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canSAR1971849
FEATURES
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NAMES
    SMILES
    CC(C)c1nc(N(Cc2ccc(OC(F)(F)F)cc2)S(=O)(=O)c2ccc(C(=O)O)cc2)c(C(C)C)c2ccccc12
    InChI
    InChI=1S/C30H29F3N2O5S/c1-18(2)26-24-7-5-6-8-25(24)27(19(3)4)34-28(26)35(17-20-9-13-22(14-10-20)40-30(31,32)33)41(38,39)23-15-11-21(12-16-23)29(36)37/h5-16,18-19H,17H2,1-4H3,(H,36,37)
    MOLECULAR FORMULA
    C30H29F3N2O5S
    CROSS REFERENCES
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    canSAR1971849

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 586.17
    AlogP 7.47
    HBond donors 1
    HBond acceptors 7
    Atoms 70
    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 canSAR1971849.