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canSAR1768303
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NAMES
    SMILES
    Cc1ccc(C(=O)Nc2cccc(N(C)C)c2)cc1Nc1ncnc2cnc(N3CCCC3)nc12
    InChI
    InChI=1S/C26H28N8O/c1-17-9-10-18(25(35)30-19-7-6-8-20(14-19)33(2)3)13-21(17)31-24-23-22(28-16-29-24)15-27-26(32-23)34-11-4-5-12-34/h6-10,13-16H,4-5,11-12H2,1-3H3,(H,30,35)(H,28,29,31)
    MOLECULAR FORMULA
    C26H28N8O
    CROSS REFERENCES
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    canSAR1768303

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.24
    AlogP 4.39
    HBond donors 2
    HBond acceptors 9
    Atoms 63
    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 canSAR1768303.