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canSAR736681
FEATURES
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NAMES
    SMILES
    Cc1c(-c2ccc(OS(=O)(=O)O)cc2)n(Cc2c(F)c(F)c(F)c(F)c2F)c2cc(OS(=O)(=O)O)cc(C(F)(F)F)c12
    InChI
    InChI=1S/C23H13F8NO8S2/c1-9-16-14(23(29,30)31)6-12(40-42(36,37)38)7-15(16)32(8-13-17(24)19(26)21(28)20(27)18(13)25)22(9)10-2-4-11(5-3-10)39-41(33,34)35/h2-7H,8H2,1H3,(H,33,34,35)(H,36,37,38)
    MOLECULAR FORMULA
    C23H13F8NO8S2
    CROSS REFERENCES
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    canSAR736681

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 647.00
    AlogP 5.74
    HBond donors 2
    HBond acceptors 9
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR736681.