canSAR546452
FEATURES
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NAMES
    SMILES
    NS(=O)(=O)c1nc2ccc(N3C(=O)c4cccnc4C3=O)cc2s1.O=S(=O)(O)C(F)(F)F
    InChI
    InChI=1S/C14H8N4O4S2.CHF3O3S/c15-24(21,22)14-17-9-4-3-7(6-10(9)23-14)18-12(19)8-2-1-5-16-11(8)13(18)20;2-1(3,4)8(5,6)7/h1-6H,(H2,15,21,22);(H,5,6,7)
    MOLECULAR FORMULA
    C15H9F3N4O7S3
    CROSS REFERENCES
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    canSAR546452
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight509.96
    AlogP1.53
    HBond donors3
    HBond acceptors11
    Atoms41
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR546452.