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canSAR547736
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NAMES
    SMILES
    Nc1ccc(-c2cc(-c3ccc(N4CCOCC4)cc3)cc(-c3ccccc3)[se+]2)cc1.[Cl-]
    InChI
    InChI=1S/C27H25N2OSe.ClH/c28-24-10-6-22(7-11-24)27-19-23(18-26(31-27)21-4-2-1-3-5-21)20-8-12-25(13-9-20)29-14-16-30-17-15-29;/h1-13,18-19H,14-17,28H2;1H/q+1;/p-1
    MOLECULAR FORMULA
    C27H25ClN2OSe
    CROSS REFERENCES
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    canSAR547736

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.08
    AlogP 2.45
    HBond donors 2
    HBond acceptors 3
    Atoms 57
    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 canSAR547736.