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canSAR1431306
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NAMES
    SMILES
    Cc1cccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1
    InChI
    InChI=1S/C17H20N4O/c1-12-3-2-4-16(19-12)20-14-8-5-13(6-9-14)7-10-15-11-22-17(18)21-15/h2-6,8-9,15H,7,10-11H2,1H3,(H2,18,21)(H,19,20)/t15-/m0/s1
    MOLECULAR FORMULA
    C17H20N4O
    CROSS REFERENCES
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    canSAR1431306

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 296.16
    AlogP 2.78
    HBond donors 3
    HBond acceptors 5
    Atoms 42
    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 canSAR1431306.