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canSAR1151352
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NAMES
    SMILES
    Cn1cc(C2=C(c3nn(CCN4CCOCC4)c4ncccc34)C(=O)NC2=O)c2ccccc21
    InChI
    InChI=1S/C25H24N6O3/c1-29-15-18(16-5-2-3-7-19(16)29)20-21(25(33)27-24(20)32)22-17-6-4-8-26-23(17)31(28-22)10-9-30-11-13-34-14-12-30/h2-8,15H,9-14H2,1H3,(H,27,32,33)
    MOLECULAR FORMULA
    C25H24N6O3
    CROSS REFERENCES
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    canSAR1151352

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.19
    AlogP 1.82
    HBond donors 1
    HBond acceptors 9
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1151352.