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canSAR1621316
FEATURES
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NAMES
    SMILES
    COc1ccc(S(=O)(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)Nc4ccc(C(F)(F)F)cc4)cc3CC(=O)N([C@H](C)CO)C[C@@H]2C)cc1
    InChI
    InChI=1S/C32H37F3N4O7S/c1-20-17-39(21(2)19-40)30(41)16-22-15-25(37-31(42)36-24-7-5-23(6-8-24)32(33,34)35)9-14-28(22)46-29(20)18-38(3)47(43,44)27-12-10-26(45-4)11-13-27/h5-15,20-21,29,40H,16-19H2,1-4H3,(H2,36,37,42)/t20-,21+,29-/m0/s1
    MOLECULAR FORMULA
    C32H37F3N4O7S
    CROSS REFERENCES
    1621316 logo

    canSAR1621316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 678.23
    AlogP 4.83
    HBond donors 3
    HBond acceptors 11
    Atoms 84
    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 canSAR1621316.