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 canSAR186419.