canSAR1417398
FEATURES
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NAMES
    SMILES
    Cc1ccc(-c2csc(NC(=O)C[n+]3cc(-c4ccc(C)cc4)n4c3CCC4)n2)cc1
    InChI
    InChI=1S/C25H24N4OS/c1-17-5-9-19(10-6-17)21-16-31-25(26-21)27-23(30)15-28-14-22(29-13-3-4-24(28)29)20-11-7-18(2)8-12-20/h5-12,14,16H,3-4,13,15H2,1-2H3/p+1
    MOLECULAR FORMULA
    C25H25N4OS+
    CROSS REFERENCES
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    canSAR1417398
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight429.17
    AlogP4.77
    HBond donors1
    HBond acceptors5
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417398.