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canSAR1112917
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NAMES
    SMILES
    O=C(CNCCO)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)CNCCO)ccc1-2
    InChI
    InChI=1S/C21H24N4O5/c26-7-5-22-11-19(28)24-13-1-3-15-16-4-2-14(25-20(29)12-23-6-8-27)10-18(16)21(30)17(15)9-13/h1-4,9-10,22-23,26-27H,5-8,11-12H2,(H,24,28)(H,25,29)
    MOLECULAR FORMULA
    C21H24N4O5
    CROSS REFERENCES
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    canSAR1112917

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.17
    AlogP -0.06
    HBond donors 6
    HBond acceptors 9
    Atoms 54
    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 canSAR1112917.