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canSAR1126268
FEATURES
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NAMES
    SMILES
    CCN(CC)c1ncc(N(CC)S(=O)(=O)c2ccc(F)c(F)c2)c(N[C@@H](Cc2ccc(OC(=O)N(C)C)cc2)C(=O)O)n1
    InChI
    InChI=1S/C28H34F2N6O6S/c1-6-35(7-2)27-31-17-24(36(8-3)43(40,41)20-13-14-21(29)22(30)16-20)25(33-27)32-23(26(37)38)15-18-9-11-19(12-10-18)42-28(39)34(4)5/h9-14,16-17,23H,6-8,15H2,1-5H3,(H,37,38)(H,31,32,33)/t23-/m0/s1
    MOLECULAR FORMULA
    C28H34F2N6O6S
    CROSS REFERENCES
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    canSAR1126268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 620.22
    AlogP 3.98
    HBond donors 2
    HBond acceptors 12
    Atoms 77
    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 canSAR1126268.