canSAR547045
FEATURES
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NAMES
    SMILES
    Cc1ccc(-c2c3nc(c(-c4ccc([N+](C)(C)C)cc4)c4ccc([nH]4)c(-c4ccc([N+](C)(C)C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
    InChI
    InChI=1S/C52H50N6/c1-33-9-13-35(14-10-33)49-41-25-26-42(53-41)50(36-15-11-34(2)12-16-36)44-28-30-46(55-44)52(38-19-23-40(24-20-38)58(6,7)8)48-32-31-47(56-48)51(45-29-27-43(49)54-45)37-17-21-39(22-18-37)57(3,4)5/h9-32,53,56H,1-8H3/q+2/b49-41-,49-43-,50-42-,50-44-,51-45-,51-47-,52-46-,52-48-
    MOLECULAR FORMULA
    C52H50N6+2
    CROSS REFERENCES
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    canSAR547045
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight758.41
    AlogP12.33
    HBond donors2
    HBond acceptors6
    Atoms108
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR547045.