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canSAR653160
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NAMES
    SMILES
    O=C(CCCCCCCn1cc(-c2ccc(-c3ccncc3)cc2)nn1)NO
    InChI
    InChI=1S/C21H25N5O2/c27-21(24-28)6-4-2-1-3-5-15-26-16-20(23-25-26)19-9-7-17(8-10-19)18-11-13-22-14-12-18/h7-14,16,28H,1-6,15H2,(H,24,27)
    MOLECULAR FORMULA
    C21H25N5O2
    CROSS REFERENCES
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    canSAR653160

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.20
    AlogP 3.85
    HBond donors 2
    HBond acceptors 7
    Atoms 53
    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 canSAR653160.