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canSAR828367
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NAMES
    SMILES
    CS(=O)(=O)Nc1ccc2c(c1)S(=O)(=O)N=C(C1=C(O)[C@@H]3C4CCC(CC4)[C@@H]3N(Cc3ccc(C(F)(F)F)cc3)C1=O)N2
    InChI
    InChI=1S/C27H27F3N4O6S2/c1-41(37,38)32-18-10-11-19-20(12-18)42(39,40)33-25(31-19)22-24(35)21-15-4-6-16(7-5-15)23(21)34(26(22)36)13-14-2-8-17(9-3-14)27(28,29)30/h2-3,8-12,15-16,21,23,32,35H,4-7,13H2,1H3,(H,31,33)/t15?,16?,21-,23+/m1/s1
    MOLECULAR FORMULA
    C27H27F3N4O6S2
    CROSS REFERENCES
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    canSAR828367

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 624.13
    AlogP 4.25
    HBond donors 3
    HBond acceptors 10
    Atoms 69
    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 canSAR828367.