canSAR1605539
FEATURES
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NAMES
    SMILES
    N#C[S-].c1cc2ccc3ccc[n+]4c3c2[n+](c1)[Nd+3]412([n+]3cccc4ccc5ccc[n+]1c5c43)[n+]1cccc3ccc4ccc[n+]2c4c31
    InChI
    InChI=1S/3C12H8N2.CHNS.Nd/c3*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2-1-3;/h3*1-8H;3H;/q;;;;+9/p-1
    MOLECULAR FORMULA
    C37H24N7NdS+8
    CROSS REFERENCES
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    canSAR1605539
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight740.08
    AlogP3.59
    HBond donors0
    HBond acceptors7
    Atoms70
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1605539.